A0A5K4F164_SCHMA Loading...

Ig-like domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F164, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,715 aa.

						>A0A5K4F164_SCHMA|A0A5K4F164
MHPRIHFYTVNSFYCILFIVFLMCNCENVEILIPTGKIFNIFLSIENSNHDLWNLPSCIHLISKSYTTINETGKISITFKGLCFQCDSMNINNELSFNENYTKLLYNNDNDYVMYLNNYHVNTHLLLNINSKNSIQSFHHILLNYNKYLSKKCYKQVPTLLLFIFNVQICNLSYIERIELNKIIKLFMNLINITYLNQSLIISNIEDDNDNVNLILESPTIYERKLSILASAKAHNYIRNSKSNFSQLVSIQHIGCGIIPDYILKILTILEKRFQMGLIPIWTLLNNTNFTRFEKFKHITLAEWIVGDLIHNSLHDAAQTKQNNVKRSLNKRSALSSREAGYLEEGSGMASFQQFPKIDYRSFLEHSSTDLIHSNIPRVKNYITPIKTTVYQISNIQIPQNTFYDLQDGYTQNLKLTLYASNLENISYIELKSMENLNQAIGEEITRDIKKWVSFDTKNQIIRLKPLPDHVGNHTFIVCATDRDQNRVCEPFQIIVKRPSPFRKNFILRIPPGIFWCYQIPIYWFKELKTLSFDKLDLEVKGDSPFSWNVQTGEVCVISNLKISQIITLFFHATNAKLAQSVEIEFRLSAKVPSVQLLVTNSKLRMKFQWPEKLTNYELNTLNKINLTLAEILQNRINPEVSSEKLYVYEIIQFKMPQNESDIASFELDWIFLPLGLPNDGEEIFLLSNDSAITNINSFQMIQNTNLHNVNQPINLYVQSNNIPKLSKLLTDCQLSNLDKAEITLQNNKKLFIPFKLESVKLLNLENSACFLAKKITKQLEEQAYSTSQRSSEIGTNLSRWSDSHLYMPANVQFMPNVLPNFTVIAGLRFKKSINPDNVTPSKRIQYMELRDAYGLILDDSSWISLTLDNSHLIGLPLNEHIRKQPYLFRLYIHSVDQKTPITIGFTVEVQDWFETMKNDKSFQLNHRVRLRILPSIQTSTSQPTEIWPVKPSSSLNYRWKLSNAIDKFLHPNCSPPCNPDVGIWQITQQNVNSLSVTWAQLSLLQEQGKSQTGISDGNTPNCPWEKFDHLQNLLIFAPTLVSAQKNLGLVTGLANDGQLYLSPWSAPSNHFRAHMESSELGIVEAAVVDRMGSCARHTNKFEGQELTGKSMQNRFSSFSSLDNDVIMNFTVFTGEGFRRKIVNDDILATMSRSNVHLYDIGGRQVGSSHWIGLEKDKSTIFGIIIGNSVQPSSHKFHITDNPEKNVGVQFSIYVAGSNPQLPINFNHRVVMHFSADHSRPWTGGHSLVDRWLLISALDDYLRPHCMGSMICRNDMDIILLTLNYQASGFSVIWAQKSILILTENINLNKTTEILDSYTQQEYWSQWSKNIHHTVKRSIDLNQISLQCNSQYENCQSSTSTIRFTKPINQQYKDEYRRKRNLLNTINCPEREIIKLENRLLSEIRKDLQQPSIDFIKHLKETGVGQLDEIQIERLGPCIQTHKAPPIFIPGPGFEGNHEMFIPNYENKREYKESVDSGPSGSSSSPSLSSLSTSSIQDEMNGSRVILLGTLLPICISLIILLLGILAFVWYRKNGKSCPNGLTSHTSIVNSGHSVVNLETEKMLTTITSPKKLTSNGRQSKNTKPDNMNSGSISTGSDKTCLSPTKPMILTNERPPFTPPDYNPGFTDSTDRLPMTHLSQSQIPLQNTNETLVTGMMDIRQNQTKTSFTLRPNPYRNLPPAIETKPGMPPPASQIPYAPFRKIMTFPNSSIDHKQ
					

Structure Viewer

Loading PAE data...

(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	33.3	Very low	27	Very low	244 Å²	244	171.8 Å²	171.8	100%	1.202	84%	0.836	S	S	*	*				0	104.6	0	-78.7	-177.2	162.9	0	0	108.7
2	H	26.8	Very low	26.9	Very low	178 Å²	178	166.4 Å²	166.4	82%	0.824	83%	0.829	S	S	*	*			trans	-80.3	134.6	156.8	-91.4	-59.8	0	0	0	107.2
3	P	33.6	Very low	26.6	Very low	108 Å²	108	167.7 Å²	167.7	70%	0.701	83%	0.827	S	S	*	*				-147.1	127	96.8	31.7	-12.5	0	0	0	112.5
4	R	24.3	Very low	26.6	Very low	217 Å²	217	170.2 Å²	170.2	82%	0.819	83%	0.825	S	S	*	*				40.6	91.9	88.4	-74.4	-167.8	-177.8	-179.8	1.9	114.3
5	I	29.5	Very low	26.6	Very low	158 Å²	158	167.3 Å²	167.3	81%	0.81	83%	0.826	S	S	*	*			trans	-102.3	112.8	163.3	-65.6	171.9	0	0	0	106.9
6	H	24.6	Very low	26.5	Very low	154 Å²	154	167.6 Å²	167.6	71%	0.713	83%	0.83	S	S	*	*			trans	-80.5	131.2	177	-99.7	-82.8	0	0	0	110.5
7	F	24.2	Very low	26.6	Very low	190 Å²	190	166.2 Å²	166.2	83%	0.833	83%	0.825	S	S	*	*			trans	-70.3	129.1	172.3	-83.5	-99.8	0	0	0	111
8	Y	25.7	Very low	26.5	Very low	229 Å²	229	167.8 Å²	167.8	90%	0.898	83%	0.827	S	S	*	*			trans	-108.2	121.1	159.6	-87.9	-83	0	0	0	109.4
9	T	23	Very low	26.6	Very low	124 Å²	124	165.9 Å²	165.9	76%	0.761	82%	0.819	S	S	*	*			trans	-91.8	114.8	176.5	47.1	0	0	0	0	110.1
10	V	27.5	Very low	26.7	Very low	136 Å²	136	163.6 Å²	163.6	82%	0.824	81%	0.814	S	S	*	*			trans	-149.9	107.3	153.4	-175.7	0	0	0	0	110.3
11	N	24.3	Very low	26.9	Very low	152 Å²	152	163.8 Å²	163.8	81%	0.813	81%	0.811	S	S	*	*			trans	29.1	130.7	145.5	-68.4	-20.5	0	0	0	123.9
12	S	25.5	Very low	26.5	Very low	107 Å²	107	160.3 Å²	160.3	75%	0.748	80%	0.796	S	S	*	*			trans	93	96.7	142	95.4	0	0	0	0	120.5
13	F	24	Very low	26.5	Very low	183 Å²	183	159 Å²	159	80%	0.803	79%	0.792	S	S	*	*			trans	61.9	120.8	134	-87.1	-80.7	0	0	0	121.7
14	Y	26.5	Very low	26.2	Very low	203 Å²	203	158.3 Å²	158.3	80%	0.796	79%	0.789	S	S	*	*			trans	72.5	99.5	160.3	-71.2	-76.8	0	0	0	119
15	C	26.2	Very low	26.6	Very low	126 Å²	126	154.9 Å²	154.9	85%	0.851	79%	0.787	S	S	*	*				176.5	96	121	-99.9	0	0	0	0	111.3	L17	C15-L17 VanDerWaalsContact C-N 3.27Å; C15-L17 PolarHBondContact O-N 3.2Å; C15-L17 VanDerWaalsContact O-N 3.09Å
16	I	25.3	Very low	26.8	Very low	173 Å²	173	152.2 Å²	152.2	89%	0.887	78%	0.781	S	S	*	*			trans	-72.2	86.9	155.2	-63.2	168.5	0	0	0	106.3
17	L	27.6	Very low	27.6	Very low	143 Å²	143	153.3 Å²	153.3	75%	0.749	79%	0.787	S	S	*	*			trans	-171.8	92.4	154.5	-139.8	94.6	0	0	0	110.5	C15	C15-L17 VanDerWaalsContact C-N 3.27Å; C15-L17 PolarHBondContact O-N 3.2Å; C15-L17 VanDerWaalsContact O-N 3.09Å
18	F	26.1	Very low	28.8	Very low	196 Å²	196	148.4 Å²	148.4	86%	0.86	77%	0.769	S	S	*	*			trans	-147.2	81.6	155.9	-123.6	-85.8	0	0	0	109.3	V20	F18-V20 HydrophobicContact CD1-CG2 3.92Å; F18-V20 HydrophobicContact CE1-CG2 4.46Å; F18-V20 PolarHBondContact O-N 3.47Å
19	I	27.2	Very low	29.9	Very low	132 Å²	132	139.9 Å²	139.9	68%	0.677	74%	0.741	S	S	*	*			trans	-76.6	106.4	162.5	-66.9	171.2	0	0	0	105.8	F21	I19-F21 HydrophobicContact CG2-CD2 4.34Å; I19-F21 HydrophobicContact CG2-CE2 4.25Å; I19-F21 WeakPolarHBondContact O-CD2 3.36Å; I19-F21 PolarHBondContact O-N 3.44Å
20	V	29.2	Very low	31.2	Very low	118 Å²	118	139.8 Å²	139.8	72%	0.715	73%	0.731	S	S	*	*			trans	-82.8	111.9	168.9	174	0	0	0	0	108.2	F18	F18-V20 HydrophobicContact CD1-CG2 3.92Å; F18-V20 HydrophobicContact CE1-CG2 4.46Å; F18-V20 PolarHBondContact O-N 3.47Å
21	F	29.6	Very low	32.5	Very low	169 Å²	169	134.6 Å²	134.6	74%	0.741	70%	0.699	S	S	*	*			trans	-68.1	123.7	174.8	-76	-100.1	0	0	0	111.2	I19	I19-F21 HydrophobicContact CG2-CD2 4.34Å; I19-F21 HydrophobicContact CG2-CE2 4.25Å; I19-F21 WeakPolarHBondContact O-CD2 3.36Å; I19-F21 PolarHBondContact O-N 3.44Å
22	L	26.8	Very low	33.8	Very low	171 Å²	171	132.7 Å²	132.7	90%	0.895	69%	0.688	S	S	*	*			trans	-91.9	109.6	164	-96.5	147.6	0	0	0	108.6
23	M	26.4	Very low	35.1	Very low	151 Å²	151	128.1 Å²	128.1	74%	0.744	66%	0.655	S	S	*	*			trans	-72.7	122.4	172.8	-72.7	-78.1	-176.9	0	0	110.1
24	C	26.7	Very low	36.5	Very low	93 Å²	93	121.4 Å²	121.4	63%	0.628	63%	0.63	S	S	*	*			trans	-112.2	129.3	168	-84.8	0	0	0	0	110.4
25	N	32.2	Very low	37.7	Very low	144 Å²	144	113.6 Å²	113.6	77%	0.77	60%	0.604	S	S	*	*			trans	-87.8	122.8	179.5	-68	-20.2	0	0	0	110.2
26	C	34.1	Very low	39	Very low	103 Å²	103	108.2 Å²	108.2	70%	0.696	57%	0.569	S	S	*	*			trans	-124.7	115.1	169.4	-64.9	0	0	0	0	110.2
27	E	40.9	Very low	40.4	Very low	177 Å²	177	104.9 Å²	104.9	83%	0.827	55%	0.548	S	S	*	.			trans	-83.5	146.6	166.8	-70.3	176.7	167	0	0	109.8
28	N	49.3	Very low	41.7	Very low	86 Å²	86	101 Å²	101	46%	0.46	53%	0.527	S	S	.	.	S	Bend	trans	57	92.9	178.2	-55.4	-40.7	0	0	0	113.6	N130	N28-N130 PolarHBondContact OD1-OD1 3.36Å
29	V	48.8	Very low	43.1	Very low	51 Å²	51	93 Å²	93	31%	0.309	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	112.8	-176.5	-171.6	0	0	0	0	109.7	I31 I129	V29-I31 HydrophobicContact CG1-CD1 4.14Å; V29-I31 HydrophobicContact CG1-CG1 3.69Å; V29-I129 PolarHBondContact N-O 2.96Å; V29-I129 PolarHBondContact O-N 3.29Å; V29-I129 VanDerWaalsContact O-N 3.08Å
30	E	50.1	Low	44.2	Very low	121 Å²	121	90.3 Å²	90.3	57%	0.565	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	112	169.7	-77.8	-174.5	178.2	0	0	110.1	L126 N128	E30-L126 HydrophobicContact CB-CD1 3.96Å; E30-L126 HydrophobicContact CG-CD1 4.22Å; E30-L126 HydrophobicContact CG-CD2 4.36Å; E30-L126 HydrophobicContact CG-CG 4.45Å; E30-N128 HydrophobicContact CG-CB 4.48Å; E30-N128 VanDerWaalsContact CG-CG 3.49Å; E30-N128 WeakPolarHBondContact CG-OD1 3.32Å; E30-N128 PolarHBondContact OE1-ND2 3.05Å
31	I	54.8	Low	45.4	Very low	27 Å²	27	85.8 Å²	85.8	14%	0.138	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	114.4	179.6	-52.9	176.1	0	0	0	108.8	V29 I33 L127 I129 L142	V29-I31 HydrophobicContact CG1-CD1 4.14Å; V29-I31 HydrophobicContact CG1-CG1 3.69Å; I31-I33 HydrophobicContact CG2-CG1 4.25Å; I31-I33 PolarHBondContact O-N 3.49Å; I31-L127 HydrophobicContact CB-CB 4.34Å; I31-L127 HydrophobicContact CD1-CD2 4.42Å; I31-L127 PolarHBondContact N-O 3.31Å; I31-L127 PolarHBondContact O-N 3.21Å; I31-I129 HydrophobicContact CD1-CD1 4.22Å; I31-L142 HydrophobicContact CD1-CD1 3.88Å
32	L	52.6	Low	46.2	Very low	112 Å²	112	81.3 Å²	81.3	59%	0.586	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	109	174.2	-78.9	155.3	0	0	0	110.1	P34 H124 L126	L32-P34 WeakPolarHBondContact O-CD 3.36Å; L32-H124 HydrophobicContact CB-CB 4.44Å; L32-H124 HydrophobicContact CD2-CB 3.49Å; L32-H124 VanDerWaalsContact CD2-CB 3.49Å; L32-L126 HydrophobicContact CD2-CD1 4.07Å; L32-L126 HydrophobicContact CG-CD1 4.12Å
33	I	52.9	Low	47.2	Very low	11 Å²	11	73.4 Å²	73.4	6%	0.056	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	112.6	177.2	-55.7	174.9	0	0	0	108.5	I31 T35 F39 I41 H124 L125 L127	I31-I33 HydrophobicContact CG2-CG1 4.25Å; I31-I33 PolarHBondContact O-N 3.49Å; I33-T35 PolarHBondContact O-N 3.42Å; I33-F39 HydrophobicContact CD1-CD1 4.47Å; I33-F39 HydrophobicContact CD1-CD2 4.1Å; I33-F39 HydrophobicContact CD1-CE2 4.15Å; I33-F39 HydrophobicContact CD1-CG 4.24Å; I33-F39 HydrophobicContact CD1-CZ 4.34Å; I33-F39 HydrophobicContact CG2-CB 4.2Å; I33-F39 HydrophobicContact CG2-CD1 3.54Å; I33-F39 HydrophobicContact CG2-CE1 4.05Å; I33-F39 HydrophobicContact CG2-CG 3.95Å; I33-I41 HydrophobicContact CD1-CD1 4.08Å; I33-H124 WeakPolarHBondContact O-CA 3.46Å; I33-L125 HydrophobicContact CB-CB 4.49Å; I33-L125 PolarHBondContact N-O 2.84Å; I33-L125 PolarHBondContact O-N 3.07Å; I33-L127 HydrophobicContact CD1-CB 4.17Å
34	P	53	Low	48	Very low	42 Å²	42	68.9 Å²	68.9	27%	0.273	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	134.3	175	25.4	-32.4	0	0	0	111.3	L32 K37 H124	L32-P34 WeakPolarHBondContact O-CD 3.36Å; P34-K37 HydrophobicContact CB-CD 4.46Å; P34-K37 HydrophobicContact CB-CG 4.48Å; P34-K37 HydrophobicContact CG-CB 4.3Å; P34-K37 HydrophobicContact CG-CD 3.77Å; P34-K37 HydrophobicContact CG-CG 4.08Å; P34-K37 PolarHBondContact O-N 3.37Å; P34-H124 WeakPolarHBondContact CA-ND1 3.3Å
35	T	51.4	Low	48.9	Very low	40 Å²	40	66.2 Å²	66.2	25%	0.245	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	143.4	179.5	52.5	0	0	0	0	111.3	I33 K37 T123 L125	I33-T35 PolarHBondContact O-N 3.42Å; T35-K37 VanDerWaalsContact C-N 3.33Å; T35-K37 PolarHBondContact O-N 3.42Å; T35-T123 PolarHBondContact N-O 2.89Å; T35-T123 PolarHBondContact OG1-O 3.22Å; T35-L125 HydrophobicContact CG2-CD1 4.45Å; T35-L125 HydrophobicContact CG2-CG 4.41Å
36	G	54.1	Low	49.4	Very low	12 Å²	12	66.1 Å²	66.1	12%	0.124	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	3.5	179.8	0	0	0	0	0	116.9	C83 F84	G36-C83 PolarHBondContact N-O 3.37Å; G36-F84 VanDerWaalsContact CA-CE1 3.41Å
37	K	53.9	Low	49.6	Very low	104 Å²	104	67.3 Å²	67.3	45%	0.452	35%	0.347	S	S	.	.	S	Bend	trans	-98.6	145.6	171.6	-64.8	-157.9	-176.3	178.2	0	112.1	P34 T35 F39	P34-K37 HydrophobicContact CB-CD 4.46Å; P34-K37 HydrophobicContact CB-CG 4.48Å; P34-K37 HydrophobicContact CG-CB 4.3Å; P34-K37 HydrophobicContact CG-CD 3.77Å; P34-K37 HydrophobicContact CG-CG 4.08Å; P34-K37 PolarHBondContact O-N 3.37Å; T35-K37 VanDerWaalsContact C-N 3.33Å; T35-K37 PolarHBondContact O-N 3.42Å; K37-F39 PolarHBondContact O-N 2.76Å
38	I	55.8	Low	49.5	Very low	60 Å²	60	60.3 Å²	60.3	31%	0.308	32%	0.317	S	S	.	.			trans	-72.9	123.2	169.3	-58.6	173.7	0	0	0	107	G81 L82	I38-G81 WeakPolarHBondContact CA-O 3.49Å; I38-L82 HydrophobicContact CB-CD1 4.38Å; I38-L82 HydrophobicContact CG1-CD1 3.44Å; I38-L82 VanDerWaalsContact CG1-CD1 3.44Å
39	F	56.3	Low	49	Very low	29 Å²	29	64.3 Å²	64.3	13%	0.127	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	143.8	171.7	61.5	-88.1	0	0	0	109.9	I33 K37 I41 I59 K80 G81	I33-F39 HydrophobicContact CD1-CD1 4.47Å; I33-F39 HydrophobicContact CD1-CD2 4.1Å; I33-F39 HydrophobicContact CD1-CE2 4.15Å; I33-F39 HydrophobicContact CD1-CG 4.24Å; I33-F39 HydrophobicContact CD1-CZ 4.34Å; I33-F39 HydrophobicContact CG2-CB 4.2Å; I33-F39 HydrophobicContact CG2-CD1 3.54Å; I33-F39 HydrophobicContact CG2-CE1 4.05Å; I33-F39 HydrophobicContact CG2-CG 3.95Å; K37-F39 PolarHBondContact O-N 2.76Å; F39-I41 HydrophobicContact CD2-CD1 4.01Å; F39-I41 HydrophobicContact CD2-CG1 4.11Å; F39-I41 HydrophobicContact CE2-CD1 4.34Å; F39-I59 HydrophobicContact CZ-CD1 4.13Å; F39-I59 HydrophobicContact CZ-CG1 4.1Å; F39-K80 WeakPolarHBondContact O-CA 3.27Å; F39-G81 WeakPolarHBondContact CD1-O 3.36Å; F39-G81 PolarHBondContact N-O 3.31Å; F39-G81 PolarHBondContact O-N 3.03Å
40	N	50.3	Low	48.4	Very low	75 Å²	75	65.4 Å²	65.4	40%	0.401	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	114.5	171.5	-62.8	-31.6	0	0	0	107.3	F42 F79 K80	N40-F42 HydrophobicContact CB-CE2 3.81Å; N40-F42 HydrophobicContact CB-CZ 4.43Å; N40-F79 VanDerWaalsContact CA-O 3.27Å; N40-F79 WeakPolarHBondContact CA-O 3.22Å; N40-K80 WeakPolarHBondContact OD1-CD 3.43Å; N40-K80 VanDerWaalsContact OD1-CE 3.24Å; N40-K80 WeakPolarHBondContact OD1-CE 3.47Å; N40-K80 WeakPolarHBondContact OD1-CG 3.28Å
41	I	52.7	Low	47.8	Very low	24 Å²	24	66 Å²	66	12%	0.123	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	121.4	173.9	-60.8	172.4	0	0	0	107.4	I33 F39 L43 T78 F79 L127	I33-I41 HydrophobicContact CD1-CD1 4.08Å; F39-I41 HydrophobicContact CD2-CD1 4.01Å; F39-I41 HydrophobicContact CD2-CG1 4.11Å; F39-I41 HydrophobicContact CE2-CD1 4.34Å; I41-L43 HydrophobicContact CG2-CD2 3.9Å; I41-L43 HydrophobicContact CG2-CG 4.25Å; I41-T78 CarbonylContact O-C 3.58Å; I41-T78 VanDerWaalsContact O-CA 3.32Å; I41-T78 WeakPolarHBondContact O-CA 3.37Å; I41-F79 HydrophobicContact CB-CB 4.41Å; I41-F79 PolarHBondContact N-O 3.08Å; I41-F79 PolarHBondContact O-N 3.4Å; I41-L127 HydrophobicContact CD1-CD2 3.45Å; I41-L127 VanDerWaalsContact CD1-CD2 3.45Å
42	F	46.9	Very low	46.9	Very low	74 Å²	74	72.8 Å²	72.8	33%	0.325	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	114.2	177.4	-62.6	-104.6	0	0	0	107.6	N40 I77 T78 I141	N40-F42 HydrophobicContact CB-CE2 3.81Å; N40-F42 HydrophobicContact CB-CZ 4.43Å; F42-I77 WeakPolarHBondContact CA-O 3.48Å; F42-T78 HydrophobicContact CB-CG2 4.42Å; F42-T78 HydrophobicContact CD1-CG2 3.04Å; F42-T78 HydrophobicContact CD2-CG2 4.37Å; F42-T78 HydrophobicContact CE1-CG2 3.12Å; F42-T78 HydrophobicContact CE2-CG2 4.43Å; F42-T78 HydrophobicContact CG-CG2 3.7Å; F42-T78 HydrophobicContact CZ-CG2 3.85Å; F42-I141 HydrophobicContact CB-CD1 4.26Å; F42-I141 HydrophobicContact CB-CG2 3.83Å; F42-I141 HydrophobicContact CD2-CG2 4.02Å; F42-I141 HydrophobicContact CG-CG2 4.16Å
43	L	49	Very low	46.6	Very low	5 Å²	5	71 Å²	71	3%	0.026	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	128.4	171.1	-57.7	-179.8	0	0	0	108.3	I41 I45 S76 I77 F79 M114 F138	I41-L43 HydrophobicContact CG2-CD2 3.9Å; I41-L43 HydrophobicContact CG2-CG 4.25Å; L43-I45 HydrophobicContact CB-CD1 4.07Å; L43-I45 HydrophobicContact CB-CG1 4.15Å; L43-I45 HydrophobicContact CD1-CD1 4.23Å; L43-I45 PolarHBondContact O-N 3.47Å; L43-S76 WeakPolarHBondContact O-CA 3.43Å; L43-I77 PolarHBondContact N-O 2.97Å; L43-I77 PolarHBondContact O-N 3.31Å; L43-F79 HydrophobicContact CD1-CD2 4.19Å; L43-F79 HydrophobicContact CD1-CE2 3.47Å; L43-F79 VanDerWaalsContact CD1-CE2 3.47Å; L43-F79 HydrophobicContact CD1-CZ 4.32Å; L43-F79 HydrophobicContact CG-CD2 4.41Å; L43-F79 HydrophobicContact CG-CE2 4.08Å; L43-M114 HydrophobicContact CD1-CE 3.25Å; L43-M114 HydrophobicContact CD1-SD 4.02Å; L43-M114 HydrophobicContact CD2-CE 3.81Å; L43-M114 HydrophobicContact CG-CE 4.18Å; L43-F138 HydrophobicContact CD2-CE1 3.61Å; L43-F138 HydrophobicContact CD2-CZ 4.05Å
44	S	42	Very low	46.1	Very low	57 Å²	57	77.8 Å²	77.8	40%	0.399	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	108.5	166.5	-180	0	0	0	0	107
45	I	46.2	Very low	46.2	Very low	36 Å²	36	77.7 Å²	77.7	19%	0.185	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	122	174.1	-66.2	168	0	0	0	106.7	L43 N47 I75 I77 F97	L43-I45 HydrophobicContact CB-CD1 4.07Å; L43-I45 HydrophobicContact CB-CG1 4.15Å; L43-I45 HydrophobicContact CD1-CD1 4.23Å; L43-I45 PolarHBondContact O-N 3.47Å; I45-N47 PolarHBondContact O-N 3.34Å; I45-I75 PolarHBondContact N-O 2.94Å; I45-I75 PolarHBondContact O-N 3.42Å; I45-I77 HydrophobicContact CB-CD1 4.28Å; I45-I77 HydrophobicContact CD1-CB 4.44Å; I45-I77 HydrophobicContact CD1-CD1 3.66Å; I45-I77 HydrophobicContact CD1-CG1 4.44Å; I45-I77 HydrophobicContact CG1-CD1 4.48Å; I45-F97 HydrophobicContact CD1-CE1 4.49Å
46	E	41.8	Very low	46.4	Very low	142 Å²	142	77.5 Å²	77.5	66%	0.664	40%	0.402	S	S	*	.	S	Bend	trans	-75.3	109.3	169.9	-73.8	-179.2	176.1	0	0	107.5
47	N	38.1	Very low	46.7	Very low	128 Å²	128	81.7 Å²	81.7	68%	0.684	43%	0.429	S	S	*	.			trans	52.9	88.5	169.3	-64.2	-22.1	0	0	0	116.9	I45	I45-N47 PolarHBondContact O-N 3.34Å
48	S	39.4	Very low	47.1	Very low	31 Å²	31	76.8 Å²	76.8	22%	0.217	41%	0.408	C	S	.	.			trans	-124.8	120.2	162.4	65.3	0	0	0	0	110.7	H50 I77	S48-H50 PolarHBondContact O-N 3.5Å; S48-I77 WeakPolarHBondContact OG-CD1 3.3Å
49	N	39	Very low	47.3	Very low	169 Å²	169	75 Å²	75	90%	0.904	40%	0.399	S	S	*	.			trans	-67.1	129.9	172.7	-92.7	-16.7	0	0	0	110.4
50	H	36.8	Very low	47.6	Very low	74 Å²	74	78.5 Å²	78.5	34%	0.343	42%	0.415	S	S	.	.			trans	-72.5	124.6	177.5	-67.8	-71.6	0	0	0	109.9	S48 S63	S48-H50 PolarHBondContact O-N 3.5Å; H50-S63 VanDerWaalsContact CE1-CB 3.46Å; H50-S63 WeakPolarHBondContact CE1-CB 3.24Å; H50-S63 WeakPolarHBondContact NE2-CB 3.46Å
51	D	37.2	Very low	47.8	Very low	135 Å²	135	76.5 Å²	76.5	72%	0.722	40%	0.404	S	S	*	.				161.9	136.8	129.5	-76.6	-22.4	0	0	0	108.6
52	L	36.6	Very low	47.8	Very low	169 Å²	169	78.3 Å²	78.3	89%	0.885	41%	0.413	S	S	*	.			trans	92.7	52.6	-177.5	-56.4	143.8	0	0	0	116.3
53	W	44.9	Very low	48	Very low	73 Å²	73	77.7 Å²	77.7	28%	0.277	42%	0.419	S	S	.	.			trans	-101.1	116.7	161.7	-68.2	38.1	0	0	0	108.8	L55 L61 F79 L95 F97	W53-L55 HydrophobicContact CB-CD1 4.2Å; W53-L55 HydrophobicContact CB-CG 4.18Å; W53-L55 HydrophobicContact CE3-CD1 4.49Å; W53-L55 PolarHBondContact O-N 3.29Å; W53-L61 HydrophobicContact CZ3-CD1 4.47Å; W53-F79 HydrophobicContact CE3-CE1 4.43Å; W53-F79 HydrophobicContact CE3-CZ 4.49Å; W53-F79 HydrophobicContact CH2-CZ 4.14Å; W53-F79 AromaticContact CZ3-CE1 3.95Å; W53-F79 HydrophobicContact CZ3-CE1 3.95Å; W53-F79 AromaticContact CZ3-CZ 3.62Å; W53-F79 HydrophobicContact CZ3-CZ 3.62Å; W53-L95 HydrophobicContact CB-CD2 4.45Å; W53-L95 HydrophobicContact CD2-CD2 3.91Å; W53-L95 HydrophobicContact CE3-CD2 3.4Å; W53-L95 VanDerWaalsContact CE3-CD2 3.4Å; W53-L95 HydrophobicContact CG-CD2 4.35Å; W53-L95 HydrophobicContact CZ3-CD2 4.03Å; W53-F97 HydrophobicContact CH2-CD1 4.26Å; W53-F97 AromaticContact CH2-CE1 3.08Å; W53-F97 HydrophobicContact CH2-CE1 3.08Å; W53-F97 HydrophobicContact CH2-CE2 4.38Å; W53-F97 AromaticContact CH2-CZ 3.16Å; W53-F97 HydrophobicContact CH2-CZ 3.16Å; W53-F97 HydrophobicContact CZ2-CD1 4.12Å; W53-F97 AromaticContact CZ2-CE1 3.27Å; W53-F97 HydrophobicContact CZ2-CE1 3.27Å; W53-F97 AromaticContact CZ2-CZ 3.86Å; W53-F97 HydrophobicContact CZ2-CZ 3.86Å; W53-F97 HydrophobicContact CZ3-CE1 4.04Å; W53-F97 AromaticContact CZ3-CZ 3.72Å; W53-F97 HydrophobicContact CZ3-CZ 3.72Å
54	N	43.3	Very low	47.6	Very low	155 Å²	155	82 Å²	82	83%	0.829	44%	0.437	S	S	*	.			trans	-83	67.5	179.2	-140.9	3.6	0	0	0	109.8
55	L	53.9	Low	47.6	Very low	39 Å²	39	83.9 Å²	83.9	20%	0.204	45%	0.45	C	S	.	.			trans	-72.2	147.6	-177.9	-77	158.7	0	0	0	111	W53 I59 L61 F79 L95	W53-L55 HydrophobicContact CB-CD1 4.2Å; W53-L55 HydrophobicContact CB-CG 4.18Å; W53-L55 HydrophobicContact CE3-CD1 4.49Å; W53-L55 PolarHBondContact O-N 3.29Å; L55-I59 HydrophobicContact CD2-CG2 4.37Å; L55-L61 HydrophobicContact CD1-CB 4.29Å; L55-L61 HydrophobicContact CD1-CD1 4.48Å; L55-F79 HydrophobicContact CD1-CE1 4.49Å; L55-F79 HydrophobicContact CD2-CE1 4.29Å; L55-L95 HydrophobicContact CD2-CD1 3.85Å
56	P	56.5	Low	47.1	Very low	37 Å²	37	89.9 Å²	89.9	24%	0.24	47%	0.472	C	S	.	.			trans	-54.7	140.2	169.5	-20.4	30.9	0	0	0	110.6	C58 I59 M89	P56-C58 PolarHBondContact O-N 3.03Å; P56-I59 PolarHBondContact O-N 2.71Å; P56-M89 HydrophobicContact CB-CE 3.27Å; P56-M89 HydrophobicContact CB-SD 3.63Å; P56-M89 HydrophobicContact CG-CE 3.39Å; P56-M89 HydrophobicContact CG-SD 3.22Å; P56-M89 WeakPolarHBondContact CG-SD 3.36Å
57	S	59.5	Low	46.6	Very low	100 Å²	100	89.2 Å²	89.2	70%	0.699	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-9.7	-174.8	55.8	0	0	0	0	115.5
58	C	63.5	Low	46.4	Very low	0 Å²	0	89.1 Å²	89.1	0%	0	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-7.4	176.1	69.7	0	0	0	0	115.1	P56 G81 L82 C83 D87	P56-C58 PolarHBondContact O-N 3.03Å; C58-G81 CarbonylContact O-C 3.49Å; C58-G81 WeakPolarHBondContact O-CA 3.47Å; C58-L82 PolarHBondContact O-N 3.38Å; C58-C83 HydrophobicContact CB-CB 3.83Å; C58-C83 WeakPolarHBondContact CB-SG 3.47Å; C58-C83 WeakPolarHBondContact SG-CB 3.37Å; C58-C83 CovalentContact SG-SG 2.06Å; C58-C83 PolarHBondContact SG-SG 3.35Å; C58-D87 WeakPolarHBondContact CB-OD2 3.29Å
59	I	60.6	Low	45.8	Very low	23 Å²	23	95.6 Å²	95.6	12%	0.118	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.9	-176.8	-54.3	179.8	0	0	0	110	F39 L55 P56 F79 L116	F39-I59 HydrophobicContact CZ-CD1 4.13Å; F39-I59 HydrophobicContact CZ-CG1 4.1Å; L55-I59 HydrophobicContact CD2-CG2 4.37Å; P56-I59 PolarHBondContact O-N 2.71Å; I59-F79 HydrophobicContact CG2-CB 4.37Å; I59-F79 HydrophobicContact CG2-CD1 3.95Å; I59-L116 HydrophobicContact CD1-CD2 4.46Å
60	H	61.6	Low	45.5	Very low	102 Å²	102	94.3 Å²	94.3	47%	0.472	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	134.5	174.6	-159.8	-66.7	0	0	0	111	K80 Y174	H60-K80 PolarHBondContact N-O 2.78Å; H60-K80 PolarHBondContact O-N 2.97Å; H60-Y174 HydrophobicContact CB-CD1 4.15Å; H60-Y174 HydrophobicContact CB-CE1 3.72Å
61	L	54.3	Low	45.4	Very low	34 Å²	34	100.1 Å²	100.1	18%	0.178	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	131.1	173.7	-159	92.4	0	0	0	109.6	W53 L55 I77 F79	W53-L61 HydrophobicContact CZ3-CD1 4.47Å; L55-L61 HydrophobicContact CD1-CB 4.29Å; L55-L61 HydrophobicContact CD1-CD1 4.48Å; L61-I77 HydrophobicContact CD1-CG2 3.34Å; L61-I77 HydrophobicContact CD2-CG2 4.34Å; L61-I77 HydrophobicContact CG-CG2 3.85Å; L61-F79 HydrophobicContact CD1-CD1 3.89Å; L61-F79 HydrophobicContact CD1-CE1 3.31Å; L61-F79 HydrophobicContact CD1-CE2 4.15Å; L61-F79 HydrophobicContact CD1-CZ 3.45Å; L61-F79 VanDerWaalsContact CD1-CZ 3.45Å
62	I	53.6	Low	45.2	Very low	61 Å²	61	98.3 Å²	98.3	31%	0.313	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	113.1	170	-53.9	176.2	0	0	0	106.8	T78 K80	I62-T78 WeakPolarHBondContact CB-OG1 3.31Å; I62-T78 PolarHBondContact N-O 3.34Å; I62-T78 PolarHBondContact O-N 3.1Å; I62-T78 PolarHBondContact O-OG1 3.42Å; I62-K80 HydrophobicContact CD1-CB 4.34Å; I62-K80 HydrophobicContact CD1-CD 3.71Å; I62-K80 HydrophobicContact CD1-CG 3.83Å
63	S	49.9	Very low	45.1	Very low	62 Å²	62	93.5 Å²	93.5	43%	0.434	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	131.8	170.6	58.8	0	0	0	0	109.4	H50	H50-S63 VanDerWaalsContact CE1-CB 3.46Å; H50-S63 WeakPolarHBondContact CE1-CB 3.24Å; H50-S63 WeakPolarHBondContact NE2-CB 3.46Å
64	K	42	Very low	44.7	Very low	95 Å²	95	95 Å²	95	41%	0.413	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	105.1	170.1	-83.1	-172.1	172.3	-170	0	108.5	S76	K64-S76 PolarHBondContact N-O 2.98Å
65	S	40.7	Very low	44.4	Very low	96 Å²	96	89.8 Å²	89.8	67%	0.671	50%	0.498	S	S	*	.			trans	-84.1	108.6	167.3	56.7	0	0	0	0	108.9	T67	S65-T67 PolarHBondContact O-N 2.88Å
66	Y	36.7	Very low	43.8	Very low	163 Å²	163	88.9 Å²	88.9	64%	0.639	50%	0.495	S	S	*	.			trans	-79.2	101.9	168.9	-74.5	-80.7	0	0	0	108.8	T68	Y66-T68 PolarHBondContact O-N 2.83Å
67	T	31.3	Very low	43.1	Very low	128 Å²	128	87.1 Å²	87.1	79%	0.785	48%	0.483	S	S	*	.			trans	-85.7	77.7	171	50.7	0	0	0	0	109.9	S65	S65-T67 PolarHBondContact O-N 2.88Å
68	T	32.3	Very low	42.8	Very low	126 Å²	126	82.4 Å²	82.4	77%	0.773	45%	0.451	S	S	*	.			trans	-145.9	112.9	158.8	45.4	0	0	0	0	109.3	Y66 N70	Y66-T68 PolarHBondContact O-N 2.83Å; T68-N70 PolarHBondContact O-N 3.11Å
69	I	28.7	Very low	42.4	Very low	166 Å²	166	83.3 Å²	83.3	85%	0.851	45%	0.454	S	S	*	.			trans	-56.7	112.6	-176.3	-65.2	156.3	0	0	0	110.5
70	N	31.6	Very low	42.3	Very low	143 Å²	143	85.5 Å²	85.5	77%	0.765	46%	0.463	S	S	*	.	S	Bend	trans	-174.8	106.4	133.8	-90.5	-11.6	0	0	0	110.3	T68 T72	T68-N70 PolarHBondContact O-N 3.11Å; N70-T72 PolarHBondContact O-N 3.33Å; N70-T72 VanDerWaalsContact O-N 3.17Å
71	E	35.6	Very low	42.4	Very low	195 Å²	195	80.7 Å²	80.7	91%	0.911	44%	0.441	S	S	*	.	S	Bend	trans	59.7	4.7	154.7	-68.3	-165.3	165.1	0	0	124.7
72	T	33	Very low	42.8	Very low	98 Å²	98	79.5 Å²	79.5	60%	0.601	44%	0.435	S	S	*	.			trans	-140.5	102.3	155.1	52.7	0	0	0	0	111.4	N70 K74	N70-T72 PolarHBondContact O-N 3.33Å; N70-T72 VanDerWaalsContact O-N 3.17Å; T72-K74 PolarHBondContact O-N 3.44Å
73	G	33	Very low	43.1	Very low	68 Å²	68	76.9 Å²	76.9	70%	0.701	42%	0.421	S	S	*	.			trans	-70.3	63.2	176.8	0	0	0	0	0	112.7
74	K	36.6	Very low	43.6	Very low	104 Å²	104	75 Å²	75	45%	0.452	41%	0.406	S	S	.	.			trans	-86.4	115.8	178.7	-70.8	178.7	176.9	-175.8	0	109.8	T72	T72-K74 PolarHBondContact O-N 3.44Å
75	I	36.7	Very low	44.2	Very low	45 Å²	45	74.6 Å²	74.6	23%	0.231	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	117.1	169.1	-59.8	175.4	0	0	0	107	I45	I45-I75 PolarHBondContact N-O 2.94Å; I45-I75 PolarHBondContact O-N 3.42Å
76	S	42.2	Very low	45	Very low	20 Å²	20	72.2 Å²	72.2	14%	0.14	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	116.8	172	65.2	0	0	0	0	109.3	L43 K64	L43-S76 WeakPolarHBondContact O-CA 3.43Å; K64-S76 PolarHBondContact N-O 2.98Å
77	I	41.7	Very low	46	Very low	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	125	170.5	-71.5	175.2	0	0	0	107.8	F42 L43 I45 S48 L61 F79	F42-I77 WeakPolarHBondContact CA-O 3.48Å; L43-I77 PolarHBondContact N-O 2.97Å; L43-I77 PolarHBondContact O-N 3.31Å; I45-I77 HydrophobicContact CB-CD1 4.28Å; I45-I77 HydrophobicContact CD1-CB 4.44Å; I45-I77 HydrophobicContact CD1-CD1 3.66Å; I45-I77 HydrophobicContact CD1-CG1 4.44Å; I45-I77 HydrophobicContact CG1-CD1 4.48Å; S48-I77 WeakPolarHBondContact OG-CD1 3.3Å; L61-I77 HydrophobicContact CD1-CG2 3.34Å; L61-I77 HydrophobicContact CD2-CG2 4.34Å; L61-I77 HydrophobicContact CG-CG2 3.85Å; I77-F79 HydrophobicContact CG2-CD2 4.16Å; I77-F79 HydrophobicContact CG2-CE2 3.55Å; I77-F79 HydrophobicContact CG2-CZ 3.91Å
78	T	54.1	Low	46.8	Very low	2 Å²	2	65.2 Å²	65.2	1%	0.012	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	116.3	175.8	47.9	0	0	0	0	111.7	I41 F42 I62	I41-T78 CarbonylContact O-C 3.58Å; I41-T78 VanDerWaalsContact O-CA 3.32Å; I41-T78 WeakPolarHBondContact O-CA 3.37Å; F42-T78 HydrophobicContact CB-CG2 4.42Å; F42-T78 HydrophobicContact CD1-CG2 3.04Å; F42-T78 HydrophobicContact CD2-CG2 4.37Å; F42-T78 HydrophobicContact CE1-CG2 3.12Å; F42-T78 HydrophobicContact CE2-CG2 4.43Å; F42-T78 HydrophobicContact CG-CG2 3.7Å; F42-T78 HydrophobicContact CZ-CG2 3.85Å; I62-T78 WeakPolarHBondContact CB-OG1 3.31Å; I62-T78 PolarHBondContact N-O 3.34Å; I62-T78 PolarHBondContact O-N 3.1Å; I62-T78 PolarHBondContact O-OG1 3.42Å
79	F	55.3	Low	47.4	Very low	19 Å²	19	61.4 Å²	61.4	8%	0.083	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	118.9	168.7	-65.5	-91.4	0	0	0	108.7	N40 I41 L43 W53 L55 I59 L61 I77	N40-F79 VanDerWaalsContact CA-O 3.27Å; N40-F79 WeakPolarHBondContact CA-O 3.22Å; I41-F79 HydrophobicContact CB-CB 4.41Å; I41-F79 PolarHBondContact N-O 3.08Å; I41-F79 PolarHBondContact O-N 3.4Å; L43-F79 HydrophobicContact CD1-CD2 4.19Å; L43-F79 HydrophobicContact CD1-CE2 3.47Å; L43-F79 VanDerWaalsContact CD1-CE2 3.47Å; L43-F79 HydrophobicContact CD1-CZ 4.32Å; L43-F79 HydrophobicContact CG-CD2 4.41Å; L43-F79 HydrophobicContact CG-CE2 4.08Å; W53-F79 HydrophobicContact CE3-CE1 4.43Å; W53-F79 HydrophobicContact CE3-CZ 4.49Å; W53-F79 HydrophobicContact CH2-CZ 4.14Å; W53-F79 AromaticContact CZ3-CE1 3.95Å; W53-F79 HydrophobicContact CZ3-CE1 3.95Å; W53-F79 AromaticContact CZ3-CZ 3.62Å; W53-F79 HydrophobicContact CZ3-CZ 3.62Å; L55-F79 HydrophobicContact CD1-CE1 4.49Å; L55-F79 HydrophobicContact CD2-CE1 4.29Å; I59-F79 HydrophobicContact CG2-CB 4.37Å; I59-F79 HydrophobicContact CG2-CD1 3.95Å; L61-F79 HydrophobicContact CD1-CD1 3.89Å; L61-F79 HydrophobicContact CD1-CE1 3.31Å; L61-F79 HydrophobicContact CD1-CE2 4.15Å; L61-F79 HydrophobicContact CD1-CZ 3.45Å; L61-F79 VanDerWaalsContact CD1-CZ 3.45Å; I77-F79 HydrophobicContact CG2-CD2 4.16Å; I77-F79 HydrophobicContact CG2-CE2 3.55Å; I77-F79 HydrophobicContact CG2-CZ 3.91Å
80	K	57.2	Low	48.3	Very low	69 Å²	69	58.9 Å²	58.9	30%	0.3	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.1	169.8	-63.8	-149.9	175.7	174	0	109.5	F39 N40 H60 I62 Y174	F39-K80 WeakPolarHBondContact O-CA 3.27Å; N40-K80 WeakPolarHBondContact OD1-CD 3.43Å; N40-K80 VanDerWaalsContact OD1-CE 3.24Å; N40-K80 WeakPolarHBondContact OD1-CE 3.47Å; N40-K80 WeakPolarHBondContact OD1-CG 3.28Å; H60-K80 PolarHBondContact N-O 2.78Å; H60-K80 PolarHBondContact O-N 2.97Å; I62-K80 HydrophobicContact CD1-CB 4.34Å; I62-K80 HydrophobicContact CD1-CD 3.71Å; I62-K80 HydrophobicContact CD1-CG 3.83Å; K80-Y174 WeakPolarHBondContact CB-OH 3.41Å
81	G	63.1	Low	48.8	Very low	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	156	-179.9	0	0	0	0	0	113.6	I38 F39 C58	I38-G81 WeakPolarHBondContact CA-O 3.49Å; F39-G81 WeakPolarHBondContact CD1-O 3.36Å; F39-G81 PolarHBondContact N-O 3.31Å; F39-G81 PolarHBondContact O-N 3.03Å; C58-G81 CarbonylContact O-C 3.49Å; C58-G81 WeakPolarHBondContact O-CA 3.47Å
82	L	63.8	Low	49.1	Very low	10 Å²	10	55.3 Å²	55.3	5%	0.052	31%	0.314	C	S	.	.			trans	-136.9	84.5	170.6	-167.4	94.4	0	0	0	108.8	I38 C58 F84 Y174 R177	I38-L82 HydrophobicContact CB-CD1 4.38Å; I38-L82 HydrophobicContact CG1-CD1 3.44Å; I38-L82 VanDerWaalsContact CG1-CD1 3.44Å; C58-L82 PolarHBondContact O-N 3.38Å; L82-F84 HydrophobicContact CD2-CE2 3.73Å; L82-F84 HydrophobicContact CD2-CZ 3.77Å; L82-F84 HydrophobicContact CG-CE2 4.24Å; L82-F84 HydrophobicContact CG-CZ 4.2Å; L82-Y174 HydrophobicContact CB-CD2 4.42Å; L82-Y174 HydrophobicContact CB-CE2 4.48Å; L82-R177 HydrophobicContact CD2-CB 3.67Å; L82-R177 PolarHBondContact O-NH1 3.02Å
83	C	60.4	Low	49.5	Very low	5 Å²	5	55.6 Å²	55.6	3%	0.034	31%	0.312	C	S	.	.			trans	-97.3	141.6	-173	-58.9	0	0	0	0	112.5	G36 C58 L125	G36-C83 PolarHBondContact N-O 3.37Å; C58-C83 HydrophobicContact CB-CB 3.83Å; C58-C83 WeakPolarHBondContact CB-SG 3.47Å; C58-C83 WeakPolarHBondContact SG-CB 3.37Å; C58-C83 CovalentContact SG-SG 2.06Å; C58-C83 PolarHBondContact SG-SG 3.35Å; C83-L125 HydrophobicContact CB-CD1 3.86Å
84	F	59.7	Low	49.8	Very low	23 Å²	23	57.7 Å²	57.7	10%	0.101	30%	0.304	C	S	.	.			trans	-119.2	163	176.9	-66.8	-70.1	0	0	0	111.4	G36 L82 C86 D87 I169 R177 L216	G36-F84 VanDerWaalsContact CA-CE1 3.41Å; L82-F84 HydrophobicContact CD2-CE2 3.73Å; L82-F84 HydrophobicContact CD2-CZ 3.77Å; L82-F84 HydrophobicContact CG-CE2 4.24Å; L82-F84 HydrophobicContact CG-CZ 4.2Å; F84-C86 PolarHBondContact O-N 3.12Å; F84-C86 VanDerWaalsContact O-N 3.1Å; F84-D87 PolarHBondContact N-OD2 3.4Å; F84-D87 PolarHBondContact O-N 3.03Å; F84-D87 VanDerWaalsContact O-N 3.08Å; F84-I169 HydrophobicContact CD2-CG2 3.57Å; F84-I169 HydrophobicContact CE2-CG2 3.4Å; F84-I169 HydrophobicContact CG-CG2 4.21Å; F84-I169 HydrophobicContact CZ-CG2 3.94Å; F84-R177 HydrophobicContact CE2-CG 4.36Å; F84-L216 HydrophobicContact CD1-CD1 4.34Å; F84-L216 HydrophobicContact CE1-CB 3.88Å; F84-L216 HydrophobicContact CE1-CD1 3.2Å; F84-L216 HydrophobicContact CE1-CG 4.03Å; F84-L216 HydrophobicContact CZ-CD1 3.38Å
85	Q	54.8	Low	50	Low	86 Å²	86	55.2 Å²	55.2	40%	0.402	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-23.5	-178.5	-173.3	172.6	-2.1	0	0	113.9	F245	Q85-F245 HydrophobicContact CB-CE1 4.34Å; Q85-F245 HydrophobicContact CB-CZ 4.15Å; Q85-F245 HydrophobicContact CG-CE2 4.49Å; Q85-F245 HydrophobicContact CG-CZ 4.13Å
86	C	57.4	Low	50.2	Low	46 Å²	46	56.1 Å²	56.1	31%	0.311	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-9.1	178.3	50.6	0	0	0	0	115	F84 S88 C170	F84-C86 PolarHBondContact O-N 3.12Å; F84-C86 VanDerWaalsContact O-N 3.1Å; C86-S88 PolarHBondContact O-N 3.03Å; C86-C170 HydrophobicContact CB-CB 3.86Å; C86-C170 WeakPolarHBondContact CB-SG 2.81Å; C86-C170 WeakPolarHBondContact SG-CB 3.47Å; C86-C170 CovalentContact SG-SG 2.03Å; C86-C170 PolarHBondContact SG-SG 3.4Å
87	D	57.2	Low	50	Low	24 Å²	24	58.4 Å²	58.4	13%	0.128	31%	0.313	C	S	.	.	S	Bend	trans	-74.4	95.7	173.1	-59.7	-40.1	0	0	0	107.6	C58 F84 M89 R177	C58-D87 WeakPolarHBondContact CB-OD2 3.29Å; F84-D87 PolarHBondContact N-OD2 3.4Å; F84-D87 PolarHBondContact O-N 3.03Å; F84-D87 VanDerWaalsContact O-N 3.08Å; D87-M89 PolarHBondContact O-N 3.44Å; D87-M89 VanDerWaalsContact O-N 3.07Å; D87-R177 IonicContact OD1-CZ 3.38Å; D87-R177 IonicContact OD1-NH1 3.58Å; D87-R177 PolarHBondContact OD1-NH1 2.84Å; D87-R177 IonicContact OD1-NH2 3.91Å; D87-R177 PolarHBondContact OD1-NH2 2.8Å; D87-R177 IonicContact OD2-CZ 3.39Å; D87-R177 IonicContact OD2-NH1 2.68Å; D87-R177 PolarHBondContact OD2-NH1 2.03Å; D87-R177 IonicContact OD2-NH2 2.67Å
88	S	47.6	Very low	49.7	Very low	121 Å²	121	62.3 Å²	62.3	85%	0.846	33%	0.334	S	S	*	.			trans	-65.5	108.3	-177.2	58.9	0	0	0	0	110.7	C86	C86-S88 PolarHBondContact O-N 3.03Å
89	M	46.7	Very low	49	Very low	45 Å²	45	69.8 Å²	69.8	22%	0.222	37%	0.369	C	S	.	.			trans	-88.3	119.1	174.3	-66.7	-92.8	175.9	0	0	108.5	P56 D87 I91 L116	P56-M89 HydrophobicContact CB-CE 3.27Å; P56-M89 HydrophobicContact CB-SD 3.63Å; P56-M89 HydrophobicContact CG-CE 3.39Å; P56-M89 HydrophobicContact CG-SD 3.22Å; P56-M89 WeakPolarHBondContact CG-SD 3.36Å; D87-M89 PolarHBondContact O-N 3.44Å; D87-M89 VanDerWaalsContact O-N 3.07Å; M89-I91 PolarHBondContact O-N 3.17Å; M89-L116 HydrophobicContact CE-CD2 3.49Å; M89-L116 VanDerWaalsContact CE-CD2 3.49Å; M89-L116 HydrophobicContact SD-CD2 3.74Å
90	N	46.1	Very low	47.9	Very low	114 Å²	114	75.6 Å²	75.6	61%	0.61	40%	0.401	S	S	*	.			trans	-70.1	116.9	171	-157.2	4.1	0	0	0	107.4	N92 N93	N90-N92 PolarHBondContact O-N 3.45Å; N90-N93 PolarHBondContact O-N 3.33Å
91	I	43.5	Very low	46.5	Very low	135 Å²	135	82.8 Å²	82.8	69%	0.692	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-18.7	-171.1	-65.4	168	0	0	0	112.3	M89	M89-I91 PolarHBondContact O-N 3.17Å
92	N	40.7	Very low	44.8	Very low	128 Å²	128	88.7 Å²	88.7	68%	0.684	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	6.3	-176.5	-60.4	-7.2	0	0	0	114.4	N90 E94	N90-N92 PolarHBondContact O-N 3.45Å; N92-E94 PolarHBondContact O-N 2.96Å
93	N	40.8	Very low	43	Very low	103 Å²	103	97.6 Å²	97.6	55%	0.551	50%	0.502	S	S	*	.			trans	-76.8	80.9	172.9	-80.7	10.4	0	0	0	109.5	N90 L95	N90-N93 PolarHBondContact O-N 3.33Å; N93-L95 PolarHBondContact O-N 3.43Å
94	E	40.8	Very low	41.2	Very low	112 Å²	112	105.1 Å²	105.1	52%	0.523	54%	0.541	S	S	.	.			trans	-72.5	118.6	167.5	-70.7	-177.7	173.9	0	0	109.1	N92 S96 Y115	N92-E94 PolarHBondContact O-N 2.96Å; E94-S96 VanDerWaalsContact C-N 3.27Å; E94-S96 PolarHBondContact O-N 3.15Å; E94-Y115 HydrophobicContact CG-CD1 4.36Å; E94-Y115 HydrophobicContact CG-CE1 3.8Å
95	L	40.3	Very low	39.5	Very low	52 Å²	52	111.7 Å²	111.7	27%	0.272	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.3	83.7	161.5	-87.4	146.6	0	0	0	106.9	W53 L55 N93	W53-L95 HydrophobicContact CB-CD2 4.45Å; W53-L95 HydrophobicContact CD2-CD2 3.91Å; W53-L95 HydrophobicContact CE3-CD2 3.4Å; W53-L95 VanDerWaalsContact CE3-CD2 3.4Å; W53-L95 HydrophobicContact CG-CD2 4.35Å; W53-L95 HydrophobicContact CZ3-CD2 4.03Å; L55-L95 HydrophobicContact CD2-CD1 3.85Å; N93-L95 PolarHBondContact O-N 3.43Å
96	S	41	Very low	38	Very low	64 Å²	64	118.2 Å²	118.2	45%	0.448	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.3	126.2	171.8	56.9	0	0	0	0	109.7	E94 N98	E94-S96 VanDerWaalsContact C-N 3.27Å; E94-S96 PolarHBondContact O-N 3.15Å; S96-N98 VanDerWaalsContact C-N 3.32Å; S96-N98 PolarHBondContact O-N 3.04Å
97	F	38.6	Very low	36.7	Very low	68 Å²	68	122.3 Å²	122.3	30%	0.298	62%	0.618	S	S	.	*			trans	-89.3	65	177.1	-66.1	-102.3	0	0	0	109.5	I45 W53 Y112	I45-F97 HydrophobicContact CD1-CE1 4.49Å; W53-F97 HydrophobicContact CH2-CD1 4.26Å; W53-F97 AromaticContact CH2-CE1 3.08Å; W53-F97 HydrophobicContact CH2-CE1 3.08Å; W53-F97 HydrophobicContact CH2-CE2 4.38Å; W53-F97 AromaticContact CH2-CZ 3.16Å; W53-F97 HydrophobicContact CH2-CZ 3.16Å; W53-F97 HydrophobicContact CZ2-CD1 4.12Å; W53-F97 AromaticContact CZ2-CE1 3.27Å; W53-F97 HydrophobicContact CZ2-CE1 3.27Å; W53-F97 AromaticContact CZ2-CZ 3.86Å; W53-F97 HydrophobicContact CZ2-CZ 3.86Å; W53-F97 HydrophobicContact CZ3-CE1 4.04Å; W53-F97 AromaticContact CZ3-CZ 3.72Å; W53-F97 HydrophobicContact CZ3-CZ 3.72Å; F97-Y112 VanDerWaalsContact CD2-O 3.26Å; F97-Y112 WeakPolarHBondContact CD2-O 3.32Å
98	N	35.7	Very low	35.6	Very low	83 Å²	83	128.2 Å²	128.2	44%	0.444	65%	0.649	S	S	.	*			trans	-101.4	118.4	-171.2	-105.7	52.7	0	0	0	116.1	S96 N100 D111	S96-N98 VanDerWaalsContact C-N 3.32Å; S96-N98 PolarHBondContact O-N 3.04Å; N98-N100 PolarHBondContact O-N 3.23Å; N98-D111 PolarHBondContact OD1-OD2 3.47Å
99	E	38.6	Very low	35.1	Very low	158 Å²	158	126.2 Å²	126.2	74%	0.738	63%	0.629	S	S	*	*	S	Bend	trans	56.8	-19.7	139.2	-66.1	-166.4	150.9	0	0	124.2
100	N	31.2	Very low	34.8	Very low	141 Å²	141	127 Å²	127	75%	0.754	63%	0.634	S	S	*	*			trans	-96	10.6	-168.3	-84.9	-12.5	0	0	0	118.3	N98 T102	N98-N100 PolarHBondContact O-N 3.23Å; N100-T102 PolarHBondContact O-N 3.43Å
101	Y	29.5	Very low	34.7	Very low	221 Å²	221	123.3 Å²	123.3	87%	0.867	61%	0.614	S	S	*	*	S	Bend	trans	-100.7	84.9	168.4	-67.2	-74.7	0	0	0	110.4	K103	Y101-K103 PolarHBondContact O-N 2.92Å
102	T	26.9	Very low	34.9	Very low	123 Å²	123	119.4 Å²	119.4	76%	0.755	59%	0.591	S	S	*	*			trans	-52	127.4	-178.5	48.3	0	0	0	0	113.3	N100	N100-T102 PolarHBondContact O-N 3.43Å
103	K	25.9	Very low	35.2	Very low	197 Å²	197	113.9 Å²	113.9	86%	0.857	56%	0.562	S	S	*	*			trans	66.8	84	160.6	-67.7	179	175.5	176.3	0	116.4	Y101	Y101-K103 PolarHBondContact O-N 2.92Å
104	L	22.4	Very low	35.4	Very low	163 Å²	163	110.1 Å²	110.1	85%	0.853	54%	0.541	S	S	*	.	S	Bend	trans	-155.2	102.2	137.1	-99.6	139.8	0	0	0	109.9
105	L	23.8	Very low	35.9	Very low	162 Å²	162	108 Å²	108	85%	0.848	53%	0.529	S	S	*	.			trans	73.5	113.6	169.8	-84.6	84.7	0	0	0	119.3	N107	L105-N107 PolarHBondContact O-N 3.36Å
106	Y	24.2	Very low	36.2	Very low	222 Å²	222	107.3 Å²	107.3	87%	0.871	53%	0.525	S	S	*	.			trans	-37.5	108.7	158.9	-112	-105.1	0	0	0	112.9
107	N	29.9	Very low	36.6	Very low	133 Å²	133	106.3 Å²	106.3	71%	0.711	52%	0.515	S	S	*	.				-155.5	113	123.2	-142.8	9.8	0	0	0	108.4	L105 D109	L105-N107 PolarHBondContact O-N 3.36Å; N107-D109 VanDerWaalsContact C-N 3.27Å; N107-D109 PolarHBondContact O-N 2.93Å
108	N	32.7	Very low	37	Very low	147 Å²	147	107.5 Å²	107.5	79%	0.786	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	31.2	-152.6	-132.7	31.2	0	0	0	114.6
109	D	38.1	Very low	37.6	Very low	80 Å²	80	110.7 Å²	110.7	43%	0.428	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.5	-7.3	-163.5	-90.8	-39.6	0	0	0	117.3	N107 D111 N133	N107-D109 VanDerWaalsContact C-N 3.27Å; N107-D109 PolarHBondContact O-N 2.93Å; D109-D111 PolarHBondContact O-N 3.47Å; D109-N133 HydrophobicContact CB-CB 3.75Å; D109-N133 WeakPolarHBondContact O-CB 3.35Å; D109-N133 PolarHBondContact OD1-ND2 3.29Å
110	N	41	Very low	37.8	Very low	61 Å²	61	112 Å²	112	33%	0.326	54%	0.537	S	S	.	.			trans	-106	60.3	-167.4	-66.2	8.1	0	0	0	114.1	Y112 N133 S134	N110-Y112 HydrophobicContact CB-CE2 3.89Å; N110-Y112 PolarHBondContact O-N 3.08Å; N110-N133 PolarHBondContact OD1-O 2.84Å; N110-S134 PolarHBondContact OD1-OG 2.94Å
111	D	43	Very low	38.5	Very low	36 Å²	36	110.8 Å²	110.8	19%	0.193	54%	0.535	C	S	.	.			trans	-69.7	113.2	160.6	-82.3	-2.6	0	0	0	109.1	N98 D109 K132	N98-D111 PolarHBondContact OD1-OD2 3.47Å; D109-D111 PolarHBondContact O-N 3.47Å; D111-K132 HydrophobicContact CB-CB 4.27Å; D111-K132 HydrophobicContact CB-CD 3.93Å; D111-K132 HydrophobicContact CB-CG 4.27Å; D111-K132 PolarHBondContact O-N 2.73Å; D111-K132 VanDerWaalsContact O-N 3.08Å; D111-K132 IonicContact OD2-NZ 2.73Å; D111-K132 PolarHBondContact OD2-NZ 3.49Å
112	Y	47.2	Very low	39.5	Very low	54 Å²	54	106 Å²	106	21%	0.212	52%	0.524	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	131.4	164.8	-62.3	-80	0	0	0	109.1	F97 N110 N130 S131 F138	F97-Y112 VanDerWaalsContact CD2-O 3.26Å; F97-Y112 WeakPolarHBondContact CD2-O 3.32Å; N110-Y112 HydrophobicContact CB-CE2 3.89Å; N110-Y112 PolarHBondContact O-N 3.08Å; Y112-N130 WeakPolarHBondContact CA-O 3.36Å; Y112-S131 WeakPolarHBondContact CE1-OG 3.36Å; Y112-F138 HydrophobicContact CE1-CE2 4.46Å
113	V	46.7	Very low	40.7	Very low	12 Å²	12	102.5 Å²	102.5	7%	0.073	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.4	170.2	-170.5	0	0	0	0	108.3	Y115 N130	V113-Y115 HydrophobicContact CB-CE2 3.78Å; V113-Y115 HydrophobicContact CG1-CD2 4.12Å; V113-Y115 HydrophobicContact CG1-CE1 4.01Å; V113-Y115 HydrophobicContact CG1-CE2 3.43Å; V113-Y115 VanDerWaalsContact CG1-CE2 3.43Å; V113-Y115 WeakPolarHBondContact CG1-OH 3.26Å; V113-N130 PolarHBondContact N-O 3.24Å; V113-N130 PolarHBondContact O-N 3.29Å; V113-N130 VanDerWaalsContact O-N 3.07Å
114	M	46.7	Very low	41.7	Very low	23 Å²	23	96.8 Å²	96.8	11%	0.113	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	119.9	176.4	-69.1	-162.1	177.4	0	0	110.6	L43 N128 I129	L43-M114 HydrophobicContact CD1-CE 3.25Å; L43-M114 HydrophobicContact CD1-SD 4.02Å; L43-M114 HydrophobicContact CD2-CE 3.81Å; L43-M114 HydrophobicContact CG-CE 4.18Å; M114-N128 WeakPolarHBondContact CA-O 3.28Å; M114-I129 HydrophobicContact CE-CB 4.48Å; M114-I129 HydrophobicContact CE-CD1 3.73Å; M114-I129 HydrophobicContact CE-CG1 3.86Å; M114-I129 HydrophobicContact CE-CG2 3.85Å; M114-I129 HydrophobicContact CG-CG1 4.14Å; M114-I129 HydrophobicContact CG-CG2 4.36Å; M114-I129 HydrophobicContact SD-CD1 4.43Å; M114-I129 HydrophobicContact SD-CG1 4.22Å
115	Y	49.7	Very low	43.2	Very low	67 Å²	67	89.6 Å²	89.6	26%	0.263	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.8	174.6	-57.8	-89.9	0	0	0	109.5	E94 V113 L127 N128	E94-Y115 HydrophobicContact CG-CD1 4.36Å; E94-Y115 HydrophobicContact CG-CE1 3.8Å; V113-Y115 HydrophobicContact CB-CE2 3.78Å; V113-Y115 HydrophobicContact CG1-CD2 4.12Å; V113-Y115 HydrophobicContact CG1-CE1 4.01Å; V113-Y115 HydrophobicContact CG1-CE2 3.43Å; V113-Y115 VanDerWaalsContact CG1-CE2 3.43Å; V113-Y115 WeakPolarHBondContact CG1-OH 3.26Å; Y115-L127 CarbonylContact O-C 3.59Å; Y115-L127 WeakPolarHBondContact O-CA 3.47Å; Y115-N128 PolarHBondContact N-O 2.97Å; Y115-N128 PolarHBondContact O-N 3.09Å
116	L	47.6	Very low	44.6	Very low	38 Å²	38	82.7 Å²	82.7	20%	0.199	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	98.3	168.9	-158.9	94.8	0	0	0	108.9	I59 M89 L125 L127	I59-L116 HydrophobicContact CD1-CD2 4.46Å; M89-L116 HydrophobicContact CE-CD2 3.49Å; M89-L116 VanDerWaalsContact CE-CD2 3.49Å; M89-L116 HydrophobicContact SD-CD2 3.74Å; L116-L125 HydrophobicContact CD2-CD1 4.5Å; L116-L125 HydrophobicContact CD2-CD2 4.24Å; L116-L127 HydrophobicContact CD1-CB 3.99Å; L116-L127 HydrophobicContact CD1-CD1 3.58Å; L116-L127 HydrophobicContact CD1-CG 4.38Å
117	N	49.9	Very low	45.9	Very low	44 Å²	44	72.8 Å²	72.8	24%	0.235	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131.6	-175.1	-73	-18.4	0	0	0	111.3	Y119 L126	N117-Y119 HydrophobicContact CB-CD2 4.36Å; N117-Y119 HydrophobicContact CB-CE2 4.41Å; N117-L126 PolarHBondContact N-O 2.97Å; N117-L126 PolarHBondContact O-N 2.81Å
118	N	46.3	Very low	47	Very low	93 Å²	93	67.5 Å²	67.5	50%	0.497	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	98.8	171.6	-170.4	8.4	0	0	0	109.1	L125	N118-L125 HydrophobicContact CB-CD2 4.09Å
119	Y	47.3	Very low	48.1	Very low	149 Å²	149	61.1 Å²	61.1	58%	0.584	31%	0.305	S	S	*	.			trans	-82.6	141.6	174.7	-96.2	-84.3	0	0	0	110.7	N117 V121 L126	N117-Y119 HydrophobicContact CB-CD2 4.36Å; N117-Y119 HydrophobicContact CB-CE2 4.41Å; Y119-V121 PolarHBondContact O-N 3Å; Y119-L126 HydrophobicContact CD2-CB 4.47Å; Y119-L126 HydrophobicContact CD2-CD2 4.08Å; Y119-L126 HydrophobicContact CE2-CD2 4Å
120	H	43.7	Very low	48.7	Very low	186 Å²	186	59.8 Å²	59.8	86%	0.861	30%	0.298	S	S	*	.	S	Bend	trans	-58.8	10.6	-177.9	-94.5	-67.2	0	0	0	116.4	N122	H120-N122 VanDerWaalsContact C-N 3.33Å; H120-N122 PolarHBondContact O-N 3.04Å
121	V	45	Very low	49.2	Very low	116 Å²	116	59 Å²	59	70%	0.703	30%	0.297	S	S	*	.	S	Bend	trans	-96	63.9	175.4	-163.2	0	0	0	0	109.4	Y119 T123	Y119-V121 PolarHBondContact O-N 3Å; V121-T123 VanDerWaalsContact C-N 3.32Å; V121-T123 PolarHBondContact O-N 2.89Å
122	N	52.1	Low	49.4	Very low	119 Å²	119	63.2 Å²	63.2	64%	0.636	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	27.2	-3	162.7	-71.5	-12.6	0	0	0	125.1	H120	H120-N122 VanDerWaalsContact C-N 3.33Å; H120-N122 PolarHBondContact O-N 3.04Å
123	T	50.8	Low	49.1	Very low	51 Å²	51	64.6 Å²	64.6	31%	0.313	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.9	-5	-176.9	52.3	0	0	0	0	116.6	T35 V121	T35-T123 PolarHBondContact N-O 2.89Å; T35-T123 PolarHBondContact OG1-O 3.22Å; V121-T123 VanDerWaalsContact C-N 3.32Å; V121-T123 PolarHBondContact O-N 2.89Å
124	H	48.4	Very low	48.9	Very low	77 Å²	77	66.8 Å²	66.8	36%	0.356	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	135	-173.9	-57.8	-71	0	0	0	112.5	L32 I33 P34	L32-H124 HydrophobicContact CB-CB 4.44Å; L32-H124 HydrophobicContact CD2-CB 3.49Å; L32-H124 VanDerWaalsContact CD2-CB 3.49Å; I33-H124 WeakPolarHBondContact O-CA 3.46Å; P34-H124 WeakPolarHBondContact CA-ND1 3.3Å
125	L	53.1	Low	48.6	Very low	12 Å²	12	73.7 Å²	73.7	6%	0.063	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	132.7	165.7	-73.7	158.5	0	0	0	108.3	I33 T35 C83 L116 N118	I33-L125 HydrophobicContact CB-CB 4.49Å; I33-L125 PolarHBondContact N-O 2.84Å; I33-L125 PolarHBondContact O-N 3.07Å; T35-L125 HydrophobicContact CG2-CD1 4.45Å; T35-L125 HydrophobicContact CG2-CG 4.41Å; C83-L125 HydrophobicContact CB-CD1 3.86Å; L116-L125 HydrophobicContact CD2-CD1 4.5Å; L116-L125 HydrophobicContact CD2-CD2 4.24Å; N118-L125 HydrophobicContact CB-CD2 4.09Å
126	L	53.7	Low	48.1	Very low	16 Å²	16	78.1 Å²	78.1	8%	0.084	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	111.6	176.2	-170.1	81.5	0	0	0	108.5	E30 L32 N117 Y119	E30-L126 HydrophobicContact CB-CD1 3.96Å; E30-L126 HydrophobicContact CG-CD1 4.22Å; E30-L126 HydrophobicContact CG-CD2 4.36Å; E30-L126 HydrophobicContact CG-CG 4.45Å; L32-L126 HydrophobicContact CD2-CD1 4.07Å; L32-L126 HydrophobicContact CG-CD1 4.12Å; N117-L126 PolarHBondContact N-O 2.97Å; N117-L126 PolarHBondContact O-N 2.81Å; Y119-L126 HydrophobicContact CD2-CB 4.47Å; Y119-L126 HydrophobicContact CD2-CD2 4.08Å; Y119-L126 HydrophobicContact CE2-CD2 4Å
127	L	51.1	Low	47.8	Very low	15 Å²	15	80 Å²	80	8%	0.079	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	113.5	166	-179.1	75.5	0	0	0	107.9	I31 I33 I41 Y115 L116 I129	I31-L127 HydrophobicContact CB-CB 4.34Å; I31-L127 HydrophobicContact CD1-CD2 4.42Å; I31-L127 PolarHBondContact N-O 3.31Å; I31-L127 PolarHBondContact O-N 3.21Å; I33-L127 HydrophobicContact CD1-CB 4.17Å; I41-L127 HydrophobicContact CD1-CD2 3.45Å; I41-L127 VanDerWaalsContact CD1-CD2 3.45Å; Y115-L127 CarbonylContact O-C 3.59Å; Y115-L127 WeakPolarHBondContact O-CA 3.47Å; L116-L127 HydrophobicContact CD1-CB 3.99Å; L116-L127 HydrophobicContact CD1-CD1 3.58Å; L116-L127 HydrophobicContact CD1-CG 4.38Å; L127-I129 HydrophobicContact CD2-CD1 4.07Å; L127-I129 HydrophobicContact CD2-CG1 4.22Å; L127-I129 HydrophobicContact CG-CG1 4.17Å
128	N	53.7	Low	47.2	Very low	22 Å²	22	82.3 Å²	82.3	12%	0.118	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.2	177	-142.5	-14.9	0	0	0	109.3	E30 M114 Y115 N130	E30-N128 HydrophobicContact CG-CB 4.48Å; E30-N128 VanDerWaalsContact CG-CG 3.49Å; E30-N128 WeakPolarHBondContact CG-OD1 3.32Å; E30-N128 PolarHBondContact OE1-ND2 3.05Å; M114-N128 WeakPolarHBondContact CA-O 3.28Å; Y115-N128 PolarHBondContact N-O 2.97Å; Y115-N128 PolarHBondContact O-N 3.09Å; N128-N130 PolarHBondContact OD1-OD1 2.98Å
129	I	54.1	Low	46.5	Very low	13 Å²	13	83.9 Å²	83.9	7%	0.067	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	102	178.2	-54.2	173.6	0	0	0	107.3	V29 I31 M114 L127	V29-I129 PolarHBondContact N-O 2.96Å; V29-I129 PolarHBondContact O-N 3.29Å; V29-I129 VanDerWaalsContact O-N 3.08Å; I31-I129 HydrophobicContact CD1-CD1 4.22Å; M114-I129 HydrophobicContact CE-CB 4.48Å; M114-I129 HydrophobicContact CE-CD1 3.73Å; M114-I129 HydrophobicContact CE-CG1 3.86Å; M114-I129 HydrophobicContact CE-CG2 3.85Å; M114-I129 HydrophobicContact CG-CG1 4.14Å; M114-I129 HydrophobicContact CG-CG2 4.36Å; M114-I129 HydrophobicContact SD-CD1 4.43Å; M114-I129 HydrophobicContact SD-CG1 4.22Å; L127-I129 HydrophobicContact CD2-CD1 4.07Å; L127-I129 HydrophobicContact CD2-CG1 4.22Å; L127-I129 HydrophobicContact CG-CG1 4.17Å
130	N	51.2	Low	45.6	Very low	52 Å²	52	84.9 Å²	84.9	28%	0.278	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.5	178.7	-70.8	-13.4	0	0	0	109.4	N28 Y112 V113 N128	N28-N130 PolarHBondContact OD1-OD1 3.36Å; Y112-N130 WeakPolarHBondContact CA-O 3.36Å; V113-N130 PolarHBondContact N-O 3.24Å; V113-N130 PolarHBondContact O-N 3.29Å; V113-N130 VanDerWaalsContact O-N 3.07Å; N128-N130 PolarHBondContact OD1-OD1 2.98Å
131	S	52.4	Low	45.2	Very low	44 Å²	44	80.9 Å²	80.9	31%	0.308	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.6	174.6	-173.4	0	0	0	0	108.1	Y112	Y112-S131 WeakPolarHBondContact CE1-OG 3.36Å
132	K	47.4	Very low	44.4	Very low	124 Å²	124	80.6 Å²	80.6	54%	0.539	42%	0.415	S	S	.	.	S	Bend	trans	-72.6	-41.5	177.3	-78	-169.9	-165.1	155.2	0	112.7	D111	D111-K132 HydrophobicContact CB-CB 4.27Å; D111-K132 HydrophobicContact CB-CD 3.93Å; D111-K132 HydrophobicContact CB-CG 4.27Å; D111-K132 PolarHBondContact O-N 2.73Å; D111-K132 VanDerWaalsContact O-N 3.08Å; D111-K132 IonicContact OD2-NZ 2.73Å; D111-K132 PolarHBondContact OD2-NZ 3.49Å
133	N	41	Very low	43.2	Very low	83 Å²	83	81.6 Å²	81.6	44%	0.444	42%	0.42	S	S	.	.	S	Bend	trans	-145	141.7	176.7	-69.6	-39.2	0	0	0	112.3	D109 N110	D109-N133 HydrophobicContact CB-CB 3.75Å; D109-N133 WeakPolarHBondContact O-CB 3.35Å; D109-N133 PolarHBondContact OD1-ND2 3.29Å; N110-N133 PolarHBondContact OD1-O 2.84Å
134	S	40.9	Very low	42.1	Very low	59 Å²	59	86.8 Å²	86.8	41%	0.413	45%	0.445	S	S	.	.			trans	83.7	109.4	156	89.5	0	0	0	0	123.6	N110 Q136	N110-S134 PolarHBondContact OD1-OG 2.94Å; S134-Q136 PolarHBondContact O-N 3.11Å
135	I	40.7	Very low	41	Very low	167 Å²	167	92 Å²	92	86%	0.856	46%	0.464	S	S	*	.			trans	32	37.4	132.1	-26.4	179.6	0	0	0	122
136	Q	39.5	Very low	39.7	Very low	161 Å²	161	98 Å²	98	75%	0.752	50%	0.496	S	S	*	.			trans	-122.6	124.3	159.8	-72.1	-170.7	-0.9	0	0	112.5	S134 F138	S134-Q136 PolarHBondContact O-N 3.11Å; Q136-F138 PolarHBondContact O-N 3.1Å
137	S	40.6	Very low	38.4	Very low	76 Å²	76	105.6 Å²	105.6	53%	0.531	53%	0.528	S	S	.	.			trans	-78.6	114.9	-174	54	0	0	0	0	111.3	H139	S137-H139 PolarHBondContact O-N 3.16Å
138	F	37.3	Very low	37.6	Very low	94 Å²	94	114 Å²	114	41%	0.412	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-71	10.1	176.6	-106.8	-85.5	0	0	0	114.3	L43 Y112 Q136 H140	L43-F138 HydrophobicContact CD2-CE1 3.61Å; L43-F138 HydrophobicContact CD2-CZ 4.05Å; Y112-F138 HydrophobicContact CE1-CE2 4.46Å; Q136-F138 PolarHBondContact O-N 3.1Å; F138-H140 VanDerWaalsContact C-N 3.3Å; F138-H140 PolarHBondContact O-N 2.91Å
139	H	33.1	Very low	36.5	Very low	125 Å²	125	119.1 Å²	119.1	58%	0.579	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-71.2	-21.7	-163.1	-146.1	-24.8	0	0	0	113.9	S137 I141	S137-H139 PolarHBondContact O-N 3.16Å; H139-I141 PolarHBondContact O-N 3.42Å
140	H	28.4	Very low	35.6	Very low	170 Å²	170	123.4 Å²	123.4	79%	0.787	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-79.9	-11.8	-161.1	-140.9	-36	0	0	0	116.1	F138	F138-H140 VanDerWaalsContact C-N 3.3Å; F138-H140 PolarHBondContact O-N 2.91Å
141	I	34.1	Very low	35.3	Very low	103 Å²	103	125.1 Å²	125.1	53%	0.528	62%	0.623	S	S	.	*	S	Bend	trans	-113.9	-12.1	-171.7	-50.7	172.7	0	0	0	114.7	F42 H139 L143	F42-I141 HydrophobicContact CB-CD1 4.26Å; F42-I141 HydrophobicContact CB-CG2 3.83Å; F42-I141 HydrophobicContact CD2-CG2 4.02Å; F42-I141 HydrophobicContact CG-CG2 4.16Å; H139-I141 PolarHBondContact O-N 3.42Å; I141-L143 VanDerWaalsContact C-N 3.35Å; I141-L143 PolarHBondContact O-N 3Å
142	L	29.5	Very low	34.9	Very low	109 Å²	109	131.1 Å²	131.1	57%	0.571	64%	0.643	S	S	*	*	S	Bend	trans	-81	-9.2	-177	-135.6	88.7	0	0	0	115	I31 N144	I31-L142 HydrophobicContact CD1-CD1 3.88Å; L142-N144 PolarHBondContact O-N 3.13Å
143	L	25.6	Very low	34.8	Very low	141 Å²	141	126.4 Å²	126.4	74%	0.738	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	5.8	-162.8	-99.7	159.6	0	0	0	116.8	I141	I141-L143 VanDerWaalsContact C-N 3.35Å; I141-L143 PolarHBondContact O-N 3Å
144	N	27.1	Very low	34.9	Very low	159 Å²	159	132.8 Å²	132.8	85%	0.85	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	25	-170.1	-127.7	4.3	0	0	0	117.1	L142	L142-N144 PolarHBondContact O-N 3.13Å
145	Y	25.8	Very low	35.2	Very low	188 Å²	188	139 Å²	139	74%	0.737	66%	0.664	S	S	*	*			trans	-131.1	60.9	176.7	-125.3	-88.9	0	0	0	114
146	N	25.9	Very low	35.9	Very low	138 Å²	138	136.1 Å²	136.1	74%	0.738	65%	0.647	S	S	*	*			trans	-131.3	44.9	166.3	-106	-13.1	0	0	0	111.1	Y148	N146-Y148 PolarHBondContact O-N 3.44Å
147	K	27.3	Very low	37.1	Very low	175 Å²	175	131.3 Å²	131.3	76%	0.761	63%	0.629	S	S	*	*			trans	-78.6	74.6	167	-137.6	178.5	-176.5	-172.1	0	108	D208	K147-D208 IonicContact NZ-OD1 2.71Å
148	Y	33.7	Very low	38.4	Very low	190 Å²	190	129 Å²	129	75%	0.745	61%	0.612	S	S	*	*			trans	-55.8	144.4	170.5	-100.1	-95.3	0	0	0	109.5	N146 S150	N146-Y148 PolarHBondContact O-N 3.44Å; Y148-S150 PolarHBondContact O-N 3.05Å
149	L	31.7	Very low	40.4	Very low	130 Å²	130	124.5 Å²	124.5	68%	0.681	59%	0.593	S	S	*	*			trans	-55.1	74.7	177.7	-140.7	92.9	0	0	0	111	K151	L149-K151 PolarHBondContact O-N 3.26Å
150	S	34.2	Very low	42.7	Very low	104 Å²	104	119.4 Å²	119.4	73%	0.727	57%	0.569	S	S	*	*			trans	-80.1	55.1	179.6	69.7	0	0	0	0	110.3	Y148	Y148-S150 PolarHBondContact O-N 3.05Å
151	K	44.5	Very low	45.3	Very low	88 Å²	88	111.4 Å²	111.4	38%	0.383	53%	0.532	S	S	.	.			trans	-112.3	72.1	167.8	-69.3	-172.9	-178.8	179.2	0	107.1	L149 C153 N211 H253	L149-K151 PolarHBondContact O-N 3.26Å; K151-C153 PolarHBondContact O-N 3.42Å; K151-N211 WeakPolarHBondContact CE-OD1 3.37Å; K151-N211 PolarHBondContact NZ-OD1 3.45Å; K151-H253 HydrophobicContact CD-CB 4.17Å
152	K	44.6	Very low	47.7	Very low	170 Å²	170	106.5 Å²	106.5	74%	0.739	51%	0.507	S	S	*	.			trans	-76	108.4	179.8	-72.9	-173.8	177.2	-176.7	0	108.8	Y154	K152-Y154 PolarHBondContact O-N 3.32Å
153	C	45	Very low	50.3	Low	24 Å²	24	101.4 Å²	101.4	16%	0.162	48%	0.48	C	S	.	.			trans	-74.5	112.6	160.4	-66.7	0	0	0	0	107.5	K151 K155 Q156 H253 C256	K151-C153 PolarHBondContact O-N 3.42Å; C153-K155 PolarHBondContact O-N 2.73Å; C153-Q156 WeakPolarHBondContact CB-O 3.41Å; C153-H253 PolarHBondContact SG-NE2 3.17Å; C153-H253 VanDerWaalsContact SG-NE2 3.37Å; C153-C256 VanDerWaalsContact CA-SG 3.56Å; C153-C256 HydrophobicContact CB-CB 3.56Å; C153-C256 WeakPolarHBondContact CB-SG 3.5Å; C153-C256 VanDerWaalsContact SG-CA 3.56Å; C153-C256 WeakPolarHBondContact SG-CB 3.38Å; C153-C256 CovalentContact SG-SG 2.02Å; C153-C256 PolarHBondContact SG-SG 3.21Å
154	Y	43.7	Very low	53.1	Low	218 Å²	218	94.7 Å²	94.7	86%	0.855	45%	0.445	S	S	*	.	S	Bend	trans	-68.5	-14.8	-169.6	-84.5	-88.4	0	0	0	114.6	K152	K152-Y154 PolarHBondContact O-N 3.32Å
155	K	47.7	Very low	55.8	Low	188 Å²	188	87.1 Å²	87.1	82%	0.817	41%	0.405	S	S	*	.	S	Bend	trans	-146.8	-13	-173.5	-68.7	-172	177.8	179.4	0	116.3	C153	C153-K155 PolarHBondContact O-N 2.73Å
156	Q	54.8	Low	58.4	Low	107 Å²	107	80.4 Å²	80.4	50%	0.5	38%	0.382	S	S	.	.	S	Bend	trans	-132.4	153.7	-177.3	-74.6	176.4	-24.7	0	0	108.4	C153 C256	C153-Q156 WeakPolarHBondContact CB-O 3.41Å; Q156-C256 HydrophobicContact CB-CB 4.32Å; Q156-C256 PolarHBondContact OE1-O 2.88Å
157	V	64.8	Low	60.7	Low	61 Å²	61	74.3 Å²	74.3	37%	0.37	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-66	141.4	176.9	-90.7	0	0	0	0	110.2	T159 G257 D308 L309	V157-T159 PolarHBondContact O-N 2.87Å; V157-G257 PolarHBondContact O-N 3.4Å; V157-D308 HydrophobicContact CB-CB 4.18Å; V157-D308 HydrophobicContact CG2-CB 3.63Å; V157-L309 WeakPolarHBondContact CG1-O 3.41Å
158	P	68.3	Low	62.8	Low	27 Å²	27	72.3 Å²	72.3	18%	0.175	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	126	177.5	21.8	-28.6	0	0	0	110.2	H253 L309	P158-H253 VanDerWaalsContact CB-CD2 3.45Å; P158-H253 WeakPolarHBondContact CB-CD2 3.49Å; P158-L309 HydrophobicContact CG-CB 3.92Å; P158-L309 HydrophobicContact CG-CD2 4.17Å; P158-L309 PolarHBondContact O-N 3.11Å
159	T	77.8	Confident	64.5	Low	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	119.1	173.1	-47.7	0	0	0	0	108.6	V157 L229 I254 G255 G257 I259 V306 D308	V157-T159 PolarHBondContact O-N 2.87Å; T159-L229 HydrophobicContact CG2-CD1 4.05Å; T159-I254 HydrophobicContact CG2-CD1 3.94Å; T159-I254 HydrophobicContact CG2-CG1 3.93Å; T159-I254 VanDerWaalsContact O-CG1 3.31Å; T159-I254 WeakPolarHBondContact O-CG1 3.4Å; T159-I254 PolarHBondContact O-N 2.98Å; T159-G255 WeakPolarHBondContact CB-O 3.5Å; T159-G255 PolarHBondContact N-O 2.95Å; T159-G255 PolarHBondContact O-N 3.13Å; T159-G257 WeakPolarHBondContact OG1-CA 3.17Å; T159-G257 PolarHBondContact OG1-N 2.94Å; T159-I259 HydrophobicContact CG2-CG1 4.2Å; T159-V306 HydrophobicContact CG2-CG1 3.74Å; T159-D308 WeakPolarHBondContact CA-OD1 3.31Å; T159-D308 WeakPolarHBondContact CB-OD1 3.4Å; T159-D308 WeakPolarHBondContact CG2-OD1 3.23Å; T159-D308 PolarHBondContact OG1-OD1 3.23Å
160	L	81.1	Confident	66.1	Low	18 Å²	18	59.9 Å²	59.9	9%	0.094	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.5	-177.5	-58.4	-179.1	0	0	0	110.3	L162 L226 I251 Q252 H253 V306 G307 L309	L160-L162 HydrophobicContact CB-CD1 4.03Å; L160-L226 HydrophobicContact CB-CD2 3.92Å; L160-L226 HydrophobicContact CD1-CD2 4.01Å; L160-L226 HydrophobicContact CG-CD2 4.29Å; L160-I251 HydrophobicContact CB-CG2 4.38Å; L160-I251 HydrophobicContact CD1-CG2 4.21Å; L160-I251 HydrophobicContact CD2-CG2 4.41Å; L160-Q252 CarbonylContact C-O 3.57Å; L160-Q252 WeakPolarHBondContact CA-O 3.35Å; L160-H253 HydrophobicContact CD2-CB 4.02Å; L160-V306 WeakPolarHBondContact O-CA 3.25Å; L160-G307 PolarHBondContact N-O 3.2Å; L160-G307 PolarHBondContact O-N 2.9Å; L160-L309 HydrophobicContact CD1-CB 4.32Å; L160-L309 HydrophobicContact CD1-CD1 3.79Å
161	L	84.6	Confident	67.8	Low	1 Å²	1	60 Å²	60	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.9	168.9	172.9	62.9	0	0	0	108.8	F163 Q252 I254 I263 L267 W304 I305 V306	L161-F163 HydrophobicContact CD1-CZ 4.34Å; L161-F163 HydrophobicContact CD2-CD2 4.48Å; L161-F163 HydrophobicContact CD2-CE2 3.57Å; L161-F163 HydrophobicContact CD2-CZ 3.67Å; L161-F163 HydrophobicContact CG-CD2 4.4Å; L161-F163 HydrophobicContact CG-CE2 3.92Å; L161-F163 HydrophobicContact CG-CZ 4.15Å; L161-Q252 PolarHBondContact N-O 2.82Å; L161-Q252 PolarHBondContact O-N 2.91Å; L161-I254 HydrophobicContact CB-CD1 4.17Å; L161-I254 HydrophobicContact CB-CG1 4.28Å; L161-I254 HydrophobicContact CB-CG2 3.56Å; L161-I254 HydrophobicContact CD2-CG2 4.03Å; L161-I254 HydrophobicContact CG-CG2 4.47Å; L161-I263 HydrophobicContact CD2-CG2 4.45Å; L161-L267 HydrophobicContact CD1-CD1 4.41Å; L161-L267 HydrophobicContact CD1-CD2 3.78Å; L161-L267 HydrophobicContact CD2-CD2 4.36Å; L161-W304 HydrophobicContact CD1-CB 4.39Å; L161-W304 HydrophobicContact CD1-CE3 4.44Å; L161-I305 CarbonylContact C-O 3.39Å; L161-I305 WeakPolarHBondContact CA-O 3.24Å; L161-V306 HydrophobicContact CB-CG2 4.43Å; L161-V306 HydrophobicContact CD1-CG2 3.49Å; L161-V306 VanDerWaalsContact CD1-CG2 3.49Å
162	L	84.2	Confident	69	Low	1 Å²	1	56.5 Å²	56.5	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	131.3	178.3	-80.4	73.6	0	0	0	109.4	L160 Y222 L226 V249 S250 I251 W304 I305	L160-L162 HydrophobicContact CB-CD1 4.03Å; L162-Y222 HydrophobicContact CD2-CG 4.24Å; L162-L226 HydrophobicContact CD1-CD1 3.4Å; L162-L226 VanDerWaalsContact CD1-CD1 3.4Å; L162-L226 HydrophobicContact CD2-CD1 3.72Å; L162-L226 HydrophobicContact CG-CD1 4.21Å; L162-V249 HydrophobicContact CB-CG1 4.46Å; L162-V249 HydrophobicContact CD2-CG1 4.01Å; L162-V249 HydrophobicContact CG-CG1 4.31Å; L162-S250 CarbonylContact C-O 3.43Å; L162-S250 VanDerWaalsContact CA-O 3.32Å; L162-S250 WeakPolarHBondContact CA-O 3.28Å; L162-I251 HydrophobicContact CD1-CG2 4.41Å; L162-I251 HydrophobicContact CG-CG1 4.13Å; L162-W304 CarbonylContact O-C 3.55Å; L162-W304 WeakPolarHBondContact O-CA 3.4Å; L162-W304 WeakPolarHBondContact O-CB 3.4Å; L162-I305 HydrophobicContact CB-CB 4.21Å; L162-I305 PolarHBondContact N-O 3.13Å; L162-I305 PolarHBondContact O-N 3.45Å
163	F	84.8	Confident	70.1	Confident	1 Å²	1	51.2 Å²	51.2	0%	0.004	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	128.1	167.7	-71.8	-67.9	0	0	0	109.9	L161 F165 F187 M188 I191 V249 S250 L270 L301 W304	L161-F163 HydrophobicContact CD1-CZ 4.34Å; L161-F163 HydrophobicContact CD2-CD2 4.48Å; L161-F163 HydrophobicContact CD2-CE2 3.57Å; L161-F163 HydrophobicContact CD2-CZ 3.67Å; L161-F163 HydrophobicContact CG-CD2 4.4Å; L161-F163 HydrophobicContact CG-CE2 3.92Å; L161-F163 HydrophobicContact CG-CZ 4.15Å; F163-F165 HydrophobicContact CB-CE2 3.77Å; F163-F165 HydrophobicContact CB-CZ 3.95Å; F163-F187 HydrophobicContact CE2-CE1 4.45Å; F163-M188 HydrophobicContact CD2-CE 3.67Å; F163-M188 HydrophobicContact CD2-SD 3.45Å; F163-M188 WeakPolarHBondContact CD2-SD 3.49Å; F163-M188 HydrophobicContact CE2-CE 3.82Å; F163-M188 HydrophobicContact CE2-SD 3.61Å; F163-I191 HydrophobicContact CE2-CD1 3.96Å; F163-I191 HydrophobicContact CZ-CD1 4Å; F163-V249 CarbonylContact O-C 3.57Å; F163-V249 WeakPolarHBondContact O-CA 2.98Å; F163-S250 PolarHBondContact N-O 3.13Å; F163-S250 PolarHBondContact O-N 3.13Å; F163-L270 HydrophobicContact CE1-CD1 3.66Å; F163-L270 HydrophobicContact CZ-CD1 4.18Å; F163-L301 HydrophobicContact CB-CD1 3.85Å; F163-L301 HydrophobicContact CD1-CD1 3.75Å; F163-L301 HydrophobicContact CD1-CD2 4.12Å; F163-L301 HydrophobicContact CE1-CD2 4.4Å; F163-L301 HydrophobicContact CG-CD1 4.2Å; F163-W304 HydrophobicContact CD1-CB 3.7Å; F163-W304 HydrophobicContact CE1-CB 3.79Å; F163-W304 HydrophobicContact CE1-CG 4.45Å
164	I	84.1	Confident	71.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	117.3	179	-53.1	175	0	0	0	108.4	P219 R239 Q247 L248 V249 A302 E303 I305	I164-P219 HydrophobicContact CD1-CB 3.78Å; I164-P219 HydrophobicContact CD1-CG 4.2Å; I164-P219 HydrophobicContact CG1-CB 4.41Å; I164-P219 HydrophobicContact CG2-CG 4.22Å; I164-R239 VanDerWaalsContact CD1-NH2 3.32Å; I164-Q247 HydrophobicContact CG2-CB 4.2Å; I164-Q247 HydrophobicContact CG2-CG 4.35Å; I164-L248 WeakPolarHBondContact CA-O 3.26Å; I164-V249 HydrophobicContact CG1-CG2 4.31Å; I164-A302 PolarHBondContact O-N 3.16Å; I164-E303 HydrophobicContact CB-CB 4.23Å; I164-E303 HydrophobicContact CD1-CB 4.25Å; I164-E303 HydrophobicContact CD1-CG 4.22Å; I164-E303 PolarHBondContact N-O 2.95Å; I164-E303 PolarHBondContact O-N 3.43Å; I164-I305 HydrophobicContact CD1-CD1 3.96Å
165	F	82.4	Confident	72.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	142.2	177	-53.4	-89.8	0	0	0	110.6	F163 I184 F187 Q247 L248 I281 I299 T300 L301	F163-F165 HydrophobicContact CB-CE2 3.77Å; F163-F165 HydrophobicContact CB-CZ 3.95Å; F165-I184 HydrophobicContact CD2-CD1 4.45Å; F165-I184 HydrophobicContact CE2-CD1 4.42Å; F165-I184 HydrophobicContact CE2-CG2 4.14Å; F165-I184 HydrophobicContact CZ-CG2 4.31Å; F165-F187 HydrophobicContact CZ-CD1 4.28Å; F165-F187 HydrophobicContact CZ-CE1 4.31Å; F165-Q247 CarbonylContact O-C 3.57Å; F165-Q247 VanDerWaalsContact O-CA 3.29Å; F165-Q247 WeakPolarHBondContact O-CA 3.48Å; F165-L248 HydrophobicContact CB-CB 4.15Å; F165-L248 HydrophobicContact CD2-CD2 4.41Å; F165-L248 HydrophobicContact CD2-CG 4.32Å; F165-L248 PolarHBondContact N-O 3.16Å; F165-L248 PolarHBondContact O-N 2.88Å; F165-I281 HydrophobicContact CD1-CD1 3.51Å; F165-I281 HydrophobicContact CD1-CG1 3.82Å; F165-I281 HydrophobicContact CE1-CD1 3.54Å; F165-I281 HydrophobicContact CE1-CG1 3.76Å; F165-I281 HydrophobicContact CG-CD1 4.36Å; F165-I281 HydrophobicContact CZ-CD1 4.43Å; F165-I299 HydrophobicContact CB-CG2 4.3Å; F165-T300 CarbonylContact C-O 3.59Å; F165-T300 WeakPolarHBondContact CA-O 3.43Å; F165-L301 HydrophobicContact CD1-CB 3.99Å; F165-L301 HydrophobicContact CD1-CD1 3.73Å; F165-L301 HydrophobicContact CD1-CG 4.49Å; F165-L301 HydrophobicContact CE1-CB 4.08Å; F165-L301 HydrophobicContact CE1-CD1 3.55Å; F165-L301 HydrophobicContact CE1-CG 4.37Å; F165-L301 HydrophobicContact CE2-CD1 4.48Å; F165-L301 HydrophobicContact CG-CD1 4.3Å; F165-L301 HydrophobicContact CZ-CD1 3.96Å
166	N	80.2	Confident	73.3	Confident	48 Å²	48	38.3 Å²	38.3	26%	0.257	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	111.6	172.9	-174.7	23.2	0	0	0	109.3	Y237 T300 A302	N166-Y237 HydrophobicContact CB-CE2 4.26Å; N166-T300 PolarHBondContact N-O 3.23Å; N166-T300 PolarHBondContact O-N 2.96Å; N166-A302 HydrophobicContact CB-CB 4.4Å
167	V	74.9	Confident	74.1	Confident	10 Å²	10	33.8 Å²	33.8	6%	0.061	18%	0.183	C	C	.	.			trans	-155.2	136.1	-177.8	56.1	0	0	0	0	112	I169 L172 L180 S246 L248 I299	V167-I169 HydrophobicContact CG1-CD1 4.12Å; V167-I169 HydrophobicContact CG1-CG1 3.69Å; V167-I169 HydrophobicContact CG2-CG1 4.26Å; V167-I169 PolarHBondContact O-N 3.14Å; V167-L172 HydrophobicContact CG2-CD1 4.16Å; V167-L180 HydrophobicContact CG2-CD2 4.33Å; V167-S246 CarbonylContact C-O 3.47Å; V167-S246 PolarHBondContact N-O 2.72Å; V167-S246 CarbonylContact O-C 3.59Å; V167-S246 VanDerWaalsContact O-CA 3.27Å; V167-S246 WeakPolarHBondContact O-CA 3.26Å; V167-L248 HydrophobicContact CG1-CB 3.55Å; V167-L248 HydrophobicContact CG1-CD2 4.02Å; V167-L248 HydrophobicContact CG1-CG 4.44Å; V167-I299 HydrophobicContact CB-CG1 4.13Å; V167-I299 HydrophobicContact CB-CG2 4.26Å; V167-I299 HydrophobicContact CG2-CD1 4.38Å; V167-I299 HydrophobicContact CG2-CG1 3.75Å
168	Q	72.2	Confident	74.2	Confident	133 Å²	133	32.4 Å²	32.4	62%	0.621	17%	0.174	S	C	*	.			trans	-85.5	82.5	172.7	-70	-177.7	-20.3	0	0	110.9	C170 N171	Q168-C170 VanDerWaalsContact C-N 3.26Å; Q168-C170 PolarHBondContact O-N 3.41Å; Q168-N171 PolarHBondContact O-N 3.16Å; Q168-N171 PolarHBondContact OE1-ND2 3.47Å; Q168-N171 VanDerWaalsContact OE1-ND2 3.14Å
169	I	67.9	Low	74.3	Confident	8 Å²	8	33.6 Å²	33.6	4%	0.041	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-62.4	-33.7	-172.4	-59.7	170.9	0	0	0	112.4	F84 V167 N171 L172 R177 L216 L248	F84-I169 HydrophobicContact CD2-CG2 3.57Å; F84-I169 HydrophobicContact CE2-CG2 3.4Å; F84-I169 HydrophobicContact CG-CG2 4.21Å; F84-I169 HydrophobicContact CZ-CG2 3.94Å; V167-I169 HydrophobicContact CG1-CD1 4.12Å; V167-I169 HydrophobicContact CG1-CG1 3.69Å; V167-I169 HydrophobicContact CG2-CG1 4.26Å; V167-I169 PolarHBondContact O-N 3.14Å; I169-N171 PolarHBondContact O-N 3.08Å; I169-L172 WeakPolarHBondContact O-CB 3.41Å; I169-L172 PolarHBondContact O-N 3.33Å; I169-L172 VanDerWaalsContact O-N 3.09Å; I169-R177 PolarHBondContact O-NE 2.82Å; I169-L216 HydrophobicContact CD1-CD1 4.02Å; I169-L216 HydrophobicContact CD1-CD2 3.14Å; I169-L216 HydrophobicContact CD1-CG 4.18Å; I169-L248 HydrophobicContact CD1-CB 4.17Å; I169-L248 HydrophobicContact CD1-CD1 4.11Å
170	C	66.8	Low	74	Confident	51 Å²	51	34 Å²	34	35%	0.345	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-64.2	-21.1	-178.3	-51.7	0	0	0	0	113.2	C86 Q168	C86-C170 HydrophobicContact CB-CB 3.86Å; C86-C170 WeakPolarHBondContact CB-SG 2.81Å; C86-C170 WeakPolarHBondContact SG-CB 3.47Å; C86-C170 CovalentContact SG-SG 2.03Å; C86-C170 PolarHBondContact SG-SG 3.4Å; Q168-C170 VanDerWaalsContact C-N 3.26Å; Q168-C170 PolarHBondContact O-N 3.41Å
171	N	70	Confident	73.5	Confident	106 Å²	106	34.7 Å²	34.7	57%	0.567	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-89.3	-3.6	177.9	-71	-7.5	0	0	0	113.8	Q168 I169	Q168-N171 PolarHBondContact O-N 3.16Å; Q168-N171 PolarHBondContact OE1-ND2 3.47Å; Q168-N171 VanDerWaalsContact OE1-ND2 3.14Å; I169-N171 PolarHBondContact O-N 3.08Å
172	L	69.2	Low	72.7	Confident	15 Å²	15	39.9 Å²	39.9	8%	0.079	21%	0.205	C	C	.	.	S	Bend	trans	-91.9	136.4	179	-61.4	173.5	0	0	0	110.5	V167 I169 E176 R177 L180 K295 F296	V167-L172 HydrophobicContact CG2-CD1 4.16Å; I169-L172 WeakPolarHBondContact O-CB 3.41Å; I169-L172 PolarHBondContact O-N 3.33Å; I169-L172 VanDerWaalsContact O-N 3.09Å; L172-E176 WeakPolarHBondContact CA-OE2 3.42Å; L172-E176 HydrophobicContact CB-CB 4.08Å; L172-E176 HydrophobicContact CD2-CB 4.13Å; L172-R177 HydrophobicContact CB-CG 3.77Å; L172-R177 PolarHBondContact O-NE 3.34Å; L172-R177 PolarHBondContact O-NH2 3.09Å; L172-L180 HydrophobicContact CD1-CD2 3.74Å; L172-K295 HydrophobicContact CD2-CB 4.39Å; L172-K295 HydrophobicContact CD2-CD 4.33Å; L172-F296 HydrophobicContact CD2-CE1 4.43Å
173	S	68.3	Low	71.9	Confident	58 Å²	58	40.3 Å²	40.3	41%	0.406	21%	0.207	S	C	.	.			trans	-67	162.8	169.3	62	0	0	0	0	111.8	I175 E176 R177	S173-I175 VanDerWaalsContact C-N 3.3Å; S173-I175 PolarHBondContact O-N 3.33Å; S173-E176 PolarHBondContact N-OE2 3.4Å; S173-E176 PolarHBondContact O-N 3.42Å; S173-E176 VanDerWaalsContact O-N 3.13Å; S173-E176 VanDerWaalsContact OG-CD 3.24Å; S173-E176 VanDerWaalsContact OG-CG 3.23Å; S173-E176 WeakPolarHBondContact OG-CG 3.41Å; S173-E176 PolarHBondContact OG-N 2.89Å; S173-E176 PolarHBondContact OG-OE2 3.14Å; S173-R177 WeakPolarHBondContact O-CG 3.47Å; S173-R177 PolarHBondContact O-N 2.74Å
174	Y	66.4	Low	71.2	Confident	29 Å²	29	40.3 Å²	40.3	11%	0.114	21%	0.207	C	C	.	.	H	α-helix	trans	-51.5	-45.8	176.4	165.3	-104.7	0	0	0	113.2	H60 K80 L82 R177 I178	H60-Y174 HydrophobicContact CB-CD1 4.15Å; H60-Y174 HydrophobicContact CB-CE1 3.72Å; K80-Y174 WeakPolarHBondContact CB-OH 3.41Å; L82-Y174 HydrophobicContact CB-CD2 4.42Å; L82-Y174 HydrophobicContact CB-CE2 4.48Å; Y174-R177 PolarHBondContact O-N 2.93Å; Y174-I178 HydrophobicContact CD1-CD1 4.48Å; Y174-I178 HydrophobicContact CD2-CD1 4.22Å; Y174-I178 HydrophobicContact CD2-CG1 4.49Å; Y174-I178 HydrophobicContact CE1-CD1 3.76Å; Y174-I178 HydrophobicContact CE2-CD1 3.44Å; Y174-I178 VanDerWaalsContact CE2-CD1 3.44Å; Y174-I178 HydrophobicContact CE2-CG1 4.07Å; Y174-I178 PolarHBondContact O-N 2.79Å; Y174-I178 WeakPolarHBondContact OH-CD1 3.21Å
175	I	67	Low	70.4	Confident	106 Å²	106	43.2 Å²	43.2	54%	0.544	22%	0.22	S	C	.	.	H	α-helix	trans	-63.3	-45.2	179.4	-62.2	170.4	0	0	0	110.2	S173 R177 I178 E179	S173-I175 VanDerWaalsContact C-N 3.3Å; S173-I175 PolarHBondContact O-N 3.33Å; I175-R177 VanDerWaalsContact C-N 3.32Å; I175-R177 PolarHBondContact O-N 3.24Å; I175-I178 PolarHBondContact O-N 3.33Å; I175-E179 WeakPolarHBondContact O-CG 2.88Å; I175-E179 PolarHBondContact O-N 3.16Å
176	E	70.1	Confident	69.7	Low	25 Å²	25	47.4 Å²	47.4	12%	0.117	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-36.3	177.1	-70.3	166.1	150.2	0	0	111.9	L172 S173 E179 L180 F293 K295 F296	L172-E176 WeakPolarHBondContact CA-OE2 3.42Å; L172-E176 HydrophobicContact CB-CB 4.08Å; L172-E176 HydrophobicContact CD2-CB 4.13Å; S173-E176 PolarHBondContact N-OE2 3.4Å; S173-E176 PolarHBondContact O-N 3.42Å; S173-E176 VanDerWaalsContact O-N 3.13Å; S173-E176 VanDerWaalsContact OG-CD 3.24Å; S173-E176 VanDerWaalsContact OG-CG 3.23Å; S173-E176 WeakPolarHBondContact OG-CG 3.41Å; S173-E176 PolarHBondContact OG-N 2.89Å; S173-E176 PolarHBondContact OG-OE2 3.14Å; E176-E179 PolarHBondContact O-N 3.24Å; E176-L180 WeakPolarHBondContact O-CB 2.95Å; E176-L180 PolarHBondContact O-N 3.22Å; E176-F293 HydrophobicContact CG-CD1 4.48Å; E176-K295 WeakPolarHBondContact OE1-CD 3.33Å; E176-K295 IonicContact OE1-NZ 3.03Å; E176-K295 PolarHBondContact OE1-NZ 3.37Å; E176-K295 IonicContact OE2-NZ 2.69Å; E176-K295 PolarHBondContact OE2-NZ 3.41Å; E176-F296 HydrophobicContact CB-CE1 4.31Å; E176-F296 HydrophobicContact CB-CZ 4.18Å; E176-F296 WeakPolarHBondContact O-CE1 3.44Å; E176-F296 VanDerWaalsContact O-CZ 3.24Å; E176-F296 WeakPolarHBondContact O-CZ 3.49Å
177	R	70.4	Confident	69	Low	11 Å²	11	45.6 Å²	45.6	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-68.1	-38.3	176.7	-67	165.4	-179.6	-171.3	7	112.2	L82 F84 D87 I169 L172 S173 Y174 I175 L180 N181	L82-R177 HydrophobicContact CD2-CB 3.67Å; L82-R177 PolarHBondContact O-NH1 3.02Å; F84-R177 HydrophobicContact CE2-CG 4.36Å; D87-R177 IonicContact OD1-CZ 3.38Å; D87-R177 IonicContact OD1-NH1 3.58Å; D87-R177 PolarHBondContact OD1-NH1 2.84Å; D87-R177 IonicContact OD1-NH2 3.91Å; D87-R177 PolarHBondContact OD1-NH2 2.8Å; D87-R177 IonicContact OD2-CZ 3.39Å; D87-R177 IonicContact OD2-NH1 2.68Å; D87-R177 PolarHBondContact OD2-NH1 2.03Å; D87-R177 IonicContact OD2-NH2 2.67Å; I169-R177 PolarHBondContact O-NE 2.82Å; L172-R177 HydrophobicContact CB-CG 3.77Å; L172-R177 PolarHBondContact O-NE 3.34Å; L172-R177 PolarHBondContact O-NH2 3.09Å; S173-R177 WeakPolarHBondContact O-CG 3.47Å; S173-R177 PolarHBondContact O-N 2.74Å; Y174-R177 PolarHBondContact O-N 2.93Å; I175-R177 VanDerWaalsContact C-N 3.32Å; I175-R177 PolarHBondContact O-N 3.24Å; R177-L180 PolarHBondContact O-N 2.9Å; R177-N181 PolarHBondContact O-N 2.76Å; R177-N181 VanDerWaalsContact O-N 3.1Å
178	I	67.5	Low	68.5	Low	33 Å²	33	45.2 Å²	45.2	17%	0.169	23%	0.229	C	C	.	.	H	α-helix	trans	-65.6	-45.2	173.9	-74.4	-174.7	0	0	0	111	Y174 I175 L180 N181 K182	Y174-I178 HydrophobicContact CD1-CD1 4.48Å; Y174-I178 HydrophobicContact CD2-CD1 4.22Å; Y174-I178 HydrophobicContact CD2-CG1 4.49Å; Y174-I178 HydrophobicContact CE1-CD1 3.76Å; Y174-I178 HydrophobicContact CE2-CD1 3.44Å; Y174-I178 VanDerWaalsContact CE2-CD1 3.44Å; Y174-I178 HydrophobicContact CE2-CG1 4.07Å; Y174-I178 PolarHBondContact O-N 2.79Å; Y174-I178 WeakPolarHBondContact OH-CD1 3.21Å; I175-I178 PolarHBondContact O-N 3.33Å; I178-L180 VanDerWaalsContact C-N 3.34Å; I178-N181 WeakPolarHBondContact O-CB 3.31Å; I178-N181 PolarHBondContact O-N 2.94Å; I178-K182 PolarHBondContact O-N 2.7Å
179	E	70.3	Confident	68.1	Low	52 Å²	52	40.7 Å²	40.7	24%	0.243	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-41.5	177.1	-70.7	-55.1	132.7	0	0	111	I175 E176 N181 K182 I183 F293 F296	I175-E179 WeakPolarHBondContact O-CG 2.88Å; I175-E179 PolarHBondContact O-N 3.16Å; E176-E179 PolarHBondContact O-N 3.24Å; E179-N181 VanDerWaalsContact C-N 3.33Å; E179-N181 PolarHBondContact O-N 2.85Å; E179-K182 WeakPolarHBondContact O-CB 3.07Å; E179-K182 PolarHBondContact O-N 3.38Å; E179-K182 VanDerWaalsContact O-N 3.1Å; E179-K182 IonicContact OE1-NZ 3.82Å; E179-K182 PolarHBondContact OE1-NZ 2.95Å; E179-I183 WeakPolarHBondContact O-CG1 3.02Å; E179-I183 PolarHBondContact O-N 2.94Å; E179-F293 HydrophobicContact CG-CE2 4.35Å; E179-F293 HydrophobicContact CG-CZ 4.18Å; E179-F296 HydrophobicContact CB-CE2 4.06Å; E179-F296 HydrophobicContact CB-CZ 3.91Å
180	L	72.5	Confident	67.4	Low	8 Å²	8	42.6 Å²	42.6	4%	0.042	22%	0.22	C	C	.	.	H	α-helix	trans	-54.8	-46.1	172.9	178.2	55.8	0	0	0	112.6	V167 L172 E176 R177 I178 K182 I183 I184 L248 F296 I299	V167-L180 HydrophobicContact CG2-CD2 4.33Å; L172-L180 HydrophobicContact CD1-CD2 3.74Å; E176-L180 WeakPolarHBondContact O-CB 2.95Å; E176-L180 PolarHBondContact O-N 3.22Å; R177-L180 PolarHBondContact O-N 2.9Å; I178-L180 VanDerWaalsContact C-N 3.34Å; L180-K182 VanDerWaalsContact C-N 3.34Å; L180-K182 PolarHBondContact O-N 2.96Å; L180-I183 PolarHBondContact O-N 3.29Å; L180-I184 HydrophobicContact CD1-CD1 3.8Å; L180-I184 HydrophobicContact CD1-CG1 4.24Å; L180-I184 HydrophobicContact CG-CD1 4.11Å; L180-I184 WeakPolarHBondContact O-CG1 3.11Å; L180-I184 PolarHBondContact O-N 3.4Å; L180-I184 VanDerWaalsContact O-N 3.09Å; L180-L248 HydrophobicContact CD2-CD2 4.04Å; L180-L248 HydrophobicContact CG-CD2 4.3Å; L180-F296 HydrophobicContact CB-CE1 4.01Å; L180-F296 HydrophobicContact CB-CZ 4.42Å; L180-I299 HydrophobicContact CD1-CD1 3.3Å; L180-I299 HydrophobicContact CD1-CG1 4.47Å; L180-I299 HydrophobicContact CD2-CD1 4.37Å; L180-I299 HydrophobicContact CG-CD1 4.41Å
181	N	69.5	Low	66.8	Low	32 Å²	32	40.7 Å²	40.7	17%	0.171	21%	0.206	C	C	.	.	H	α-helix	trans	-60.1	-44.1	176.7	-175.2	18.5	0	0	0	111.4	R177 I178 E179 I183 I184 K185 L214	R177-N181 PolarHBondContact O-N 2.76Å; R177-N181 VanDerWaalsContact O-N 3.1Å; I178-N181 WeakPolarHBondContact O-CB 3.31Å; I178-N181 PolarHBondContact O-N 2.94Å; E179-N181 VanDerWaalsContact C-N 3.33Å; E179-N181 PolarHBondContact O-N 2.85Å; N181-I183 PolarHBondContact O-N 3.05Å; N181-I184 PolarHBondContact O-N 3.17Å; N181-K185 WeakPolarHBondContact O-CG 3.16Å; N181-K185 PolarHBondContact O-N 3.38Å; N181-L214 WeakPolarHBondContact OD1-CD1 3.25Å
182	K	68.7	Low	65.6	Low	110 Å²	110	38.8 Å²	38.8	48%	0.478	20%	0.195	S	C	.	.	H	α-helix	trans	-61.2	-44.2	175.8	-68.6	176.8	-174	168.9	0	112.1	I178 E179 L180 I184 K185 L186	I178-K182 PolarHBondContact O-N 2.7Å; E179-K182 WeakPolarHBondContact O-CB 3.07Å; E179-K182 PolarHBondContact O-N 3.38Å; E179-K182 VanDerWaalsContact O-N 3.1Å; E179-K182 IonicContact OE1-NZ 3.82Å; E179-K182 PolarHBondContact OE1-NZ 2.95Å; L180-K182 VanDerWaalsContact C-N 3.34Å; L180-K182 PolarHBondContact O-N 2.96Å; K182-I184 VanDerWaalsContact C-N 3.34Å; K182-I184 PolarHBondContact O-N 3.23Å; K182-K185 PolarHBondContact O-N 2.89Å; K182-L186 WeakPolarHBondContact O-CB 3.47Å; K182-L186 PolarHBondContact O-N 2.84Å
183	I	67.9	Low	64	Low	11 Å²	11	42 Å²	42	6%	0.056	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-44.5	-179.4	-65.3	166.1	0	0	0	111	E179 L180 N181 L186 F187 I281 L285 F290 F296	E179-I183 WeakPolarHBondContact O-CG1 3.02Å; E179-I183 PolarHBondContact O-N 2.94Å; L180-I183 PolarHBondContact O-N 3.29Å; N181-I183 PolarHBondContact O-N 3.05Å; I183-L186 WeakPolarHBondContact O-CB 3.47Å; I183-L186 PolarHBondContact O-N 3.38Å; I183-F187 PolarHBondContact O-N 3.2Å; I183-I281 HydrophobicContact CG2-CG2 3.87Å; I183-L285 HydrophobicContact CG2-CD1 3.7Å; I183-F290 HydrophobicContact CB-CZ 4.4Å; I183-F290 HydrophobicContact CD1-CD1 4.36Å; I183-F290 HydrophobicContact CD1-CE1 3.33Å; I183-F290 HydrophobicContact CD1-CZ 3.78Å; I183-F290 HydrophobicContact CG1-CE1 3.62Å; I183-F290 HydrophobicContact CG1-CZ 3.64Å; I183-F290 HydrophobicContact CG2-CZ 3.9Å; I183-F296 HydrophobicContact CD1-CD2 3.66Å; I183-F296 HydrophobicContact CD1-CE2 3.67Å; I183-F296 HydrophobicContact CD1-CG 4.27Å; I183-F296 HydrophobicContact CD1-CZ 4.24Å
184	I	69.3	Low	62.6	Low	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-70.2	-40.2	-179	-65.3	168.3	0	0	0	110.7	F165 L180 N181 K182 L186 F187 M188 L214 L248 I281	F165-I184 HydrophobicContact CD2-CD1 4.45Å; F165-I184 HydrophobicContact CE2-CD1 4.42Å; F165-I184 HydrophobicContact CE2-CG2 4.14Å; F165-I184 HydrophobicContact CZ-CG2 4.31Å; L180-I184 HydrophobicContact CD1-CD1 3.8Å; L180-I184 HydrophobicContact CD1-CG1 4.24Å; L180-I184 HydrophobicContact CG-CD1 4.11Å; L180-I184 WeakPolarHBondContact O-CG1 3.11Å; L180-I184 PolarHBondContact O-N 3.4Å; L180-I184 VanDerWaalsContact O-N 3.09Å; N181-I184 PolarHBondContact O-N 3.17Å; K182-I184 VanDerWaalsContact C-N 3.34Å; K182-I184 PolarHBondContact O-N 3.23Å; I184-L186 PolarHBondContact O-N 3.36Å; I184-F187 PolarHBondContact O-N 2.74Å; I184-M188 HydrophobicContact CG2-CG 4.27Å; I184-M188 VanDerWaalsContact O-CG 3.22Å; I184-M188 WeakPolarHBondContact O-CG 3.39Å; I184-M188 PolarHBondContact O-N 3.35Å; I184-L214 HydrophobicContact CB-CD1 3.84Å; I184-L214 HydrophobicContact CB-CD2 4.44Å; I184-L214 HydrophobicContact CD1-CD2 3.71Å; I184-L214 HydrophobicContact CG2-CD1 3.72Å; I184-L214 HydrophobicContact CG2-CD2 4.12Å; I184-L214 HydrophobicContact CG2-CG 4.18Å; I184-L248 HydrophobicContact CD1-CD2 3.14Å; I184-L248 HydrophobicContact CD1-CG 4.18Å; I184-I281 HydrophobicContact CG1-CD1 4.28Å
185	K	67.1	Low	61	Low	61 Å²	61	46.9 Å²	46.9	27%	0.265	23%	0.232	S	C	.	.	H	α-helix	trans	-56.4	-41.2	170.6	-73.1	-168.4	173.2	-166.2	0	111.8	N181 K182 M188 N189 V212	N181-K185 WeakPolarHBondContact O-CG 3.16Å; N181-K185 PolarHBondContact O-N 3.38Å; K182-K185 PolarHBondContact O-N 2.89Å; K185-M188 PolarHBondContact O-N 3.43Å; K185-N189 WeakPolarHBondContact O-CB 3.31Å; K185-N189 PolarHBondContact O-N 2.9Å; K185-V212 WeakPolarHBondContact CE-O 3.33Å; K185-V212 HydrophobicContact CG-CB 4.15Å; K185-V212 HydrophobicContact CG-CG1 4.23Å
186	L	67.1	Low	59.2	Low	89 Å²	89	46.8 Å²	46.8	47%	0.466	23%	0.232	S	C	.	.	H	α-helix	trans	-64.9	-43.9	177.9	-129.8	147.1	0	0	0	112.2	K182 I183 I184 N189 L190	K182-L186 WeakPolarHBondContact O-CB 3.47Å; K182-L186 PolarHBondContact O-N 2.84Å; I183-L186 WeakPolarHBondContact O-CB 3.47Å; I183-L186 PolarHBondContact O-N 3.38Å; I184-L186 PolarHBondContact O-N 3.36Å; L186-N189 PolarHBondContact O-N 3.37Å; L186-L190 HydrophobicContact CD2-CD1 3.81Å; L186-L190 WeakPolarHBondContact O-CB 3.03Å; L186-L190 PolarHBondContact O-N 3.34Å
187	F	65.9	Low	57.3	Low	10 Å²	10	51.6 Å²	51.6	4%	0.044	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-46.7	173.6	171	-109.7	0	0	0	111.8	F163 F165 I183 I184 N189 L190 I191 L284 L285	F163-F187 HydrophobicContact CE2-CE1 4.45Å; F165-F187 HydrophobicContact CZ-CD1 4.28Å; F165-F187 HydrophobicContact CZ-CE1 4.31Å; I183-F187 PolarHBondContact O-N 3.2Å; I184-F187 PolarHBondContact O-N 2.74Å; F187-N189 VanDerWaalsContact C-N 3.34Å; F187-N189 PolarHBondContact O-N 3.24Å; F187-L190 PolarHBondContact O-N 3.34Å; F187-I191 HydrophobicContact CD1-CD1 4.3Å; F187-I191 HydrophobicContact CE1-CD1 3.74Å; F187-I191 HydrophobicContact CE2-CD1 4.15Å; F187-I191 HydrophobicContact CE2-CG1 4.4Å; F187-I191 HydrophobicContact CZ-CD1 3.66Å; F187-I191 HydrophobicContact CZ-CG1 4.37Å; F187-I191 WeakPolarHBondContact O-CG1 3.47Å; F187-I191 PolarHBondContact O-N 2.87Å; F187-I191 VanDerWaalsContact O-N 3.15Å; F187-L284 HydrophobicContact CD2-CB 3.81Å; F187-L284 HydrophobicContact CD2-CD1 4.19Å; F187-L284 HydrophobicContact CE2-CB 3.58Å; F187-L284 HydrophobicContact CE2-CD1 3.47Å; F187-L284 VanDerWaalsContact CE2-CD1 3.47Å; F187-L284 HydrophobicContact CE2-CD2 4.29Å; F187-L284 HydrophobicContact CE2-CG 3.95Å; F187-L284 HydrophobicContact CZ-CD1 3.74Å; F187-L285 HydrophobicContact CB-CD2 4.17Å
188	M	64.9	Low	55.6	Low	1 Å²	1	58.1 Å²	58.1	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-66	-35.1	179.6	-64.7	-59.9	-78.9	0	0	112.4	F163 I184 K185 I191 V212 Q252	F163-M188 HydrophobicContact CD2-CE 3.67Å; F163-M188 HydrophobicContact CD2-SD 3.45Å; F163-M188 WeakPolarHBondContact CD2-SD 3.49Å; F163-M188 HydrophobicContact CE2-CE 3.82Å; F163-M188 HydrophobicContact CE2-SD 3.61Å; I184-M188 HydrophobicContact CG2-CG 4.27Å; I184-M188 VanDerWaalsContact O-CG 3.22Å; I184-M188 WeakPolarHBondContact O-CG 3.39Å; I184-M188 PolarHBondContact O-N 3.35Å; K185-M188 PolarHBondContact O-N 3.43Å; M188-I191 HydrophobicContact SD-CD1 4.27Å; M188-V212 HydrophobicContact CB-CB 4.46Å; M188-V212 HydrophobicContact CB-CG1 3.98Å; M188-V212 HydrophobicContact CB-CG2 3.61Å; M188-V212 HydrophobicContact CG-CG1 3.83Å; M188-V212 HydrophobicContact CG-CG2 4.36Å; M188-Q252 HydrophobicContact CE-CB 3.57Å; M188-Q252 HydrophobicContact CE-CG 4.25Å
189	N	63.6	Low	53.6	Low	39 Å²	39	60.1 Å²	60.1	21%	0.209	31%	0.306	C	S	.	.	H	α-helix	trans	-73.6	-34.7	173	-80.3	-5.2	0	0	0	112.7	K185 L186 F187 I191 N192 I193 N209	K185-N189 WeakPolarHBondContact O-CB 3.31Å; K185-N189 PolarHBondContact O-N 2.9Å; L186-N189 PolarHBondContact O-N 3.37Å; F187-N189 VanDerWaalsContact C-N 3.34Å; F187-N189 PolarHBondContact O-N 3.24Å; N189-I191 VanDerWaalsContact C-N 3.27Å; N189-I191 PolarHBondContact O-N 3.49Å; N189-N192 WeakPolarHBondContact O-CA 3.4Å; N189-N192 WeakPolarHBondContact O-CB 3.39Å; N189-N192 PolarHBondContact O-N 2.84Å; N189-I193 WeakPolarHBondContact O-CG1 3.34Å; N189-I193 PolarHBondContact O-N 3.35Å; N189-N209 PolarHBondContact ND2-OD1 2.69Å
190	L	53.6	Low	51.4	Low	48 Å²	48	64.1 Å²	64.1	25%	0.251	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-32.5	175.2	-95.9	154.5	0	0	0	112.6	L186 F187 N192 I193 T194 L285	L186-L190 HydrophobicContact CD2-CD1 3.81Å; L186-L190 WeakPolarHBondContact O-CB 3.03Å; L186-L190 PolarHBondContact O-N 3.34Å; F187-L190 PolarHBondContact O-N 3.34Å; L190-N192 PolarHBondContact O-N 2.78Å; L190-I193 PolarHBondContact O-N 2.68Å; L190-T194 HydrophobicContact CD2-CG2 3.76Å; L190-T194 WeakPolarHBondContact O-CB 3.48Å; L190-T194 WeakPolarHBondContact O-CG2 3.46Å; L190-T194 PolarHBondContact O-N 3.24Å; L190-T194 PolarHBondContact O-OG1 3.11Å; L190-L285 HydrophobicContact CD1-CD2 3.46Å; L190-L285 VanDerWaalsContact CD1-CD2 3.46Å
191	I	54.2	Low	49.2	Very low	10 Å²	10	70.9 Å²	70.9	5%	0.051	36%	0.363	C	S	.	.	H	α-helix	trans	-58.7	-34	170.6	-70.8	171.2	0	0	0	111	F163 F187 M188 N189 I263 I266	F163-I191 HydrophobicContact CE2-CD1 3.96Å; F163-I191 HydrophobicContact CZ-CD1 4Å; F187-I191 HydrophobicContact CD1-CD1 4.3Å; F187-I191 HydrophobicContact CE1-CD1 3.74Å; F187-I191 HydrophobicContact CE2-CD1 4.15Å; F187-I191 HydrophobicContact CE2-CG1 4.4Å; F187-I191 HydrophobicContact CZ-CD1 3.66Å; F187-I191 HydrophobicContact CZ-CG1 4.37Å; F187-I191 WeakPolarHBondContact O-CG1 3.47Å; F187-I191 PolarHBondContact O-N 2.87Å; F187-I191 VanDerWaalsContact O-N 3.15Å; M188-I191 HydrophobicContact SD-CD1 4.27Å; N189-I191 VanDerWaalsContact C-N 3.27Å; N189-I191 PolarHBondContact O-N 3.49Å; I191-I263 HydrophobicContact CG2-CD1 4.36Å; I191-I266 HydrophobicContact CB-CD1 4.5Å; I191-I266 HydrophobicContact CG2-CD1 3.74Å
192	N	45	Very low	47.1	Very low	66 Å²	66	76 Å²	76	35%	0.353	39%	0.389	S	S	.	.	H	α-helix	trans	-77.1	-39.4	172.6	-76.4	-16.9	0	0	0	112.8	N189 L190	N189-N192 WeakPolarHBondContact O-CA 3.4Å; N189-N192 WeakPolarHBondContact O-CB 3.39Å; N189-N192 PolarHBondContact O-N 2.84Å; L190-N192 PolarHBondContact O-N 2.78Å
193	I	35	Very low	45	Very low	83 Å²	83	74.8 Å²	74.8	43%	0.426	40%	0.395	S	S	.	.	H	α-helix	trans	-83.5	-35.4	-170.3	-63.5	166.6	0	0	0	113.3	N189 L190 Y195 L196 N197	N189-I193 WeakPolarHBondContact O-CG1 3.34Å; N189-I193 PolarHBondContact O-N 3.35Å; L190-I193 PolarHBondContact O-N 2.68Å; I193-Y195 PolarHBondContact O-N 3.37Å; I193-L196 PolarHBondContact O-N 2.93Å; I193-N197 PolarHBondContact O-N 3.33Å
194	T	38.7	Very low	43	Very low	89 Å²	89	81.5 Å²	81.5	55%	0.546	43%	0.431	S	S	.	.	H	α-helix	trans	-62.9	-18.6	-172.3	42.7	0	0	0	0	114.3	L190	L190-T194 HydrophobicContact CD2-CG2 3.76Å; L190-T194 WeakPolarHBondContact O-CB 3.48Å; L190-T194 WeakPolarHBondContact O-CG2 3.46Å; L190-T194 PolarHBondContact O-N 3.24Å; L190-T194 PolarHBondContact O-OG1 3.11Å
195	Y	32.6	Very low	40.9	Very low	101 Å²	101	88.4 Å²	88.4	40%	0.396	47%	0.466	S	S	.	.	H	α-helix	trans	-98.6	-24.9	172.4	-129.5	-82.8	0	0	0	113.8	I193 N197 Q198 K265	I193-Y195 PolarHBondContact O-N 3.37Å; Y195-N197 VanDerWaalsContact C-N 3.33Å; Y195-N197 PolarHBondContact O-N 2.77Å; Y195-Q198 PolarHBondContact O-N 2.01Å; Y195-K265 PolarHBondContact OH-NZ 3.11Å
196	L	30.1	Very low	38.9	Very low	104 Å²	104	94 Å²	94	55%	0.545	49%	0.493	S	S	.	.	H	α-helix	trans	-70.1	-27.3	179	-107	145.3	0	0	0	112.8	I193 Q198 S199	I193-L196 PolarHBondContact O-N 2.93Å; L196-Q198 PolarHBondContact O-N 2.92Å; L196-Q198 VanDerWaalsContact O-N 3.16Å; L196-S199 CarbonylContact O-C 3.56Å; L196-S199 VanDerWaalsContact O-C 3.3Å; L196-S199 PolarHBondContact O-N 2.82Å
197	N	30	Very low	37.1	Very low	125 Å²	125	97 Å²	97	67%	0.668	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-2.6	176	-82.9	-10.6	0	0	0	115.1	I193 Y195	I193-N197 PolarHBondContact O-N 3.33Å; Y195-N197 VanDerWaalsContact C-N 3.33Å; Y195-N197 PolarHBondContact O-N 2.77Å
198	Q	33.5	Very low	35.4	Very low	149 Å²	149	101.1 Å²	101.1	70%	0.696	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-1.5	164.9	-84.5	-172.8	-31	0	0	113.9	Y195 L196	Y195-Q198 PolarHBondContact O-N 2.01Å; L196-Q198 PolarHBondContact O-N 2.92Å; L196-Q198 VanDerWaalsContact O-N 3.16Å
199	S	26.8	Very low	33.9	Very low	75 Å²	75	105.8 Å²	105.8	52%	0.524	56%	0.557	S	S	.	*	S	Bend	trans	-136.6	78.3	173.4	62.2	0	0	0	0	109.8	L196 I201	L196-S199 CarbonylContact O-C 3.56Å; L196-S199 VanDerWaalsContact O-C 3.3Å; L196-S199 PolarHBondContact O-N 2.82Å; S199-I201 PolarHBondContact O-N 2.85Å; S199-I201 VanDerWaalsContact O-N 3.07Å
200	L	23.2	Very low	32.8	Very low	135 Å²	135	109.1 Å²	109.1	71%	0.707	58%	0.575	S	S	*	*			trans	-61.1	101.9	171.4	-96	149.1	0	0	0	110.7	I202	L200-I202 HydrophobicContact CD2-CD1 4.21Å; L200-I202 HydrophobicContact CD2-CG1 4.2Å
201	I	26.1	Very low	32.3	Very low	150 Å²	150	110.3 Å²	110.3	77%	0.769	58%	0.582	S	S	*	*			trans	-138.4	110.1	137.2	-62.5	-173.7	0	0	0	106.4	S199 S203	S199-I201 PolarHBondContact O-N 2.85Å; S199-I201 VanDerWaalsContact O-N 3.07Å; I201-S203 PolarHBondContact O-N 3.39Å; I201-S203 VanDerWaalsContact O-N 3.09Å
202	I	25.2	Very low	31.7	Very low	139 Å²	139	110.1 Å²	110.1	71%	0.713	58%	0.581	S	S	*	*			trans	-72.1	94.9	176.7	-60.6	167.3	0	0	0	107.2	L200	L200-I202 HydrophobicContact CD2-CD1 4.21Å; L200-I202 HydrophobicContact CD2-CG1 4.2Å
203	S	24.9	Very low	31.8	Very low	86 Å²	86	110.9 Å²	110.9	60%	0.601	59%	0.585	S	S	*	*			trans	-95.1	118.2	157.9	59.9	0	0	0	0	107.5	I201 I205	I201-S203 PolarHBondContact O-N 3.39Å; I201-S203 VanDerWaalsContact O-N 3.09Å; S203-I205 PolarHBondContact O-N 3.16Å
204	N	25.5	Very low	32.1	Very low	151 Å²	151	108.2 Å²	108.2	81%	0.807	57%	0.572	S	S	*	*			trans	-50.4	96.6	173.3	-69	-22	0	0	0	110.2	E206	N204-E206 PolarHBondContact O-N 3.46Å
205	I	26.1	Very low	32.6	Very low	146 Å²	146	106.3 Å²	106.3	75%	0.749	56%	0.557	S	S	*	*			trans	-88.6	102.2	165.2	-66.8	172.4	0	0	0	105.1	S203 D207	S203-I205 PolarHBondContact O-N 3.16Å; I205-D207 PolarHBondContact O-N 3.42Å
206	E	25.4	Very low	33.2	Very low	178 Å²	178	103.6 Å²	103.6	83%	0.832	55%	0.55	S	S	*	.			trans	-53.4	115.7	166.5	-72.4	174.8	147.2	0	0	109.8	N204 D208	N204-E206 PolarHBondContact O-N 3.46Å; E206-D208 VanDerWaalsContact C-N 3.29Å; E206-D208 PolarHBondContact O-N 3.4Å
207	D	28.8	Very low	34.1	Very low	153 Å²	153	101.4 Å²	101.4	82%	0.818	54%	0.537	S	S	*	.			trans	33.7	28.8	142.4	-89.3	-19.8	0	0	0	122	I205 N209	I205-D207 PolarHBondContact O-N 3.42Å; D207-N209 PolarHBondContact O-N 2.84Å
208	D	30.5	Very low	35.3	Very low	96 Å²	96	98.2 Å²	98.2	51%	0.513	52%	0.524	S	S	.	.			trans	-85.2	52.4	169.4	-133.3	10.9	0	0	0	111.4	K147 E206 D210 N211	K147-D208 IonicContact NZ-OD1 2.71Å; E206-D208 VanDerWaalsContact C-N 3.29Å; E206-D208 PolarHBondContact O-N 3.4Å; D208-D210 PolarHBondContact O-N 3.1Å; D208-N211 PolarHBondContact O-ND2 3.11Å
209	N	34	Very low	36.4	Very low	98 Å²	98	91.3 Å²	91.3	52%	0.524	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	4.2	-172.7	-136	-4.2	0	0	0	113.9	N189 D207 N211	N189-N209 PolarHBondContact ND2-OD1 2.69Å; D207-N209 PolarHBondContact O-N 2.84Å; N209-N211 VanDerWaalsContact C-N 3.33Å; N209-N211 PolarHBondContact O-N 3.49Å
210	D	39.1	Very low	38.2	Very low	110 Å²	110	90.4 Å²	90.4	59%	0.588	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	13.6	-177.3	-82.9	-26.9	0	0	0	114.3	D208 V212	D208-D210 PolarHBondContact O-N 3.1Å; D210-V212 VanDerWaalsContact C-N 3.28Å; D210-V212 PolarHBondContact O-N 2.87Å; D210-V212 VanDerWaalsContact O-N 3.13Å
211	N	44.8	Very low	40	Very low	72 Å²	72	86.9 Å²	86.9	39%	0.385	47%	0.465	S	S	.	.			trans	-74.9	0.8	-168	-85.2	-46.9	0	0	0	117	K151 D208 N209	K151-N211 WeakPolarHBondContact CE-OD1 3.37Å; K151-N211 PolarHBondContact NZ-OD1 3.45Å; D208-N211 PolarHBondContact O-ND2 3.11Å; N209-N211 VanDerWaalsContact C-N 3.33Å; N209-N211 PolarHBondContact O-N 3.49Å
212	V	39.6	Very low	41.8	Very low	7 Å²	7	80.9 Å²	80.9	4%	0.042	43%	0.433	C	S	.	.			trans	-122	105.2	-176.3	-178.7	0	0	0	0	109.9	K185 M188 D210	K185-V212 WeakPolarHBondContact CE-O 3.33Å; K185-V212 HydrophobicContact CG-CB 4.15Å; K185-V212 HydrophobicContact CG-CG1 4.23Å; M188-V212 HydrophobicContact CB-CB 4.46Å; M188-V212 HydrophobicContact CB-CG1 3.98Å; M188-V212 HydrophobicContact CB-CG2 3.61Å; M188-V212 HydrophobicContact CG-CG1 3.83Å; M188-V212 HydrophobicContact CG-CG2 4.36Å; D210-V212 VanDerWaalsContact C-N 3.28Å; D210-V212 PolarHBondContact O-N 2.87Å; D210-V212 VanDerWaalsContact O-N 3.13Å
213	N	48	Very low	43.8	Very low	81 Å²	81	76.5 Å²	76.5	43%	0.433	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	111.8	173.3	-74.8	-23.4	0	0	0	109.2	I215	N213-I215 HydrophobicContact CB-CD1 4.36Å; N213-I215 HydrophobicContact CB-CG1 4.19Å
214	L	42.2	Very low	45.7	Very low	28 Å²	28	81.2 Å²	81.2	15%	0.147	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	119.5	161.4	-89.6	120.9	0	0	0	108.2	N181 I184 L248	N181-L214 WeakPolarHBondContact OD1-CD1 3.25Å; I184-L214 HydrophobicContact CB-CD1 3.84Å; I184-L214 HydrophobicContact CB-CD2 4.44Å; I184-L214 HydrophobicContact CD1-CD2 3.71Å; I184-L214 HydrophobicContact CG2-CD1 3.72Å; I184-L214 HydrophobicContact CG2-CD2 4.12Å; I184-L214 HydrophobicContact CG2-CG 4.18Å; L214-L248 HydrophobicContact CD2-CD1 3.43Å; L214-L248 VanDerWaalsContact CD2-CD1 3.43Å; L214-L248 HydrophobicContact CD2-CD2 3.92Å; L214-L248 HydrophobicContact CD2-CG 3.73Å
215	I	49.3	Very low	47.8	Very low	48 Å²	48	78 Å²	78	25%	0.246	39%	0.393	C	S	.	.			trans	-123.6	115.8	175.7	-48.5	177.3	0	0	0	107.9	N213 E217 Y222 V249 I251	N213-I215 HydrophobicContact CB-CD1 4.36Å; N213-I215 HydrophobicContact CB-CG1 4.19Å; I215-E217 VanDerWaalsContact C-N 3.29Å; I215-E217 HydrophobicContact CG2-CG 4.1Å; I215-E217 PolarHBondContact O-N 3.43Å; I215-Y222 HydrophobicContact CB-CE2 4.31Å; I215-Y222 VanDerWaalsContact CB-OH 3.28Å; I215-Y222 WeakPolarHBondContact CB-OH 3.25Å; I215-Y222 VanDerWaalsContact CD1-OH 3.28Å; I215-Y222 WeakPolarHBondContact CD1-OH 3.25Å; I215-Y222 HydrophobicContact CG2-CE2 4.29Å; I215-Y222 WeakPolarHBondContact CG2-OH 3.23Å; I215-V249 PolarHBondContact N-O 3.09Å; I215-V249 VanDerWaalsContact O-O 3.08Å; I215-I251 HydrophobicContact CD1-CD1 4.27Å
216	L	45	Very low	49.8	Very low	45 Å²	45	71.4 Å²	71.4	24%	0.236	36%	0.359	C	S	.	.			trans	-92.5	63.5	-176.6	-91.2	147	0	0	0	110.7	F84 I169 L248	F84-L216 HydrophobicContact CD1-CD1 4.34Å; F84-L216 HydrophobicContact CE1-CB 3.88Å; F84-L216 HydrophobicContact CE1-CD1 3.2Å; F84-L216 HydrophobicContact CE1-CG 4.03Å; F84-L216 HydrophobicContact CZ-CD1 3.38Å; I169-L216 HydrophobicContact CD1-CD1 4.02Å; I169-L216 HydrophobicContact CD1-CD2 3.14Å; I169-L216 HydrophobicContact CD1-CG 4.18Å; L216-L248 HydrophobicContact CD1-CD1 3.3Å; L216-L248 HydrophobicContact CD2-CB 4.21Å; L216-L248 HydrophobicContact CD2-CD1 3.43Å; L216-L248 VanDerWaalsContact CD2-CD1 3.43Å; L216-L248 HydrophobicContact CD2-CG 4.45Å; L216-L248 HydrophobicContact CG-CD1 3.35Å
217	E	48.3	Very low	52.2	Low	58 Å²	58	65.4 Å²	65.4	27%	0.271	34%	0.336	S	S	.	.	S	Bend	trans	-102.1	160.8	164.9	-72.5	179.8	-173.8	0	0	109.4	I215 I221 Y222	I215-E217 VanDerWaalsContact C-N 3.29Å; I215-E217 HydrophobicContact CG2-CG 4.1Å; I215-E217 PolarHBondContact O-N 3.43Å; E217-I221 HydrophobicContact CB-CD1 4.12Å; E217-I221 WeakPolarHBondContact OE2-CG2 3.31Å; E217-Y222 HydrophobicContact CB-CD2 4.43Å; E217-Y222 HydrophobicContact CB-CE2 3.79Å; E217-Y222 HydrophobicContact CG-CE2 4.46Å
218	S	55.1	Low	54.5	Low	57 Å²	57	62 Å²	62	40%	0.399	32%	0.317	S	S	.	.			trans	-52.7	130.2	169.6	177.4	0	0	0	0	109	T220 I221	S218-T220 PolarHBondContact O-N 2.67Å; S218-T220 PolarHBondContact OG-N 3.26Å; S218-T220 PolarHBondContact OG-OG1 3.2Å; S218-I221 WeakPolarHBondContact O-CB 3.22Å; S218-I221 PolarHBondContact O-N 2.78Å
219	P	57.2	Low	56.8	Low	5 Å²	5	61.8 Å²	61.8	3%	0.032	32%	0.316	C	S	.	.	H	α-helix	trans	-51.3	-30.4	176.8	-17.9	21.1	0	0	0	112.4	I164 I221 Y222 E223 Q247 V249	I164-P219 HydrophobicContact CD1-CB 3.78Å; I164-P219 HydrophobicContact CD1-CG 4.2Å; I164-P219 HydrophobicContact CG1-CB 4.41Å; I164-P219 HydrophobicContact CG2-CG 4.22Å; P219-I221 PolarHBondContact O-N 3.43Å; P219-Y222 PolarHBondContact O-N 3.28Å; P219-Y222 VanDerWaalsContact O-N 3.14Å; P219-E223 WeakPolarHBondContact O-CG 3.47Å; P219-E223 PolarHBondContact O-N 2.92Å; P219-Q247 HydrophobicContact CG-CB 4.39Å; P219-V249 HydrophobicContact CB-CG2 3.92Å; P219-V249 HydrophobicContact CG-CG2 3.59Å
220	T	64.1	Low	59.1	Low	56 Å²	56	59 Å²	59	34%	0.344	31%	0.306	S	S	.	.	H	α-helix	trans	-60.1	-28	178.2	66.8	0	0	0	0	114	S218 R224	S218-T220 PolarHBondContact O-N 2.67Å; S218-T220 PolarHBondContact OG-N 3.26Å; S218-T220 PolarHBondContact OG-OG1 3.2Å; T220-R224 VanDerWaalsContact O-CG 3.27Å; T220-R224 WeakPolarHBondContact O-CG 3.37Å; T220-R224 PolarHBondContact O-N 3.31Å
221	I	62	Low	61.4	Low	61 Å²	61	56.8 Å²	56.8	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-70.9	-41.4	178	-65.1	168.9	0	0	0	109.9	E217 S218 P219 K225	E217-I221 HydrophobicContact CB-CD1 4.12Å; E217-I221 WeakPolarHBondContact OE2-CG2 3.31Å; S218-I221 WeakPolarHBondContact O-CB 3.22Å; S218-I221 PolarHBondContact O-N 2.78Å; P219-I221 PolarHBondContact O-N 3.43Å; I221-K225 WeakPolarHBondContact O-CG 3.1Å
222	Y	63.3	Low	63.4	Low	24 Å²	24	53.9 Å²	53.9	9%	0.094	29%	0.285	C	S	.	.	H	α-helix	trans	-76	-39.6	177.6	-70.6	-68.5	0	0	0	112.6	L162 I215 E217 P219 R224 K225 L226 I251	L162-Y222 HydrophobicContact CD2-CG 4.24Å; I215-Y222 HydrophobicContact CB-CE2 4.31Å; I215-Y222 VanDerWaalsContact CB-OH 3.28Å; I215-Y222 WeakPolarHBondContact CB-OH 3.25Å; I215-Y222 VanDerWaalsContact CD1-OH 3.28Å; I215-Y222 WeakPolarHBondContact CD1-OH 3.25Å; I215-Y222 HydrophobicContact CG2-CE2 4.29Å; I215-Y222 WeakPolarHBondContact CG2-OH 3.23Å; E217-Y222 HydrophobicContact CB-CD2 4.43Å; E217-Y222 HydrophobicContact CB-CE2 3.79Å; E217-Y222 HydrophobicContact CG-CE2 4.46Å; P219-Y222 PolarHBondContact O-N 3.28Å; P219-Y222 VanDerWaalsContact O-N 3.14Å; Y222-R224 PolarHBondContact O-N 3.41Å; Y222-K225 CarbonylContact O-C 3.59Å; Y222-K225 WeakPolarHBondContact O-CA 3.33Å; Y222-K225 PolarHBondContact O-N 3.39Å; Y222-L226 VanDerWaalsContact O-CD1 3.29Å; Y222-L226 WeakPolarHBondContact O-CD1 3.27Å; Y222-L226 VanDerWaalsContact O-CG 3.23Å; Y222-L226 WeakPolarHBondContact O-CG 3.35Å; Y222-L226 PolarHBondContact O-N 3.43Å; Y222-L226 VanDerWaalsContact O-N 3.12Å; Y222-I251 HydrophobicContact CD1-CD1 3.58Å; Y222-I251 HydrophobicContact CD2-CD1 3.85Å; Y222-I251 HydrophobicContact CE1-CD1 3.31Å; Y222-I251 HydrophobicContact CE2-CD1 3.55Å; Y222-I251 HydrophobicContact CG-CD1 3.86Å
223	E	66.3	Low	65.7	Low	46 Å²	46	60.5 Å²	60.5	22%	0.215	31%	0.314	C	S	.	.	H	α-helix	trans	-57	-37.1	174.7	-74.3	171.8	173.2	0	0	112.1	P219 K225 L226 I228 R239 I305	P219-E223 WeakPolarHBondContact O-CG 3.47Å; P219-E223 PolarHBondContact O-N 2.92Å; E223-K225 PolarHBondContact O-N 2.89Å; E223-L226 PolarHBondContact O-N 2.78Å; E223-L226 VanDerWaalsContact O-O 3.11Å; E223-I228 HydrophobicContact CG-CD1 4.41Å; E223-R239 IonicContact OE1-CZ 2.88Å; E223-R239 IonicContact OE1-NH1 3.43Å; E223-R239 PolarHBondContact OE1-NH1 3.44Å; E223-R239 IonicContact OE1-NH2 2.67Å; E223-R239 PolarHBondContact OE1-NH2 3.35Å; E223-R239 IonicContact OE2-NH1 3.08Å; E223-R239 PolarHBondContact OE2-NH1 3.28Å; E223-I305 HydrophobicContact CG-CD1 3.74Å; E223-I305 WeakPolarHBondContact OE1-CD1 3.31Å
224	R	66.3	Low	67.5	Low	185 Å²	185	56.9 Å²	56.9	70%	0.698	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-21	174.2	-74.4	176.7	-172.6	174.6	4.3	114	T220 Y222	T220-R224 VanDerWaalsContact O-CG 3.27Å; T220-R224 WeakPolarHBondContact O-CG 3.37Å; T220-R224 PolarHBondContact O-N 3.31Å; Y222-R224 PolarHBondContact O-N 3.41Å
225	K	68	Low	69.3	Low	84 Å²	84	61.2 Å²	61.2	37%	0.365	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	2.2	177.7	-67.8	176.5	-178.8	174.9	0	112.2	I221 Y222 E223 L309 I310	I221-K225 WeakPolarHBondContact O-CG 3.1Å; Y222-K225 CarbonylContact O-C 3.59Å; Y222-K225 WeakPolarHBondContact O-CA 3.33Å; Y222-K225 PolarHBondContact O-N 3.39Å; E223-K225 PolarHBondContact O-N 2.89Å; K225-L309 HydrophobicContact CB-CD1 4.35Å; K225-L309 CarbonylContact O-C 3.38Å; K225-L309 WeakPolarHBondContact O-CA 3.42Å; K225-I310 PolarHBondContact O-N 3.33Å
226	L	68.6	Low	70.6	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.037	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	134.6	-176.2	-69	160.1	0	0	0	110.8	L160 L162 Y222 E223 I228 G307 D308 I310	L160-L226 HydrophobicContact CB-CD2 3.92Å; L160-L226 HydrophobicContact CD1-CD2 4.01Å; L160-L226 HydrophobicContact CG-CD2 4.29Å; L162-L226 HydrophobicContact CD1-CD1 3.4Å; L162-L226 VanDerWaalsContact CD1-CD1 3.4Å; L162-L226 HydrophobicContact CD2-CD1 3.72Å; L162-L226 HydrophobicContact CG-CD1 4.21Å; Y222-L226 VanDerWaalsContact O-CD1 3.29Å; Y222-L226 WeakPolarHBondContact O-CD1 3.27Å; Y222-L226 VanDerWaalsContact O-CG 3.23Å; Y222-L226 WeakPolarHBondContact O-CG 3.35Å; Y222-L226 PolarHBondContact O-N 3.43Å; Y222-L226 VanDerWaalsContact O-N 3.12Å; E223-L226 PolarHBondContact O-N 2.78Å; E223-L226 VanDerWaalsContact O-O 3.11Å; L226-I228 PolarHBondContact O-N 2.78Å; L226-G307 WeakPolarHBondContact CD2-O 3.36Å; L226-D308 CarbonylContact C-O 3.58Å; L226-D308 VanDerWaalsContact CA-O 3.28Å; L226-D308 WeakPolarHBondContact CA-O 3.49Å; L226-I310 VanDerWaalsContact C-CD1 3.45Å
227	S	77.1	Confident	72.1	Confident	52 Å²	52	65 Å²	65	36%	0.364	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	97.6	161	64.5	0	0	0	0	107.6	L229 G307 D308	S227-L229 PolarHBondContact O-N 2.6Å; S227-G307 CarbonylContact O-C 3.59Å; S227-G307 WeakPolarHBondContact O-CA 3.27Å; S227-D308 PolarHBondContact N-O 2.85Å; S227-D308 PolarHBondContact O-N 3.48Å; S227-D308 WeakPolarHBondContact OG-CB 3.3Å; S227-D308 PolarHBondContact OG-O 3.42Å
228	I	75.6	Confident	73	Confident	82 Å²	82	69 Å²	69	42%	0.421	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	117.7	-174	-58.7	173.6	0	0	0	109.5	E223 L226 I305 V306	E223-I228 HydrophobicContact CG-CD1 4.41Å; L226-I228 PolarHBondContact O-N 2.78Å; I228-I305 HydrophobicContact CB-CG2 4.35Å; I228-I305 HydrophobicContact CD1-CG2 4.04Å; I228-I305 HydrophobicContact CG1-CG2 3.82Å; I228-I305 HydrophobicContact CG2-CG2 3.75Å; I228-V306 CarbonylContact C-O 3.49Å
229	L	78.5	Confident	73.5	Confident	91 Å²	91	69.3 Å²	69.3	48%	0.476	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-38.8	175.7	-63.3	176.1	0	0	0	111.2	T159 S227 I259 V306	T159-L229 HydrophobicContact CG2-CD1 4.05Å; S227-L229 PolarHBondContact O-N 2.6Å; L229-I259 HydrophobicContact CD1-CD1 4.31Å; L229-V306 HydrophobicContact CD1-CG1 4.44Å; L229-V306 PolarHBondContact N-O 2.6Å
230	A	82.5	Confident	73.6	Confident	39 Å²	39	74.3 Å²	74.3	32%	0.322	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	149.7	178.6	0	0	0	0	0	110.7	W304 V306	A230-W304 HydrophobicContact CB-CH2 4.11Å; A230-W304 HydrophobicContact CB-CZ3 3.93Å; A230-V306 PolarHBondContact N-O 3.19Å; A230-V306 VanDerWaalsContact N-O 3.16Å; A230-V306 PolarHBondContact O-N 2.73Å
231	S	88.5	Confident	73	Confident	64 Å²	64	77.2 Å²	77.2	45%	0.448	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	152.3	169.9	62.5	0	0	0	0	111.1	W304	S231-W304 VanDerWaalsContact CA-O 3.27Å; S231-W304 WeakPolarHBondContact CA-O 3.05Å; S231-W304 WeakPolarHBondContact CB-O 3.31Å
232	A	86.1	Confident	72.3	Confident	11 Å²	11	83.3 Å²	83.3	9%	0.091	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	142.1	171.5	0	0	0	0	0	110.9	E271 F274 E303 W304	A232-E271 HydrophobicContact CB-CB 4.24Å; A232-E271 HydrophobicContact CB-CG 3.95Å; A232-F274 HydrophobicContact CB-CD2 4.04Å; A232-F274 HydrophobicContact CB-CE2 4.43Å; A232-F274 VanDerWaalsContact O-CE2 3.24Å; A232-F274 WeakPolarHBondContact O-CE2 3.42Å; A232-E303 VanDerWaalsContact O-CA 3.31Å; A232-E303 WeakPolarHBondContact O-CA 3.24Å; A232-E303 WeakPolarHBondContact O-CG 3.21Å; A232-W304 HydrophobicContact CB-CD2 4.29Å; A232-W304 VanDerWaalsContact CB-CE2 3.49Å; A232-W304 HydrophobicContact CB-CH2 4.28Å; A232-W304 HydrophobicContact CB-CZ2 3.48Å; A232-W304 VanDerWaalsContact CB-CZ2 3.48Å; A232-W304 PolarHBondContact N-O 2.91Å; A232-W304 PolarHBondContact O-N 2.82Å
233	K	87.8	Confident	71.6	Confident	147 Å²	147	84.5 Å²	84.5	64%	0.639	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.4	-173.2	49.9	-177.1	173.5	-177.9	0	111	E303	K233-E303 HydrophobicContact CB-CB 4.25Å; K233-E303 HydrophobicContact CB-CG 4.08Å
234	A	85.6	Confident	70.7	Confident	4 Å²	4	88.3 Å²	88.3	3%	0.033	45%	0.454	C	S	.	.			trans	-60.4	140.2	178.2	0	0	0	0	0	112.3	N236 Y237 F274 L278 A302	A234-N236 PolarHBondContact O-N 2.87Å; A234-Y237 WeakPolarHBondContact O-CB 3.27Å; A234-Y237 PolarHBondContact O-N 3.06Å; A234-Y237 VanDerWaalsContact O-N 3.15Å; A234-F274 HydrophobicContact CB-CD1 3.81Å; A234-F274 HydrophobicContact CB-CE1 4.38Å; A234-F274 HydrophobicContact CB-CG 4.36Å; A234-L278 HydrophobicContact CB-CD2 3.89Å; A234-L278 HydrophobicContact CB-CG 4.36Å; A234-A302 WeakPolarHBondContact CB-O 3.47Å; A234-A302 PolarHBondContact N-O 2.91Å
235	H	81.4	Confident	69.9	Low	119 Å²	119	84 Å²	84	55%	0.551	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	135.7	176.8	-167.5	72.2	0	0	0	110.5	Y237 F274	H235-Y237 PolarHBondContact O-N 3.33Å; H235-Y237 VanDerWaalsContact O-N 3.15Å; H235-F274 WeakPolarHBondContact CB-O 3.34Å; H235-F274 PolarHBondContact N-O 3.23Å
236	N	76.6	Confident	69.1	Low	140 Å²	140	81 Å²	81	75%	0.749	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	7.4	-174.2	-61.2	-25.7	0	0	0	116.7	A234 I238	A234-N236 PolarHBondContact O-N 2.87Å; N236-I238 PolarHBondContact O-N 3.3Å
237	Y	75.4	Confident	68.8	Low	32 Å²	32	82 Å²	82	13%	0.125	44%	0.435	C	S	.	.			trans	-79.7	112.4	170.7	-178.4	-107.6	0	0	0	110.4	N166 A234 H235 R239 Q247 L278 A302	N166-Y237 HydrophobicContact CB-CE2 4.26Å; A234-Y237 WeakPolarHBondContact O-CB 3.27Å; A234-Y237 PolarHBondContact O-N 3.06Å; A234-Y237 VanDerWaalsContact O-N 3.15Å; H235-Y237 PolarHBondContact O-N 3.33Å; H235-Y237 VanDerWaalsContact O-N 3.15Å; Y237-R239 HydrophobicContact CE1-CB 4.29Å; Y237-R239 HydrophobicContact CE1-CG 4.45Å; Y237-Q247 VanDerWaalsContact OH-CD 3.28Å; Y237-Q247 PolarHBondContact OH-NE2 2.97Å; Y237-L278 HydrophobicContact CD2-CD1 4.49Å; Y237-L278 HydrophobicContact CD2-CD2 3.77Å; Y237-L278 HydrophobicContact CE2-CD2 4.35Å; Y237-L278 HydrophobicContact CG-CD2 4.16Å; Y237-A302 HydrophobicContact CD1-CB 3.86Å; Y237-A302 HydrophobicContact CD2-CB 4.11Å; Y237-A302 HydrophobicContact CE1-CB 3.59Å; Y237-A302 HydrophobicContact CE2-CB 3.84Å; Y237-A302 HydrophobicContact CG-CB 4.09Å
238	I	67.2	Low	68.4	Low	143 Å²	143	79.7 Å²	79.7	73%	0.733	42%	0.418	S	S	*	.			trans	-104	116.8	172.5	-58.8	174.7	0	0	0	107.9	N236 N240	N236-I238 PolarHBondContact O-N 3.3Å; I238-N240 PolarHBondContact O-N 3.03Å; I238-N240 VanDerWaalsContact O-N 3.08Å
239	R	65.3	Low	68	Low	63 Å²	63	75.8 Å²	75.8	24%	0.238	40%	0.398	C	S	.	.			trans	-69.1	104.3	179.1	-159.3	-168.7	-70.9	-176.9	-3.3	109.4	I164 E223 Y237 S241 E303	I164-R239 VanDerWaalsContact CD1-NH2 3.32Å; E223-R239 IonicContact OE1-CZ 2.88Å; E223-R239 IonicContact OE1-NH1 3.43Å; E223-R239 PolarHBondContact OE1-NH1 3.44Å; E223-R239 IonicContact OE1-NH2 2.67Å; E223-R239 PolarHBondContact OE1-NH2 3.35Å; E223-R239 IonicContact OE2-NH1 3.08Å; E223-R239 PolarHBondContact OE2-NH1 3.28Å; Y237-R239 HydrophobicContact CE1-CB 4.29Å; Y237-R239 HydrophobicContact CE1-CG 4.45Å; R239-S241 PolarHBondContact O-N 2.98Å; R239-E303 IonicContact CZ-OE2 3.11Å; R239-E303 IonicContact NE-OE2 3.26Å; R239-E303 IonicContact NH2-OE1 2.64Å; R239-E303 PolarHBondContact NH2-OE1 2.83Å; R239-E303 VanDerWaalsContact NH2-OE1 3.09Å; R239-E303 IonicContact NH2-OE2 3.28Å; R239-E303 PolarHBondContact NH2-OE2 3.22Å
240	N	59.2	Low	67.8	Low	110 Å²	110	71.4 Å²	71.4	59%	0.588	38%	0.376	S	S	*	.			trans	-68.1	103.1	177.6	-105.9	-13.5	0	0	0	110.4	I238 K242 S243	I238-N240 PolarHBondContact O-N 3.03Å; I238-N240 VanDerWaalsContact O-N 3.08Å; N240-K242 PolarHBondContact O-N 2.77Å; N240-K242 VanDerWaalsContact O-N 3.16Å; N240-S243 WeakPolarHBondContact CB-OG 2.68Å; N240-S243 PolarHBondContact O-N 3.03Å; N240-S243 PolarHBondContact O-OG 3.18Å
241	S	50.8	Low	67.2	Low	117 Å²	117	70.6 Å²	70.6	82%	0.818	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-17.6	-178.9	61.4	0	0	0	0	114.2	R239	R239-S241 PolarHBondContact O-N 2.98Å
242	K	49	Very low	66.5	Low	189 Å²	189	68.4 Å²	68.4	82%	0.822	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-13.9	-178.5	-73.4	-176.4	177.6	179	0	114.9	N240 N244	N240-K242 PolarHBondContact O-N 2.77Å; N240-K242 VanDerWaalsContact O-N 3.16Å; K242-N244 PolarHBondContact O-N 3.12Å; K242-N244 VanDerWaalsContact O-N 3.1Å
243	S	46.9	Very low	65.9	Low	49 Å²	49	70.3 Å²	70.3	34%	0.343	36%	0.355	S	S	.	.			trans	-82.6	94.1	179	59.6	0	0	0	0	108.8	N240 F245 S246	N240-S243 WeakPolarHBondContact CB-OG 2.68Å; N240-S243 PolarHBondContact O-N 3.03Å; N240-S243 PolarHBondContact O-OG 3.18Å; S243-F245 PolarHBondContact O-N 2.92Å; S243-S246 PolarHBondContact OG-OG 2.64Å
244	N	47.9	Very low	65.3	Low	127 Å²	127	63.9 Å²	63.9	68%	0.679	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-19.4	-161.2	-80.5	-20.3	0	0	0	116.5	K242	K242-N244 PolarHBondContact O-N 3.12Å; K242-N244 VanDerWaalsContact O-N 3.1Å
245	F	50.2	Low	64.6	Low	94 Å²	94	64.2 Å²	64.2	41%	0.412	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.2	34.6	-173	-55.9	-72.1	0	0	0	116.4	Q85 S243	Q85-F245 HydrophobicContact CB-CE1 4.34Å; Q85-F245 HydrophobicContact CB-CZ 4.15Å; Q85-F245 HydrophobicContact CG-CE2 4.49Å; Q85-F245 HydrophobicContact CG-CZ 4.13Å; S243-F245 PolarHBondContact O-N 2.92Å
246	S	51.3	Low	64.2	Low	22 Å²	22	60.8 Å²	60.8	15%	0.154	32%	0.32	C	S	.	.			trans	-95	6.2	179.1	57.8	0	0	0	0	115.4	V167 S243	V167-S246 CarbonylContact C-O 3.47Å; V167-S246 PolarHBondContact N-O 2.72Å; V167-S246 CarbonylContact O-C 3.59Å; V167-S246 VanDerWaalsContact O-CA 3.27Å; V167-S246 WeakPolarHBondContact O-CA 3.26Å; S243-S246 PolarHBondContact OG-OG 2.64Å
247	Q	62.3	Low	63.7	Low	27 Å²	27	55.7 Å²	55.7	13%	0.126	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	130.6	-173.9	-71.5	167	19.7	0	0	111.3	I164 F165 P219 Y237	I164-Q247 HydrophobicContact CG2-CB 4.2Å; I164-Q247 HydrophobicContact CG2-CG 4.35Å; F165-Q247 CarbonylContact O-C 3.57Å; F165-Q247 VanDerWaalsContact O-CA 3.29Å; F165-Q247 WeakPolarHBondContact O-CA 3.48Å; P219-Q247 HydrophobicContact CG-CB 4.39Å; Y237-Q247 VanDerWaalsContact OH-CD 3.28Å; Y237-Q247 PolarHBondContact OH-NE2 2.97Å
248	L	67.9	Low	63.1	Low	3 Å²	3	60 Å²	60	2%	0.016	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125	-179.7	174	69.1	0	0	0	108.8	I164 F165 V167 I169 L180 I184 L214 L216	I164-L248 WeakPolarHBondContact CA-O 3.26Å; F165-L248 HydrophobicContact CB-CB 4.15Å; F165-L248 HydrophobicContact CD2-CD2 4.41Å; F165-L248 HydrophobicContact CD2-CG 4.32Å; F165-L248 PolarHBondContact N-O 3.16Å; F165-L248 PolarHBondContact O-N 2.88Å; V167-L248 HydrophobicContact CG1-CB 3.55Å; V167-L248 HydrophobicContact CG1-CD2 4.02Å; V167-L248 HydrophobicContact CG1-CG 4.44Å; I169-L248 HydrophobicContact CD1-CB 4.17Å; I169-L248 HydrophobicContact CD1-CD1 4.11Å; L180-L248 HydrophobicContact CD2-CD2 4.04Å; L180-L248 HydrophobicContact CG-CD2 4.3Å; I184-L248 HydrophobicContact CD1-CD2 3.14Å; I184-L248 HydrophobicContact CD1-CG 4.18Å; L214-L248 HydrophobicContact CD2-CD1 3.43Å; L214-L248 VanDerWaalsContact CD2-CD1 3.43Å; L214-L248 HydrophobicContact CD2-CD2 3.92Å; L214-L248 HydrophobicContact CD2-CG 3.73Å; L216-L248 HydrophobicContact CD1-CD1 3.3Å; L216-L248 HydrophobicContact CD2-CB 4.21Å; L216-L248 HydrophobicContact CD2-CD1 3.43Å; L216-L248 VanDerWaalsContact CD2-CD1 3.43Å; L216-L248 HydrophobicContact CD2-CG 4.45Å; L216-L248 HydrophobicContact CG-CD1 3.35Å
249	V	68.7	Low	63.3	Low	0 Å²	0	55 Å²	55	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	131.2	-179.5	-172.6	0	0	0	0	110.1	L162 F163 I164 I215 P219 I251	L162-V249 HydrophobicContact CB-CG1 4.46Å; L162-V249 HydrophobicContact CD2-CG1 4.01Å; L162-V249 HydrophobicContact CG-CG1 4.31Å; F163-V249 CarbonylContact O-C 3.57Å; F163-V249 WeakPolarHBondContact O-CA 2.98Å; I164-V249 HydrophobicContact CG1-CG2 4.31Å; I215-V249 PolarHBondContact N-O 3.09Å; I215-V249 VanDerWaalsContact O-O 3.08Å; P219-V249 HydrophobicContact CB-CG2 3.92Å; P219-V249 HydrophobicContact CG-CG2 3.59Å; V249-I251 HydrophobicContact CG1-CG1 4.3Å
250	S	73.3	Confident	63.3	Low	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	135.7	170.5	-175.1	0	0	0	0	109.4	L162 F163	L162-S250 CarbonylContact C-O 3.43Å; L162-S250 VanDerWaalsContact CA-O 3.32Å; L162-S250 WeakPolarHBondContact CA-O 3.28Å; F163-S250 PolarHBondContact N-O 3.13Å; F163-S250 PolarHBondContact O-N 3.13Å
251	I	69.3	Low	64	Low	21 Å²	21	54.5 Å²	54.5	11%	0.108	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.7	-175.7	-55.5	173.3	0	0	0	109.4	L160 L162 I215 Y222 V249	L160-I251 HydrophobicContact CB-CG2 4.38Å; L160-I251 HydrophobicContact CD1-CG2 4.21Å; L160-I251 HydrophobicContact CD2-CG2 4.41Å; L162-I251 HydrophobicContact CD1-CG2 4.41Å; L162-I251 HydrophobicContact CG-CG1 4.13Å; I215-I251 HydrophobicContact CD1-CD1 4.27Å; Y222-I251 HydrophobicContact CD1-CD1 3.58Å; Y222-I251 HydrophobicContact CD2-CD1 3.85Å; Y222-I251 HydrophobicContact CE1-CD1 3.31Å; Y222-I251 HydrophobicContact CE2-CD1 3.55Å; Y222-I251 HydrophobicContact CG-CD1 3.86Å; V249-I251 HydrophobicContact CG1-CG1 4.3Å
252	Q	73.8	Confident	64.9	Low	19 Å²	19	53.1 Å²	53.1	9%	0.089	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135.2	175.8	-177	177.2	5.8	0	0	110.9	L160 L161 M188 I254	L160-Q252 CarbonylContact C-O 3.57Å; L160-Q252 WeakPolarHBondContact CA-O 3.35Å; L161-Q252 PolarHBondContact N-O 2.82Å; L161-Q252 PolarHBondContact O-N 2.91Å; M188-Q252 HydrophobicContact CE-CB 3.57Å; M188-Q252 HydrophobicContact CE-CG 4.25Å; Q252-I254 HydrophobicContact CG-CG2 4.19Å
253	H	74	Confident	66.2	Low	51 Å²	51	44.2 Å²	44.2	24%	0.236	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	118.1	168.1	177.6	-95.8	0	0	0	110	K151 C153 P158 L160 G255	K151-H253 HydrophobicContact CD-CB 4.17Å; C153-H253 PolarHBondContact SG-NE2 3.17Å; C153-H253 VanDerWaalsContact SG-NE2 3.37Å; P158-H253 VanDerWaalsContact CB-CD2 3.45Å; P158-H253 WeakPolarHBondContact CB-CD2 3.49Å; L160-H253 HydrophobicContact CD2-CB 4.02Å; H253-G255 PolarHBondContact CE1-O 3.43Å; H253-G255 PolarHBondContact NE2-O 2.96Å
254	I	75.3	Confident	67.6	Low	11 Å²	11	45.5 Å²	45.5	6%	0.056	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-16.8	-175.8	57	160.8	0	0	0	113.8	T159 L161 Q252 I259 P260 I263 V306	T159-I254 HydrophobicContact CG2-CD1 3.94Å; T159-I254 HydrophobicContact CG2-CG1 3.93Å; T159-I254 VanDerWaalsContact O-CG1 3.31Å; T159-I254 WeakPolarHBondContact O-CG1 3.4Å; T159-I254 PolarHBondContact O-N 2.98Å; L161-I254 HydrophobicContact CB-CD1 4.17Å; L161-I254 HydrophobicContact CB-CG1 4.28Å; L161-I254 HydrophobicContact CB-CG2 3.56Å; L161-I254 HydrophobicContact CD2-CG2 4.03Å; L161-I254 HydrophobicContact CG-CG2 4.47Å; Q252-I254 HydrophobicContact CG-CG2 4.19Å; I254-I259 HydrophobicContact CD1-CG1 4.19Å; I254-I259 HydrophobicContact CD1-CG2 4.11Å; I254-P260 WeakPolarHBondContact O-CD 3.07Å; I254-I263 HydrophobicContact CD1-CG2 4.25Å; I254-I263 HydrophobicContact CG2-CD1 4.33Å; I254-I263 HydrophobicContact CG2-CG1 4.47Å; I254-V306 HydrophobicContact CD1-CG1 3.74Å; I254-V306 HydrophobicContact CD1-CG2 4.24Å
255	G	72	Confident	68.8	Low	12 Å²	12	44.1 Å²	44.1	12%	0.124	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.3	-176.9	-178.9	0	0	0	0	0	113	T159 H253	T159-G255 WeakPolarHBondContact CB-O 3.5Å; T159-G255 PolarHBondContact N-O 2.95Å; T159-G255 PolarHBondContact O-N 3.13Å; H253-G255 PolarHBondContact CE1-O 3.43Å; H253-G255 PolarHBondContact NE2-O 2.96Å
256	C	71.5	Confident	70	Confident	46 Å²	46	41 Å²	41	31%	0.311	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	88	174.1	-57.4	0	0	0	0	106.7	C153 Q156 I258	C153-C256 VanDerWaalsContact CA-SG 3.56Å; C153-C256 HydrophobicContact CB-CB 3.56Å; C153-C256 WeakPolarHBondContact CB-SG 3.5Å; C153-C256 VanDerWaalsContact SG-CA 3.56Å; C153-C256 WeakPolarHBondContact SG-CB 3.38Å; C153-C256 CovalentContact SG-SG 2.02Å; C153-C256 PolarHBondContact SG-SG 3.21Å; Q156-C256 HydrophobicContact CB-CB 4.32Å; Q156-C256 PolarHBondContact OE1-O 2.88Å; C256-I258 PolarHBondContact O-N 3.48Å
257	G	66	Low	71.5	Confident	33 Å²	33	40.2 Å²	40.2	34%	0.34	21%	0.214	S	C	.	.	S	Bend	trans	74.4	-5	-179.3	0	0	0	0	0	117	V157 T159	V157-G257 PolarHBondContact O-N 3.4Å; T159-G257 WeakPolarHBondContact OG1-CA 3.17Å; T159-G257 PolarHBondContact OG1-N 2.94Å
258	I	63.6	Low	72.4	Confident	123 Å²	123	42.1 Å²	42.1	63%	0.631	23%	0.228	S	C	*	.			trans	-133.5	126.2	179.5	-53.4	174.6	0	0	0	109	C256 P260	C256-I258 PolarHBondContact O-N 3.48Å; I258-P260 WeakPolarHBondContact O-CD 3.46Å
259	I	70.3	Confident	72.9	Confident	37 Å²	37	46.5 Å²	46.5	19%	0.19	25%	0.25	C	S	.	.			trans	-87.9	119.1	177.3	-56.8	168.3	0	0	0	108.5	T159 L229 I254 I263 L264 V306	T159-I259 HydrophobicContact CG2-CG1 4.2Å; L229-I259 HydrophobicContact CD1-CD1 4.31Å; I254-I259 HydrophobicContact CD1-CG1 4.19Å; I254-I259 HydrophobicContact CD1-CG2 4.11Å; I259-I263 HydrophobicContact CG2-CB 4.16Å; I259-I263 HydrophobicContact CG2-CG2 4.03Å; I259-L264 HydrophobicContact CB-CD2 4.42Å; I259-L264 HydrophobicContact CB-CG 4.46Å; I259-L264 HydrophobicContact CG2-CD2 3.82Å; I259-L264 HydrophobicContact CG2-CG 3.79Å; I259-V306 HydrophobicContact CD1-CG1 3.61Å; I259-V306 HydrophobicContact CG1-CG1 4.07Å
260	P	66.9	Low	73.7	Confident	39 Å²	39	46.7 Å²	46.7	25%	0.253	25%	0.251	S	S	.	.			trans	-62.9	142.2	177.4	-23.1	34.1	0	0	0	113	I254 I258 Y262 I263 L264	I254-P260 WeakPolarHBondContact O-CD 3.07Å; I258-P260 WeakPolarHBondContact O-CD 3.46Å; P260-Y262 HydrophobicContact CB-CD1 3.52Å; P260-Y262 HydrophobicContact CB-CE1 3.3Å; P260-Y262 HydrophobicContact CG-CE1 3.89Å; P260-Y262 PolarHBondContact O-N 3.11Å; P260-Y262 VanDerWaalsContact O-N 3.1Å; P260-I263 WeakPolarHBondContact O-CB 3.26Å; P260-I263 PolarHBondContact O-N 2.84Å; P260-L264 PolarHBondContact O-N 3.36Å
261	D	72.2	Confident	74.2	Confident	125 Å²	125	50.9 Å²	50.9	67%	0.668	27%	0.271	S	S	*	.	H	α-helix	trans	-54.8	-33.5	-177.4	-72	-13.3	0	0	0	114.5	I263 L264 K265	D261-I263 VanDerWaalsContact C-N 3.33Å; D261-I263 PolarHBondContact O-N 2.92Å; D261-L264 PolarHBondContact O-N 3.28Å; D261-K265 PolarHBondContact O-N 3.18Å
262	Y	71.2	Confident	74.9	Confident	87 Å²	87	56.9 Å²	56.9	34%	0.341	30%	0.296	S	S	.	.	H	α-helix	trans	-67	-34.9	179.3	76.3	-90.2	0	0	0	112	P260 I266	P260-Y262 HydrophobicContact CB-CD1 3.52Å; P260-Y262 HydrophobicContact CB-CE1 3.3Å; P260-Y262 HydrophobicContact CG-CE1 3.89Å; P260-Y262 PolarHBondContact O-N 3.11Å; P260-Y262 VanDerWaalsContact O-N 3.1Å; Y262-I266 WeakPolarHBondContact O-CG1 3.49Å; Y262-I266 PolarHBondContact O-N 3.32Å
263	I	75.9	Confident	75.3	Confident	2 Å²	2	61 Å²	61	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-67.5	-45.7	173.3	-63.3	-65.2	0	0	0	109.4	L161 I191 I254 I259 P260 D261 K265 I266 L267	L161-I263 HydrophobicContact CD2-CG2 4.45Å; I191-I263 HydrophobicContact CG2-CD1 4.36Å; I254-I263 HydrophobicContact CD1-CG2 4.25Å; I254-I263 HydrophobicContact CG2-CD1 4.33Å; I254-I263 HydrophobicContact CG2-CG1 4.47Å; I259-I263 HydrophobicContact CG2-CB 4.16Å; I259-I263 HydrophobicContact CG2-CG2 4.03Å; P260-I263 WeakPolarHBondContact O-CB 3.26Å; P260-I263 PolarHBondContact O-N 2.84Å; D261-I263 VanDerWaalsContact C-N 3.33Å; D261-I263 PolarHBondContact O-N 2.92Å; I263-K265 VanDerWaalsContact C-N 3.31Å; I263-K265 PolarHBondContact O-N 3.46Å; I263-I266 PolarHBondContact O-N 3.25Å; I263-I266 VanDerWaalsContact O-N 3.07Å; I263-L267 HydrophobicContact CG2-CD1 3.74Å; I263-L267 HydrophobicContact CG2-CG 4.04Å; I263-L267 WeakPolarHBondContact O-CG 3.25Å; I263-L267 PolarHBondContact O-N 3.31Å
264	L	76.5	Confident	76	Confident	76 Å²	76	58.8 Å²	58.8	40%	0.398	30%	0.301	S	S	.	.	H	α-helix	trans	-55.9	-44.3	177.8	-70.9	173.2	0	0	0	111.8	I259 P260 D261 I266 L267 T268	I259-L264 HydrophobicContact CB-CD2 4.42Å; I259-L264 HydrophobicContact CB-CG 4.46Å; I259-L264 HydrophobicContact CG2-CD2 3.82Å; I259-L264 HydrophobicContact CG2-CG 3.79Å; P260-L264 PolarHBondContact O-N 3.36Å; D261-L264 PolarHBondContact O-N 3.28Å; L264-I266 PolarHBondContact O-N 2.86Å; L264-L267 PolarHBondContact O-N 3.4Å; L264-T268 VanDerWaalsContact O-CG2 3.27Å; L264-T268 WeakPolarHBondContact O-CG2 3.31Å; L264-T268 PolarHBondContact O-N 3.29Å; L264-T268 PolarHBondContact O-OG1 3.24Å
265	K	72.8	Confident	76.3	Confident	98 Å²	98	65.2 Å²	65.2	43%	0.426	33%	0.33	S	S	.	.	H	α-helix	trans	-58.6	-44.8	175.5	-75.8	179.3	179.9	174.8	0	112.4	Y195 D261 I263 T268 I269	Y195-K265 PolarHBondContact OH-NZ 3.11Å; D261-K265 PolarHBondContact O-N 3.18Å; I263-K265 VanDerWaalsContact C-N 3.31Å; I263-K265 PolarHBondContact O-N 3.46Å; K265-T268 PolarHBondContact O-N 2.97Å; K265-T268 PolarHBondContact O-OG1 3.12Å; K265-I269 WeakPolarHBondContact O-CG1 3.31Å; K265-I269 PolarHBondContact O-N 3.09Å; K265-I269 VanDerWaalsContact O-N 3.15Å
266	I	74.3	Confident	76.8	Confident	28 Å²	28	73.1 Å²	73.1	14%	0.144	37%	0.366	C	S	.	.	H	α-helix	trans	-65.9	-44.1	179.8	-67.1	172.2	0	0	0	110.9	I191 Y262 I263 L264 T268 I269 L270	I191-I266 HydrophobicContact CB-CD1 4.5Å; I191-I266 HydrophobicContact CG2-CD1 3.74Å; Y262-I266 WeakPolarHBondContact O-CG1 3.49Å; Y262-I266 PolarHBondContact O-N 3.32Å; I263-I266 PolarHBondContact O-N 3.25Å; I263-I266 VanDerWaalsContact O-N 3.07Å; L264-I266 PolarHBondContact O-N 2.86Å; I266-T268 VanDerWaalsContact C-N 3.31Å; I266-T268 PolarHBondContact O-N 3.09Å; I266-I269 PolarHBondContact O-N 2.86Å; I266-I269 VanDerWaalsContact O-N 3.13Å; I266-L270 HydrophobicContact CG2-CD1 4.26Å; I266-L270 PolarHBondContact O-N 3.03Å
267	L	84.2	Confident	77.3	Confident	6 Å²	6	71.6 Å²	71.6	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-61.4	-39.9	177.7	-64.8	178.8	0	0	0	111.7	L161 I263 L264 I269 L270 E271 W304 V306	L161-L267 HydrophobicContact CD1-CD1 4.41Å; L161-L267 HydrophobicContact CD1-CD2 3.78Å; L161-L267 HydrophobicContact CD2-CD2 4.36Å; I263-L267 HydrophobicContact CG2-CD1 3.74Å; I263-L267 HydrophobicContact CG2-CG 4.04Å; I263-L267 WeakPolarHBondContact O-CG 3.25Å; I263-L267 PolarHBondContact O-N 3.31Å; L264-L267 PolarHBondContact O-N 3.4Å; L267-I269 VanDerWaalsContact C-N 3.34Å; L267-I269 PolarHBondContact O-N 3.33Å; L267-L270 PolarHBondContact O-N 2.83Å; L267-E271 VanDerWaalsContact O-CB 3.31Å; L267-E271 WeakPolarHBondContact O-CB 3.47Å; L267-E271 PolarHBondContact O-N 3.11Å; L267-W304 HydrophobicContact CB-CH2 4.13Å; L267-W304 HydrophobicContact CB-CZ2 3.82Å; L267-W304 HydrophobicContact CD1-CE3 4.18Å; L267-W304 HydrophobicContact CD1-CH2 4.2Å; L267-W304 HydrophobicContact CD1-CZ3 3.95Å; L267-W304 HydrophobicContact CD2-CD2 3.66Å; L267-W304 HydrophobicContact CD2-CE3 3.92Å; L267-W304 HydrophobicContact CD2-CG 3.91Å; L267-W304 HydrophobicContact CD2-CZ2 4.45Å; L267-W304 HydrophobicContact CD2-CZ3 4.43Å; L267-W304 HydrophobicContact CG-CD2 4.49Å; L267-V306 HydrophobicContact CD1-CG2 3.65Å
268	T	79.8	Confident	78.1	Confident	67 Å²	67	73.2 Å²	73.2	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-32.7	175.1	63	0	0	0	0	113.3	L264 K265 I266 K272	L264-T268 VanDerWaalsContact O-CG2 3.27Å; L264-T268 WeakPolarHBondContact O-CG2 3.31Å; L264-T268 PolarHBondContact O-N 3.29Å; L264-T268 PolarHBondContact O-OG1 3.24Å; K265-T268 PolarHBondContact O-N 2.97Å; K265-T268 PolarHBondContact O-OG1 3.12Å; I266-T268 VanDerWaalsContact C-N 3.31Å; I266-T268 PolarHBondContact O-N 3.09Å; T268-K272 WeakPolarHBondContact O-CG 3.49Å; T268-K272 PolarHBondContact O-N 2.77Å; T268-K272 VanDerWaalsContact O-N 3.08Å
269	I	79.9	Confident	79.1	Confident	96 Å²	96	67.7 Å²	67.7	49%	0.492	33%	0.33	S	S	.	.	H	α-helix	trans	-68.7	-44.8	174.4	-67.3	166.6	0	0	0	110.2	K265 I266 L267 K272 R273	K265-I269 WeakPolarHBondContact O-CG1 3.31Å; K265-I269 PolarHBondContact O-N 3.09Å; K265-I269 VanDerWaalsContact O-N 3.15Å; I266-I269 PolarHBondContact O-N 2.86Å; I266-I269 VanDerWaalsContact O-N 3.13Å; L267-I269 VanDerWaalsContact C-N 3.34Å; L267-I269 PolarHBondContact O-N 3.33Å; I269-K272 PolarHBondContact O-N 3.14Å; I269-R273 PolarHBondContact O-N 2.96Å; I269-R273 VanDerWaalsContact O-N 3.09Å
270	L	84.4	Confident	79.6	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-41.3	176.6	-70.1	175.3	0	0	0	111.4	F163 I266 L267 K272 R273 F274 I279 L284 L301	F163-L270 HydrophobicContact CE1-CD1 3.66Å; F163-L270 HydrophobicContact CZ-CD1 4.18Å; I266-L270 HydrophobicContact CG2-CD1 4.26Å; I266-L270 PolarHBondContact O-N 3.03Å; L267-L270 PolarHBondContact O-N 2.83Å; L270-K272 PolarHBondContact O-N 3.28Å; L270-R273 CarbonylContact O-C 3.52Å; L270-R273 PolarHBondContact O-N 3.46Å; L270-R273 VanDerWaalsContact O-N 3.14Å; L270-F274 WeakPolarHBondContact O-CG 3.4Å; L270-F274 PolarHBondContact O-N 3.3Å; L270-I279 HydrophobicContact CD2-CD1 3.96Å; L270-L284 HydrophobicContact CD2-CD2 3.86Å; L270-L301 HydrophobicContact CD1-CD2 4.22Å; L270-L301 HydrophobicContact CD2-CD2 4.07Å
271	E	84.3	Confident	79.9	Confident	87 Å²	87	66.1 Å²	66.1	41%	0.407	32%	0.322	S	S	.	.	H	α-helix	trans	-60.1	-44.7	176.3	-175.1	179.6	-171.4	0	0	111.9	A232 L267 R273 F274 Q275 W304	A232-E271 HydrophobicContact CB-CB 4.24Å; A232-E271 HydrophobicContact CB-CG 3.95Å; L267-E271 VanDerWaalsContact O-CB 3.31Å; L267-E271 WeakPolarHBondContact O-CB 3.47Å; L267-E271 PolarHBondContact O-N 3.11Å; E271-R273 VanDerWaalsContact C-N 3.32Å; E271-R273 PolarHBondContact O-N 2.92Å; E271-F274 WeakPolarHBondContact O-CB 3.43Å; E271-F274 PolarHBondContact O-N 2.62Å; E271-Q275 PolarHBondContact O-N 2.78Å; E271-W304 HydrophobicContact CB-CZ2 4.5Å
272	K	83.6	Confident	79.8	Confident	148 Å²	148	67 Å²	67	64%	0.643	32%	0.316	S	S	*	.	H	α-helix	trans	-61.3	-39.3	173.6	-75.4	179.9	-179.7	-178.4	0	112.5	T268 I269 L270 Q275	T268-K272 WeakPolarHBondContact O-CG 3.49Å; T268-K272 PolarHBondContact O-N 2.77Å; T268-K272 VanDerWaalsContact O-N 3.08Å; I269-K272 PolarHBondContact O-N 3.14Å; L270-K272 PolarHBondContact O-N 3.28Å; K272-Q275 WeakPolarHBondContact O-CB 3.49Å; K272-Q275 PolarHBondContact O-N 3.41Å
273	R	83.3	Confident	79.8	Confident	106 Å²	106	64.5 Å²	64.5	40%	0.4	31%	0.31	S	S	.	.	H	α-helix	trans	-70.8	-33.5	176.3	-73.7	-171.5	-179.6	-167.8	1.7	112.3	I269 L270 E271 Q275 M276 I279 T283	I269-R273 PolarHBondContact O-N 2.96Å; I269-R273 VanDerWaalsContact O-N 3.09Å; L270-R273 CarbonylContact O-C 3.52Å; L270-R273 PolarHBondContact O-N 3.46Å; L270-R273 VanDerWaalsContact O-N 3.14Å; E271-R273 VanDerWaalsContact C-N 3.32Å; E271-R273 PolarHBondContact O-N 2.92Å; R273-Q275 PolarHBondContact O-N 2.91Å; R273-M276 WeakPolarHBondContact O-CB 3.29Å; R273-M276 PolarHBondContact O-N 3.34Å; R273-I279 HydrophobicContact CB-CD1 3.44Å; R273-I279 VanDerWaalsContact CB-CD1 3.44Å; R273-I279 HydrophobicContact CB-CG1 3.9Å; R273-T283 PolarHBondContact NH1-O 3.32Å
274	F	88.3	Confident	79.3	Confident	3 Å²	3	66.2 Å²	66.2	1%	0.013	32%	0.319	C	S	.	.	H	α-helix	trans	-61.9	-28.4	174.7	-80	-25.5	0	0	0	113	A232 A234 H235 L270 E271 M276 G277 I279 L301 W304	A232-F274 HydrophobicContact CB-CD2 4.04Å; A232-F274 HydrophobicContact CB-CE2 4.43Å; A232-F274 VanDerWaalsContact O-CE2 3.24Å; A232-F274 WeakPolarHBondContact O-CE2 3.42Å; A234-F274 HydrophobicContact CB-CD1 3.81Å; A234-F274 HydrophobicContact CB-CE1 4.38Å; A234-F274 HydrophobicContact CB-CG 4.36Å; H235-F274 WeakPolarHBondContact CB-O 3.34Å; H235-F274 PolarHBondContact N-O 3.23Å; L270-F274 WeakPolarHBondContact O-CG 3.4Å; L270-F274 PolarHBondContact O-N 3.3Å; E271-F274 WeakPolarHBondContact O-CB 3.43Å; E271-F274 PolarHBondContact O-N 2.62Å; F274-M276 PolarHBondContact O-N 2.92Å; F274-G277 PolarHBondContact O-N 3.4Å; F274-I279 HydrophobicContact CD1-CD1 3.44Å; F274-I279 VanDerWaalsContact CD1-CD1 3.44Å; F274-I279 HydrophobicContact CD1-CG1 3.77Å; F274-I279 HydrophobicContact CE1-CD1 3.55Å; F274-I279 HydrophobicContact CE1-CG1 3.97Å; F274-I279 HydrophobicContact CG-CD1 4.22Å; F274-I279 HydrophobicContact CZ-CD1 4.42Å; F274-L301 HydrophobicContact CE1-CD2 4.14Å; F274-L301 HydrophobicContact CE1-CG 4.01Å; F274-L301 WeakPolarHBondContact CE1-O 3.42Å; F274-L301 HydrophobicContact CZ-CD2 3.85Å; F274-L301 HydrophobicContact CZ-CG 3.84Å; F274-W304 AromaticContact CE2-CD1 3.28Å; F274-W304 HydrophobicContact CE2-CG 4.18Å; F274-W304 AromaticContact CE2-NE1 3.74Å
275	Q	82.1	Confident	78.8	Confident	146 Å²	146	63 Å²	63	68%	0.682	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.4	171.6	-64.2	-179.3	-12.2	0	0	112.8	E271 K272 R273	E271-Q275 PolarHBondContact O-N 2.78Å; K272-Q275 WeakPolarHBondContact O-CB 3.49Å; K272-Q275 PolarHBondContact O-N 3.41Å; R273-Q275 PolarHBondContact O-N 2.91Å
276	M	80.8	Confident	77.9	Confident	178 Å²	178	65 Å²	65	88%	0.877	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-8.4	176	-62.8	179.2	155.9	0	0	113.4	R273 F274	R273-M276 WeakPolarHBondContact O-CB 3.29Å; R273-M276 PolarHBondContact O-N 3.34Å; F274-M276 PolarHBondContact O-N 2.92Å
277	G	82.8	Confident	76.8	Confident	14 Å²	14	71.4 Å²	71.4	14%	0.144	35%	0.352	C	S	.	.	S	Bend	trans	120.5	-159.1	-178.8	0	0	0	0	0	113.5	F274	F274-G277 PolarHBondContact O-N 3.4Å
278	L	83.9	Confident	75.2	Confident	68 Å²	68	74 Å²	74	36%	0.356	37%	0.368	S	S	.	.			trans	-66.2	134.5	179.6	-74	172.2	0	0	0	111.2	A234 Y237 P280 T300 A302	A234-L278 HydrophobicContact CB-CD2 3.89Å; A234-L278 HydrophobicContact CB-CG 4.36Å; Y237-L278 HydrophobicContact CD2-CD1 4.49Å; Y237-L278 HydrophobicContact CD2-CD2 3.77Å; Y237-L278 HydrophobicContact CE2-CD2 4.35Å; Y237-L278 HydrophobicContact CG-CD2 4.16Å; L278-P280 WeakPolarHBondContact O-CD 3.17Å; L278-T300 HydrophobicContact CB-CG2 4.03Å; L278-A302 HydrophobicContact CD2-CB 3.62Å
279	I	84.2	Confident	73.9	Confident	6 Å²	6	78.3 Å²	78.3	3%	0.031	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	113.4	-176.1	-55.2	171.4	0	0	0	109.3	L270 R273 F274 I281 L284 T300 L301	L270-I279 HydrophobicContact CD2-CD1 3.96Å; R273-I279 HydrophobicContact CB-CD1 3.44Å; R273-I279 VanDerWaalsContact CB-CD1 3.44Å; R273-I279 HydrophobicContact CB-CG1 3.9Å; F274-I279 HydrophobicContact CD1-CD1 3.44Å; F274-I279 VanDerWaalsContact CD1-CD1 3.44Å; F274-I279 HydrophobicContact CD1-CG1 3.77Å; F274-I279 HydrophobicContact CE1-CD1 3.55Å; F274-I279 HydrophobicContact CE1-CG1 3.97Å; F274-I279 HydrophobicContact CG-CD1 4.22Å; F274-I279 HydrophobicContact CZ-CD1 4.42Å; I279-I281 PolarHBondContact O-N 2.75Å; I279-L284 HydrophobicContact CG2-CD1 4.02Å; I279-L284 HydrophobicContact CG2-CD2 4.22Å; I279-L284 HydrophobicContact CG2-CG 4.1Å; I279-T300 CarbonylContact O-C 3.54Å; I279-T300 VanDerWaalsContact O-CA 3.29Å; I279-T300 WeakPolarHBondContact O-CA 3.43Å; I279-L301 HydrophobicContact CB-CB 4.36Å; I279-L301 PolarHBondContact N-O 2.87Å; I279-L301 VanDerWaalsContact N-O 3.13Å; I279-L301 PolarHBondContact O-N 2.8Å
280	P	79.8	Confident	72.5	Confident	34 Å²	34	77 Å²	77	22%	0.221	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	133	177.1	-14	27.5	0	0	0	110.9	L278 W282 T283 T300	L278-P280 WeakPolarHBondContact O-CD 3.17Å; P280-W282 VanDerWaalsContact CB-CD1 3.49Å; P280-W282 HydrophobicContact CB-CG 4.3Å; P280-W282 PolarHBondContact O-N 3.43Å; P280-W282 VanDerWaalsContact O-N 3.13Å; P280-T283 HydrophobicContact CB-CG2 4.07Å; P280-T283 HydrophobicContact CG-CG2 4.02Å; P280-T283 WeakPolarHBondContact O-CB 3.27Å; P280-T283 PolarHBondContact O-N 3.16Å; P280-T283 PolarHBondContact O-OG1 2.91Å; P280-T300 HydrophobicContact CB-CG2 4.45Å
281	I	73.8	Confident	71	Confident	9 Å²	9	83.2 Å²	83.2	5%	0.046	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-53.5	-38.8	-176.9	-81	-175.5	0	0	0	112.2	F165 I183 I184 I279 T283 L284 L285 I299	F165-I281 HydrophobicContact CD1-CD1 3.51Å; F165-I281 HydrophobicContact CD1-CG1 3.82Å; F165-I281 HydrophobicContact CE1-CD1 3.54Å; F165-I281 HydrophobicContact CE1-CG1 3.76Å; F165-I281 HydrophobicContact CG-CD1 4.36Å; F165-I281 HydrophobicContact CZ-CD1 4.43Å; I183-I281 HydrophobicContact CG2-CG2 3.87Å; I184-I281 HydrophobicContact CG1-CD1 4.28Å; I279-I281 PolarHBondContact O-N 2.75Å; I281-T283 PolarHBondContact O-N 2.85Å; I281-L284 WeakPolarHBondContact O-CB 3.46Å; I281-L284 PolarHBondContact O-N 3.28Å; I281-L285 HydrophobicContact CG2-CD1 3.74Å; I281-I299 HydrophobicContact CD1-CB 4.18Å; I281-I299 HydrophobicContact CD1-CG2 3.33Å; I281-I299 HydrophobicContact CG1-CG2 4.01Å; I281-I299 PolarHBondContact N-O 3.08Å; I281-I299 VanDerWaalsContact N-O 3.09Å
282	W	69.3	Low	69.7	Low	143 Å²	143	89.3 Å²	89.3	54%	0.542	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-63	-25.4	-178.1	65.6	-95.4	0	0	0	113.1	P280 L284 L285	P280-W282 VanDerWaalsContact CB-CD1 3.49Å; P280-W282 HydrophobicContact CB-CG 4.3Å; P280-W282 PolarHBondContact O-N 3.43Å; P280-W282 VanDerWaalsContact O-N 3.13Å; W282-L284 PolarHBondContact O-N 3.38Å; W282-L285 PolarHBondContact O-N 2.91Å
283	T	71.6	Confident	68.5	Low	36 Å²	36	84.9 Å²	84.9	22%	0.221	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-72.2	-9.3	175.9	67.2	0	0	0	0	113.8	R273 P280 I281	R273-T283 PolarHBondContact NH1-O 3.32Å; P280-T283 HydrophobicContact CB-CG2 4.07Å; P280-T283 HydrophobicContact CG-CG2 4.02Å; P280-T283 WeakPolarHBondContact O-CB 3.27Å; P280-T283 PolarHBondContact O-N 3.16Å; P280-T283 PolarHBondContact O-OG1 2.91Å; I281-T283 PolarHBondContact O-N 2.85Å
284	L	65.8	Low	67.5	Low	37 Å²	37	86 Å²	86	19%	0.194	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-100.3	-18.3	178.6	-60.9	164.3	0	0	0	111.9	F187 L270 I279 I281 W282	F187-L284 HydrophobicContact CD2-CB 3.81Å; F187-L284 HydrophobicContact CD2-CD1 4.19Å; F187-L284 HydrophobicContact CE2-CB 3.58Å; F187-L284 HydrophobicContact CE2-CD1 3.47Å; F187-L284 VanDerWaalsContact CE2-CD1 3.47Å; F187-L284 HydrophobicContact CE2-CD2 4.29Å; F187-L284 HydrophobicContact CE2-CG 3.95Å; F187-L284 HydrophobicContact CZ-CD1 3.74Å; L270-L284 HydrophobicContact CD2-CD2 3.86Å; I279-L284 HydrophobicContact CG2-CD1 4.02Å; I279-L284 HydrophobicContact CG2-CD2 4.22Å; I279-L284 HydrophobicContact CG2-CG 4.1Å; I281-L284 WeakPolarHBondContact O-CB 3.46Å; I281-L284 PolarHBondContact O-N 3.28Å; W282-L284 PolarHBondContact O-N 3.38Å
285	L	65.8	Low	66.4	Low	8 Å²	8	90.7 Å²	90.7	4%	0.042	45%	0.448	C	S	.	.	S	Bend	trans	-103	74.6	-178	-64.1	163.8	0	0	0	108.9	I183 F187 L190 I281 W282 N287 F290	I183-L285 HydrophobicContact CG2-CD1 3.7Å; F187-L285 HydrophobicContact CB-CD2 4.17Å; L190-L285 HydrophobicContact CD1-CD2 3.46Å; L190-L285 VanDerWaalsContact CD1-CD2 3.46Å; I281-L285 HydrophobicContact CG2-CD1 3.74Å; W282-L285 PolarHBondContact O-N 2.91Å; L285-N287 PolarHBondContact O-N 2.95Å; L285-N287 VanDerWaalsContact O-N 3.11Å; L285-F290 HydrophobicContact CB-CE2 4.48Å; L285-F290 HydrophobicContact CD1-CE2 3.7Å; L285-F290 HydrophobicContact CD1-CZ 4.03Å
286	N	54.3	Low	65.6	Low	140 Å²	140	84.6 Å²	84.6	75%	0.749	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	115.4	176	-74.8	-14.6	0	0	0	109.4
287	N	50.2	Low	64.9	Low	163 Å²	163	81.6 Å²	81.6	87%	0.872	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.5	16.7	171	-57.7	-15.6	0	0	0	119.9	L285	L285-N287 PolarHBondContact O-N 2.95Å; L285-N287 VanDerWaalsContact O-N 3.11Å
288	T	50.7	Low	64.2	Low	60 Å²	60	88 Å²	88	37%	0.368	43%	0.428	S	S	.	.			trans	-98.9	118.6	169.6	49.7	0	0	0	0	111.9	F290	T288-F290 WeakPolarHBondContact O-CD2 3.42Å; T288-F290 PolarHBondContact O-N 3.45Å; T288-F290 WeakPolarHBondContact OG1-CD2 3.42Å; T288-F290 WeakPolarHBondContact OG1-CE2 3.44Å
289	N	52.9	Low	63.7	Low	159 Å²	159	85 Å²	85	85%	0.85	41%	0.412	S	S	*	.			trans	-67.1	91.6	176.4	-81.7	-16.8	0	0	0	110.8	T291	N289-T291 VanDerWaalsContact C-N 3.3Å; N289-T291 PolarHBondContact O-N 3.17Å
290	F	50.4	Low	63.6	Low	69 Å²	69	85.5 Å²	85.5	30%	0.303	42%	0.415	S	S	.	.			trans	-85.2	15.6	-177.7	-92.5	-67.8	0	0	0	115.3	I183 L285 T288 R292 F293	I183-F290 HydrophobicContact CB-CZ 4.4Å; I183-F290 HydrophobicContact CD1-CD1 4.36Å; I183-F290 HydrophobicContact CD1-CE1 3.33Å; I183-F290 HydrophobicContact CD1-CZ 3.78Å; I183-F290 HydrophobicContact CG1-CE1 3.62Å; I183-F290 HydrophobicContact CG1-CZ 3.64Å; I183-F290 HydrophobicContact CG2-CZ 3.9Å; L285-F290 HydrophobicContact CB-CE2 4.48Å; L285-F290 HydrophobicContact CD1-CE2 3.7Å; L285-F290 HydrophobicContact CD1-CZ 4.03Å; T288-F290 WeakPolarHBondContact O-CD2 3.42Å; T288-F290 PolarHBondContact O-N 3.45Å; T288-F290 WeakPolarHBondContact OG1-CD2 3.42Å; T288-F290 WeakPolarHBondContact OG1-CE2 3.44Å; F290-R292 PolarHBondContact O-N 2.8Å; F290-F293 PolarHBondContact O-N 2.9Å
291	T	52.7	Low	63.9	Low	134 Å²	134	83.9 Å²	83.9	82%	0.822	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-13.8	-170.1	50.9	0	0	0	0	115.3	N289	N289-T291 VanDerWaalsContact C-N 3.3Å; N289-T291 PolarHBondContact O-N 3.17Å
292	R	56.9	Low	64.4	Low	214 Å²	214	83.5 Å²	83.5	81%	0.808	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-12.9	-176.8	-153.6	171	-163.8	160.5	4.6	115.5	F290	F290-R292 PolarHBondContact O-N 2.8Å
293	F	58.2	Low	65.3	Low	55 Å²	55	77.4 Å²	77.4	24%	0.241	38%	0.38	C	S	.	.			trans	-140.1	76.3	-169.4	-57	-72.5	0	0	0	114	E176 E179 F290 K295 F296	E176-F293 HydrophobicContact CG-CD1 4.48Å; E179-F293 HydrophobicContact CG-CE2 4.35Å; E179-F293 HydrophobicContact CG-CZ 4.18Å; F290-F293 PolarHBondContact O-N 2.9Å; F293-K295 PolarHBondContact O-N 2.81Å; F293-K295 VanDerWaalsContact O-N 3.08Å; F293-F296 HydrophobicContact CB-CD2 3.27Å; F293-F296 HydrophobicContact CB-CE2 3.49Å; F293-F296 VanDerWaalsContact CB-CE2 3.49Å; F293-F296 HydrophobicContact CB-CG 4.09Å; F293-F296 HydrophobicContact CB-CZ 4.47Å; F293-F296 HydrophobicContact CD1-CE2 4.18Å; F293-F296 HydrophobicContact CD2-CD2 4.12Å; F293-F296 AromaticContact CD2-CE2 3.72Å; F293-F296 HydrophobicContact CD2-CE2 3.72Å; F293-F296 HydrophobicContact CE2-CE2 4.49Å; F293-F296 AromaticContact CG-CD2 3.86Å; F293-F296 HydrophobicContact CG-CD2 3.86Å; F293-F296 AromaticContact CG-CE2 3.53Å; F293-F296 HydrophobicContact CG-CE2 3.53Å; F293-F296 HydrophobicContact CG-CZ 4.45Å; F293-F296 PolarHBondContact O-N 3.09Å
294	E	63.5	Low	66.2	Low	130 Å²	130	76.2 Å²	76.2	61%	0.607	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-45.9	-37.4	174.2	-83.8	-76.4	146.2	0	0	113.5	F296 K297	E294-F296 VanDerWaalsContact C-N 3.26Å; E294-F296 PolarHBondContact O-N 2.87Å; E294-K297 WeakPolarHBondContact O-CB 3.37Å; E294-K297 PolarHBondContact O-N 3.46Å; E294-K297 IonicContact OE1-NZ 2.55Å; E294-K297 PolarHBondContact OE1-NZ 3Å; E294-K297 IonicContact OE2-NZ 3.7Å; E294-K297 PolarHBondContact OE2-NZ 3.34Å
295	K	64	Low	67.2	Low	102 Å²	102	74.5 Å²	74.5	44%	0.443	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-62.7	-27.1	-178.3	-69.5	-168.6	-165.6	160.1	0	114	L172 E176 F293 K297 H298	L172-K295 HydrophobicContact CD2-CB 4.39Å; L172-K295 HydrophobicContact CD2-CD 4.33Å; E176-K295 WeakPolarHBondContact OE1-CD 3.33Å; E176-K295 IonicContact OE1-NZ 3.03Å; E176-K295 PolarHBondContact OE1-NZ 3.37Å; E176-K295 IonicContact OE2-NZ 2.69Å; E176-K295 PolarHBondContact OE2-NZ 3.41Å; F293-K295 PolarHBondContact O-N 2.81Å; F293-K295 VanDerWaalsContact O-N 3.08Å; K295-K297 VanDerWaalsContact C-N 3.25Å; K295-K297 PolarHBondContact O-N 3.18Å; K295-H298 PolarHBondContact O-N 2.92Å; K295-H298 PolarHBondContact O-ND1 2.8Å
296	F	66.6	Low	68.2	Low	18 Å²	18	74.1 Å²	74.1	8%	0.079	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-72.6	-14.5	-178.6	-66.4	-35.2	0	0	0	114.1	L172 E176 E179 L180 I183 F293 E294 H298 I299	L172-F296 HydrophobicContact CD2-CE1 4.43Å; E176-F296 HydrophobicContact CB-CE1 4.31Å; E176-F296 HydrophobicContact CB-CZ 4.18Å; E176-F296 WeakPolarHBondContact O-CE1 3.44Å; E176-F296 VanDerWaalsContact O-CZ 3.24Å; E176-F296 WeakPolarHBondContact O-CZ 3.49Å; E179-F296 HydrophobicContact CB-CE2 4.06Å; E179-F296 HydrophobicContact CB-CZ 3.91Å; L180-F296 HydrophobicContact CB-CE1 4.01Å; L180-F296 HydrophobicContact CB-CZ 4.42Å; I183-F296 HydrophobicContact CD1-CD2 3.66Å; I183-F296 HydrophobicContact CD1-CE2 3.67Å; I183-F296 HydrophobicContact CD1-CG 4.27Å; I183-F296 HydrophobicContact CD1-CZ 4.24Å; F293-F296 HydrophobicContact CB-CD2 3.27Å; F293-F296 HydrophobicContact CB-CE2 3.49Å; F293-F296 VanDerWaalsContact CB-CE2 3.49Å; F293-F296 HydrophobicContact CB-CG 4.09Å; F293-F296 HydrophobicContact CB-CZ 4.47Å; F293-F296 HydrophobicContact CD1-CE2 4.18Å; F293-F296 HydrophobicContact CD2-CD2 4.12Å; F293-F296 AromaticContact CD2-CE2 3.72Å; F293-F296 HydrophobicContact CD2-CE2 3.72Å; F293-F296 HydrophobicContact CE2-CE2 4.49Å; F293-F296 AromaticContact CG-CD2 3.86Å; F293-F296 HydrophobicContact CG-CD2 3.86Å; F293-F296 AromaticContact CG-CE2 3.53Å; F293-F296 HydrophobicContact CG-CE2 3.53Å; F293-F296 HydrophobicContact CG-CZ 4.45Å; F293-F296 PolarHBondContact O-N 3.09Å; E294-F296 VanDerWaalsContact C-N 3.26Å; E294-F296 PolarHBondContact O-N 2.87Å; F296-H298 PolarHBondContact O-N 2.75Å; F296-H298 VanDerWaalsContact O-N 3.15Å; F296-I299 HydrophobicContact CB-CD1 3.99Å; F296-I299 HydrophobicContact CD1-CD1 3.42Å; F296-I299 VanDerWaalsContact CD1-CD1 3.42Å; F296-I299 HydrophobicContact CE1-CD1 4.28Å; F296-I299 HydrophobicContact CG-CD1 4.05Å; F296-I299 PolarHBondContact O-N 3.35Å; F296-I299 VanDerWaalsContact O-N 3.07Å
297	K	66	Low	69.4	Low	114 Å²	114	67.5 Å²	67.5	50%	0.496	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-58.7	-25.8	174.5	-72.2	176	179.3	165.8	0	113.1	E294 K295 I299	E294-K297 WeakPolarHBondContact O-CB 3.37Å; E294-K297 PolarHBondContact O-N 3.46Å; E294-K297 IonicContact OE1-NZ 2.55Å; E294-K297 PolarHBondContact OE1-NZ 3Å; E294-K297 IonicContact OE2-NZ 3.7Å; E294-K297 PolarHBondContact OE2-NZ 3.34Å; K295-K297 VanDerWaalsContact C-N 3.25Å; K295-K297 PolarHBondContact O-N 3.18Å; K297-I299 VanDerWaalsContact C-N 3.3Å; K297-I299 PolarHBondContact O-N 2.98Å
298	H	68.1	Low	70.8	Confident	149 Å²	149	60.8 Å²	60.8	69%	0.69	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-79.4	-10.2	-180	-59	92.5	0	0	0	113.7	K295 F296 T300	K295-H298 PolarHBondContact O-N 2.92Å; K295-H298 PolarHBondContact O-ND1 2.8Å; F296-H298 PolarHBondContact O-N 2.75Å; F296-H298 VanDerWaalsContact O-N 3.15Å; H298-T300 PolarHBondContact O-N 2.99Å
299	I	73.4	Confident	71.5	Confident	5 Å²	5	60.2 Å²	60.2	3%	0.026	28%	0.284	C	S	.	.			trans	-81	114.4	-179.1	-53.4	162.1	0	0	0	108.9	F165 V167 L180 I281 F296 K297	F165-I299 HydrophobicContact CB-CG2 4.3Å; V167-I299 HydrophobicContact CB-CG1 4.13Å; V167-I299 HydrophobicContact CB-CG2 4.26Å; V167-I299 HydrophobicContact CG2-CD1 4.38Å; V167-I299 HydrophobicContact CG2-CG1 3.75Å; L180-I299 HydrophobicContact CD1-CD1 3.3Å; L180-I299 HydrophobicContact CD1-CG1 4.47Å; L180-I299 HydrophobicContact CD2-CD1 4.37Å; L180-I299 HydrophobicContact CG-CD1 4.41Å; I281-I299 HydrophobicContact CD1-CB 4.18Å; I281-I299 HydrophobicContact CD1-CG2 3.33Å; I281-I299 HydrophobicContact CG1-CG2 4.01Å; I281-I299 PolarHBondContact N-O 3.08Å; I281-I299 VanDerWaalsContact N-O 3.09Å; F296-I299 HydrophobicContact CB-CD1 3.99Å; F296-I299 HydrophobicContact CD1-CD1 3.42Å; F296-I299 VanDerWaalsContact CD1-CD1 3.42Å; F296-I299 HydrophobicContact CE1-CD1 4.28Å; F296-I299 HydrophobicContact CG-CD1 4.05Å; F296-I299 PolarHBondContact O-N 3.35Å; F296-I299 VanDerWaalsContact O-N 3.07Å; K297-I299 VanDerWaalsContact C-N 3.3Å; K297-I299 PolarHBondContact O-N 2.98Å
300	T	82.2	Confident	71.9	Confident	17 Å²	17	55 Å²	55	10%	0.104	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.8	-177.8	49	0	0	0	0	110.3	F165 N166 L278 I279 P280 H298	F165-T300 CarbonylContact C-O 3.59Å; F165-T300 WeakPolarHBondContact CA-O 3.43Å; N166-T300 PolarHBondContact N-O 3.23Å; N166-T300 PolarHBondContact O-N 2.96Å; L278-T300 HydrophobicContact CB-CG2 4.03Å; I279-T300 CarbonylContact O-C 3.54Å; I279-T300 VanDerWaalsContact O-CA 3.29Å; I279-T300 WeakPolarHBondContact O-CA 3.43Å; P280-T300 HydrophobicContact CB-CG2 4.45Å; H298-T300 PolarHBondContact O-N 2.99Å
301	L	85.3	Confident	71.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	127.2	166.9	-177.9	71.4	0	0	0	108	F163 F165 L270 F274 I279	F163-L301 HydrophobicContact CB-CD1 3.85Å; F163-L301 HydrophobicContact CD1-CD1 3.75Å; F163-L301 HydrophobicContact CD1-CD2 4.12Å; F163-L301 HydrophobicContact CE1-CD2 4.4Å; F163-L301 HydrophobicContact CG-CD1 4.2Å; F165-L301 HydrophobicContact CD1-CB 3.99Å; F165-L301 HydrophobicContact CD1-CD1 3.73Å; F165-L301 HydrophobicContact CD1-CG 4.49Å; F165-L301 HydrophobicContact CE1-CB 4.08Å; F165-L301 HydrophobicContact CE1-CD1 3.55Å; F165-L301 HydrophobicContact CE1-CG 4.37Å; F165-L301 HydrophobicContact CE2-CD1 4.48Å; F165-L301 HydrophobicContact CG-CD1 4.3Å; F165-L301 HydrophobicContact CZ-CD1 3.96Å; L270-L301 HydrophobicContact CD1-CD2 4.22Å; L270-L301 HydrophobicContact CD2-CD2 4.07Å; F274-L301 HydrophobicContact CE1-CD2 4.14Å; F274-L301 HydrophobicContact CE1-CG 4.01Å; F274-L301 WeakPolarHBondContact CE1-O 3.42Å; F274-L301 HydrophobicContact CZ-CD2 3.85Å; F274-L301 HydrophobicContact CZ-CG 3.84Å; I279-L301 HydrophobicContact CB-CB 4.36Å; I279-L301 PolarHBondContact N-O 2.87Å; I279-L301 VanDerWaalsContact N-O 3.13Å; I279-L301 PolarHBondContact O-N 2.8Å
302	A	84.6	Confident	71.3	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-34.4	-173.4	0	0	0	0	0	113	I164 N166 A234 Y237 L278	I164-A302 PolarHBondContact O-N 3.16Å; N166-A302 HydrophobicContact CB-CB 4.4Å; A234-A302 WeakPolarHBondContact CB-O 3.47Å; A234-A302 PolarHBondContact N-O 2.91Å; Y237-A302 HydrophobicContact CD1-CB 3.86Å; Y237-A302 HydrophobicContact CD2-CB 4.11Å; Y237-A302 HydrophobicContact CE1-CB 3.59Å; Y237-A302 HydrophobicContact CE2-CB 3.84Å; Y237-A302 HydrophobicContact CG-CB 4.09Å; L278-A302 HydrophobicContact CD2-CB 3.62Å
303	E	87.8	Confident	70.1	Confident	16 Å²	16	53.4 Å²	53.4	8%	0.075	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	152.2	-176.2	179.3	169.3	-179.7	0	0	111.4	I164 A232 K233 R239 I305	I164-E303 HydrophobicContact CB-CB 4.23Å; I164-E303 HydrophobicContact CD1-CB 4.25Å; I164-E303 HydrophobicContact CD1-CG 4.22Å; I164-E303 PolarHBondContact N-O 2.95Å; I164-E303 PolarHBondContact O-N 3.43Å; A232-E303 VanDerWaalsContact O-CA 3.31Å; A232-E303 WeakPolarHBondContact O-CA 3.24Å; A232-E303 WeakPolarHBondContact O-CG 3.21Å; K233-E303 HydrophobicContact CB-CB 4.25Å; K233-E303 HydrophobicContact CB-CG 4.08Å; R239-E303 IonicContact CZ-OE2 3.11Å; R239-E303 IonicContact NE-OE2 3.26Å; R239-E303 IonicContact NH2-OE1 2.64Å; R239-E303 PolarHBondContact NH2-OE1 2.83Å; R239-E303 VanDerWaalsContact NH2-OE1 3.09Å; R239-E303 IonicContact NH2-OE2 3.28Å; R239-E303 PolarHBondContact NH2-OE2 3.22Å; E303-I305 HydrophobicContact CG-CG1 4.14Å
304	W	90.6	Very high	68.9	Low	11 Å²	11	58.2 Å²	58.2	4%	0.042	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	148.8	164.8	63.9	-108.5	0	0	0	111	L161 L162 F163 A230 S231 A232 L267 E271 F274 V306	L161-W304 HydrophobicContact CD1-CB 4.39Å; L161-W304 HydrophobicContact CD1-CE3 4.44Å; L162-W304 CarbonylContact O-C 3.55Å; L162-W304 WeakPolarHBondContact O-CA 3.4Å; L162-W304 WeakPolarHBondContact O-CB 3.4Å; F163-W304 HydrophobicContact CD1-CB 3.7Å; F163-W304 HydrophobicContact CE1-CB 3.79Å; F163-W304 HydrophobicContact CE1-CG 4.45Å; A230-W304 HydrophobicContact CB-CH2 4.11Å; A230-W304 HydrophobicContact CB-CZ3 3.93Å; S231-W304 VanDerWaalsContact CA-O 3.27Å; S231-W304 WeakPolarHBondContact CA-O 3.05Å; S231-W304 WeakPolarHBondContact CB-O 3.31Å; A232-W304 HydrophobicContact CB-CD2 4.29Å; A232-W304 VanDerWaalsContact CB-CE2 3.49Å; A232-W304 HydrophobicContact CB-CH2 4.28Å; A232-W304 HydrophobicContact CB-CZ2 3.48Å; A232-W304 VanDerWaalsContact CB-CZ2 3.48Å; A232-W304 PolarHBondContact N-O 2.91Å; A232-W304 PolarHBondContact O-N 2.82Å; L267-W304 HydrophobicContact CB-CH2 4.13Å; L267-W304 HydrophobicContact CB-CZ2 3.82Å; L267-W304 HydrophobicContact CD1-CE3 4.18Å; L267-W304 HydrophobicContact CD1-CH2 4.2Å; L267-W304 HydrophobicContact CD1-CZ3 3.95Å; L267-W304 HydrophobicContact CD2-CD2 3.66Å; L267-W304 HydrophobicContact CD2-CE3 3.92Å; L267-W304 HydrophobicContact CD2-CG 3.91Å; L267-W304 HydrophobicContact CD2-CZ2 4.45Å; L267-W304 HydrophobicContact CD2-CZ3 4.43Å; L267-W304 HydrophobicContact CG-CD2 4.49Å; E271-W304 HydrophobicContact CB-CZ2 4.5Å; F274-W304 AromaticContact CE2-CD1 3.28Å; F274-W304 HydrophobicContact CE2-CG 4.18Å; F274-W304 AromaticContact CE2-NE1 3.74Å; W304-V306 HydrophobicContact CE3-CG2 4.08Å; W304-V306 HydrophobicContact CZ3-CG2 3.99Å
305	I	86.7	Confident	67.4	Low	1 Å²	1	60 Å²	60	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	129.1	-178.3	-52.7	178	0	0	0	108.8	L161 L162 I164 E223 I228 E303	L161-I305 CarbonylContact C-O 3.39Å; L161-I305 WeakPolarHBondContact CA-O 3.24Å; L162-I305 HydrophobicContact CB-CB 4.21Å; L162-I305 PolarHBondContact N-O 3.13Å; L162-I305 PolarHBondContact O-N 3.45Å; I164-I305 HydrophobicContact CD1-CD1 3.96Å; E223-I305 HydrophobicContact CG-CD1 3.74Å; E223-I305 WeakPolarHBondContact OE1-CD1 3.31Å; I228-I305 HydrophobicContact CB-CG2 4.35Å; I228-I305 HydrophobicContact CD1-CG2 4.04Å; I228-I305 HydrophobicContact CG1-CG2 3.82Å; I228-I305 HydrophobicContact CG2-CG2 3.75Å; E303-I305 HydrophobicContact CG-CG1 4.14Å
306	V	87.1	Confident	65.8	Low	0 Å²	0	63 Å²	63	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.1	170	178.3	0	0	0	0	108.6	T159 L160 L161 I228 L229 A230 I254 I259 L267 W304	T159-V306 HydrophobicContact CG2-CG1 3.74Å; L160-V306 WeakPolarHBondContact O-CA 3.25Å; L161-V306 HydrophobicContact CB-CG2 4.43Å; L161-V306 HydrophobicContact CD1-CG2 3.49Å; L161-V306 VanDerWaalsContact CD1-CG2 3.49Å; I228-V306 CarbonylContact C-O 3.49Å; L229-V306 HydrophobicContact CD1-CG1 4.44Å; L229-V306 PolarHBondContact N-O 2.6Å; A230-V306 PolarHBondContact N-O 3.19Å; A230-V306 VanDerWaalsContact N-O 3.16Å; A230-V306 PolarHBondContact O-N 2.73Å; I254-V306 HydrophobicContact CD1-CG1 3.74Å; I254-V306 HydrophobicContact CD1-CG2 4.24Å; I259-V306 HydrophobicContact CD1-CG1 3.61Å; I259-V306 HydrophobicContact CG1-CG1 4.07Å; L267-V306 HydrophobicContact CD1-CG2 3.65Å; W304-V306 HydrophobicContact CE3-CG2 4.08Å; W304-V306 HydrophobicContact CZ3-CG2 3.99Å
307	G	78.9	Confident	64.1	Low	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	160	176.2	0	0	0	0	0	113.2	L160 L226 S227	L160-G307 PolarHBondContact N-O 3.2Å; L160-G307 PolarHBondContact O-N 2.9Å; L226-G307 WeakPolarHBondContact CD2-O 3.36Å; S227-G307 CarbonylContact O-C 3.59Å; S227-G307 WeakPolarHBondContact O-CA 3.27Å
308	D	79.3	Confident	62.5	Low	22 Å²	22	65.1 Å²	65.1	12%	0.118	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	139.6	174.9	-62.4	-32.1	0	0	0	110.6	V157 T159 L226 S227 I310	V157-D308 HydrophobicContact CB-CB 4.18Å; V157-D308 HydrophobicContact CG2-CB 3.63Å; T159-D308 WeakPolarHBondContact CA-OD1 3.31Å; T159-D308 WeakPolarHBondContact CB-OD1 3.4Å; T159-D308 WeakPolarHBondContact CG2-OD1 3.23Å; T159-D308 PolarHBondContact OG1-OD1 3.23Å; L226-D308 CarbonylContact C-O 3.58Å; L226-D308 VanDerWaalsContact CA-O 3.28Å; L226-D308 WeakPolarHBondContact CA-O 3.49Å; S227-D308 PolarHBondContact N-O 2.85Å; S227-D308 PolarHBondContact O-N 3.48Å; S227-D308 WeakPolarHBondContact OG-CB 3.3Å; S227-D308 PolarHBondContact OG-O 3.42Å; D308-I310 PolarHBondContact O-N 3Å
309	L	66.2	Low	60.6	Low	49 Å²	49	67 Å²	67	26%	0.257	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	119.7	-178	-169.2	80.5	0	0	0	111.5	V157 P158 L160 K225 H311	V157-L309 WeakPolarHBondContact CG1-O 3.41Å; P158-L309 HydrophobicContact CG-CB 3.92Å; P158-L309 HydrophobicContact CG-CD2 4.17Å; P158-L309 PolarHBondContact O-N 3.11Å; L160-L309 HydrophobicContact CD1-CB 4.32Å; L160-L309 HydrophobicContact CD1-CD1 3.79Å; K225-L309 HydrophobicContact CB-CD1 4.35Å; K225-L309 CarbonylContact O-C 3.38Å; K225-L309 WeakPolarHBondContact O-CA 3.42Å; L309-H311 PolarHBondContact O-N 2.99Å
310	I	60.6	Low	58.4	Low	48 Å²	48	72.7 Å²	72.7	25%	0.246	41%	0.408	C	S	.	.			trans	-77.7	114.5	174.5	-53.7	170.9	0	0	0	108.4	K225 L226 D308 N312 M349	K225-I310 PolarHBondContact O-N 3.33Å; L226-I310 VanDerWaalsContact C-CD1 3.45Å; D308-I310 PolarHBondContact O-N 3Å; I310-N312 PolarHBondContact O-N 2.93Å; I310-M349 HydrophobicContact CG2-CE 4.39Å; I310-M349 HydrophobicContact CG2-SD 3.84Å
311	H	50.8	Low	55.8	Low	156 Å²	156	81.6 Å²	81.6	72%	0.722	45%	0.445	S	S	*	.			trans	-69.1	96.9	175.9	-114.1	51.9	0	0	0	110.2	L309	L309-H311 PolarHBondContact O-N 2.99Å
312	N	40.3	Very low	52.9	Low	107 Å²	107	90.5 Å²	90.5	57%	0.572	49%	0.487	S	S	*	.			trans	-97.9	101	170.3	-86.5	-17.9	0	0	0	109.9	I310 L314	I310-N312 PolarHBondContact O-N 2.93Å; N312-L314 PolarHBondContact O-N 3.22Å
313	S	32.4	Very low	50.3	Low	122 Å²	122	98 Å²	98	85%	0.853	53%	0.527	S	S	*	.			trans	-71.9	84.6	176.5	62	0	0	0	0	111.4
314	L	32.8	Very low	47.4	Very low	156 Å²	156	104.7 Å²	104.7	82%	0.817	56%	0.563	S	S	*	*			trans	-137.9	0.7	173.9	-131.2	130.7	0	0	0	115.6	N312	N312-L314 PolarHBondContact O-N 3.22Å
315	H	30.8	Very low	44.4	Very low	167 Å²	167	111 Å²	111	77%	0.773	60%	0.602	S	S	*	*	S	Bend	trans	-101.6	-8.2	-177.6	-104.9	-50.4	0	0	0	117.1	A317	H315-A317 VanDerWaalsContact C-N 3.28Å; H315-A317 PolarHBondContact O-N 3.42Å
316	D	30.8	Very low	41.5	Very low	165 Å²	165	120.6 Å²	120.6	88%	0.882	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	3.1	179.8	-70.4	-19.1	0	0	0	114.4
317	A	32.4	Very low	38.5	Very low	94 Å²	94	132 Å²	132	78%	0.777	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-5.1	176.1	0	0	0	0	0	114.5	H315	H315-A317 VanDerWaalsContact C-N 3.28Å; H315-A317 PolarHBondContact O-N 3.42Å
318	A	30.6	Very low	36	Very low	82 Å²	82	137.2 Å²	137.2	68%	0.678	72%	0.723	S	S	*	*	S	Bend	trans	-101.6	1.6	-168.8	0	0	0	0	0	116.3
319	Q	28.3	Very low	33.4	Very low	190 Å²	190	144.2 Å²	144.2	89%	0.888	76%	0.76	S	S	*	*	S	Bend	trans	-116.3	19.8	-177.7	-79.3	-163.3	-8.9	0	0	116.7
320	T	28.1	Very low	31.5	Very low	123 Å²	123	149.3 Å²	149.3	76%	0.755	79%	0.788	S	S	*	*	S	Bend	trans	-136.2	54.2	174.9	36.8	0	0	0	0	113.6
321	K	26.6	Very low	29.9	Very low	204 Å²	204	156.6 Å²	156.6	89%	0.887	82%	0.818	S	S	*	*			trans	-149.5	77.2	158.5	-76.1	-163	179.4	175.5	0	112.9
322	Q	26.1	Very low	28.7	Very low	188 Å²	188	161.6 Å²	161.6	88%	0.879	83%	0.83	S	S	*	*			trans	-136.4	93.1	148.1	-89.1	-173.6	-14.3	0	0	107.8
323	N	28.3	Very low	27.9	Very low	158 Å²	158	161.4 Å²	161.4	85%	0.845	84%	0.837	S	S	*	*	S	Bend	trans	-162.5	90.6	148.7	-90.7	-22.3	0	0	0	108.6
324	N	27.6	Very low	27.9	Very low	155 Å²	155	159.7 Å²	159.7	83%	0.829	83%	0.83	S	S	*	*			trans	17.4	106.9	149.6	-61	-27.1	0	0	0	118.9
325	V	27.7	Very low	27.8	Very low	143 Å²	143	160.1 Å²	160.1	87%	0.867	83%	0.833	S	S	*	*				-151.3	113.7	128.4	-179.4	0	0	0	0	108.6
326	K	25.1	Very low	27.6	Very low	203 Å²	203	157.9 Å²	157.9	88%	0.883	84%	0.836	S	S	*	*			trans	-63	140.7	165.2	-71	172.4	176.5	172.7	0	108.9
327	R	24.8	Very low	27.4	Very low	241 Å²	241	155.2 Å²	155.2	91%	0.909	83%	0.83	S	S	*	*			trans	117.7	129.6	149.1	-146.4	172.5	-160.4	171.9	2.5	116.4
328	S	26.5	Very low	27.2	Very low	108 Å²	108	160.6 Å²	160.6	76%	0.755	83%	0.83	S	S	*	*			trans	66.6	100.6	165.9	64.7	0	0	0	0	120.2	N330	S328-N330 PolarHBondContact O-N 3.48Å
329	L	25.3	Very low	27	Very low	170 Å²	170	166 Å²	166	89%	0.89	84%	0.842	S	S	*	*			trans	-50.4	112.1	146.1	-74.2	122	0	0	0	110.4
330	N	26.5	Very low	27	Very low	156 Å²	156	161.6 Å²	161.6	83%	0.834	84%	0.837	S	S	*	*			trans	170.7	139.6	139.5	-88.6	-21.2	0	0	0	109.3	S328	S328-N330 PolarHBondContact O-N 3.48Å
331	K	26.5	Very low	26.8	Very low	201 Å²	201	158.9 Å²	158.9	87%	0.874	83%	0.833	S	S	*	*			trans	79.9	93.2	-175.5	-61.1	-176.6	174.5	-178	0	115.3	S333	K331-S333 PolarHBondContact O-N 3.36Å
332	R	24.5	Very low	26.6	Very low	261 Å²	261	156.5 Å²	156.5	99%	0.985	82%	0.82	S	S	*	*			trans	-54.4	99.5	152.9	-101	175.4	179.4	170.7	-0.3	107.6
333	S	25.4	Very low	26.5	Very low	103 Å²	103	155.7 Å²	155.7	72%	0.72	82%	0.821	S	S	*	*			trans	-87	138.4	167.9	50.9	0	0	0	0	109.6	K331 L335	K331-S333 PolarHBondContact O-N 3.36Å; S333-L335 PolarHBondContact O-N 3.27Å
334	A	32.2	Very low	26.5	Very low	86 Å²	86	154.4 Å²	154.4	71%	0.711	81%	0.81	S	S	*	*	S	Bend	trans	-75.5	50.1	-170.4	0	0	0	0	0	114.2
335	L	29.3	Very low	26.4	Very low	165 Å²	165	155.1 Å²	155.1	86%	0.864	81%	0.808	S	S	*	*			trans	-123.4	46	-178.2	-142	84.1	0	0	0	113.3	S333	S333-L335 PolarHBondContact O-N 3.27Å
336	S	26.7	Very low	26.3	Very low	120 Å²	120	150.8 Å²	150.8	84%	0.839	79%	0.793	S	S	*	*			trans	-123.8	17.7	168.1	85.7	0	0	0	0	113.8
337	S	28	Very low	26.4	Very low	109 Å²	109	145 Å²	145	76%	0.762	78%	0.777	S	S	*	*	S	Bend	trans	-98.7	4.3	-177.1	54.2	0	0	0	0	114.9
338	R	27.4	Very low	26.5	Very low	207 Å²	207	137 Å²	137	78%	0.781	77%	0.77	S	S	*	*	S	Bend	trans	-116.1	-2.5	-171	-133.9	177.8	177.7	177.8	-1	118.5
339	E	26.9	Very low	26.3	Very low	196 Å²	196	138.5 Å²	138.5	92%	0.916	77%	0.767	S	S	*	*			trans	-120.1	19.2	-178.4	-81.1	163.6	164.9	0	0	115.1	G341	E339-G341 PolarHBondContact O-N 3.27Å
340	A	27.1	Very low	26.4	Very low	97 Å²	97	134.9 Å²	134.9	80%	0.802	76%	0.762	S	S	*	*			trans	-83.5	90.7	166.1	0	0	0	0	0	109.7
341	G	24.1	Very low	26.2	Very low	65 Å²	65	133.5 Å²	133.5	67%	0.67	77%	0.765	S	S	*	*			trans	-59.1	148.7	168.1	0	0	0	0	0	112.2	E339 L343	E339-G341 PolarHBondContact O-N 3.27Å; G341-L343 PolarHBondContact O-N 3.42Å; G341-L343 VanDerWaalsContact O-N 3.12Å
342	Y	23.7	Very low	26	Very low	154 Å²	154	131.6 Å²	131.6	60%	0.604	76%	0.757	S	S	*	*			trans	-35.8	103	175.5	-91.2	-101.7	0	0	0	114.9	Q924	Y342-Q924 WeakPolarHBondContact OH-CB 3.04Å; Y342-Q924 WeakPolarHBondContact OH-CG 3.18Å; Y342-Q924 PolarHBondContact OH-NE2 3.27Å; Y342-Q924 PolarHBondContact OH-OE1 2.95Å
343	L	23.9	Very low	26	Very low	172 Å²	172	125.4 Å²	125.4	90%	0.901	74%	0.739	S	S	*	*			trans	-140	124.4	154.9	-84.7	167.9	0	0	0	108.1	G341	G341-L343 PolarHBondContact O-N 3.42Å; G341-L343 VanDerWaalsContact O-N 3.12Å
344	E	27.2	Very low	26	Very low	131 Å²	131	127.8 Å²	127.8	61%	0.612	74%	0.739	S	S	*	*			trans	-63.8	163.8	176.3	-64.4	176.5	136.3	0	0	111.1
345	E	25.9	Very low	25.7	Very low	169 Å²	169	128 Å²	128	79%	0.79	72%	0.724	S	S	*	*			trans	93.9	85.6	166.8	-50.8	-175.4	175.7	0	0	117.3	S347	E345-S347 PolarHBondContact O-N 3.07Å
346	G	25.5	Very low	25.5	Very low	53 Å²	53	125.2 Å²	125.2	55%	0.546	72%	0.715	S	S	.	*			trans	-86.7	76.7	160.6	0	0	0	0	0	111.4	T1052	G346-T1052 VanDerWaalsContact O-CG2 3.27Å; G346-T1052 WeakPolarHBondContact O-CG2 3.4Å
347	S	26.3	Very low	25.4	Very low	80 Å²	80	128.7 Å²	128.7	56%	0.559	72%	0.715	S	S	*	*			trans	-110	69.3	179.1	-49.6	0	0	0	0	109.9	E345 M349	E345-S347 PolarHBondContact O-N 3.07Å; S347-M349 PolarHBondContact O-N 2.95Å
348	G	27.3	Very low	25.2	Very low	74 Å²	74	131.7 Å²	131.7	76%	0.763	72%	0.721	S	S	*	*			trans	-74.5	92.6	-176.8	0	0	0	0	0	112.9
349	M	23.7	Very low	25.1	Very low	139 Å²	139	128.9 Å²	128.9	69%	0.685	72%	0.721	S	S	*	*			trans	-69	132.9	166.1	-69.4	-167.2	66	0	0	111.5	I310 S347	I310-M349 HydrophobicContact CG2-CE 4.39Å; I310-M349 HydrophobicContact CG2-SD 3.84Å; S347-M349 PolarHBondContact O-N 2.95Å
350	A	25.6	Very low	25	Very low	95 Å²	95	130.2 Å²	130.2	79%	0.785	72%	0.72	S	S	*	*			trans	-114.6	136.8	163	0	0	0	0	0	109.7
351	S	23.5	Very low	24.9	Very low	127 Å²	127	137.1 Å²	137.1	89%	0.888	73%	0.725	S	S	*	*			trans	-75.7	133.7	-163.8	55.9	0	0	0	0	114.8
352	F	22.4	Very low	24.9	Very low	161 Å²	161	139 Å²	139	71%	0.706	73%	0.727	S	S	*	*			trans	-100.3	122.6	177.4	-132	-98.7	0	0	0	110.4
353	Q	23.7	Very low	24.9	Very low	130 Å²	130	140.8 Å²	140.8	61%	0.607	74%	0.739	S	S	*	*			trans	-138.1	101.4	152	-78.4	-170.8	-48.2	0	0	103
354	Q	25.2	Very low	24.9	Very low	154 Å²	154	138.5 Å²	138.5	72%	0.72	73%	0.727	S	S	*	*				73.8	95.2	64.6	-164.1	153.4	23.6	0	0	112.8	T1630	Q354-T1630 PolarHBondContact N-O 3.29Å
355	F	25.6	Very low	24.8	Very low	91 Å²	91	138.8 Å²	138.8	40%	0.399	73%	0.728	S	S	.	*			trans	-128.5	153.8	153.9	-88.4	-93.1	0	0	0	112.6	T1630 D1631 R1632	F355-T1630 PolarHBondContact N-OG1 3.41Å; F355-D1631 WeakPolarHBondContact CE2-OD1 3.15Å; F355-R1632 HydrophobicContact CD2-CG 4.25Å; F355-R1632 HydrophobicContact CE1-CG 4.41Å; F355-R1632 HydrophobicContact CE2-CB 4.08Å; F355-R1632 HydrophobicContact CE2-CG 3.28Å; F355-R1632 HydrophobicContact CZ-CB 4.13Å; F355-R1632 HydrophobicContact CZ-CG 3.4Å
356	P	26.6	Very low	24.8	Very low	106 Å²	106	138.2 Å²	138.2	69%	0.688	73%	0.725	S	S	*	*			trans	-109.6	151.4	-155	21.3	-0.7	0	0	0	114.5
357	K	23.3	Very low	24.9	Very low	192 Å²	192	137.2 Å²	137.2	84%	0.835	71%	0.71	S	S	*	*			trans	-6.1	139.9	145.3	-83	179.3	167.3	-178.1	0	117.6
358	I	25.2	Very low	24.9	Very low	173 Å²	173	137 Å²	137	89%	0.887	71%	0.709	S	S	*	*				172.8	152.6	129.2	-88.3	147.8	0	0	0	107.8
359	D	25	Very low	25	Very low	147 Å²	147	139.1 Å²	139.1	79%	0.786	71%	0.707	S	S	*	*			cis	-154.2	128.7	-49.7	-162.8	-0.8	0	0	0	102.6	R361	D359-R361 PolarHBondContact O-N 3.13Å
360	Y	24.7	Very low	25.4	Very low	224 Å²	224	139.3 Å²	139.3	88%	0.878	71%	0.711	S	S	*	*			trans	-79.4	117.2	-172.7	-85.9	-106.2	0	0	0	109.1
361	R	23.8	Very low	25.8	Very low	243 Å²	243	141.1 Å²	141.1	92%	0.917	71%	0.707	S	S	*	*			trans	-158.9	119.7	152.2	-111.6	160.2	-164.4	178.9	6.1	111.9	D359	D359-R361 PolarHBondContact O-N 3.13Å
362	S	25.7	Very low	26.3	Very low	103 Å²	103	141.5 Å²	141.5	72%	0.72	70%	0.697	S	S	*	*			trans	74.1	76.5	162.8	85.8	0	0	0	0	117.9
363	F	22.3	Very low	27.2	Very low	192 Å²	192	141.2 Å²	141.2	84%	0.842	70%	0.698	S	S	*	*			trans	-116	71.1	136.9	-103.5	-90.7	0	0	0	107.8
364	L	25.6	Very low	28.4	Very low	124 Å²	124	136.8 Å²	136.8	65%	0.649	68%	0.681	S	S	*	*			trans	-74.6	140.4	147.1	-90.3	156.2	0	0	0	106
365	E	24.9	Very low	30.2	Very low	137 Å²	137	132.1 Å²	132.1	64%	0.64	66%	0.661	S	S	*	*			trans	90.4	87.2	163.9	-60.6	175.6	168.7	0	0	117.2
366	H	25.5	Very low	32.5	Very low	157 Å²	157	132.1 Å²	132.1	73%	0.727	66%	0.664	S	S	*	*				159	88.8	97.4	-75.4	-55.3	0	0	0	115.1
367	S	27.2	Very low	35.2	Very low	33 Å²	33	127.1 Å²	127.1	23%	0.231	63%	0.632	C	S	.	*			trans	-96.6	132.6	157.8	99.3	0	0	0	0	118	E1403 K1406	S367-E1403 WeakPolarHBondContact CB-OE1 3.34Å; S367-E1403 PolarHBondContact OG-OE1 2.72Å; S367-K1406 VanDerWaalsContact N-CE 3.31Å; S367-K1406 VanDerWaalsContact N-CG 3.3Å; S367-K1406 VanDerWaalsContact O-CD 3.26Å; S367-K1406 WeakPolarHBondContact O-CD 3.2Å; S367-K1406 WeakPolarHBondContact O-CE 3.15Å; S367-K1406 WeakPolarHBondContact O-CG 3.18Å; S367-K1406 PolarHBondContact O-NZ 3.06Å; S367-K1406 VanDerWaalsContact OG-CA 3.26Å; S367-K1406 WeakPolarHBondContact OG-CA 3.38Å; S367-K1406 WeakPolarHBondContact OG-CB 3.29Å; S367-K1406 WeakPolarHBondContact OG-CG 3.36Å
368	S	26.7	Very low	38.1	Very low	76 Å²	76	125.3 Å²	125.3	53%	0.531	62%	0.62	S	S	.	*			trans	52.3	119.1	147.4	58.6	0	0	0	0	122.6	E1403	S368-E1403 VanDerWaalsContact OG-CD 3.3Å; S368-E1403 PolarHBondContact OG-OE1 3.24Å; S368-E1403 PolarHBondContact OG-OE2 3.41Å
369	T	29.7	Very low	41	Very low	118 Å²	118	118.4 Å²	118.4	72%	0.724	59%	0.586	S	S	*	*			trans	-74.8	141.1	147.1	41.1	0	0	0	0	110.9
370	D	32.1	Very low	43.8	Very low	142 Å²	142	114.9 Å²	114.9	76%	0.759	56%	0.563	S	S	*	*			trans	159.4	153.2	133.4	-77.8	-13.1	0	0	0	114.7
371	L	34.2	Very low	46.6	Very low	134 Å²	134	105.9 Å²	105.9	70%	0.702	53%	0.53	S	S	*	.			trans	103.5	88.2	171	-76.2	102.8	0	0	0	121	Y404 L406	L371-Y404 PolarHBondContact O-OH 2.8Å; L371-L406 VanDerWaalsContact O-CD1 3.22Å; L371-L406 WeakPolarHBondContact O-CD1 2.94Å
372	I	33.1	Very low	49.5	Very low	135 Å²	135	101.9 Å²	101.9	69%	0.692	52%	0.516	S	S	*	.				24.4	136.3	108.6	-53.5	174.9	0	0	0	121.4	L406	I372-L406 VanDerWaalsContact O-CD1 3.27Å; I372-L406 WeakPolarHBondContact O-CD1 2.98Å
373	H	41.4	Very low	52.4	Low	154 Å²	154	97.9 Å²	97.9	71%	0.713	49%	0.487	S	S	*	.			cis	-158.1	87.9	-15.8	-101.7	75.9	0	0	0	109.2	L406	H373-L406 HydrophobicContact CB-CD2 4.37Å
374	S	49	Very low	55.4	Low	37 Å²	37	94.2 Å²	94.2	26%	0.259	48%	0.48	S	S	.	.			trans	-154.7	100	167.4	155.5	0	0	0	0	108	I376 R378 L406	S374-I376 PolarHBondContact O-N 2.81Å; S374-R378 PolarHBondContact OG-NH2 3.4Å; S374-L406 VanDerWaalsContact O-CB 3.3Å; S374-L406 WeakPolarHBondContact O-CB 3.45Å
375	N	63.5	Low	58.3	Low	56 Å²	56	91.7 Å²	91.7	30%	0.299	47%	0.471	S	S	.	.			trans	-82.9	42.3	-171.7	-52.9	-0.7	0	0	0	112.3	D405 Q407 D482 N486	N375-D405 WeakPolarHBondContact CA-OD2 3.16Å; N375-Q407 HydrophobicContact CB-CB 4.21Å; N375-Q407 PolarHBondContact ND2-OE1 3.46Å; N375-D482 VanDerWaalsContact O-OD2 3.04Å; N375-N486 PolarHBondContact O-ND2 2.82Å
376	I	74.2	Confident	61.5	Low	91 Å²	91	86 Å²	86	47%	0.467	45%	0.445	S	S	.	.	S	Bend	trans	-121.9	127	171.1	-59.2	172	0	0	0	106	S374 R378 D405 N486	S374-I376 PolarHBondContact O-N 2.81Å; I376-R378 WeakPolarHBondContact O-CG 3.3Å; I376-R378 PolarHBondContact O-N 2.94Å; I376-D405 WeakPolarHBondContact CA-OD2 3.1Å; I376-D405 PolarHBondContact N-OD2 3.44Å; I376-D405 VanDerWaalsContact N-OD2 3.08Å; I376-N486 HydrophobicContact CG2-CB 4.13Å
377	P	83.2	Confident	64.6	Low	2 Å²	2	86 Å²	86	1%	0.013	44%	0.443	C	S	.	.			trans	-63.7	139.4	-178.2	25.6	-33.9	0	0	0	109.8	D405 L414 D482 N486 V488	P377-D405 HydrophobicContact CB-CB 4.07Å; P377-D405 VanDerWaalsContact N-OD2 3.16Å; P377-L414 HydrophobicContact CB-CD1 3.98Å; P377-L414 HydrophobicContact CB-CD2 4.42Å; P377-D482 VanDerWaalsContact CD-OD2 3.31Å; P377-D482 WeakPolarHBondContact CD-OD2 3.25Å; P377-D482 HydrophobicContact CG-CB 4.31Å; P377-N486 WeakPolarHBondContact CG-O 3.18Å; P377-V488 HydrophobicContact CB-CG1 3.7Å; P377-V488 HydrophobicContact CG-CB 4.44Å; P377-V488 HydrophobicContact CG-CG1 3.96Å; P377-V488 VanDerWaalsContact O-CB 3.28Å; P377-V488 WeakPolarHBondContact O-CB 3.47Å; P377-V488 WeakPolarHBondContact O-CG1 3.46Å
378	R	84.3	Confident	67.6	Low	154 Å²	154	84.6 Å²	84.6	58%	0.581	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.4	178.1	-58.8	-179.3	-174	-175.4	0.7	110.5	S374 I376 K380 F403 Y404	S374-R378 PolarHBondContact OG-NH2 3.4Å; I376-R378 WeakPolarHBondContact O-CG 3.3Å; I376-R378 PolarHBondContact O-N 2.94Å; R378-K380 PolarHBondContact O-N 3.05Å; R378-F403 VanDerWaalsContact O-CA 3.31Å; R378-F403 WeakPolarHBondContact O-CA 3.35Å; R378-Y404 PolarHBondContact N-O 2.99Å; R378-Y404 PolarHBondContact O-N 2.82Å
379	V	84.8	Confident	70.6	Confident	28 Å²	28	83.2 Å²	83.2	17%	0.17	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	114.4	167.1	-171.4	0	0	0	0	107.7	Y382 T402 F403 Y428 V488 E490	V379-Y382 HydrophobicContact CG1-CD1 3.91Å; V379-Y382 HydrophobicContact CG1-CE1 4.09Å; V379-T402 CarbonylContact C-O 3.57Å; V379-F403 HydrophobicContact CG2-CD1 4.22Å; V379-F403 HydrophobicContact CG2-CE1 3.89Å; V379-Y428 HydrophobicContact CG2-CE2 3.88Å; V379-V488 HydrophobicContact CG2-CG2 3.68Å; V379-E490 HydrophobicContact CG1-CB 4.41Å; V379-E490 HydrophobicContact CG1-CG 4.3Å; V379-E490 HydrophobicContact CG2-CB 4.16Å
380	K	83.4	Confident	73.2	Confident	72 Å²	72	78 Å²	78	31%	0.313	39%	0.39	S	S	.	.			trans	-91.1	-40.4	176.5	-174.1	176.1	-170	173.3	0	111.1	R378 N401 T402 Y410 I1404	R378-K380 PolarHBondContact O-N 3.05Å; K380-N401 WeakPolarHBondContact CB-O 3.45Å; K380-T402 PolarHBondContact N-O 3.1Å; K380-Y410 HydrophobicContact CD-CE1 3.89Å; K380-Y410 PolarHBondContact NZ-OH 3.32Å; K380-I1404 HydrophobicContact CD-CG2 4.1Å; K380-I1404 PolarHBondContact NZ-O 3.46Å
381	N	83.9	Confident	75.6	Confident	35 Å²	35	76.1 Å²	76.1	19%	0.187	37%	0.372	C	S	.	.	S	Bend	trans	-140.5	134.2	176.5	-69.4	-69.6	0	0	0	111.3	N401 T402	N381-N401 WeakPolarHBondContact CB-O 3.46Å; N381-N401 PolarHBondContact N-O 2.75Å; N381-N401 PolarHBondContact ND2-ND2 3.36Å; N381-N401 PolarHBondContact ND2-O 2.61Å; N381-T402 PolarHBondContact N-O 2.76Å; N381-T402 VanDerWaalsContact N-O 3.17Å; N381-T402 WeakPolarHBondContact O-CA 3.37Å; N381-T402 WeakPolarHBondContact O-CG2 3.49Å
382	Y	84.9	Confident	78	Confident	159 Å²	159	73.8 Å²	73.8	62%	0.624	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-71.6	149	177.2	-55	-63.3	0	0	0	111.8	V379 E490	V379-Y382 HydrophobicContact CG1-CD1 3.91Å; V379-Y382 HydrophobicContact CG1-CE1 4.09Å; Y382-E490 VanDerWaalsContact CD1-CD 3.49Å; Y382-E490 WeakPolarHBondContact CD1-OE1 3.48Å; Y382-E490 WeakPolarHBondContact CD1-OE2 3.49Å
383	I	86.1	Confident	80.5	Confident	20 Å²	20	73.3 Å²	73.3	10%	0.103	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-86.7	119.1	177.2	-59.3	175	0	0	0	108.6	I398 T402 V478 F492	I383-I398 HydrophobicContact CD1-CG2 4.27Å; I383-T402 HydrophobicContact CD1-CG2 4.06Å; I383-T402 HydrophobicContact CG1-CG2 3.88Å; I383-V478 HydrophobicContact CD1-CG1 3.63Å; I383-F492 HydrophobicContact CB-CB 3.82Å; I383-F492 HydrophobicContact CB-CD1 4.48Å; I383-F492 HydrophobicContact CB-CG 4.09Å; I383-F492 HydrophobicContact CD1-CD1 3.96Å; I383-F492 HydrophobicContact CD1-CE1 4.29Å; I383-F492 HydrophobicContact CD1-CG 4.36Å; I383-F492 HydrophobicContact CG2-CB 3.97Å; I383-F492 HydrophobicContact CG2-CD2 4.01Å; I383-F492 HydrophobicContact CG2-CG 3.91Å
384	T	85.9	Confident	82.7	Confident	115 Å²	115	67 Å²	67	71%	0.706	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-66.9	149.8	177.3	53.3	0	0	0	0	111.4	I386	T384-I386 PolarHBondContact O-N 2.66Å
385	P	87	Confident	84.7	Confident	70 Å²	70	70.3 Å²	70.3	46%	0.455	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-56.1	123.7	-179.5	-26.9	34.7	0	0	0	112.5	K387 Q493 I495	P385-K387 PolarHBondContact O-N 2.74Å; P385-Q493 CarbonylContact C-O 3.59Å; P385-Q493 WeakPolarHBondContact CA-O 2.93Å; P385-Q493 HydrophobicContact CB-CB 4.36Å; P385-I495 HydrophobicContact CB-CD1 4.25Å
386	I	90.7	Very high	86	Confident	19 Å²	19	69.6 Å²	69.6	10%	0.097	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	118.9	-180	-68.8	164.3	0	0	0	108.5	T384 I396 L464 F492 Q493 I494 I495	T384-I386 PolarHBondContact O-N 2.66Å; I386-I396 HydrophobicContact CB-CD1 4.18Å; I386-I396 HydrophobicContact CD1-CD1 3.76Å; I386-I396 HydrophobicContact CD1-CG2 3.94Å; I386-I396 HydrophobicContact CG1-CD1 4Å; I386-I396 HydrophobicContact CG1-CG2 4.48Å; I386-I396 HydrophobicContact CG2-CD1 3.16Å; I386-L464 HydrophobicContact CG2-CD1 3.92Å; I386-F492 HydrophobicContact CD1-CD2 4.03Å; I386-F492 HydrophobicContact CD1-CE2 3.75Å; I386-Q493 PolarHBondContact N-O 3.01Å; I386-I494 HydrophobicContact CB-CG1 4.17Å; I386-I494 HydrophobicContact CD1-CG1 4.29Å; I386-I494 HydrophobicContact CG2-CG2 4.21Å; I386-I494 CarbonylContact O-C 3.59Å; I386-I494 WeakPolarHBondContact O-CA 3.29Å; I386-I495 PolarHBondContact O-N 2.88Å
387	K	90.7	Very high	86.8	Confident	155 Å²	155	69.5 Å²	69.5	67%	0.674	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	124	175.2	-65	173.1	-175.4	169.6	0	109.3	P385 I495	P385-K387 PolarHBondContact O-N 2.74Å; K387-I495 HydrophobicContact CG-CB 4.4Å; K387-I495 HydrophobicContact CG-CD1 4.46Å
388	T	91.9	Very high	87.1	Confident	4 Å²	4	69.4 Å²	69.4	3%	0.025	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	164.1	176.2	-167.8	0	0	0	0	111.1	L464 P466 I494 I495 V496 K497	T388-L464 HydrophobicContact CG2-CD1 4.21Å; T388-P466 HydrophobicContact CG2-CG 4.07Å; T388-I494 HydrophobicContact CG2-CG2 4.18Å; T388-I495 PolarHBondContact N-O 3.32Å; T388-V496 HydrophobicContact CG2-CG2 3.96Å; T388-V496 WeakPolarHBondContact O-CA 3.33Å; T388-K497 PolarHBondContact O-N 3Å
389	T	87.8	Confident	87.4	Confident	48 Å²	48	64.7 Å²	64.7	29%	0.294	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	154.4	176.7	60	0	0	0	0	111.8	Y391 Q392 P466 K497	T389-Y391 PolarHBondContact O-N 3.36Å; T389-Q392 VanDerWaalsContact N-OE1 3.1Å; T389-Q392 WeakPolarHBondContact O-CB 3.23Å; T389-Q392 PolarHBondContact O-N 2.87Å; T389-Q392 WeakPolarHBondContact OG1-CB 3.23Å; T389-Q392 PolarHBondContact OG1-OE1 3.22Å; T389-P466 WeakPolarHBondContact O-CG 3.48Å; T389-K497 VanDerWaalsContact CA-O 3.25Å; T389-K497 WeakPolarHBondContact CA-O 3.32Å
390	V	84.5	Confident	87.4	Confident	8 Å²	8	66.6 Å²	66.6	5%	0.048	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	138.3	177.1	-173.4	0	0	0	0	110.7	Q392 P468 V471 V496 K497 A579	V390-Q392 PolarHBondContact O-N 3.37Å; V390-P468 HydrophobicContact CG1-CG 3.95Å; V390-V471 HydrophobicContact CG2-CG2 3.43Å; V390-V471 VanDerWaalsContact CG2-CG2 3.43Å; V390-V496 HydrophobicContact CG2-CG1 4.01Å; V390-K497 PolarHBondContact N-O 3Å; V390-K497 VanDerWaalsContact N-O 3.1Å; V390-A579 HydrophobicContact CB-CB 4.06Å; V390-A579 HydrophobicContact CG1-CB 3.88Å; V390-A579 HydrophobicContact CG2-CB 4Å
391	Y	84	Confident	87.6	Confident	102 Å²	102	63.5 Å²	63.5	40%	0.4	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	-2.7	-172.7	-62	-68	0	0	0	116.9	T389 I393 P466 L467 P468 K577 L578	T389-Y391 PolarHBondContact O-N 3.36Å; Y391-I393 PolarHBondContact O-N 3.47Å; Y391-I393 VanDerWaalsContact O-N 3.14Å; Y391-P466 PolarHBondContact N-O 3.36Å; Y391-L467 HydrophobicContact CD1-CD2 4.21Å; Y391-L467 HydrophobicContact CE1-CD2 3.53Å; Y391-P468 HydrophobicContact CE2-CG 3.9Å; Y391-P468 VanDerWaalsContact OH-CD 3.25Å; Y391-P468 WeakPolarHBondContact OH-CD 3.2Å; Y391-P468 WeakPolarHBondContact OH-CG 3.39Å; Y391-K577 PolarHBondContact OH-O 2.89Å; Y391-L578 VanDerWaalsContact CE2-O 3.3Å; Y391-L578 WeakPolarHBondContact CE2-O 3.48Å
392	Q	83.2	Confident	87.8	Confident	85 Å²	85	61.9 Å²	61.9	40%	0.397	31%	0.311	S	S	.	.			trans	-76.2	103.4	174.2	-173	-179.6	-6.4	0	0	110	T389 V390 S394 P466	T389-Q392 VanDerWaalsContact N-OE1 3.1Å; T389-Q392 WeakPolarHBondContact O-CB 3.23Å; T389-Q392 PolarHBondContact O-N 2.87Å; T389-Q392 WeakPolarHBondContact OG1-CB 3.23Å; T389-Q392 PolarHBondContact OG1-OE1 3.22Å; V390-Q392 PolarHBondContact O-N 3.37Å; Q392-S394 PolarHBondContact O-N 2.82Å; Q392-P466 WeakPolarHBondContact O-CD 3.48Å
393	I	85.5	Confident	88.1	Confident	125 Å²	125	54.3 Å²	54.3	64%	0.641	28%	0.281	S	S	*	.			trans	-72	120.8	173.4	-57.2	174.4	0	0	0	107.9	Y391 L464 K465	Y391-I393 PolarHBondContact O-N 3.47Å; Y391-I393 VanDerWaalsContact O-N 3.14Å; I393-L464 VanDerWaalsContact CA-O 3.31Å; I393-L464 WeakPolarHBondContact CA-O 3.39Å; I393-K465 HydrophobicContact CG1-CG 4.48Å
394	S	87.3	Confident	88.1	Confident	22 Å²	22	56.3 Å²	56.3	15%	0.154	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	131.9	-178.4	-62.7	0	0	0	0	110.2	Q392 L464	Q392-S394 PolarHBondContact O-N 2.82Å; S394-L464 PolarHBondContact N-O 2.8Å; S394-L464 VanDerWaalsContact N-O 3.1Å; S394-L464 PolarHBondContact O-N 3.46Å
395	N	91.3	Very high	88	Confident	106 Å²	106	50.9 Å²	50.9	57%	0.567	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.8	111.1	170.6	-69	-29.3	0	0	0	106.9	I461 R463	N395-I461 HydrophobicContact CB-CG2 3.77Å; N395-R463 WeakPolarHBondContact OD1-CG 3.48Å
396	I	91.8	Very high	87.6	Confident	42 Å²	42	49.4 Å²	49.4	22%	0.215	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	110.2	-175.7	-57	177.9	0	0	0	107.1	I386 I398 I461 I462 L464	I386-I396 HydrophobicContact CB-CD1 4.18Å; I386-I396 HydrophobicContact CD1-CD1 3.76Å; I386-I396 HydrophobicContact CD1-CG2 3.94Å; I386-I396 HydrophobicContact CG1-CD1 4Å; I386-I396 HydrophobicContact CG1-CG2 4.48Å; I386-I396 HydrophobicContact CG2-CD1 3.16Å; I396-I398 PolarHBondContact O-N 2.86Å; I396-I461 WeakPolarHBondContact O-CA 3.4Å; I396-I462 HydrophobicContact CB-CB 4.43Å; I396-I462 PolarHBondContact N-O 2.81Å; I396-I462 PolarHBondContact O-N 3.41Å; I396-L464 HydrophobicContact CD1-CD1 3.57Å; I396-L464 HydrophobicContact CD1-CG 4.36Å
397	Q	91.1	Very high	87.1	Confident	88 Å²	88	53.6 Å²	53.6	41%	0.411	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	126.9	171.8	-170.9	66.5	38.3	0	0	108	P399 N459 Q460	Q397-P399 WeakPolarHBondContact O-CD 3.27Å; Q397-N459 PolarHBondContact NE2-O 3.2Å; Q397-N459 PolarHBondContact OE1-O 3.19Å; Q397-Q460 PolarHBondContact NE2-O 2.91Å
398	I	89.6	Confident	86.8	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-63.1	127.7	169.4	-64.2	178.2	0	0	0	107.4	I383 I396 Q400 T411 L416 F455 Q460 I462 V478	I383-I398 HydrophobicContact CD1-CG2 4.27Å; I396-I398 PolarHBondContact O-N 2.86Å; I398-Q400 PolarHBondContact O-N 2.85Å; I398-T411 HydrophobicContact CG2-CG2 4.13Å; I398-L416 HydrophobicContact CD1-CD1 3.76Å; I398-L416 HydrophobicContact CG2-CD1 4.36Å; I398-F455 HydrophobicContact CD1-CD2 4.46Å; I398-F455 HydrophobicContact CD1-CE2 3.41Å; I398-F455 VanDerWaalsContact CD1-CE2 3.41Å; I398-F455 HydrophobicContact CD1-CZ 3.69Å; I398-F455 HydrophobicContact CG1-CE2 4.33Å; I398-Q460 PolarHBondContact N-O 3.41Å; I398-I462 HydrophobicContact CD1-CD1 4.19Å; I398-I462 HydrophobicContact CD1-CG1 4.23Å; I398-I462 HydrophobicContact CG1-CD1 3.92Å; I398-I462 HydrophobicContact CG1-CG1 4.08Å; I398-V478 HydrophobicContact CD1-CG2 4.01Å
399	P	89.5	Confident	86.4	Confident	54 Å²	54	47 Å²	47	35%	0.351	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-52.7	129.8	-180	-26.2	33.7	0	0	0	111.2	Q397 N401 T402 T411	Q397-P399 WeakPolarHBondContact O-CD 3.27Å; P399-N401 WeakPolarHBondContact CB-OD1 3.41Å; P399-N401 PolarHBondContact O-N 3.22Å; P399-T402 WeakPolarHBondContact CB-OG1 3.41Å; P399-T402 WeakPolarHBondContact O-CB 3.43Å; P399-T402 PolarHBondContact O-N 3.44Å; P399-T402 PolarHBondContact O-OG1 3.24Å; P399-T411 PolarHBondContact O-OG1 2.81Å
400	Q	86	Confident	86.5	Confident	68 Å²	68	47 Å²	47	32%	0.318	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.7	-176.1	-93.7	-170.7	6	0	0	112.8	I398 Y410 T411 R1405	I398-Q400 PolarHBondContact O-N 2.85Å; Q400-Y410 WeakPolarHBondContact O-CB 3.44Å; Q400-T411 WeakPolarHBondContact O-CB 3.48Å; Q400-T411 PolarHBondContact O-OG1 3.34Å; Q400-T411 VanDerWaalsContact O-OG1 3.06Å; Q400-R1405 PolarHBondContact O-NE 2.94Å; Q400-R1405 PolarHBondContact O-NH2 3.22Å
401	N	86.4	Confident	86.6	Confident	8 Å²	8	46.7 Å²	46.7	4%	0.043	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	15.3	176.7	65.9	-13.2	0	0	0	114	K380 N381 P399 I1404	K380-N401 WeakPolarHBondContact CB-O 3.45Å; N381-N401 WeakPolarHBondContact CB-O 3.46Å; N381-N401 PolarHBondContact N-O 2.75Å; N381-N401 PolarHBondContact ND2-ND2 3.36Å; N381-N401 PolarHBondContact ND2-O 2.61Å; P399-N401 WeakPolarHBondContact CB-OD1 3.41Å; P399-N401 PolarHBondContact O-N 3.22Å; N401-I1404 HydrophobicContact CB-CG2 3.69Å
402	T	88.7	Confident	86.7	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	23%	0.232	C	C	.	.	S	Bend	trans	-66.2	-48.1	175.2	-61.9	0	0	0	0	112.1	V379 K380 N381 I383 P399 T411	V379-T402 CarbonylContact C-O 3.57Å; K380-T402 PolarHBondContact N-O 3.1Å; N381-T402 PolarHBondContact N-O 2.76Å; N381-T402 VanDerWaalsContact N-O 3.17Å; N381-T402 WeakPolarHBondContact O-CA 3.37Å; N381-T402 WeakPolarHBondContact O-CG2 3.49Å; I383-T402 HydrophobicContact CD1-CG2 4.06Å; I383-T402 HydrophobicContact CG1-CG2 3.88Å; P399-T402 WeakPolarHBondContact CB-OG1 3.41Å; P399-T402 WeakPolarHBondContact O-CB 3.43Å; P399-T402 PolarHBondContact O-N 3.44Å; P399-T402 PolarHBondContact O-OG1 3.24Å; T402-T411 PolarHBondContact N-OG1 2.83Å
403	F	91.7	Very high	86.9	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	148.9	179.6	-59	-78.5	0	0	0	110.6	R378 V379 Y410 T411 L414 L416 V478 A480 V488 E490	R378-F403 VanDerWaalsContact O-CA 3.31Å; R378-F403 WeakPolarHBondContact O-CA 3.35Å; V379-F403 HydrophobicContact CG2-CD1 4.22Å; V379-F403 HydrophobicContact CG2-CE1 3.89Å; F403-Y410 CarbonylContact O-C 3.55Å; F403-Y410 WeakPolarHBondContact O-CA 3.43Å; F403-T411 HydrophobicContact CD2-CG2 3.99Å; F403-T411 PolarHBondContact N-OG1 3.48Å; F403-T411 PolarHBondContact O-N 3.33Å; F403-T411 PolarHBondContact O-OG1 2.01Å; F403-L414 HydrophobicContact CB-CD1 3.81Å; F403-L416 HydrophobicContact CD2-CD2 3.94Å; F403-L416 HydrophobicContact CE2-CD2 4.06Å; F403-V478 HydrophobicContact CE2-CG1 3.99Å; F403-V478 HydrophobicContact CE2-CG2 3.97Å; F403-V478 HydrophobicContact CZ-CG1 3.89Å; F403-V478 HydrophobicContact CZ-CG2 4.33Å; F403-A480 HydrophobicContact CB-CB 3.99Å; F403-A480 HydrophobicContact CD1-CB 3.79Å; F403-A480 HydrophobicContact CD2-CB 3.77Å; F403-A480 HydrophobicContact CE1-CB 4.14Å; F403-A480 HydrophobicContact CE2-CB 4.13Å; F403-A480 HydrophobicContact CG-CB 3.57Å; F403-A480 HydrophobicContact CZ-CB 4.28Å; F403-V488 HydrophobicContact CD1-CG1 3.52Å; F403-V488 HydrophobicContact CE1-CG1 3.75Å; F403-E490 HydrophobicContact CE1-CB 4.11Å; F403-E490 HydrophobicContact CZ-CB 3.89Å
404	Y	86.4	Confident	87	Confident	61 Å²	61	41 Å²	41	24%	0.239	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	118.5	173.5	179.8	-105.2	0	0	0	108.7	L371 R378 L406 Y410	L371-Y404 PolarHBondContact O-OH 2.8Å; R378-Y404 PolarHBondContact N-O 2.99Å; R378-Y404 PolarHBondContact O-N 2.82Å; Y404-L406 HydrophobicContact CE1-CD1 4.34Å; Y404-Y410 AromaticContact CD2-CD1 3.59Å; Y404-Y410 HydrophobicContact CD2-CD1 3.59Å; Y404-Y410 HydrophobicContact CD2-CD2 4.13Å; Y404-Y410 AromaticContact CD2-CE1 3.48Å; Y404-Y410 HydrophobicContact CD2-CE1 3.48Å; Y404-Y410 VanDerWaalsContact CD2-CE1 3.48Å; Y404-Y410 HydrophobicContact CD2-CE2 4.04Å; Y404-Y410 AromaticContact CD2-CG 3.86Å; Y404-Y410 HydrophobicContact CD2-CG 3.86Å; Y404-Y410 AromaticContact CD2-CZ 3.67Å; Y404-Y410 HydrophobicContact CE2-CD1 4.42Å; Y404-Y410 HydrophobicContact CE2-CD2 4.26Å; Y404-Y410 HydrophobicContact CE2-CE1 4.09Å; Y404-Y410 AromaticContact CE2-CE2 3.92Å; Y404-Y410 HydrophobicContact CE2-CE2 3.92Å; Y404-Y410 HydrophobicContact CE2-CG 4.44Å; Y404-Y410 AromaticContact CE2-CZ 3.77Å; Y404-Y410 HydrophobicContact CG-CD1 4.38Å; Y404-Y410 HydrophobicContact CG-CE1 4.23Å
405	D	83.5	Confident	87.1	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	151.3	161.2	-176.2	-98.1	0	0	0	108.3	N375 I376 P377 Q407 D408 G409 L414	N375-D405 WeakPolarHBondContact CA-OD2 3.16Å; I376-D405 WeakPolarHBondContact CA-OD2 3.1Å; I376-D405 PolarHBondContact N-OD2 3.44Å; I376-D405 VanDerWaalsContact N-OD2 3.08Å; P377-D405 HydrophobicContact CB-CB 4.07Å; P377-D405 VanDerWaalsContact N-OD2 3.16Å; D405-Q407 WeakPolarHBondContact OD1-CA 3.31Å; D405-Q407 PolarHBondContact OD1-N 3.26Å; D405-D408 HydrophobicContact CB-CB 4.14Å; D405-D408 PolarHBondContact OD1-N 3.19Å; D405-G409 PolarHBondContact N-O 3.07Å; D405-G409 CarbonylContact O-C 3.18Å; D405-G409 WeakPolarHBondContact O-CA 3.25Å; D405-G409 PolarHBondContact O-N 3.42Å; D405-L414 HydrophobicContact CB-CD1 4.12Å; D405-L414 HydrophobicContact CB-CD2 3.71Å; D405-L414 HydrophobicContact CB-CG 4.37Å
406	L	78.3	Confident	87.1	Confident	39 Å²	39	42.2 Å²	42.2	20%	0.204	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-33.3	-174.3	-163.3	125.5	0	0	0	114.1	L371 I372 H373 S374 Y404	L371-L406 VanDerWaalsContact O-CD1 3.22Å; L371-L406 WeakPolarHBondContact O-CD1 2.94Å; I372-L406 VanDerWaalsContact O-CD1 3.27Å; I372-L406 WeakPolarHBondContact O-CD1 2.98Å; H373-L406 HydrophobicContact CB-CD2 4.37Å; S374-L406 VanDerWaalsContact O-CB 3.3Å; S374-L406 WeakPolarHBondContact O-CB 3.45Å; Y404-L406 HydrophobicContact CE1-CD1 4.34Å
407	Q	80.7	Confident	87.1	Confident	107 Å²	107	40.9 Å²	40.9	50%	0.5	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-43.5	180	-178.6	177.3	4.6	0	0	111.1	N375 D405	N375-Q407 HydrophobicContact CB-CB 4.21Å; N375-Q407 PolarHBondContact ND2-OE1 3.46Å; D405-Q407 WeakPolarHBondContact OD1-CA 3.31Å; D405-Q407 PolarHBondContact OD1-N 3.26Å
408	D	82.7	Confident	87.1	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.032	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-24.1	177.1	-76.8	-45.9	0	0	0	111.9	D405 N413 L414 D482 R483	D405-D408 HydrophobicContact CB-CB 4.14Å; D405-D408 PolarHBondContact OD1-N 3.19Å; D408-N413 WeakPolarHBondContact O-CB 3.37Å; D408-N413 VanDerWaalsContact O-CG 3.26Å; D408-N413 PolarHBondContact O-ND2 3.47Å; D408-L414 HydrophobicContact CB-CD2 3.62Å; D408-L414 HydrophobicContact CB-CG 4.45Å; D408-D482 VanDerWaalsContact OD2-CA 3.3Å; D408-D482 WeakPolarHBondContact OD2-CA 3.23Å; D408-D482 VanDerWaalsContact OD2-CB 3.26Å; D408-D482 WeakPolarHBondContact OD2-CB 3.32Å; D408-R483 VanDerWaalsContact OD1-CD 3.29Å; D408-R483 WeakPolarHBondContact OD1-CD 3.07Å; D408-R483 WeakPolarHBondContact OD1-CG 3.49Å; D408-R483 IonicContact OD1-CZ 3.49Å; D408-R483 IonicContact OD1-NE 2.73Å; D408-R483 PolarHBondContact OD1-NE 3.34Å; D408-R483 IonicContact OD1-NH2 3.69Å; D408-R483 PolarHBondContact OD2-N 3.41Å
409	G	85.4	Confident	87.1	Confident	15 Å²	15	37.9 Å²	37.9	16%	0.155	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.2	-152.5	-177.8	0	0	0	0	0	112.6	D405	D405-G409 PolarHBondContact N-O 3.07Å; D405-G409 CarbonylContact O-C 3.18Å; D405-G409 WeakPolarHBondContact O-CA 3.25Å; D405-G409 PolarHBondContact O-N 3.42Å
410	Y	89.4	Confident	87	Confident	49 Å²	49	36.8 Å²	36.8	19%	0.192	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	171.5	-175.7	-70.7	-80.9	0	0	0	114.1	K380 Q400 F403 Y404 Q412 N413 I1404 R1405	K380-Y410 HydrophobicContact CD-CE1 3.89Å; K380-Y410 PolarHBondContact NZ-OH 3.32Å; Q400-Y410 WeakPolarHBondContact O-CB 3.44Å; F403-Y410 CarbonylContact O-C 3.55Å; F403-Y410 WeakPolarHBondContact O-CA 3.43Å; Y404-Y410 AromaticContact CD2-CD1 3.59Å; Y404-Y410 HydrophobicContact CD2-CD1 3.59Å; Y404-Y410 HydrophobicContact CD2-CD2 4.13Å; Y404-Y410 AromaticContact CD2-CE1 3.48Å; Y404-Y410 HydrophobicContact CD2-CE1 3.48Å; Y404-Y410 VanDerWaalsContact CD2-CE1 3.48Å; Y404-Y410 HydrophobicContact CD2-CE2 4.04Å; Y404-Y410 AromaticContact CD2-CG 3.86Å; Y404-Y410 HydrophobicContact CD2-CG 3.86Å; Y404-Y410 AromaticContact CD2-CZ 3.67Å; Y404-Y410 HydrophobicContact CE2-CD1 4.42Å; Y404-Y410 HydrophobicContact CE2-CD2 4.26Å; Y404-Y410 HydrophobicContact CE2-CE1 4.09Å; Y404-Y410 AromaticContact CE2-CE2 3.92Å; Y404-Y410 HydrophobicContact CE2-CE2 3.92Å; Y404-Y410 HydrophobicContact CE2-CG 4.44Å; Y404-Y410 AromaticContact CE2-CZ 3.77Å; Y404-Y410 HydrophobicContact CG-CD1 4.38Å; Y404-Y410 HydrophobicContact CG-CE1 4.23Å; Y410-Q412 PolarHBondContact O-N 3.4Å; Y410-N413 PolarHBondContact O-N 3.36Å; Y410-I1404 WeakPolarHBondContact CE1-O 3.38Å; Y410-I1404 PolarHBondContact OH-O 3.38Å; Y410-R1405 HydrophobicContact CD1-CG 4.23Å; Y410-R1405 HydrophobicContact CD2-CG 3.79Å; Y410-R1405 HydrophobicContact CE1-CG 4.18Å; Y410-R1405 HydrophobicContact CE2-CG 3.74Å; Y410-R1405 HydrophobicContact CG-CG 4.08Å
411	T	87.2	Confident	86.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-31.3	-44.4	-179.5	-49.7	0	0	0	0	115.6	I398 P399 Q400 T402 F403 N413 L414 L416 Q460	I398-T411 HydrophobicContact CG2-CG2 4.13Å; P399-T411 PolarHBondContact O-OG1 2.81Å; Q400-T411 WeakPolarHBondContact O-CB 3.48Å; Q400-T411 PolarHBondContact O-OG1 3.34Å; Q400-T411 VanDerWaalsContact O-OG1 3.06Å; T402-T411 PolarHBondContact N-OG1 2.83Å; F403-T411 HydrophobicContact CD2-CG2 3.99Å; F403-T411 PolarHBondContact N-OG1 3.48Å; F403-T411 PolarHBondContact O-N 3.33Å; F403-T411 PolarHBondContact O-OG1 2.01Å; T411-N413 PolarHBondContact O-N 3.41Å; T411-L414 PolarHBondContact O-N 2.73Å; T411-L414 VanDerWaalsContact O-N 3.14Å; T411-L416 HydrophobicContact CG2-CD1 3.68Å; T411-L416 HydrophobicContact CG2-CD2 4.15Å; T411-L416 HydrophobicContact CG2-CG 4.33Å; T411-Q460 PolarHBondContact O-NE2 3.26Å
412	Q	85.7	Confident	86.4	Confident	95 Å²	95	40 Å²	40	44%	0.444	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-62.3	-26.5	-175.6	77.9	-168.8	17.5	0	0	114.8	Y410 Q460	Y410-Q412 PolarHBondContact O-N 3.4Å; Q412-Q460 VanDerWaalsContact CA-NE2 3.29Å; Q412-Q460 PolarHBondContact O-NE2 3.21Å
413	N	86.1	Confident	85.5	Confident	92 Å²	92	44.4 Å²	44.4	49%	0.492	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-95.4	-8.7	-178.6	-67	-13.3	0	0	0	112.3	D408 Y410 T411	D408-N413 WeakPolarHBondContact O-CB 3.37Å; D408-N413 VanDerWaalsContact O-CG 3.26Å; D408-N413 PolarHBondContact O-ND2 3.47Å; Y410-N413 PolarHBondContact O-N 3.36Å; T411-N413 PolarHBondContact O-N 3.41Å
414	L	87.9	Confident	84.5	Confident	6 Å²	6	52 Å²	52	3%	0.031	26%	0.259	C	S	.	.	S	Bend	trans	-91.2	145.3	177.2	-63.9	171.3	0	0	0	110.2	P377 F403 D405 D408 T411 L416 Q460 A480 D482	P377-L414 HydrophobicContact CB-CD1 3.98Å; P377-L414 HydrophobicContact CB-CD2 4.42Å; F403-L414 HydrophobicContact CB-CD1 3.81Å; D405-L414 HydrophobicContact CB-CD1 4.12Å; D405-L414 HydrophobicContact CB-CD2 3.71Å; D405-L414 HydrophobicContact CB-CG 4.37Å; D408-L414 HydrophobicContact CB-CD2 3.62Å; D408-L414 HydrophobicContact CB-CG 4.45Å; T411-L414 PolarHBondContact O-N 2.73Å; T411-L414 VanDerWaalsContact O-N 3.14Å; L414-L416 PolarHBondContact O-N 3.01Å; L414-Q460 PolarHBondContact O-NE2 2.84Å; L414-A480 HydrophobicContact CB-CB 4.08Å; L414-A480 HydrophobicContact CD1-CB 3.92Å; L414-D482 HydrophobicContact CD2-CB 4.01Å
415	K	89.4	Confident	83.6	Confident	152 Å²	152	53.8 Å²	53.8	66%	0.661	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.4	111.4	173.5	177.4	-176.1	179	-172.4	0	108.3	T481	K415-T481 WeakPolarHBondContact CB-OG1 3.43Å; K415-T481 PolarHBondContact N-O 3.4Å; K415-T481 PolarHBondContact O-N 3.14Å; K415-T481 PolarHBondContact O-OG1 2.97Å; K415-T481 VanDerWaalsContact O-OG1 3.04Å
416	L	92.1	Very high	83	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	140.7	177.8	-60.7	-171.9	0	0	0	111.7	I398 F403 T411 L414 F455 T457 Q460 C479 A480	I398-L416 HydrophobicContact CD1-CD1 3.76Å; I398-L416 HydrophobicContact CG2-CD1 4.36Å; F403-L416 HydrophobicContact CD2-CD2 3.94Å; F403-L416 HydrophobicContact CE2-CD2 4.06Å; T411-L416 HydrophobicContact CG2-CD1 3.68Å; T411-L416 HydrophobicContact CG2-CD2 4.15Å; T411-L416 HydrophobicContact CG2-CG 4.33Å; L414-L416 PolarHBondContact O-N 3.01Å; L416-F455 HydrophobicContact CB-CE1 3.83Å; L416-F455 HydrophobicContact CB-CZ 3.72Å; L416-F455 HydrophobicContact CD1-CZ 4.11Å; L416-T457 WeakPolarHBondContact O-CG2 3.27Å; L416-Q460 HydrophobicContact CD1-CB 4.08Å; L416-Q460 HydrophobicContact CD1-CG 3.81Å; L416-Q460 HydrophobicContact CG-CG 4.42Å; L416-C479 CarbonylContact C-O 3.51Å; L416-C479 WeakPolarHBondContact CA-O 3.49Å; L416-A480 HydrophobicContact CD2-CB 3.53Å
417	T	90.6	Very high	82.6	Confident	13 Å²	13	54.9 Å²	54.9	8%	0.08	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.2	169.4	47.9	0	0	0	0	108.8	Y419 V478 C479	T417-Y419 WeakPolarHBondContact CB-OH 3.42Å; T417-Y419 WeakPolarHBondContact OG1-CE2 3.3Å; T417-Y419 PolarHBondContact OG1-OH 3.44Å; T417-V478 WeakPolarHBondContact O-CA 3.38Å; T417-C479 PolarHBondContact N-O 3.29Å; T417-C479 PolarHBondContact O-N 3Å; T417-C479 PolarHBondContact OG1-O 2.85Å
418	L	92.3	Very high	81.9	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.6	-179.7	-176.6	71.5	0	0	0	108.9	I445 V453 F455 I462 F476 V478 F492	L418-I445 HydrophobicContact CB-CB 4.39Å; L418-I445 HydrophobicContact CD2-CB 4.25Å; L418-I445 HydrophobicContact CD2-CD1 3.94Å; L418-I445 HydrophobicContact CD2-CG2 4.34Å; L418-I445 HydrophobicContact CG-CB 4.35Å; L418-I445 HydrophobicContact CG-CD1 4.09Å; L418-I445 PolarHBondContact O-N 2.94Å; L418-V453 HydrophobicContact CD2-CG1 4.16Å; L418-F455 HydrophobicContact CB-CB 3.93Å; L418-F455 HydrophobicContact CB-CD1 3.62Å; L418-F455 HydrophobicContact CB-CD2 4.34Å; L418-F455 HydrophobicContact CB-CE1 4.21Å; L418-F455 HydrophobicContact CB-CG 3.7Å; L418-F455 HydrophobicContact CD2-CB 3.82Å; L418-F455 HydrophobicContact CD2-CD2 4.27Å; L418-F455 HydrophobicContact CD2-CG 4.07Å; L418-I462 HydrophobicContact CD2-CG1 4.26Å; L418-I462 HydrophobicContact CD2-CG2 4.44Å; L418-F476 HydrophobicContact CD1-CB 4.25Å; L418-V478 HydrophobicContact CD1-CB 3.94Å; L418-F492 HydrophobicContact CD1-CE1 3.71Å; L418-F492 HydrophobicContact CD1-CZ 3.79Å
419	Y	89.8	Confident	81.1	Confident	26 Å²	26	59 Å²	59	10%	0.102	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.2	-179.9	-52	-100.4	0	0	0	111.7	T417 I441 E443 E444 F476 I477 C479 R487	T417-Y419 WeakPolarHBondContact CB-OH 3.42Å; T417-Y419 WeakPolarHBondContact OG1-CE2 3.3Å; T417-Y419 PolarHBondContact OG1-OH 3.44Å; Y419-I441 WeakPolarHBondContact CB-O 3.47Å; Y419-I441 HydrophobicContact CD1-CG2 3.1Å; Y419-I441 HydrophobicContact CD2-CG2 3.54Å; Y419-I441 HydrophobicContact CE1-CG2 3.46Å; Y419-I441 VanDerWaalsContact CE1-CG2 3.46Å; Y419-I441 HydrophobicContact CE2-CG2 3.89Å; Y419-I441 HydrophobicContact CG-CG2 3.15Å; Y419-E443 CarbonylContact C-O 3.58Å; Y419-E443 VanDerWaalsContact CA-O 3.27Å; Y419-E443 WeakPolarHBondContact CA-O 3.24Å; Y419-E444 VanDerWaalsContact CD1-CA 3.49Å; Y419-E444 HydrophobicContact CD1-CB 3.76Å; Y419-E444 HydrophobicContact CD1-CG 4.18Å; Y419-E444 HydrophobicContact CE1-CB 3.72Å; Y419-E444 HydrophobicContact CE1-CG 3.9Å; Y419-F476 WeakPolarHBondContact O-CA 3.26Å; Y419-I477 PolarHBondContact N-O 3.19Å; Y419-I477 PolarHBondContact O-N 2.79Å; Y419-C479 HydrophobicContact CE2-CB 4.3Å; Y419-R487 PolarHBondContact OH-NH1 3.07Å; Y419-R487 PolarHBondContact OH-NH2 3.16Å
420	A	86.7	Confident	80.2	Confident	31 Å²	31	62.7 Å²	62.7	26%	0.256	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	116.5	169.1	0	0	0	0	0	108.6	G442 E443 I445 F476	A420-G442 CarbonylContact O-C 3.55Å; A420-G442 VanDerWaalsContact O-CA 3.26Å; A420-G442 WeakPolarHBondContact O-CA 3.37Å; A420-E443 PolarHBondContact N-O 3.16Å; A420-E443 PolarHBondContact O-N 3.24Å; A420-I445 HydrophobicContact CB-CD1 4.02Å; A420-I445 HydrophobicContact CB-CG1 4.26Å; A420-F476 HydrophobicContact CB-CD1 4.3Å; A420-F476 HydrophobicContact CB-CE1 4.1Å
421	S	83	Confident	79.3	Confident	20 Å²	20	60.6 Å²	60.6	14%	0.14	31%	0.307	C	S	.	.			trans	-66.9	138.9	-179.2	178.9	0	0	0	0	111.1	L423 I426 T475	S421-L423 VanDerWaalsContact C-N 3.29Å; S421-L423 PolarHBondContact OG-N 3.42Å; S421-L423 VanDerWaalsContact OG-N 3.12Å; S421-L423 PolarHBondContact OG-O 3.14Å; S421-I426 VanDerWaalsContact OG-CD1 3.25Å; S421-I426 WeakPolarHBondContact OG-CD1 3.48Å; S421-T475 VanDerWaalsContact CB-O 3.31Å; S421-T475 WeakPolarHBondContact CB-O 3.42Å; S421-T475 PolarHBondContact N-O 2.8Å; S421-T475 VanDerWaalsContact N-O 3.09Å
422	N	76.2	Confident	78.3	Confident	123 Å²	123	68.2 Å²	68.2	66%	0.658	34%	0.341	S	S	*	.	S	Bend	trans	-80.1	-11.6	171.5	-69.9	-13.9	0	0	0	112.9
423	L	71.1	Confident	77.1	Confident	94 Å²	94	67.7 Å²	67.7	49%	0.492	35%	0.347	S	S	.	.	S	Bend	trans	-116.9	136.3	179.4	-57.8	157.2	0	0	0	109.7	S421 I426	S421-L423 VanDerWaalsContact C-N 3.29Å; S421-L423 PolarHBondContact OG-N 3.42Å; S421-L423 VanDerWaalsContact OG-N 3.12Å; S421-L423 PolarHBondContact OG-O 3.14Å; L423-I426 HydrophobicContact CB-CD1 3.65Å; L423-I426 HydrophobicContact CB-CG1 3.5Å; L423-I426 VanDerWaalsContact CB-CG1 3.5Å; L423-I426 HydrophobicContact CD1-CD1 3.69Å; L423-I426 HydrophobicContact CD1-CG1 4.09Å; L423-I426 HydrophobicContact CG-CD1 4.19Å; L423-I426 HydrophobicContact CG-CG1 4.42Å
424	E	69.8	Low	75.8	Confident	160 Å²	160	66.6 Å²	66.6	75%	0.748	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	133.7	174.7	-64.1	-177.1	177.8	0	0	110.1
425	N	67.7	Low	74.2	Confident	97 Å²	97	75.6 Å²	75.6	52%	0.519	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	30	172.9	-49.9	-46.1	0	0	0	116.9	S427 T475 Q493	N425-S427 PolarHBondContact O-N 2.77Å; N425-T475 PolarHBondContact N-OG1 3.44Å; N425-Q493 PolarHBondContact OD1-NE2 3.32Å
426	I	71.3	Confident	72.5	Confident	15 Å²	15	73.4 Å²	73.4	8%	0.077	38%	0.378	C	S	.	.			trans	-62.2	130.2	172.4	-46.5	-179.9	0	0	0	110.7	S421 L423 E430 L431 A440 I477	S421-I426 VanDerWaalsContact OG-CD1 3.25Å; S421-I426 WeakPolarHBondContact OG-CD1 3.48Å; L423-I426 HydrophobicContact CB-CD1 3.65Å; L423-I426 HydrophobicContact CB-CG1 3.5Å; L423-I426 VanDerWaalsContact CB-CG1 3.5Å; L423-I426 HydrophobicContact CD1-CD1 3.69Å; L423-I426 HydrophobicContact CD1-CG1 4.09Å; L423-I426 HydrophobicContact CG-CD1 4.19Å; L423-I426 HydrophobicContact CG-CG1 4.42Å; I426-E430 HydrophobicContact CG2-CB 3.9Å; I426-L431 HydrophobicContact CD1-CD2 4.49Å; I426-L431 HydrophobicContact CG2-CD1 4.44Å; I426-L431 HydrophobicContact CG2-CD2 4.12Å; I426-L431 HydrophobicContact CG2-CG 3.73Å; I426-A440 HydrophobicContact CD1-CB 4.23Å; I426-I477 HydrophobicContact CD1-CD1 4.36Å
427	S	69.1	Low	70.9	Confident	48 Å²	48	75.7 Å²	75.7	34%	0.336	39%	0.389	S	S	.	.			trans	-88.1	157.9	173.6	68.2	0	0	0	0	113	N425 I429 E430 L431	N425-S427 PolarHBondContact O-N 2.77Å; S427-I429 PolarHBondContact O-N 3.3Å; S427-E430 PolarHBondContact N-OE2 3.12Å; S427-E430 PolarHBondContact O-N 3.08Å; S427-E430 VanDerWaalsContact O-N 3.17Å; S427-E430 VanDerWaalsContact OG-CD 3.28Å; S427-E430 VanDerWaalsContact OG-CG 3.31Å; S427-E430 WeakPolarHBondContact OG-CG 3.4Å; S427-E430 PolarHBondContact OG-N 2.94Å; S427-E430 PolarHBondContact OG-OE2 2.68Å; S427-L431 PolarHBondContact O-N 2.91Å
428	Y	67.5	Low	69.6	Low	66 Å²	66	81.5 Å²	81.5	26%	0.259	42%	0.42	S	S	.	.	H	α-helix	trans	-56.5	-35.3	175.6	173	-101.4	0	0	0	112.8	V379 L431 K432 C489	V379-Y428 HydrophobicContact CG2-CE2 3.88Å; Y428-L431 PolarHBondContact O-N 3.34Å; Y428-K432 HydrophobicContact CE1-CD 4.36Å; Y428-K432 WeakPolarHBondContact O-CB 3.46Å; Y428-K432 PolarHBondContact O-N 3.45Å; Y428-C489 WeakPolarHBondContact CE2-O 3.42Å
429	I	64.7	Low	68	Low	133 Å²	133	88.9 Å²	88.9	68%	0.682	45%	0.454	S	S	*	.	H	α-helix	trans	-66.7	-42.6	179.6	-59.9	172.1	0	0	0	110.5	S427 K432 S433	S427-I429 PolarHBondContact O-N 3.3Å; I429-K432 PolarHBondContact O-N 2.79Å; I429-S433 PolarHBondContact O-N 2.94Å; I429-S433 PolarHBondContact O-OG 3.36Å
430	E	67.1	Low	66.5	Low	93 Å²	93	87.7 Å²	87.7	44%	0.435	45%	0.45	S	S	.	.	H	α-helix	trans	-66.8	-37.5	176.4	-71.7	163.6	152.7	0	0	112.2	I426 S427 K432 S433 M434	I426-E430 HydrophobicContact CG2-CB 3.9Å; S427-E430 PolarHBondContact N-OE2 3.12Å; S427-E430 PolarHBondContact O-N 3.08Å; S427-E430 VanDerWaalsContact O-N 3.17Å; S427-E430 VanDerWaalsContact OG-CD 3.28Å; S427-E430 VanDerWaalsContact OG-CG 3.31Å; S427-E430 WeakPolarHBondContact OG-CG 3.4Å; S427-E430 PolarHBondContact OG-N 2.94Å; S427-E430 PolarHBondContact OG-OE2 2.68Å; E430-K432 VanDerWaalsContact C-N 3.29Å; E430-K432 PolarHBondContact O-N 3.16Å; E430-S433 WeakPolarHBondContact CA-OG 3.48Å; E430-S433 PolarHBondContact O-N 2.9Å; E430-S433 PolarHBondContact O-OG 3.49Å; E430-S433 VanDerWaalsContact O-OG 3.13Å; E430-M434 WeakPolarHBondContact O-CE 3.22Å; E430-M434 PolarHBondContact O-N 3.09Å; E430-M434 VanDerWaalsContact O-N 3.16Å
431	L	70.1	Confident	65.7	Low	5 Å²	5	86.5 Å²	86.5	3%	0.026	44%	0.44	C	S	.	.	H	α-helix	trans	-62.9	-37.6	173.3	-77.5	168	0	0	0	112.1	I426 S427 Y428 L437 A440 I477 P491	I426-L431 HydrophobicContact CD1-CD2 4.49Å; I426-L431 HydrophobicContact CG2-CD1 4.44Å; I426-L431 HydrophobicContact CG2-CD2 4.12Å; I426-L431 HydrophobicContact CG2-CG 3.73Å; S427-L431 PolarHBondContact O-N 2.91Å; Y428-L431 PolarHBondContact O-N 3.34Å; L431-L437 HydrophobicContact CB-CD1 4.49Å; L431-L437 HydrophobicContact CD2-CD1 4.41Å; L431-L437 VanDerWaalsContact O-CD1 3.23Å; L431-L437 WeakPolarHBondContact O-CD1 3.04Å; L431-A440 HydrophobicContact CD2-CB 3.85Å; L431-I477 HydrophobicContact CD1-CD1 4.33Å; L431-I477 HydrophobicContact CD1-CG1 4.31Å; L431-I477 HydrophobicContact CD1-CG2 4.22Å; L431-I477 HydrophobicContact CD2-CD1 3.83Å; L431-P491 HydrophobicContact CD1-CB 3.76Å; L431-P491 HydrophobicContact CD1-CG 3.59Å
432	K	66.1	Low	65.3	Low	161 Å²	161	86.7 Å²	86.7	70%	0.7	45%	0.445	S	S	*	.	H	α-helix	trans	-76.6	-27.9	-179.3	-164.3	175	-179.3	-178.8	0	112.9	Y428 I429 E430	Y428-K432 HydrophobicContact CE1-CD 4.36Å; Y428-K432 WeakPolarHBondContact O-CB 3.46Å; Y428-K432 PolarHBondContact O-N 3.45Å; I429-K432 PolarHBondContact O-N 2.79Å; E430-K432 VanDerWaalsContact C-N 3.29Å; E430-K432 PolarHBondContact O-N 3.16Å
433	S	60.9	Low	65.6	Low	84 Å²	84	86.5 Å²	86.5	59%	0.587	44%	0.44	S	S	*	.	H	α-helix	trans	-84.2	-14.5	176.8	64.8	0	0	0	0	113.7	I429 E430 E435	I429-S433 PolarHBondContact O-N 2.94Å; I429-S433 PolarHBondContact O-OG 3.36Å; E430-S433 WeakPolarHBondContact CA-OG 3.48Å; E430-S433 PolarHBondContact O-N 2.9Å; E430-S433 PolarHBondContact O-OG 3.49Å; E430-S433 VanDerWaalsContact O-OG 3.13Å; S433-E435 PolarHBondContact O-N 2.84Å; S433-E435 VanDerWaalsContact O-N 3.17Å
434	M	57.8	Low	66.3	Low	68 Å²	68	86.3 Å²	86.3	34%	0.335	44%	0.436	S	S	.	.			trans	-73	104.2	178.8	-133.7	83.6	74.1	0	0	110.5	E430 N436 L437 A440	E430-M434 WeakPolarHBondContact O-CE 3.22Å; E430-M434 PolarHBondContact O-N 3.09Å; E430-M434 VanDerWaalsContact O-N 3.16Å; M434-N436 PolarHBondContact O-N 2.92Å; M434-N436 VanDerWaalsContact O-N 3.12Å; M434-L437 PolarHBondContact O-N 3.03Å; M434-A440 HydrophobicContact CE-CB 3.98Å
435	E	55.9	Low	67.2	Low	196 Å²	196	79.2 Å²	79.2	92%	0.916	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.8	177.2	-80.1	-177	153.8	0	0	112.8	S433	S433-E435 PolarHBondContact O-N 2.84Å; S433-E435 VanDerWaalsContact O-N 3.17Å
436	N	53.5	Low	68.2	Low	106 Å²	106	78.1 Å²	78.1	57%	0.567	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	76.9	174.3	-77.6	-39.4	0	0	0	111	M434 N438 Q439	M434-N436 PolarHBondContact O-N 2.92Å; M434-N436 VanDerWaalsContact O-N 3.12Å; N436-N438 PolarHBondContact O-N 3.41Å; N436-Q439 PolarHBondContact O-N 3.05Å
437	L	57.8	Low	68.8	Low	49 Å²	49	83.9 Å²	83.9	26%	0.257	42%	0.421	S	S	.	.	H	α-helix	trans	-45.6	-34.5	175.8	-161.9	74.2	0	0	0	112.6	L431 M434 Q439 A440 I441	L431-L437 HydrophobicContact CB-CD1 4.49Å; L431-L437 HydrophobicContact CD2-CD1 4.41Å; L431-L437 VanDerWaalsContact O-CD1 3.23Å; L431-L437 WeakPolarHBondContact O-CD1 3.04Å; M434-L437 PolarHBondContact O-N 3.03Å; L437-Q439 VanDerWaalsContact C-N 3.26Å; L437-Q439 PolarHBondContact O-N 2.95Å; L437-A440 PolarHBondContact O-N 3.49Å; L437-A440 VanDerWaalsContact O-N 3.1Å; L437-I441 HydrophobicContact CB-CD1 4.05Å; L437-I441 HydrophobicContact CD2-CD1 3.66Å; L437-I441 HydrophobicContact CD2-CG1 4.48Å; L437-I441 HydrophobicContact CG-CD1 3.46Å; L437-I441 VanDerWaalsContact CG-CD1 3.46Å; L437-I441 HydrophobicContact CG-CG1 3.96Å; L437-I441 VanDerWaalsContact O-CD1 3.31Å; L437-I441 WeakPolarHBondContact O-CD1 3.36Å; L437-I441 WeakPolarHBondContact O-CG1 3.5Å; L437-I441 PolarHBondContact O-N 2.91Å; L437-I441 VanDerWaalsContact O-N 3.11Å
438	N	62.7	Low	69.5	Low	135 Å²	135	84.3 Å²	84.3	72%	0.722	42%	0.419	S	S	*	.	H	α-helix	trans	-60.1	-26.1	179.7	-66.8	-20.5	0	0	0	114.7	N436	N436-N438 PolarHBondContact O-N 3.41Å
439	Q	58.4	Low	70	Confident	156 Å²	156	88 Å²	88	73%	0.729	44%	0.442	S	S	*	.	H	α-helix	trans	-75.1	-31.6	176.1	-108.4	175.5	-8.4	0	0	112.5	N436 L437	N436-Q439 PolarHBondContact O-N 3.05Å; L437-Q439 VanDerWaalsContact C-N 3.26Å; L437-Q439 PolarHBondContact O-N 2.95Å
440	A	59.4	Low	70.7	Confident	2 Å²	2	90.9 Å²	90.9	2%	0.017	45%	0.45	C	S	.	.	H	α-helix	trans	-86.1	-30.3	-178	0	0	0	0	0	113	I426 L431 M434 L437 G442	I426-A440 HydrophobicContact CD1-CB 4.23Å; L431-A440 HydrophobicContact CD2-CB 3.85Å; M434-A440 HydrophobicContact CE-CB 3.98Å; L437-A440 PolarHBondContact O-N 3.49Å; L437-A440 VanDerWaalsContact O-N 3.1Å; A440-G442 PolarHBondContact O-N 3.38Å
441	I	70.5	Confident	71.7	Confident	6 Å²	6	90.1 Å²	90.1	3%	0.031	45%	0.445	C	S	.	.	H	α-helix	trans	-63.6	-33.4	-170.9	-75.1	162.2	0	0	0	113.2	Y419 L437 R487	Y419-I441 WeakPolarHBondContact CB-O 3.47Å; Y419-I441 HydrophobicContact CD1-CG2 3.1Å; Y419-I441 HydrophobicContact CD2-CG2 3.54Å; Y419-I441 HydrophobicContact CE1-CG2 3.46Å; Y419-I441 VanDerWaalsContact CE1-CG2 3.46Å; Y419-I441 HydrophobicContact CE2-CG2 3.89Å; Y419-I441 HydrophobicContact CG-CG2 3.15Å; L437-I441 HydrophobicContact CB-CD1 4.05Å; L437-I441 HydrophobicContact CD2-CD1 3.66Å; L437-I441 HydrophobicContact CD2-CG1 4.48Å; L437-I441 HydrophobicContact CG-CD1 3.46Å; L437-I441 VanDerWaalsContact CG-CD1 3.46Å; L437-I441 HydrophobicContact CG-CG1 3.96Å; L437-I441 VanDerWaalsContact O-CD1 3.31Å; L437-I441 WeakPolarHBondContact O-CD1 3.36Å; L437-I441 WeakPolarHBondContact O-CG1 3.5Å; L437-I441 PolarHBondContact O-N 2.91Å; L437-I441 VanDerWaalsContact O-N 3.11Å; I441-R487 VanDerWaalsContact CD1-CZ 3.46Å
442	G	74.9	Confident	72.7	Confident	24 Å²	24	92 Å²	92	25%	0.247	45%	0.452	C	S	.	.			trans	72.5	-156.3	178.8	0	0	0	0	0	114.9	A420 A440	A420-G442 CarbonylContact O-C 3.55Å; A420-G442 VanDerWaalsContact O-CA 3.26Å; A420-G442 WeakPolarHBondContact O-CA 3.37Å; A440-G442 PolarHBondContact O-N 3.38Å
443	E	82.5	Confident	74	Confident	118 Å²	118	84.5 Å²	84.5	55%	0.551	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	131.2	-174	-167.1	-169	159.8	0	0	111.7	Y419 A420 I445 K451	Y419-E443 CarbonylContact C-O 3.58Å; Y419-E443 VanDerWaalsContact CA-O 3.27Å; Y419-E443 WeakPolarHBondContact CA-O 3.24Å; A420-E443 PolarHBondContact N-O 3.16Å; A420-E443 PolarHBondContact O-N 3.24Å; E443-I445 PolarHBondContact O-N 3.09Å; E443-K451 IonicContact OE1-NZ 2.9Å; E443-K451 PolarHBondContact OE1-NZ 2.82Å; E443-K451 IonicContact OE2-NZ 3.18Å
444	E	85.7	Confident	75.4	Confident	90 Å²	90	80.8 Å²	80.8	42%	0.421	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	128.5	174.3	-170.1	-179.1	171.1	0	0	111.4	Y419 T446	Y419-E444 VanDerWaalsContact CD1-CA 3.49Å; Y419-E444 HydrophobicContact CD1-CB 3.76Å; Y419-E444 HydrophobicContact CD1-CG 4.18Å; Y419-E444 HydrophobicContact CE1-CB 3.72Å; Y419-E444 HydrophobicContact CE1-CG 3.9Å; E444-T446 HydrophobicContact CG-CG2 4.49Å; E444-T446 PolarHBondContact O-N 3.39Å
445	I	87.9	Confident	77.1	Confident	11 Å²	11	77.5 Å²	77.5	6%	0.056	38%	0.378	C	S	.	.			trans	-92.5	99.9	177.6	-55.6	-179.5	0	0	0	108.6	L418 A420 E443 V453 F455 F476	L418-I445 HydrophobicContact CB-CB 4.39Å; L418-I445 HydrophobicContact CD2-CB 4.25Å; L418-I445 HydrophobicContact CD2-CD1 3.94Å; L418-I445 HydrophobicContact CD2-CG2 4.34Å; L418-I445 HydrophobicContact CG-CB 4.35Å; L418-I445 HydrophobicContact CG-CD1 4.09Å; L418-I445 PolarHBondContact O-N 2.94Å; A420-I445 HydrophobicContact CB-CD1 4.02Å; A420-I445 HydrophobicContact CB-CG1 4.26Å; E443-I445 PolarHBondContact O-N 3.09Å; I445-V453 HydrophobicContact CD1-CB 4.38Å; I445-V453 HydrophobicContact CD1-CG1 4.08Å; I445-V453 HydrophobicContact CG2-CB 4.44Å; I445-V453 HydrophobicContact CG2-CG1 4.14Å; I445-V453 WeakPolarHBondContact CG2-O 3.49Å; I445-F455 HydrophobicContact CG2-CB 4.32Å; I445-F476 HydrophobicContact CD1-CD1 3.39Å; I445-F476 HydrophobicContact CD1-CE1 3.33Å
446	T	87.8	Confident	78.8	Confident	74 Å²	74	68.2 Å²	68.2	45%	0.454	33%	0.334	S	S	.	.			trans	-84	174.2	175.5	59.6	0	0	0	0	112.2	E444 D448	E444-T446 HydrophobicContact CG-CG2 4.49Å; E444-T446 PolarHBondContact O-N 3.39Å; T446-D448 PolarHBondContact O-N 3.4Å
447	R	84.7	Confident	80.4	Confident	137 Å²	137	66.5 Å²	66.5	52%	0.517	33%	0.327	S	S	.	.	S	Bend	trans	-72.6	69.1	173.7	-166.7	176.9	171.7	173	-9.5	112	S454 F455 D456	R447-S454 WeakPolarHBondContact CA-OG 3.41Å; R447-F455 WeakPolarHBondContact CA-O 3.1Å; R447-F455 WeakPolarHBondContact CB-O 3.4Å; R447-F455 PolarHBondContact N-O 3.08Å; R447-D456 IonicContact CZ-OD1 2.75Å; R447-D456 IonicContact CZ-OD2 3.24Å; R447-D456 IonicContact NE-OD1 3.44Å; R447-D456 IonicContact NE-OD2 3.68Å; R447-D456 VanDerWaalsContact NH1-CG 3.33Å; R447-D456 IonicContact NH1-OD1 2.76Å; R447-D456 PolarHBondContact NH1-OD1 3.21Å; R447-D456 IonicContact NH1-OD2 3.36Å; R447-D456 PolarHBondContact NH1-OD2 2.82Å; R447-D456 IonicContact NH2-OD2 2.61Å
448	D	83.9	Confident	81.7	Confident	56 Å²	56	72.6 Å²	72.6	30%	0.299	35%	0.352	S	S	.	.			trans	-104.1	116.7	171.2	-172.1	-3.5	0	0	0	110.9	T446 K450 K451 S454	T446-D448 PolarHBondContact O-N 3.4Å; D448-K450 PolarHBondContact O-N 3.28Å; D448-K450 WeakPolarHBondContact OD1-CB 3.36Å; D448-K450 PolarHBondContact OD1-N 3.15Å; D448-K451 HydrophobicContact CB-CG 4.31Å; D448-K451 PolarHBondContact O-N 3.24Å; D448-S454 PolarHBondContact N-OG 3.42Å; D448-S454 VanDerWaalsContact O-CB 3.27Å; D448-S454 WeakPolarHBondContact O-CB 3.47Å; D448-S454 PolarHBondContact O-OG 2.88Å
449	I	77.4	Confident	82.9	Confident	145 Å²	145	69.7 Å²	69.7	74%	0.744	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-15.7	180	-56.5	163.7	0	0	0	111.4
450	K	80	Confident	84.4	Confident	193 Å²	193	62.8 Å²	62.8	84%	0.839	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-25.5	179.1	-63.4	-179.4	179.9	177.7	0	113.5	D448	D448-K450 PolarHBondContact O-N 3.28Å; D448-K450 WeakPolarHBondContact OD1-CB 3.36Å; D448-K450 PolarHBondContact OD1-N 3.15Å
451	K	88.2	Confident	85.9	Confident	77 Å²	77	64.2 Å²	64.2	34%	0.335	31%	0.311	S	S	.	.	S	Bend	trans	-79.3	154.6	177.9	-69.5	-165.4	176.7	-171	0	111	E443 D448 V453	E443-K451 IonicContact OE1-NZ 2.9Å; E443-K451 PolarHBondContact OE1-NZ 2.82Å; E443-K451 IonicContact OE2-NZ 3.18Å; D448-K451 HydrophobicContact CB-CG 4.31Å; D448-K451 PolarHBondContact O-N 3.24Å; K451-V453 WeakPolarHBondContact CB-O 3.23Å
452	W	90.8	Very high	87	Confident	43 Å²	43	64 Å²	64	16%	0.163	31%	0.31	C	S	.	.	S	Bend	trans	-73.5	-29.8	-179.5	79.3	-86.8	0	0	0	112.8	L464 K465 P466 H470 H474 F476 I494 V496	W452-L464 HydrophobicContact CZ3-CD2 4.35Å; W452-L464 CarbonylContact O-C 3.57Å; W452-L464 WeakPolarHBondContact O-CA 3.45Å; W452-K465 WeakPolarHBondContact CB-O 3.37Å; W452-K465 PolarHBondContact O-N 2.83Å; W452-P466 HydrophobicContact CE3-CB 4.33Å; W452-H470 AromaticContact CD1-CD2 3.15Å; W452-H470 AromaticContact CD1-CE1 3.82Å; W452-H470 AromaticContact CD1-NE2 2.98Å; W452-H470 HydrophobicContact CD2-CB 4.3Å; W452-H470 AromaticContact CD2-CD2 3.61Å; W452-H470 AromaticContact CD2-CG 3.84Å; W452-H470 AromaticContact CE2-CD2 3.48Å; W452-H470 VanDerWaalsContact CE2-CD2 3.48Å; W452-H470 HydrophobicContact CE3-CB 4.46Å; W452-H470 AromaticContact CG-CD2 3.37Å; W452-H470 AromaticContact CG-CE1 3.73Å; W452-H470 AromaticContact CG-CG 3.79Å; W452-H470 AromaticContact CG-NE2 3.31Å; W452-H470 VanDerWaalsContact CG-NE2 3.31Å; W452-H470 AromaticContact NE1-CD2 3.2Å; W452-H470 PolarHBondContact NE1-CD2 2.93Å; W452-H470 AromaticContact NE1-NE2 3.54Å; W452-H474 HydrophobicContact CH2-CB 4.11Å; W452-H474 AromaticContact CH2-CD2 3.8Å; W452-H474 AromaticContact CH2-CG 3.8Å; W452-H474 HydrophobicContact CZ2-CB 4.22Å; W452-H474 AromaticContact CZ2-CG 3.75Å; W452-H474 AromaticContact CZ2-ND1 3.77Å; W452-F476 HydrophobicContact CH2-CE2 4.04Å; W452-F476 AromaticContact CH2-CZ 3.81Å; W452-F476 HydrophobicContact CH2-CZ 3.81Å; W452-F476 HydrophobicContact CZ2-CE2 4.31Å; W452-F476 AromaticContact CZ2-CZ 3.68Å; W452-F476 HydrophobicContact CZ2-CZ 3.68Å; W452-I494 HydrophobicContact CZ3-CG2 4.48Å; W452-V496 HydrophobicContact CH2-CG2 4.27Å; W452-V496 HydrophobicContact CZ3-CG2 4.02Å
453	V	92.3	Very high	87.8	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.024	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.1	163.4	-172.5	0	0	0	0	108.2	L418 I445 K451 I462 R463 L464 F476	L418-V453 HydrophobicContact CD2-CG1 4.16Å; I445-V453 HydrophobicContact CD1-CB 4.38Å; I445-V453 HydrophobicContact CD1-CG1 4.08Å; I445-V453 HydrophobicContact CG2-CB 4.44Å; I445-V453 HydrophobicContact CG2-CG1 4.14Å; I445-V453 WeakPolarHBondContact CG2-O 3.49Å; K451-V453 WeakPolarHBondContact CB-O 3.23Å; V453-I462 HydrophobicContact CG1-CG2 3.93Å; V453-R463 WeakPolarHBondContact CA-O 3.3Å; V453-L464 HydrophobicContact CB-CD2 4.32Å; V453-L464 HydrophobicContact CG1-CD2 3.99Å; V453-L464 HydrophobicContact CG2-CD2 3.76Å; V453-F476 HydrophobicContact CB-CE1 4.42Å; V453-F476 HydrophobicContact CB-CZ 4.45Å; V453-F476 HydrophobicContact CG1-CE1 4.39Å; V453-F476 HydrophobicContact CG2-CE1 4.06Å; V453-F476 HydrophobicContact CG2-CE2 4.41Å; V453-F476 HydrophobicContact CG2-CZ 3.62Å
454	S	91.8	Very high	88.4	Confident	6 Å²	6	60.6 Å²	60.6	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.1	172.7	-173.6	0	0	0	0	108.9	R447 D448 R463	R447-S454 WeakPolarHBondContact CA-OG 3.41Å; D448-S454 PolarHBondContact N-OG 3.42Å; D448-S454 VanDerWaalsContact O-CB 3.27Å; D448-S454 WeakPolarHBondContact O-CB 3.47Å; D448-S454 PolarHBondContact O-OG 2.88Å; S454-R463 PolarHBondContact N-O 2.79Å; S454-R463 PolarHBondContact O-N 2.79Å
455	F	93.8	Very high	88.6	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123.4	178.7	-174.4	-125.6	0	0	0	111	I398 L416 L418 I445 R447 T457 I462	I398-F455 HydrophobicContact CD1-CD2 4.46Å; I398-F455 HydrophobicContact CD1-CE2 3.41Å; I398-F455 VanDerWaalsContact CD1-CE2 3.41Å; I398-F455 HydrophobicContact CD1-CZ 3.69Å; I398-F455 HydrophobicContact CG1-CE2 4.33Å; L416-F455 HydrophobicContact CB-CE1 3.83Å; L416-F455 HydrophobicContact CB-CZ 3.72Å; L416-F455 HydrophobicContact CD1-CZ 4.11Å; L418-F455 HydrophobicContact CB-CB 3.93Å; L418-F455 HydrophobicContact CB-CD1 3.62Å; L418-F455 HydrophobicContact CB-CD2 4.34Å; L418-F455 HydrophobicContact CB-CE1 4.21Å; L418-F455 HydrophobicContact CB-CG 3.7Å; L418-F455 HydrophobicContact CD2-CB 3.82Å; L418-F455 HydrophobicContact CD2-CD2 4.27Å; L418-F455 HydrophobicContact CD2-CG 4.07Å; I445-F455 HydrophobicContact CG2-CB 4.32Å; R447-F455 WeakPolarHBondContact CA-O 3.1Å; R447-F455 WeakPolarHBondContact CB-O 3.4Å; R447-F455 PolarHBondContact N-O 3.08Å; F455-T457 HydrophobicContact CD1-CG2 3.56Å; F455-T457 HydrophobicContact CE1-CG2 3.65Å; F455-T457 PolarHBondContact O-N 3.19Å; F455-I462 HydrophobicContact CD2-CG1 3.81Å; F455-I462 HydrophobicContact CE2-CG1 4.11Å
456	D	90.1	Very high	88.7	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	87.2	173.5	-161.4	-8.6	0	0	0	109.4	R447 K458 N459 Q460 I461 R463	R447-D456 IonicContact CZ-OD1 2.75Å; R447-D456 IonicContact CZ-OD2 3.24Å; R447-D456 IonicContact NE-OD1 3.44Å; R447-D456 IonicContact NE-OD2 3.68Å; R447-D456 VanDerWaalsContact NH1-CG 3.33Å; R447-D456 IonicContact NH1-OD1 2.76Å; R447-D456 PolarHBondContact NH1-OD1 3.21Å; R447-D456 IonicContact NH1-OD2 3.36Å; R447-D456 PolarHBondContact NH1-OD2 2.82Å; R447-D456 IonicContact NH2-OD2 2.61Å; D456-K458 PolarHBondContact O-N 2.82Å; D456-K458 VanDerWaalsContact O-N 3.1Å; D456-N459 HydrophobicContact CB-CB 4.36Å; D456-N459 CarbonylContact O-C 3.56Å; D456-N459 PolarHBondContact O-N 2.98Å; D456-N459 PolarHBondContact OD2-ND2 2.74Å; D456-Q460 WeakPolarHBondContact O-CA 3.34Å; D456-Q460 PolarHBondContact O-N 2.79Å; D456-I461 HydrophobicContact CB-CB 4.46Å; D456-I461 PolarHBondContact N-O 2.96Å; D456-I461 PolarHBondContact O-N 2.82Å; D456-R463 VanDerWaalsContact CB-NH1 3.29Å; D456-R463 IonicContact OD2-CZ 3.82Å; D456-R463 IonicContact OD2-NH1 2.85Å; D456-R463 PolarHBondContact OD2-NH1 2.84Å; D456-R463 IonicContact OD2-NH2 3.64Å; D456-R463 PolarHBondContact OD2-NH2 3.18Å
457	T	86.9	Confident	88.7	Confident	69 Å²	69	60.4 Å²	60.4	42%	0.423	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-35.2	-178.8	54.9	0	0	0	0	112.5	L416 F455	L416-T457 WeakPolarHBondContact O-CG2 3.27Å; F455-T457 HydrophobicContact CD1-CG2 3.56Å; F455-T457 HydrophobicContact CE1-CG2 3.65Å; F455-T457 PolarHBondContact O-N 3.19Å
458	K	85.1	Confident	88.5	Confident	178 Å²	178	55.5 Å²	55.5	77%	0.774	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-40.8	179	-175.5	176.7	179.5	179.3	0	113.2	D456	D456-K458 PolarHBondContact O-N 2.82Å; D456-K458 VanDerWaalsContact O-N 3.1Å
459	N	88.5	Confident	88.5	Confident	73 Å²	73	58.6 Å²	58.6	39%	0.39	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-6.3	-176.6	-63.4	-47.1	0	0	0	112.6	Q397 D456 I461	Q397-N459 PolarHBondContact NE2-O 3.2Å; Q397-N459 PolarHBondContact OE1-O 3.19Å; D456-N459 HydrophobicContact CB-CB 4.36Å; D456-N459 CarbonylContact O-C 3.56Å; D456-N459 PolarHBondContact O-N 2.98Å; D456-N459 PolarHBondContact OD2-ND2 2.74Å; N459-I461 HydrophobicContact CB-CD1 3.84Å; N459-I461 HydrophobicContact CB-CG1 4.07Å; N459-I461 PolarHBondContact O-N 3.14Å
460	Q	89.9	Confident	89.1	Confident	12 Å²	12	53.1 Å²	53.1	6%	0.056	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	36.5	-174.4	-52.5	-174.8	-13.1	0	0	113.4	Q397 I398 T411 Q412 L414 L416 D456	Q397-Q460 PolarHBondContact NE2-O 2.91Å; I398-Q460 PolarHBondContact N-O 3.41Å; T411-Q460 PolarHBondContact O-NE2 3.26Å; Q412-Q460 VanDerWaalsContact CA-NE2 3.29Å; Q412-Q460 PolarHBondContact O-NE2 3.21Å; L414-Q460 PolarHBondContact O-NE2 2.84Å; L416-Q460 HydrophobicContact CD1-CB 4.08Å; L416-Q460 HydrophobicContact CD1-CG 3.81Å; L416-Q460 HydrophobicContact CG-CG 4.42Å; D456-Q460 WeakPolarHBondContact O-CA 3.34Å; D456-Q460 PolarHBondContact O-N 2.79Å
461	I	91.2	Very high	89.4	Confident	31 Å²	31	46.5 Å²	46.5	16%	0.159	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.5	179	-64.5	168.6	0	0	0	108.9	N395 I396 D456 N459 R463	N395-I461 HydrophobicContact CB-CG2 3.77Å; I396-I461 WeakPolarHBondContact O-CA 3.4Å; D456-I461 HydrophobicContact CB-CB 4.46Å; D456-I461 PolarHBondContact N-O 2.96Å; D456-I461 PolarHBondContact O-N 2.82Å; N459-I461 HydrophobicContact CB-CD1 3.84Å; N459-I461 HydrophobicContact CB-CG1 4.07Å; N459-I461 PolarHBondContact O-N 3.14Å; I461-R463 HydrophobicContact CG2-CG 3.95Å
462	I	93.3	Very high	89.4	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	119.1	164.9	-55.3	169.5	0	0	0	107.4	I396 I398 L418 V453 F455 L464 F492	I396-I462 HydrophobicContact CB-CB 4.43Å; I396-I462 PolarHBondContact N-O 2.81Å; I396-I462 PolarHBondContact O-N 3.41Å; I398-I462 HydrophobicContact CD1-CD1 4.19Å; I398-I462 HydrophobicContact CD1-CG1 4.23Å; I398-I462 HydrophobicContact CG1-CD1 3.92Å; I398-I462 HydrophobicContact CG1-CG1 4.08Å; L418-I462 HydrophobicContact CD2-CG1 4.26Å; L418-I462 HydrophobicContact CD2-CG2 4.44Å; V453-I462 HydrophobicContact CG1-CG2 3.93Å; F455-I462 HydrophobicContact CD2-CG1 3.81Å; F455-I462 HydrophobicContact CE2-CG1 4.11Å; I462-L464 HydrophobicContact CG2-CD2 3.74Å; I462-L464 HydrophobicContact CG2-CG 4.25Å; I462-F492 HydrophobicContact CD1-CE2 4.11Å; I462-F492 HydrophobicContact CD1-CZ 3.62Å
463	R	92.9	Very high	89.3	Confident	71 Å²	71	46.4 Å²	46.4	27%	0.268	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	120.8	175.2	-58.4	-163.8	173.3	91.4	7.1	109	N395 V453 S454 D456 I461	N395-R463 WeakPolarHBondContact OD1-CG 3.48Å; V453-R463 WeakPolarHBondContact CA-O 3.3Å; S454-R463 PolarHBondContact N-O 2.79Å; S454-R463 PolarHBondContact O-N 2.79Å; D456-R463 VanDerWaalsContact CB-NH1 3.29Å; D456-R463 IonicContact OD2-CZ 3.82Å; D456-R463 IonicContact OD2-NH1 2.85Å; D456-R463 PolarHBondContact OD2-NH1 2.84Å; D456-R463 IonicContact OD2-NH2 3.64Å; D456-R463 PolarHBondContact OD2-NH2 3.18Å; I461-R463 HydrophobicContact CG2-CG 3.95Å
464	L	93.4	Very high	89.2	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.6	177.6	-56.2	-178.8	0	0	0	110	I386 T388 I393 S394 I396 W452 V453 I462 I494	I386-L464 HydrophobicContact CG2-CD1 3.92Å; T388-L464 HydrophobicContact CG2-CD1 4.21Å; I393-L464 VanDerWaalsContact CA-O 3.31Å; I393-L464 WeakPolarHBondContact CA-O 3.39Å; S394-L464 PolarHBondContact N-O 2.8Å; S394-L464 VanDerWaalsContact N-O 3.1Å; S394-L464 PolarHBondContact O-N 3.46Å; I396-L464 HydrophobicContact CD1-CD1 3.57Å; I396-L464 HydrophobicContact CD1-CG 4.36Å; W452-L464 HydrophobicContact CZ3-CD2 4.35Å; W452-L464 CarbonylContact O-C 3.57Å; W452-L464 WeakPolarHBondContact O-CA 3.45Å; V453-L464 HydrophobicContact CB-CD2 4.32Å; V453-L464 HydrophobicContact CG1-CD2 3.99Å; V453-L464 HydrophobicContact CG2-CD2 3.76Å; I462-L464 HydrophobicContact CG2-CD2 3.74Å; I462-L464 HydrophobicContact CG2-CG 4.25Å; L464-I494 HydrophobicContact CD1-CD1 4.1Å; L464-I494 HydrophobicContact CD1-CG2 3.95Å; L464-I494 HydrophobicContact CD2-CD1 3.61Å; L464-I494 HydrophobicContact CG-CD1 4.49Å
465	K	89.9	Confident	89	Confident	112 Å²	112	49.1 Å²	49.1	49%	0.487	25%	0.253	S	S	.	.			trans	-134.8	65	171.4	-171.5	-173.2	174.2	-176.4	0	108.6	I393 W452 L467	I393-K465 HydrophobicContact CG1-CG 4.48Å; W452-K465 WeakPolarHBondContact CB-O 3.37Å; W452-K465 PolarHBondContact O-N 2.83Å; K465-L467 PolarHBondContact O-N 2.86Å
466	P	91.6	Very high	88.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.			trans	-63.3	132.1	-176.2	27.7	-34.8	0	0	0	110.5	T388 T389 Y391 Q392 W452 V496	T388-P466 HydrophobicContact CG2-CG 4.07Å; T389-P466 WeakPolarHBondContact O-CG 3.48Å; Y391-P466 PolarHBondContact N-O 3.36Å; Q392-P466 WeakPolarHBondContact O-CD 3.48Å; W452-P466 HydrophobicContact CE3-CB 4.33Å; P466-V496 HydrophobicContact CB-CG1 3.69Å; P466-V496 HydrophobicContact CB-CG2 4.12Å; P466-V496 HydrophobicContact CG-CG1 4.49Å
467	L	87.3	Confident	88.9	Confident	59 Å²	59	49.3 Å²	49.3	31%	0.309	25%	0.254	S	S	.	.			trans	-106.9	166.2	172.9	-64.5	170.6	0	0	0	109.7	Y391 K465 D469 H470	Y391-L467 HydrophobicContact CD1-CD2 4.21Å; Y391-L467 HydrophobicContact CE1-CD2 3.53Å; K465-L467 PolarHBondContact O-N 2.86Å; L467-D469 VanDerWaalsContact C-OD1 3.25Å; L467-D469 WeakPolarHBondContact CB-OD1 3.48Å; L467-D469 PolarHBondContact O-N 2.77Å; L467-D469 VanDerWaalsContact O-N 3.17Å; L467-H470 WeakPolarHBondContact CB-ND1 3.31Å; L467-H470 PolarHBondContact N-ND1 3.24Å; L467-H470 VanDerWaalsContact N-ND1 3.17Å; L467-H470 WeakPolarHBondContact O-CB 3.29Å; L467-H470 PolarHBondContact O-N 2.82Å; L467-H470 PolarHBondContact O-ND1 2.74Å
468	P	80.6	Confident	89.2	Confident	34 Å²	34	46 Å²	46	22%	0.221	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-53.6	-33.2	-175.4	-32	37.5	0	0	0	116.1	V390 Y391 H470 V471 A579	V390-P468 HydrophobicContact CG1-CG 3.95Å; Y391-P468 HydrophobicContact CE2-CG 3.9Å; Y391-P468 VanDerWaalsContact OH-CD 3.25Å; Y391-P468 WeakPolarHBondContact OH-CD 3.2Å; Y391-P468 WeakPolarHBondContact OH-CG 3.39Å; P468-H470 PolarHBondContact O-N 2.75Å; P468-V471 VanDerWaalsContact O-CG2 3.32Å; P468-V471 WeakPolarHBondContact O-CG2 3.37Å; P468-V471 PolarHBondContact O-N 2.88Å; P468-A579 HydrophobicContact CB-CB 3.88Å; P468-A579 HydrophobicContact CG-CB 3.89Å
469	D	84.6	Confident	89.4	Confident	121 Å²	121	37.6 Å²	37.6	65%	0.647	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-66.3	-16.8	174.4	54.1	-23.2	0	0	0	113.8	L467	L467-D469 VanDerWaalsContact C-OD1 3.25Å; L467-D469 WeakPolarHBondContact CB-OD1 3.48Å; L467-D469 PolarHBondContact O-N 2.77Å; L467-D469 VanDerWaalsContact O-N 3.17Å
470	H	88.8	Confident	89.5	Confident	30 Å²	30	34.1 Å²	34.1	14%	0.139	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-96.8	9.6	-179.9	-52.5	93.5	0	0	0	113.3	W452 L467 P468 G472 H474 V496	W452-H470 AromaticContact CD1-CD2 3.15Å; W452-H470 AromaticContact CD1-CE1 3.82Å; W452-H470 AromaticContact CD1-NE2 2.98Å; W452-H470 HydrophobicContact CD2-CB 4.3Å; W452-H470 AromaticContact CD2-CD2 3.61Å; W452-H470 AromaticContact CD2-CG 3.84Å; W452-H470 AromaticContact CE2-CD2 3.48Å; W452-H470 VanDerWaalsContact CE2-CD2 3.48Å; W452-H470 HydrophobicContact CE3-CB 4.46Å; W452-H470 AromaticContact CG-CD2 3.37Å; W452-H470 AromaticContact CG-CE1 3.73Å; W452-H470 AromaticContact CG-CG 3.79Å; W452-H470 AromaticContact CG-NE2 3.31Å; W452-H470 VanDerWaalsContact CG-NE2 3.31Å; W452-H470 AromaticContact NE1-CD2 3.2Å; W452-H470 PolarHBondContact NE1-CD2 2.93Å; W452-H470 AromaticContact NE1-NE2 3.54Å; L467-H470 WeakPolarHBondContact CB-ND1 3.31Å; L467-H470 PolarHBondContact N-ND1 3.24Å; L467-H470 VanDerWaalsContact N-ND1 3.17Å; L467-H470 WeakPolarHBondContact O-CB 3.29Å; L467-H470 PolarHBondContact O-N 2.82Å; L467-H470 PolarHBondContact O-ND1 2.74Å; P468-H470 PolarHBondContact O-N 2.75Å; H470-G472 PolarHBondContact O-N 3.21Å; H470-H474 PolarHBondContact O-NE2 2.86Å; H470-V496 VanDerWaalsContact O-CB 3.23Å; H470-V496 WeakPolarHBondContact O-CB 3.23Å
471	V	86.1	Confident	89.5	Confident	54 Å²	54	34.8 Å²	34.8	33%	0.327	18%	0.183	S	C	.	.			trans	-64	126.1	176.4	172.4	0	0	0	0	109.8	V390 P468 R498	V390-V471 HydrophobicContact CG2-CG2 3.43Å; V390-V471 VanDerWaalsContact CG2-CG2 3.43Å; P468-V471 VanDerWaalsContact O-CG2 3.32Å; P468-V471 WeakPolarHBondContact O-CG2 3.37Å; P468-V471 PolarHBondContact O-N 2.88Å; V471-R498 HydrophobicContact CG1-CG 4.08Å; V471-R498 HydrophobicContact CG2-CG 3.77Å
472	G	87.7	Confident	89.3	Confident	28 Å²	28	33.9 Å²	33.9	29%	0.289	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	143	-171.4	-176.5	0	0	0	0	0	113.3	H470 V496	H470-G472 PolarHBondContact O-N 3.21Å; G472-V496 PolarHBondContact N-O 2.86Å; G472-V496 PolarHBondContact O-N 2.9Å
473	N	89.3	Confident	88.7	Confident	90 Å²	90	43.1 Å²	43.1	48%	0.481	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.8	176.2	-65.3	-7.8	0	0	0	109.1
474	H	89.8	Confident	88.1	Confident	52 Å²	52	44.1 Å²	44.1	24%	0.241	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.4	-179.8	-60.4	-89.1	0	0	0	109.4	W452 H470 F476 Q493 I494	W452-H474 HydrophobicContact CH2-CB 4.11Å; W452-H474 AromaticContact CH2-CD2 3.8Å; W452-H474 AromaticContact CH2-CG 3.8Å; W452-H474 HydrophobicContact CZ2-CB 4.22Å; W452-H474 AromaticContact CZ2-CG 3.75Å; W452-H474 AromaticContact CZ2-ND1 3.77Å; H470-H474 PolarHBondContact O-NE2 2.86Å; H474-F476 HydrophobicContact CB-CD2 4.3Å; H474-F476 HydrophobicContact CB-CE2 3.45Å; H474-F476 VanDerWaalsContact CB-CE2 3.45Å; H474-F476 HydrophobicContact CB-CZ 3.95Å; H474-Q493 WeakPolarHBondContact O-CA 3.37Å; H474-I494 PolarHBondContact N-O 2.76Å; H474-I494 PolarHBondContact O-N 2.82Å
475	T	89.2	Confident	87.4	Confident	14 Å²	14	52.3 Å²	52.3	9%	0.086	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.5	179.9	-54.7	0	0	0	0	109.7	S421 N425	S421-T475 VanDerWaalsContact CB-O 3.31Å; S421-T475 WeakPolarHBondContact CB-O 3.42Å; S421-T475 PolarHBondContact N-O 2.8Å; S421-T475 VanDerWaalsContact N-O 3.09Å; N425-T475 PolarHBondContact N-OG1 3.44Å
476	F	91.3	Very high	87	Confident	6 Å²	6	49.9 Å²	49.9	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	153.2	178.2	-65.3	-83.5	0	0	0	110.2	L418 Y419 A420 I445 W452 V453 H474 P491 F492 I494	L418-F476 HydrophobicContact CD1-CB 4.25Å; Y419-F476 WeakPolarHBondContact O-CA 3.26Å; A420-F476 HydrophobicContact CB-CD1 4.3Å; A420-F476 HydrophobicContact CB-CE1 4.1Å; I445-F476 HydrophobicContact CD1-CD1 3.39Å; I445-F476 HydrophobicContact CD1-CE1 3.33Å; W452-F476 HydrophobicContact CH2-CE2 4.04Å; W452-F476 AromaticContact CH2-CZ 3.81Å; W452-F476 HydrophobicContact CH2-CZ 3.81Å; W452-F476 HydrophobicContact CZ2-CE2 4.31Å; W452-F476 AromaticContact CZ2-CZ 3.68Å; W452-F476 HydrophobicContact CZ2-CZ 3.68Å; V453-F476 HydrophobicContact CB-CE1 4.42Å; V453-F476 HydrophobicContact CB-CZ 4.45Å; V453-F476 HydrophobicContact CG1-CE1 4.39Å; V453-F476 HydrophobicContact CG2-CE1 4.06Å; V453-F476 HydrophobicContact CG2-CE2 4.41Å; V453-F476 HydrophobicContact CG2-CZ 3.62Å; H474-F476 HydrophobicContact CB-CD2 4.3Å; H474-F476 HydrophobicContact CB-CE2 3.45Å; H474-F476 VanDerWaalsContact CB-CE2 3.45Å; H474-F476 HydrophobicContact CB-CZ 3.95Å; F476-P491 CarbonylContact O-C 3.59Å; F476-P491 VanDerWaalsContact O-CA 3.31Å; F476-P491 WeakPolarHBondContact O-CA 3.25Å; F476-F492 HydrophobicContact CB-CD1 4.4Å; F476-F492 HydrophobicContact CB-CE1 3.83Å; F476-F492 HydrophobicContact CB-CE2 4.13Å; F476-F492 HydrophobicContact CB-CZ 3.67Å; F476-F492 HydrophobicContact CG-CZ 4.44Å; F476-F492 PolarHBondContact N-O 2.92Å; F476-F492 PolarHBondContact O-N 3.34Å; F476-F492 VanDerWaalsContact O-O 3.11Å; F476-I494 HydrophobicContact CD2-CB 4.16Å; F476-I494 HydrophobicContact CD2-CD1 3.6Å; F476-I494 HydrophobicContact CD2-CG1 3.61Å; F476-I494 HydrophobicContact CE2-CB 3.87Å; F476-I494 HydrophobicContact CE2-CD1 3.51Å; F476-I494 HydrophobicContact CE2-CG1 3.72Å; F476-I494 HydrophobicContact CG-CD1 4.46Å; F476-I494 HydrophobicContact CZ-CD1 4.34Å
477	I	90.4	Very high	86.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.4	178.2	-57	163.7	0	0	0	107.2	Y419 I426 L431 C489 E490 P491	Y419-I477 PolarHBondContact N-O 3.19Å; Y419-I477 PolarHBondContact O-N 2.79Å; I426-I477 HydrophobicContact CD1-CD1 4.36Å; L431-I477 HydrophobicContact CD1-CD1 4.33Å; L431-I477 HydrophobicContact CD1-CG1 4.31Å; L431-I477 HydrophobicContact CD1-CG2 4.22Å; L431-I477 HydrophobicContact CD2-CD1 3.83Å; I477-C489 HydrophobicContact CG2-CB 3.84Å; I477-E490 WeakPolarHBondContact CA-O 3.48Å; I477-P491 HydrophobicContact CG1-CB 4.33Å
478	V	92.1	Very high	86.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	136.4	170.9	56.4	0	0	0	0	109.2	I383 I398 F403 T417 L418 C489 E490 F492	I383-V478 HydrophobicContact CD1-CG1 3.63Å; I398-V478 HydrophobicContact CD1-CG2 4.01Å; F403-V478 HydrophobicContact CE2-CG1 3.99Å; F403-V478 HydrophobicContact CE2-CG2 3.97Å; F403-V478 HydrophobicContact CZ-CG1 3.89Å; F403-V478 HydrophobicContact CZ-CG2 4.33Å; T417-V478 WeakPolarHBondContact O-CA 3.38Å; L418-V478 HydrophobicContact CD1-CB 3.94Å; V478-C489 CarbonylContact O-C 3.52Å; V478-C489 WeakPolarHBondContact O-CA 3.13Å; V478-E490 HydrophobicContact CG1-CB 4.19Å; V478-E490 PolarHBondContact N-O 2.86Å; V478-E490 PolarHBondContact O-N 2.85Å; V478-F492 HydrophobicContact CB-CE1 4.12Å; V478-F492 HydrophobicContact CG1-CD1 4.1Å; V478-F492 HydrophobicContact CG1-CE1 3.96Å
479	C	90	Very high	87	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136	177.6	-53.8	0	0	0	0	111.7	L416 T417 Y419 R487 V488 C489	L416-C479 CarbonylContact C-O 3.51Å; L416-C479 WeakPolarHBondContact CA-O 3.49Å; T417-C479 PolarHBondContact N-O 3.29Å; T417-C479 PolarHBondContact O-N 3Å; T417-C479 PolarHBondContact OG1-O 2.85Å; Y419-C479 HydrophobicContact CE2-CB 4.3Å; C479-R487 HydrophobicContact CB-CG 3.98Å; C479-R487 PolarHBondContact SG-NE 3.17Å; C479-R487 VanDerWaalsContact SG-NE 3.36Å; C479-R487 PolarHBondContact SG-NH2 2.71Å; C479-V488 CarbonylContact C-O 3.45Å; C479-V488 WeakPolarHBondContact CA-O 3.34Å; C479-V488 WeakPolarHBondContact CB-O 3.34Å; C479-C489 HydrophobicContact CB-CB 4.1Å; C479-C489 WeakPolarHBondContact CB-SG 3.42Å; C479-C489 WeakPolarHBondContact SG-CB 3.09Å; C479-C489 CovalentContact SG-SG 2.03Å; C479-C489 PolarHBondContact SG-SG 3.45Å
480	A	90.5	Very high	87.1	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	128.9	175.1	0	0	0	0	0	109.7	F403 L414 L416 R487 V488	F403-A480 HydrophobicContact CB-CB 3.99Å; F403-A480 HydrophobicContact CD1-CB 3.79Å; F403-A480 HydrophobicContact CD2-CB 3.77Å; F403-A480 HydrophobicContact CE1-CB 4.14Å; F403-A480 HydrophobicContact CE2-CB 4.13Å; F403-A480 HydrophobicContact CG-CB 3.57Å; F403-A480 HydrophobicContact CZ-CB 4.28Å; L414-A480 HydrophobicContact CB-CB 4.08Å; L414-A480 HydrophobicContact CD1-CB 3.92Å; L416-A480 HydrophobicContact CD2-CB 3.53Å; A480-R487 WeakPolarHBondContact O-CA 3.26Å; A480-V488 HydrophobicContact CB-CG1 4.15Å; A480-V488 PolarHBondContact N-O 3.19Å; A480-V488 PolarHBondContact O-N 3.46Å
481	T	89.8	Confident	87.2	Confident	26 Å²	26	44.3 Å²	44.3	16%	0.16	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	131	172.8	55.4	0	0	0	0	109.9	K415 N486 R487	K415-T481 WeakPolarHBondContact CB-OG1 3.43Å; K415-T481 PolarHBondContact N-O 3.4Å; K415-T481 PolarHBondContact O-N 3.14Å; K415-T481 PolarHBondContact O-OG1 2.97Å; K415-T481 VanDerWaalsContact O-OG1 3.04Å; T481-N486 VanDerWaalsContact CA-O 3.28Å; T481-N486 WeakPolarHBondContact CA-O 3.35Å; T481-R487 HydrophobicContact CG2-CB 3.86Å; T481-R487 HydrophobicContact CG2-CG 3.8Å
482	D	86.6	Confident	87.4	Confident	12 Å²	12	42.1 Å²	42.1	6%	0.064	21%	0.207	C	C	.	.			trans	-78.1	-179	171.9	67.7	13.3	0	0	0	111.4	N375 P377 D408 L414 D484 Q485 N486	N375-D482 VanDerWaalsContact O-OD2 3.04Å; P377-D482 VanDerWaalsContact CD-OD2 3.31Å; P377-D482 WeakPolarHBondContact CD-OD2 3.25Å; P377-D482 HydrophobicContact CG-CB 4.31Å; D408-D482 VanDerWaalsContact OD2-CA 3.3Å; D408-D482 WeakPolarHBondContact OD2-CA 3.23Å; D408-D482 VanDerWaalsContact OD2-CB 3.26Å; D408-D482 WeakPolarHBondContact OD2-CB 3.32Å; L414-D482 HydrophobicContact CD2-CB 4.01Å; D482-D484 VanDerWaalsContact C-N 3.29Å; D482-D484 WeakPolarHBondContact OD1-CA 3.35Å; D482-D484 PolarHBondContact OD1-N 2.82Å; D482-Q485 PolarHBondContact O-N 3.28Å; D482-Q485 WeakPolarHBondContact OD1-CA 3.4Å; D482-Q485 PolarHBondContact OD1-N 3.32Å; D482-N486 PolarHBondContact N-O 2.8Å; D482-N486 VanDerWaalsContact N-O 3.09Å; D482-N486 PolarHBondContact OD1-N 2.87Å; D482-N486 VanDerWaalsContact OD2-CB 3.24Å; D482-N486 WeakPolarHBondContact OD2-CB 3.16Å; D482-N486 PolarHBondContact OD2-ND2 3.18Å
483	R	81.5	Confident	87.5	Confident	195 Å²	195	43.1 Å²	43.1	74%	0.736	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-28.1	174.5	-68.5	179.2	-157.2	-168.3	1.6	113.6	D408 Q485	D408-R483 VanDerWaalsContact OD1-CD 3.29Å; D408-R483 WeakPolarHBondContact OD1-CD 3.07Å; D408-R483 WeakPolarHBondContact OD1-CG 3.49Å; D408-R483 IonicContact OD1-CZ 3.49Å; D408-R483 IonicContact OD1-NE 2.73Å; D408-R483 PolarHBondContact OD1-NE 3.34Å; D408-R483 IonicContact OD1-NH2 3.69Å; D408-R483 PolarHBondContact OD2-N 3.41Å; R483-Q485 PolarHBondContact O-N 3.47Å
484	D	79.4	Confident	87.7	Confident	93 Å²	93	38.8 Å²	38.8	50%	0.497	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	6.2	177.9	-66.1	-21.5	0	0	0	112.4	D482 N486	D482-D484 VanDerWaalsContact C-N 3.29Å; D482-D484 WeakPolarHBondContact OD1-CA 3.35Å; D482-D484 PolarHBondContact OD1-N 2.82Å; D484-N486 PolarHBondContact O-N 3.09Å
485	Q	79.7	Confident	87.8	Confident	172 Å²	172	37.6 Å²	37.6	80%	0.804	18%	0.176	S	C	*	.			trans	64	14.6	-177.5	-54.3	-168.1	9.1	0	0	115.8	D482 R483	D482-Q485 PolarHBondContact O-N 3.28Å; D482-Q485 WeakPolarHBondContact OD1-CA 3.4Å; D482-Q485 PolarHBondContact OD1-N 3.32Å; R483-Q485 PolarHBondContact O-N 3.47Å
486	N	81.3	Confident	87.9	Confident	61 Å²	61	37 Å²	37	33%	0.326	17%	0.173	S	C	.	.			trans	-71.7	137.5	169.4	-49	-61.8	0	0	0	109.8	N375 I376 P377 T481 D482 D484	N375-N486 PolarHBondContact O-ND2 2.82Å; I376-N486 HydrophobicContact CG2-CB 4.13Å; P377-N486 WeakPolarHBondContact CG-O 3.18Å; T481-N486 VanDerWaalsContact CA-O 3.28Å; T481-N486 WeakPolarHBondContact CA-O 3.35Å; D482-N486 PolarHBondContact N-O 2.8Å; D482-N486 VanDerWaalsContact N-O 3.09Å; D482-N486 PolarHBondContact OD1-N 2.87Å; D482-N486 VanDerWaalsContact OD2-CB 3.24Å; D482-N486 WeakPolarHBondContact OD2-CB 3.16Å; D482-N486 PolarHBondContact OD2-ND2 3.18Å; D484-N486 PolarHBondContact O-N 3.09Å
487	R	83.9	Confident	87.9	Confident	76 Å²	76	42.5 Å²	42.5	29%	0.287	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	137.4	-172.3	-174.8	177	168.8	171.8	-0.1	111.3	Y419 I441 C479 A480 T481 C489	Y419-R487 PolarHBondContact OH-NH1 3.07Å; Y419-R487 PolarHBondContact OH-NH2 3.16Å; I441-R487 VanDerWaalsContact CD1-CZ 3.46Å; C479-R487 HydrophobicContact CB-CG 3.98Å; C479-R487 PolarHBondContact SG-NE 3.17Å; C479-R487 VanDerWaalsContact SG-NE 3.36Å; C479-R487 PolarHBondContact SG-NH2 2.71Å; A480-R487 WeakPolarHBondContact O-CA 3.26Å; T481-R487 HydrophobicContact CG2-CB 3.86Å; T481-R487 HydrophobicContact CG2-CG 3.8Å; R487-C489 PolarHBondContact NE-SG 2.89Å
488	V	86.4	Confident	87.5	Confident	18 Å²	18	50.2 Å²	50.2	11%	0.109	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.6	166.1	67.2	0	0	0	0	109.7	P377 V379 F403 C479 A480	P377-V488 HydrophobicContact CB-CG1 3.7Å; P377-V488 HydrophobicContact CG-CB 4.44Å; P377-V488 HydrophobicContact CG-CG1 3.96Å; P377-V488 VanDerWaalsContact O-CB 3.28Å; P377-V488 WeakPolarHBondContact O-CB 3.47Å; P377-V488 WeakPolarHBondContact O-CG1 3.46Å; V379-V488 HydrophobicContact CG2-CG2 3.68Å; F403-V488 HydrophobicContact CD1-CG1 3.52Å; F403-V488 HydrophobicContact CE1-CG1 3.75Å; C479-V488 CarbonylContact C-O 3.45Å; C479-V488 WeakPolarHBondContact CA-O 3.34Å; C479-V488 WeakPolarHBondContact CB-O 3.34Å; A480-V488 HydrophobicContact CB-CG1 4.15Å; A480-V488 PolarHBondContact N-O 3.19Å; A480-V488 PolarHBondContact O-N 3.46Å
489	C	87.6	Confident	87.1	Confident	10 Å²	10	51.6 Å²	51.6	7%	0.068	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	148.1	-176.4	-68.1	0	0	0	0	111.7	Y428 I477 V478 C479 R487	Y428-C489 WeakPolarHBondContact CE2-O 3.42Å; I477-C489 HydrophobicContact CG2-CB 3.84Å; V478-C489 CarbonylContact O-C 3.52Å; V478-C489 WeakPolarHBondContact O-CA 3.13Å; C479-C489 HydrophobicContact CB-CB 4.1Å; C479-C489 WeakPolarHBondContact CB-SG 3.42Å; C479-C489 WeakPolarHBondContact SG-CB 3.09Å; C479-C489 CovalentContact SG-SG 2.03Å; C479-C489 PolarHBondContact SG-SG 3.45Å; R487-C489 PolarHBondContact NE-SG 2.89Å
490	E	88.2	Confident	86.8	Confident	9 Å²	9	56.6 Å²	56.6	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	121.6	179.1	174.3	55	-164.2	0	0	110.3	V379 Y382 F403 I477 V478	V379-E490 HydrophobicContact CG1-CB 4.41Å; V379-E490 HydrophobicContact CG1-CG 4.3Å; V379-E490 HydrophobicContact CG2-CB 4.16Å; Y382-E490 VanDerWaalsContact CD1-CD 3.49Å; Y382-E490 WeakPolarHBondContact CD1-OE1 3.48Å; Y382-E490 WeakPolarHBondContact CD1-OE2 3.49Å; F403-E490 HydrophobicContact CE1-CB 4.11Å; F403-E490 HydrophobicContact CZ-CB 3.89Å; I477-E490 WeakPolarHBondContact CA-O 3.48Å; V478-E490 HydrophobicContact CG1-CB 4.19Å; V478-E490 PolarHBondContact N-O 2.86Å; V478-E490 PolarHBondContact O-N 2.85Å
491	P	89.7	Confident	86.5	Confident	15 Å²	15	58.4 Å²	58.4	10%	0.097	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	142.8	174.2	32.7	-30	0	0	0	111.4	L431 F476 I477	L431-P491 HydrophobicContact CD1-CB 3.76Å; L431-P491 HydrophobicContact CD1-CG 3.59Å; F476-P491 CarbonylContact O-C 3.59Å; F476-P491 VanDerWaalsContact O-CA 3.31Å; F476-P491 WeakPolarHBondContact O-CA 3.25Å; I477-P491 HydrophobicContact CG1-CB 4.33Å
492	F	90.6	Very high	86.3	Confident	7 Å²	7	61.2 Å²	61.2	3%	0.031	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	164.8	171.4	69.7	-82	0	0	0	111	I383 I386 L418 I462 F476 V478 I494	I383-F492 HydrophobicContact CB-CB 3.82Å; I383-F492 HydrophobicContact CB-CD1 4.48Å; I383-F492 HydrophobicContact CB-CG 4.09Å; I383-F492 HydrophobicContact CD1-CD1 3.96Å; I383-F492 HydrophobicContact CD1-CE1 4.29Å; I383-F492 HydrophobicContact CD1-CG 4.36Å; I383-F492 HydrophobicContact CG2-CB 3.97Å; I383-F492 HydrophobicContact CG2-CD2 4.01Å; I383-F492 HydrophobicContact CG2-CG 3.91Å; I386-F492 HydrophobicContact CD1-CD2 4.03Å; I386-F492 HydrophobicContact CD1-CE2 3.75Å; L418-F492 HydrophobicContact CD1-CE1 3.71Å; L418-F492 HydrophobicContact CD1-CZ 3.79Å; I462-F492 HydrophobicContact CD1-CE2 4.11Å; I462-F492 HydrophobicContact CD1-CZ 3.62Å; F476-F492 HydrophobicContact CB-CD1 4.4Å; F476-F492 HydrophobicContact CB-CE1 3.83Å; F476-F492 HydrophobicContact CB-CE2 4.13Å; F476-F492 HydrophobicContact CB-CZ 3.67Å; F476-F492 HydrophobicContact CG-CZ 4.44Å; F476-F492 PolarHBondContact N-O 2.92Å; F476-F492 PolarHBondContact O-N 3.34Å; F476-F492 VanDerWaalsContact O-O 3.11Å; V478-F492 HydrophobicContact CB-CE1 4.12Å; V478-F492 HydrophobicContact CG1-CD1 4.1Å; V478-F492 HydrophobicContact CG1-CE1 3.96Å; F492-I494 HydrophobicContact CD2-CG1 4.35Å; F492-I494 HydrophobicContact CE2-CD1 4.07Å; F492-I494 HydrophobicContact CE2-CG1 3.87Å
493	Q	91	Very high	86.3	Confident	49 Å²	49	67.9 Å²	67.9	23%	0.229	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	142.3	-175.5	-64.9	-173.1	-13.7	0	0	112.2	P385 I386 N425 H474	P385-Q493 CarbonylContact C-O 3.59Å; P385-Q493 WeakPolarHBondContact CA-O 2.93Å; P385-Q493 HydrophobicContact CB-CB 4.36Å; I386-Q493 PolarHBondContact N-O 3.01Å; N425-Q493 PolarHBondContact OD1-NE2 3.32Å; H474-Q493 WeakPolarHBondContact O-CA 3.37Å
494	I	92.5	Very high	86.7	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	116.1	165.8	-54.4	-176	0	0	0	107.9	I386 T388 W452 L464 H474 F476 F492 V496	I386-I494 HydrophobicContact CB-CG1 4.17Å; I386-I494 HydrophobicContact CD1-CG1 4.29Å; I386-I494 HydrophobicContact CG2-CG2 4.21Å; I386-I494 CarbonylContact O-C 3.59Å; I386-I494 WeakPolarHBondContact O-CA 3.29Å; T388-I494 HydrophobicContact CG2-CG2 4.18Å; W452-I494 HydrophobicContact CZ3-CG2 4.48Å; L464-I494 HydrophobicContact CD1-CD1 4.1Å; L464-I494 HydrophobicContact CD1-CG2 3.95Å; L464-I494 HydrophobicContact CD2-CD1 3.61Å; L464-I494 HydrophobicContact CG-CD1 4.49Å; H474-I494 PolarHBondContact N-O 2.76Å; H474-I494 PolarHBondContact O-N 2.82Å; F476-I494 HydrophobicContact CD2-CB 4.16Å; F476-I494 HydrophobicContact CD2-CD1 3.6Å; F476-I494 HydrophobicContact CD2-CG1 3.61Å; F476-I494 HydrophobicContact CE2-CB 3.87Å; F476-I494 HydrophobicContact CE2-CD1 3.51Å; F476-I494 HydrophobicContact CE2-CG1 3.72Å; F476-I494 HydrophobicContact CG-CD1 4.46Å; F476-I494 HydrophobicContact CZ-CD1 4.34Å; F492-I494 HydrophobicContact CD2-CG1 4.35Å; F492-I494 HydrophobicContact CE2-CD1 4.07Å; F492-I494 HydrophobicContact CE2-CG1 3.87Å; I494-V496 HydrophobicContact CG2-CG2 4.28Å
495	I	92.2	Very high	87.1	Confident	26 Å²	26	62.5 Å²	62.5	13%	0.133	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	111.5	180	-58.1	172.6	0	0	0	107.7	P385 I386 K387 T388 K497	P385-I495 HydrophobicContact CB-CD1 4.25Å; I386-I495 PolarHBondContact O-N 2.88Å; K387-I495 HydrophobicContact CG-CB 4.4Å; K387-I495 HydrophobicContact CG-CD1 4.46Å; T388-I495 PolarHBondContact N-O 3.32Å; I495-K497 HydrophobicContact CG2-CG 4.07Å
496	V	92	Very high	87.5	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.018	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	110.7	177.8	-177.6	0	0	0	0	108.8	T388 V390 W452 P466 H470 G472 I494	T388-V496 HydrophobicContact CG2-CG2 3.96Å; T388-V496 WeakPolarHBondContact O-CA 3.33Å; V390-V496 HydrophobicContact CG2-CG1 4.01Å; W452-V496 HydrophobicContact CH2-CG2 4.27Å; W452-V496 HydrophobicContact CZ3-CG2 4.02Å; P466-V496 HydrophobicContact CB-CG1 3.69Å; P466-V496 HydrophobicContact CB-CG2 4.12Å; P466-V496 HydrophobicContact CG-CG1 4.49Å; H470-V496 VanDerWaalsContact O-CB 3.23Å; H470-V496 WeakPolarHBondContact O-CB 3.23Å; G472-V496 PolarHBondContact N-O 2.86Å; G472-V496 PolarHBondContact O-N 2.9Å; I494-V496 HydrophobicContact CG2-CG2 4.28Å
497	K	89.6	Confident	87.7	Confident	120 Å²	120	57.9 Å²	57.9	52%	0.522	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	151.2	176.4	-63.1	-169.4	177.1	-170.8	0	111.4	T388 T389 V390 I495	T388-K497 PolarHBondContact O-N 3Å; T389-K497 VanDerWaalsContact CA-O 3.25Å; T389-K497 WeakPolarHBondContact CA-O 3.32Å; V390-K497 PolarHBondContact N-O 3Å; V390-K497 VanDerWaalsContact N-O 3.1Å; I495-K497 HydrophobicContact CG2-CG 4.07Å
498	R	83.9	Confident	88	Confident	163 Å²	163	57.2 Å²	57.2	62%	0.615	28%	0.278	S	S	*	.	P	Polyproline II helix	trans	-66.7	144.5	163.4	-64.1	-175.2	-171.8	173.9	2.8	109	V471 A579	V471-R498 HydrophobicContact CG1-CG 4.08Å; V471-R498 HydrophobicContact CG2-CG 3.77Å; R498-A579 HydrophobicContact CG-CB 4.43Å
499	P	83.5	Confident	87.9	Confident	29 Å²	29	63.1 Å²	63.1	19%	0.188	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-57.2	147	170.3	24.4	-33.5	0	0	0	110.5	A579 Q580	P499-A579 WeakPolarHBondContact CD-O 3.5Å; P499-Q580 HydrophobicContact CG-CG 3.71Å
500	S	82.1	Confident	87.9	Confident	104 Å²	104	63 Å²	63	73%	0.727	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-57.5	142.8	176.5	-58.5	0	0	0	0	111.1
501	P	85.3	Confident	87.8	Confident	39 Å²	39	65.4 Å²	65.4	25%	0.253	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-59.8	139.4	178.3	22.4	-31.6	0	0	0	110.9	R503 S581 E583	P501-R503 PolarHBondContact O-N 2.99Å; P501-S581 WeakPolarHBondContact CA-O 3.48Å; P501-S581 WeakPolarHBondContact CB-OG 3.41Å; P501-E583 HydrophobicContact CB-CB 4.45Å; P501-E583 HydrophobicContact CB-CG 3.83Å; P501-E583 HydrophobicContact CG-CG 4.34Å
502	F	85.5	Confident	87.8	Confident	84 Å²	84	65.2 Å²	65.2	37%	0.368	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	114.6	169.3	-65.4	-81.7	0	0	0	109	E527 S581 V582 E583	F502-E527 HydrophobicContact CB-CG 4.47Å; F502-E527 HydrophobicContact CD1-CG 4.02Å; F502-E527 HydrophobicContact CD2-CB 3.68Å; F502-E527 HydrophobicContact CD2-CG 4.06Å; F502-E527 HydrophobicContact CE1-CG 4.25Å; F502-E527 HydrophobicContact CE2-CB 3.8Å; F502-E527 HydrophobicContact CE2-CG 4.28Å; F502-E527 HydrophobicContact CG-CB 4.07Å; F502-E527 HydrophobicContact CG-CG 3.92Å; F502-E527 HydrophobicContact CZ-CB 4.28Å; F502-E527 HydrophobicContact CZ-CG 4.38Å; F502-S581 PolarHBondContact N-O 3.1Å; F502-V582 HydrophobicContact CB-CG2 4.07Å; F502-V582 HydrophobicContact CD2-CG2 4.26Å; F502-V582 CarbonylContact O-C 3.57Å; F502-V582 WeakPolarHBondContact O-CA 3.44Å; F502-E583 PolarHBondContact O-N 3.44Å
503	R	86.9	Confident	87.7	Confident	152 Å²	152	64.9 Å²	64.9	57%	0.574	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	131.1	-180	-68.9	-177.7	173.4	-178.4	2.3	111.5	P501 E583	P501-R503 PolarHBondContact O-N 2.99Å; R503-E583 CarbonylContact C-O 3.46Å; R503-E583 VanDerWaalsContact CA-O 3.3Å; R503-E583 WeakPolarHBondContact CA-O 3.24Å; R503-E583 HydrophobicContact CG-CB 4.13Å; R503-E583 IonicContact CZ-OE2 2.68Å; R503-E583 IonicContact NE-OE2 2.8Å; R503-E583 PolarHBondContact NE-OE2 2.81Å; R503-E583 IonicContact NH2-OE2 3.09Å; R503-E583 PolarHBondContact NH2-OE2 3.31Å
504	K	88.6	Confident	87.5	Confident	52 Å²	52	64.2 Å²	64.2	23%	0.226	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	148.8	174.9	-62.7	-178.3	-178	175	0	110.4	F506 W524 E527 E583 I584 E585	K504-F506 HydrophobicContact CB-CE2 4.02Å; K504-F506 HydrophobicContact CB-CZ 4.35Å; K504-F506 HydrophobicContact CD-CE2 4.38Å; K504-F506 HydrophobicContact CD-CZ 4.23Å; K504-W524 PolarHBondContact NZ-O 3.05Å; K504-E527 WeakPolarHBondContact CE-OE1 3.4Å; K504-E527 WeakPolarHBondContact CE-OE2 3.43Å; K504-E527 IonicContact NZ-OE1 2.76Å; K504-E527 PolarHBondContact NZ-OE1 2.86Å; K504-E527 IonicContact NZ-OE2 2.67Å; K504-E527 PolarHBondContact NZ-OE2 2.99Å; K504-E583 PolarHBondContact N-O 3.2Å; K504-I584 HydrophobicContact CB-CG1 4.35Å; K504-I584 HydrophobicContact CB-CG2 4.42Å; K504-I584 WeakPolarHBondContact O-CA 3.25Å; K504-E585 PolarHBondContact O-N 3.17Å
505	N	88.5	Confident	87.1	Confident	123 Å²	123	65.5 Å²	65.5	66%	0.658	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.9	135.9	174.2	54.5	2.9	0	0	0	110.4	E585	N505-E585 CarbonylContact C-O 3.11Å; N505-E585 VanDerWaalsContact CA-O 3.29Å; N505-E585 WeakPolarHBondContact CA-O 3.28Å
506	F	88.1	Confident	86.9	Confident	63 Å²	63	66.2 Å²	66.2	28%	0.276	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.4	176.4	-62	-72.9	0	0	0	108.8	K504 W524 I584 E585 F586 R587	K504-F506 HydrophobicContact CB-CE2 4.02Å; K504-F506 HydrophobicContact CB-CZ 4.35Å; K504-F506 HydrophobicContact CD-CE2 4.38Å; K504-F506 HydrophobicContact CD-CZ 4.23Å; F506-W524 HydrophobicContact CB-CH2 4.3Å; F506-W524 HydrophobicContact CB-CZ2 4.46Å; F506-W524 HydrophobicContact CD1-CZ2 4.37Å; F506-W524 AromaticContact CD2-CD2 3.96Å; F506-W524 HydrophobicContact CD2-CD2 3.96Å; F506-W524 AromaticContact CD2-CE2 3.92Å; F506-W524 AromaticContact CD2-CE3 3.89Å; F506-W524 HydrophobicContact CD2-CE3 3.89Å; F506-W524 AromaticContact CD2-CH2 3.84Å; F506-W524 HydrophobicContact CD2-CH2 3.84Å; F506-W524 AromaticContact CD2-CZ2 3.9Å; F506-W524 HydrophobicContact CD2-CZ2 3.9Å; F506-W524 AromaticContact CD2-CZ3 3.81Å; F506-W524 HydrophobicContact CD2-CZ3 3.81Å; F506-W524 AromaticContact CE2-CD2 3.54Å; F506-W524 HydrophobicContact CE2-CD2 3.54Å; F506-W524 AromaticContact CE2-CE2 3.74Å; F506-W524 AromaticContact CE2-CE3 3.79Å; F506-W524 HydrophobicContact CE2-CE3 3.79Å; F506-W524 AromaticContact CE2-CG 3.93Å; F506-W524 HydrophobicContact CE2-CG 3.93Å; F506-W524 HydrophobicContact CE2-CH2 4.42Å; F506-W524 HydrophobicContact CE2-CZ2 4.21Å; F506-W524 HydrophobicContact CE2-CZ3 4.2Å; F506-W524 HydrophobicContact CG-CH2 4.13Å; F506-W524 AromaticContact CG-CZ2 3.99Å; F506-W524 HydrophobicContact CG-CZ2 3.99Å; F506-W524 AromaticContact CZ-CD1 3.93Å; F506-W524 HydrophobicContact CZ-CD2 4.03Å; F506-W524 AromaticContact CZ-CE2 3.94Å; F506-W524 HydrophobicContact CZ-CG 4.08Å; F506-W524 AromaticContact CZ-NE1 3.85Å; F506-I584 HydrophobicContact CD2-CG2 3.37Å; F506-I584 HydrophobicContact CE2-CD1 4.34Å; F506-I584 HydrophobicContact CE2-CG2 3.53Å; F506-E585 PolarHBondContact N-O 3.49Å; F506-F586 HydrophobicContact CB-CD2 3.7Å; F506-F586 HydrophobicContact CB-CE2 4.27Å; F506-F586 CarbonylContact O-C 3.58Å; F506-F586 WeakPolarHBondContact O-CA 3.31Å; F506-R587 PolarHBondContact O-N 2.77Å
507	I	86.3	Confident	86.6	Confident	73 Å²	73	67.8 Å²	67.8	37%	0.374	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.8	174.7	-51.3	-172.7	0	0	0	107.9	R587 Y1675	I507-R587 CarbonylContact C-O 3.45Å; I507-R587 VanDerWaalsContact CA-O 3.31Å; I507-R587 WeakPolarHBondContact CA-O 3.25Å; I507-R587 HydrophobicContact CG1-CB 4.21Å; I507-R587 HydrophobicContact CG2-CB 4.42Å; I507-Y1675 HydrophobicContact CD1-CE1 4.16Å
508	L	88.6	Confident	86.6	Confident	63 Å²	63	65.6 Å²	65.6	33%	0.33	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.7	176.3	-174.2	70.2	0	0	0	110	I510 W516 F586 R587 L588 S589	L508-I510 HydrophobicContact CD2-CG2 4.23Å; L508-I510 HydrophobicContact CG-CG2 4.37Å; L508-W516 HydrophobicContact CD2-CH2 3.33Å; L508-W516 HydrophobicContact CD2-CZ2 3.29Å; L508-F586 HydrophobicContact CB-CE2 3.96Å; L508-F586 HydrophobicContact CB-CZ 4.34Å; L508-F586 HydrophobicContact CD2-CZ 4.3Å; L508-R587 PolarHBondContact N-O 2.74Å; L508-L588 HydrophobicContact CB-CD2 3.97Å; L508-L588 HydrophobicContact CD2-CD2 4.22Å; L508-L588 CarbonylContact O-C 3.54Å; L508-L588 WeakPolarHBondContact O-CA 3.42Å; L508-S589 PolarHBondContact O-N 2.77Å
509	R	84.7	Confident	86.9	Confident	142 Å²	142	64.2 Å²	64.2	54%	0.536	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.3	174.1	-166.8	175.2	-178.2	-152.8	-7.2	109.2	S589 D680	R509-S589 WeakPolarHBondContact CA-O 3.39Å; R509-D680 IonicContact CZ-OD2 3.38Å; R509-D680 IonicContact NH1-OD2 3.94Å; R509-D680 PolarHBondContact NH1-OD2 2.86Å; R509-D680 IonicContact NH2-OD1 3.2Å; R509-D680 PolarHBondContact NH2-OD1 2.84Å; R509-D680 IonicContact NH2-OD2 2.78Å; R509-D680 PolarHBondContact NH2-OD2 3.46Å
510	I	88	Confident	87.1	Confident	6 Å²	6	62.9 Å²	62.9	3%	0.031	31%	0.307	C	S	.	.			trans	-118.3	153.1	179.2	61.6	168.7	0	0	0	110.2	L508 W516 V557 L588 S589 A590	L508-I510 HydrophobicContact CD2-CG2 4.23Å; L508-I510 HydrophobicContact CG-CG2 4.37Å; I510-W516 HydrophobicContact CB-CD2 4.49Å; I510-W516 HydrophobicContact CB-CG 4.46Å; I510-W516 HydrophobicContact CG2-CD2 3.72Å; I510-W516 HydrophobicContact CG2-CE3 4.1Å; I510-W516 HydrophobicContact CG2-CG 4.16Å; I510-W516 HydrophobicContact CG2-CH2 4.15Å; I510-W516 HydrophobicContact CG2-CZ2 3.85Å; I510-W516 HydrophobicContact CG2-CZ3 4.3Å; I510-V557 HydrophobicContact CD1-CG2 4.09Å; I510-L588 HydrophobicContact CD1-CB 3.99Å; I510-L588 HydrophobicContact CD1-CD1 4.45Å; I510-L588 HydrophobicContact CG1-CB 4.35Å; I510-L588 HydrophobicContact CG2-CD2 4.04Å; I510-S589 PolarHBondContact N-O 2.83Å; I510-A590 HydrophobicContact CG1-CB 4.19Å
511	P	86.4	Confident	87.4	Confident	61 Å²	61	59.2 Å²	59.2	40%	0.396	28%	0.28	S	S	.	.			trans	-60.3	142.1	172.5	-14.8	25.8	0	0	0	111.1	I514 S559	P511-I514 HydrophobicContact CB-CD1 3.72Å; P511-I514 HydrophobicContact CB-CG1 4.08Å; P511-I514 HydrophobicContact CG-CD1 3.61Å; P511-I514 HydrophobicContact CG-CG1 4.47Å; P511-I514 WeakPolarHBondContact O-CG1 3.28Å; P511-S559 PolarHBondContact O-OG 3.3Å
512	P	89.3	Confident	87.5	Confident	11 Å²	11	59.7 Å²	59.7	7%	0.071	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	156.7	171.9	33.5	-38.1	0	0	0	112.1	I514 S559 L561 A590 K591 V592 L677	P512-I514 PolarHBondContact O-N 2.75Å; P512-S559 VanDerWaalsContact C-OG 3.3Å; P512-S559 WeakPolarHBondContact CA-OG 3.38Å; P512-L561 HydrophobicContact CB-CD1 3.74Å; P512-L561 HydrophobicContact CG-CD1 3.59Å; P512-A590 HydrophobicContact CB-CB 4.35Å; P512-K591 WeakPolarHBondContact CG-O 3.38Å; P512-V592 HydrophobicContact CB-CB 4.46Å; P512-V592 HydrophobicContact CB-CG1 3.69Å; P512-V592 HydrophobicContact CG-CG1 4.5Å; P512-L677 HydrophobicContact CG-CD1 3.77Å; P512-L677 HydrophobicContact CG-CD2 4.43Å
513	G	88.2	Confident	87.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.1	28	174	0	0	0	0	0	115.5	S559 Y647 V648	G513-S559 CarbonylContact C-O 3.54Å; G513-S559 VanDerWaalsContact CA-O 3.24Å; G513-S559 WeakPolarHBondContact CA-O 3.47Å; G513-S559 PolarHBondContact N-O 2.81Å; G513-S559 PolarHBondContact N-OG 2.85Å; G513-Y647 CarbonylContact O-C 3.46Å; G513-Y647 WeakPolarHBondContact O-CA 3.34Å; G513-Y647 WeakPolarHBondContact O-CB 3.47Å; G513-V648 WeakPolarHBondContact CA-O 3.33Å; G513-V648 PolarHBondContact O-N 2.67Å
514	I	86.6	Confident	87.7	Confident	35 Å²	35	55.8 Å²	55.8	18%	0.179	26%	0.264	C	S	.	.	S	Bend	trans	-130.7	159.2	179.1	63.2	162.1	0	0	0	112	P511 P512 W516 S559 Y647	P511-I514 HydrophobicContact CB-CD1 3.72Å; P511-I514 HydrophobicContact CB-CG1 4.08Å; P511-I514 HydrophobicContact CG-CD1 3.61Å; P511-I514 HydrophobicContact CG-CG1 4.47Å; P511-I514 WeakPolarHBondContact O-CG1 3.28Å; P512-I514 PolarHBondContact O-N 2.75Å; I514-W516 HydrophobicContact CD1-CB 4.28Å; I514-W516 HydrophobicContact CG1-CB 4.43Å; I514-S559 PolarHBondContact N-OG 3.26Å; I514-S559 PolarHBondContact O-N 2.85Å; I514-S559 PolarHBondContact O-OG 3.15Å; I514-Y647 HydrophobicContact CG2-CD1 3.64Å; I514-Y647 HydrophobicContact CG2-CE1 3.81Å
515	F	84.9	Confident	87.8	Confident	27 Å²	27	53.3 Å²	53.3	12%	0.118	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.5	160.5	177.3	-102.4	0	0	0	108.7	C517 C556 I558 L619 N620 N623	F515-C517 WeakPolarHBondContact CE1-SG 3.32Å; F515-C517 WeakPolarHBondContact CZ-SG 3.27Å; F515-C556 HydrophobicContact CE1-CB 4.49Å; F515-C556 HydrophobicContact CE2-CB 3.66Å; F515-C556 HydrophobicContact CZ-CB 3.49Å; F515-C556 VanDerWaalsContact CZ-CB 3.49Å; F515-I558 HydrophobicContact CD2-CG1 4.05Å; F515-L619 HydrophobicContact CD2-CD2 4.44Å; F515-L619 HydrophobicContact CD2-CG 4.4Å; F515-L619 VanDerWaalsContact CE2-C 3.43Å; F515-L619 HydrophobicContact CE2-CB 3.72Å; F515-L619 HydrophobicContact CE2-CD2 3.93Å; F515-L619 HydrophobicContact CE2-CG 3.76Å; F515-L619 WeakPolarHBondContact CE2-O 3.27Å; F515-L619 HydrophobicContact CZ-CB 4.31Å; F515-L619 WeakPolarHBondContact CZ-O 3.48Å; F515-N620 VanDerWaalsContact CZ-CA 3.49Å; F515-N623 HydrophobicContact CD1-CB 3.88Å; F515-N623 HydrophobicContact CE1-CB 4.08Å
516	W	86.7	Confident	87.7	Confident	41 Å²	41	54.9 Å²	54.9	16%	0.155	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.3	-176.3	-176.8	83.8	0	0	0	110.6	L508 I510 I514 Y518 C556 V557 F586 L588	L508-W516 HydrophobicContact CD2-CH2 3.33Å; L508-W516 HydrophobicContact CD2-CZ2 3.29Å; I510-W516 HydrophobicContact CB-CD2 4.49Å; I510-W516 HydrophobicContact CB-CG 4.46Å; I510-W516 HydrophobicContact CG2-CD2 3.72Å; I510-W516 HydrophobicContact CG2-CE3 4.1Å; I510-W516 HydrophobicContact CG2-CG 4.16Å; I510-W516 HydrophobicContact CG2-CH2 4.15Å; I510-W516 HydrophobicContact CG2-CZ2 3.85Å; I510-W516 HydrophobicContact CG2-CZ3 4.3Å; I514-W516 HydrophobicContact CD1-CB 4.28Å; I514-W516 HydrophobicContact CG1-CB 4.43Å; W516-Y518 HydrophobicContact CH2-CD1 4.29Å; W516-Y518 AromaticContact CH2-CD2 3.93Å; W516-Y518 HydrophobicContact CH2-CD2 3.93Å; W516-Y518 AromaticContact CH2-CG 3.54Å; W516-Y518 HydrophobicContact CH2-CG 3.54Å; W516-Y518 AromaticContact CZ2-CD2 3.91Å; W516-Y518 HydrophobicContact CZ2-CD2 3.91Å; W516-Y518 AromaticContact CZ2-CG 3.97Å; W516-Y518 HydrophobicContact CZ2-CG 3.97Å; W516-Y518 VanDerWaalsContact CZ3-CB 3.42Å; W516-Y518 HydrophobicContact CZ3-CG 4.3Å; W516-C556 CarbonylContact O-C 3.47Å; W516-C556 VanDerWaalsContact O-CA 3.26Å; W516-C556 WeakPolarHBondContact O-CA 3.25Å; W516-V557 HydrophobicContact CB-CG2 4.45Å; W516-V557 HydrophobicContact CE3-CG2 4.05Å; W516-V557 PolarHBondContact N-O 3.48Å; W516-V557 PolarHBondContact O-N 3.23Å; W516-F586 HydrophobicContact CH2-CE1 4.48Å; W516-F586 HydrophobicContact CH2-CZ 4.12Å; W516-F586 HydrophobicContact CZ3-CE1 4.39Å; W516-F586 HydrophobicContact CZ3-CZ 4.44Å; W516-L588 HydrophobicContact CE3-CD1 4.08Å; W516-L588 HydrophobicContact CE3-CD2 4.38Å; W516-L588 HydrophobicContact CH2-CD2 3.77Å; W516-L588 HydrophobicContact CZ3-CD1 3.74Å; W516-L588 HydrophobicContact CZ3-CD2 3.57Å; W516-L588 HydrophobicContact CZ3-CG 4.32Å
517	C	87.6	Confident	87.6	Confident	35 Å²	35	54.7 Å²	54.7	24%	0.236	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.8	176.7	-70.2	0	0	0	0	111.4	F515 E554 V555 C556 N620	F515-C517 WeakPolarHBondContact CE1-SG 3.32Å; F515-C517 WeakPolarHBondContact CZ-SG 3.27Å; C517-E554 HydrophobicContact CB-CG 3.96Å; C517-E554 VanDerWaalsContact CB-OE1 3.26Å; C517-E554 WeakPolarHBondContact CB-OE1 3.31Å; C517-V555 CarbonylContact C-O 3.55Å; C517-V555 VanDerWaalsContact CA-O 3.24Å; C517-V555 WeakPolarHBondContact CA-O 3.19Å; C517-C556 HydrophobicContact CB-CB 4.17Å; C517-C556 WeakPolarHBondContact CB-SG 3.32Å; C517-C556 WeakPolarHBondContact SG-CB 3.42Å; C517-C556 CovalentContact SG-SG 2.03Å; C517-C556 PolarHBondContact SG-SG 2.71Å; C517-N620 PolarHBondContact SG-OD1 3.14Å; C517-N620 VanDerWaalsContact SG-OD1 3.35Å
518	Y	89.8	Confident	87.7	Confident	74 Å²	74	51.2 Å²	51.2	29%	0.29	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	130.8	176.6	-179	-102.3	0	0	0	111.7	W516 I520 W524 V555 F586	W516-Y518 HydrophobicContact CH2-CD1 4.29Å; W516-Y518 AromaticContact CH2-CD2 3.93Å; W516-Y518 HydrophobicContact CH2-CD2 3.93Å; W516-Y518 AromaticContact CH2-CG 3.54Å; W516-Y518 HydrophobicContact CH2-CG 3.54Å; W516-Y518 AromaticContact CZ2-CD2 3.91Å; W516-Y518 HydrophobicContact CZ2-CD2 3.91Å; W516-Y518 AromaticContact CZ2-CG 3.97Å; W516-Y518 HydrophobicContact CZ2-CG 3.97Å; W516-Y518 VanDerWaalsContact CZ3-CB 3.42Å; W516-Y518 HydrophobicContact CZ3-CG 4.3Å; Y518-I520 HydrophobicContact CD1-CD1 3.77Å; Y518-I520 HydrophobicContact CD1-CG1 4.49Å; Y518-I520 HydrophobicContact CE1-CD1 4.07Å; Y518-I520 PolarHBondContact O-N 2.86Å; Y518-W524 HydrophobicContact CE1-CH2 4.17Å; Y518-W524 HydrophobicContact CE1-CZ2 4.01Å; Y518-V555 PolarHBondContact N-O 2.68Å; Y518-V555 PolarHBondContact O-N 2.82Å; Y518-F586 HydrophobicContact CD1-CE1 4.39Å; Y518-F586 HydrophobicContact CD1-CZ 4.19Å; Y518-F586 HydrophobicContact CE1-CZ 4.48Å
519	Q	89.1	Confident	87.5	Confident	135 Å²	135	56.4 Å²	56.4	63%	0.631	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	109	174.4	-166.7	174.2	20.2	0	0	109.4	P521 T552	Q519-P521 WeakPolarHBondContact O-CD 3.43Å; Q519-T552 PolarHBondContact NE2-O 3.41Å; Q519-T552 VanDerWaalsContact NE2-O 3.09Å
520	I	88.7	Confident	87.3	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	24%	0.235	C	C	.	.			trans	-66.7	119	176.2	-59.1	-69.7	0	0	0	108	Y518 W524 F525 F533 W548 G553 V555 F571 F586	Y518-I520 HydrophobicContact CD1-CD1 3.77Å; Y518-I520 HydrophobicContact CD1-CG1 4.49Å; Y518-I520 HydrophobicContact CE1-CD1 4.07Å; Y518-I520 PolarHBondContact O-N 2.86Å; I520-W524 HydrophobicContact CD1-CE3 4.16Å; I520-W524 HydrophobicContact CD1-CH2 3.66Å; I520-W524 HydrophobicContact CD1-CZ3 3.43Å; I520-W524 VanDerWaalsContact CD1-CZ3 3.43Å; I520-W524 HydrophobicContact CG2-CD2 3.99Å; I520-W524 HydrophobicContact CG2-CE3 3.52Å; I520-W524 HydrophobicContact CG2-CZ3 3.92Å; I520-F525 HydrophobicContact CG2-CE2 4.09Å; I520-F533 HydrophobicContact CG2-CZ 4.38Å; I520-F533 WeakPolarHBondContact O-CZ 3.01Å; I520-W548 HydrophobicContact CB-CH2 4.35Å; I520-W548 HydrophobicContact CB-CZ3 4.19Å; I520-W548 HydrophobicContact CG1-CH2 4.4Å; I520-W548 HydrophobicContact CG1-CZ3 3.8Å; I520-G553 PolarHBondContact N-O 3.11Å; I520-V555 HydrophobicContact CD1-CG2 3.85Å; I520-V555 HydrophobicContact CG1-CB 4.4Å; I520-V555 HydrophobicContact CG1-CG2 3.44Å; I520-V555 VanDerWaalsContact CG1-CG2 3.44Å; I520-F571 HydrophobicContact CD1-CE1 4.47Å; I520-F571 HydrophobicContact CD1-CE2 4.49Å; I520-F571 HydrophobicContact CD1-CZ 3.98Å; I520-F571 HydrophobicContact CG1-CE1 4.2Å; I520-F571 HydrophobicContact CG1-CZ 4.17Å; I520-F586 HydrophobicContact CD1-CD1 4.23Å; I520-F586 HydrophobicContact CD1-CE1 4.11Å
521	P	88.4	Confident	86.9	Confident	27 Å²	27	57.9 Å²	57.9	18%	0.175	27%	0.274	C	S	.	.			trans	-79.9	138.2	-174.5	32.1	-34.6	0	0	0	110.8	Q519 Y523 W524	Q519-P521 WeakPolarHBondContact O-CD 3.43Å; P521-Y523 HydrophobicContact CB-CD1 3.54Å; P521-Y523 HydrophobicContact CB-CE1 3.25Å; P521-Y523 HydrophobicContact CB-CG 4.45Å; P521-Y523 HydrophobicContact CG-CD1 3.97Å; P521-Y523 HydrophobicContact CG-CE1 3.35Å; P521-Y523 HydrophobicContact CG-CE2 4.24Å; P521-Y523 VanDerWaalsContact CG-CZ 3.49Å; P521-Y523 PolarHBondContact O-N 3.34Å; P521-W524 VanDerWaalsContact CG-CD1 3.49Å; P521-W524 HydrophobicContact CG-CD2 4.39Å; P521-W524 HydrophobicContact CG-CG 4.12Å; P521-W524 VanDerWaalsContact CG-NE1 3.34Å; P521-W524 WeakPolarHBondContact O-CB 3.41Å; P521-W524 PolarHBondContact O-N 2.6Å
522	I	86.8	Confident	86.7	Confident	48 Å²	48	56.9 Å²	56.9	25%	0.246	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-57.3	-26	-175.9	-167.3	61.3	0	0	0	113.7	W524 F525 T530 F533 L536	I522-W524 PolarHBondContact O-N 3.25Å; I522-W524 VanDerWaalsContact O-N 3.16Å; I522-F525 PolarHBondContact O-N 3.36Å; I522-T530 HydrophobicContact CD1-CG2 4.1Å; I522-F533 HydrophobicContact CB-CE2 4.41Å; I522-F533 HydrophobicContact CD1-CD1 3.94Å; I522-F533 HydrophobicContact CD1-CD2 4.04Å; I522-F533 HydrophobicContact CD1-CE1 3.93Å; I522-F533 HydrophobicContact CD1-CE2 4.02Å; I522-F533 HydrophobicContact CD1-CG 3.99Å; I522-F533 HydrophobicContact CD1-CZ 3.97Å; I522-L536 HydrophobicContact CD1-CD1 4.46Å
523	Y	88.3	Confident	86.3	Confident	147 Å²	147	57.3 Å²	57.3	58%	0.576	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-66.5	-14.5	178.4	73	-103.7	0	0	0	113.6	P521 F525 K526	P521-Y523 HydrophobicContact CB-CD1 3.54Å; P521-Y523 HydrophobicContact CB-CE1 3.25Å; P521-Y523 HydrophobicContact CB-CG 4.45Å; P521-Y523 HydrophobicContact CG-CD1 3.97Å; P521-Y523 HydrophobicContact CG-CE1 3.35Å; P521-Y523 HydrophobicContact CG-CE2 4.24Å; P521-Y523 VanDerWaalsContact CG-CZ 3.49Å; P521-Y523 PolarHBondContact O-N 3.34Å; Y523-F525 PolarHBondContact O-N 3.28Å; Y523-K526 VanDerWaalsContact O-CB 3.24Å; Y523-K526 WeakPolarHBondContact O-CB 3.44Å; Y523-K526 PolarHBondContact O-N 2.76Å; Y523-K526 VanDerWaalsContact O-N 3.11Å
524	W	89.1	Confident	85.9	Confident	7 Å²	7	63.3 Å²	63.3	3%	0.027	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-57.2	-26.9	168.8	-79.8	19.9	0	0	0	111.8	K504 F506 Y518 I520 P521 I522 I584 F586	K504-W524 PolarHBondContact NZ-O 3.05Å; F506-W524 HydrophobicContact CB-CH2 4.3Å; F506-W524 HydrophobicContact CB-CZ2 4.46Å; F506-W524 HydrophobicContact CD1-CZ2 4.37Å; F506-W524 AromaticContact CD2-CD2 3.96Å; F506-W524 HydrophobicContact CD2-CD2 3.96Å; F506-W524 AromaticContact CD2-CE2 3.92Å; F506-W524 AromaticContact CD2-CE3 3.89Å; F506-W524 HydrophobicContact CD2-CE3 3.89Å; F506-W524 AromaticContact CD2-CH2 3.84Å; F506-W524 HydrophobicContact CD2-CH2 3.84Å; F506-W524 AromaticContact CD2-CZ2 3.9Å; F506-W524 HydrophobicContact CD2-CZ2 3.9Å; F506-W524 AromaticContact CD2-CZ3 3.81Å; F506-W524 HydrophobicContact CD2-CZ3 3.81Å; F506-W524 AromaticContact CE2-CD2 3.54Å; F506-W524 HydrophobicContact CE2-CD2 3.54Å; F506-W524 AromaticContact CE2-CE2 3.74Å; F506-W524 AromaticContact CE2-CE3 3.79Å; F506-W524 HydrophobicContact CE2-CE3 3.79Å; F506-W524 AromaticContact CE2-CG 3.93Å; F506-W524 HydrophobicContact CE2-CG 3.93Å; F506-W524 HydrophobicContact CE2-CH2 4.42Å; F506-W524 HydrophobicContact CE2-CZ2 4.21Å; F506-W524 HydrophobicContact CE2-CZ3 4.2Å; F506-W524 HydrophobicContact CG-CH2 4.13Å; F506-W524 AromaticContact CG-CZ2 3.99Å; F506-W524 HydrophobicContact CG-CZ2 3.99Å; F506-W524 AromaticContact CZ-CD1 3.93Å; F506-W524 HydrophobicContact CZ-CD2 4.03Å; F506-W524 AromaticContact CZ-CE2 3.94Å; F506-W524 HydrophobicContact CZ-CG 4.08Å; F506-W524 AromaticContact CZ-NE1 3.85Å; Y518-W524 HydrophobicContact CE1-CH2 4.17Å; Y518-W524 HydrophobicContact CE1-CZ2 4.01Å; I520-W524 HydrophobicContact CD1-CE3 4.16Å; I520-W524 HydrophobicContact CD1-CH2 3.66Å; I520-W524 HydrophobicContact CD1-CZ3 3.43Å; I520-W524 VanDerWaalsContact CD1-CZ3 3.43Å; I520-W524 HydrophobicContact CG2-CD2 3.99Å; I520-W524 HydrophobicContact CG2-CE3 3.52Å; I520-W524 HydrophobicContact CG2-CZ3 3.92Å; P521-W524 VanDerWaalsContact CG-CD1 3.49Å; P521-W524 HydrophobicContact CG-CD2 4.39Å; P521-W524 HydrophobicContact CG-CG 4.12Å; P521-W524 VanDerWaalsContact CG-NE1 3.34Å; P521-W524 WeakPolarHBondContact O-CB 3.41Å; P521-W524 PolarHBondContact O-N 2.6Å; I522-W524 PolarHBondContact O-N 3.25Å; I522-W524 VanDerWaalsContact O-N 3.16Å; W524-I584 HydrophobicContact CB-CD1 3.71Å; W524-I584 HydrophobicContact CD2-CD1 4.39Å; W524-I584 HydrophobicContact CE3-CD1 3.9Å; W524-I584 HydrophobicContact CE3-CG2 4.08Å; W524-I584 HydrophobicContact CG-CD1 4.36Å; W524-I584 HydrophobicContact CZ3-CG2 4.23Å; W524-F586 HydrophobicContact CH2-CD1 4.33Å; W524-F586 AromaticContact CH2-CD2 3.82Å; W524-F586 HydrophobicContact CH2-CD2 3.82Å; W524-F586 HydrophobicContact CH2-CE1 4.4Å; W524-F586 AromaticContact CH2-CE2 3.87Å; W524-F586 HydrophobicContact CH2-CE2 3.87Å; W524-F586 HydrophobicContact CH2-CG 4.03Å; W524-F586 HydrophobicContact CH2-CZ 4.15Å; W524-F586 HydrophobicContact CZ3-CB 4.41Å; W524-F586 HydrophobicContact CZ3-CD2 4.41Å; W524-F586 HydrophobicContact CZ3-CG 4.22Å
525	F	89.6	Confident	85.6	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-108.5	22.1	179.1	-52	-80.9	0	0	0	112.8	I520 I522 Y523 E527 L528 F533 L536 L538 F571 A573 V582 I584	I520-F525 HydrophobicContact CG2-CE2 4.09Å; I522-F525 PolarHBondContact O-N 3.36Å; Y523-F525 PolarHBondContact O-N 3.28Å; F525-E527 PolarHBondContact O-N 2.77Å; F525-E527 VanDerWaalsContact O-N 3.08Å; F525-L528 HydrophobicContact CB-CD1 4.32Å; F525-L528 HydrophobicContact CD1-CD1 4.38Å; F525-L528 WeakPolarHBondContact O-CB 3.48Å; F525-L528 PolarHBondContact O-N 2.83Å; F525-F533 AromaticContact CD2-CE1 3.8Å; F525-F533 HydrophobicContact CD2-CE1 3.8Å; F525-F533 HydrophobicContact CD2-CZ 4.44Å; F525-F533 AromaticContact CE2-CE1 3.58Å; F525-F533 HydrophobicContact CE2-CE1 3.58Å; F525-F533 HydrophobicContact CE2-CZ 4.25Å; F525-L536 HydrophobicContact CB-CD1 3.91Å; F525-L536 HydrophobicContact CD1-CD1 4.38Å; F525-L536 HydrophobicContact CD2-CD1 4.32Å; F525-L536 HydrophobicContact CG-CD1 3.93Å; F525-L538 HydrophobicContact CE1-CD1 3.98Å; F525-L538 HydrophobicContact CZ-CD1 3.88Å; F525-F571 HydrophobicContact CE1-CB 4.41Å; F525-F571 HydrophobicContact CZ-CB 4.18Å; F525-A573 HydrophobicContact CD1-CB 3.38Å; F525-A573 HydrophobicContact CE1-CB 3.41Å; F525-A573 VanDerWaalsContact CE1-CB 3.41Å; F525-A573 HydrophobicContact CG-CB 4.39Å; F525-A573 HydrophobicContact CZ-CB 4.44Å; F525-V582 HydrophobicContact CD1-CB 4.06Å; F525-V582 HydrophobicContact CD1-CG1 4.06Å; F525-V582 HydrophobicContact CE1-CG1 4.4Å; F525-I584 HydrophobicContact CD1-CD1 4.13Å; F525-I584 HydrophobicContact CE1-CD1 3.56Å; F525-I584 HydrophobicContact CE1-CG1 4.21Å; F525-I584 HydrophobicContact CE2-CD1 4.31Å; F525-I584 HydrophobicContact CZ-CD1 3.68Å
526	K	87.5	Confident	85.5	Confident	157 Å²	157	68.6 Å²	68.6	68%	0.683	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-53.8	-31.5	-176.9	-178.2	177.9	179.1	-178.8	0	113.1	Y523 L528 K529	Y523-K526 VanDerWaalsContact O-CB 3.24Å; Y523-K526 WeakPolarHBondContact O-CB 3.44Å; Y523-K526 PolarHBondContact O-N 2.76Å; Y523-K526 VanDerWaalsContact O-N 3.11Å; K526-L528 PolarHBondContact O-N 3.17Å; K526-K529 PolarHBondContact O-N 3.14Å
527	E	85.8	Confident	85.4	Confident	59 Å²	59	72.1 Å²	72.1	28%	0.276	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-62.1	-30.7	177.5	-64.1	75	-167.3	0	0	112.1	F502 K504 F525 K529 Q580 V582	F502-E527 HydrophobicContact CB-CG 4.47Å; F502-E527 HydrophobicContact CD1-CG 4.02Å; F502-E527 HydrophobicContact CD2-CB 3.68Å; F502-E527 HydrophobicContact CD2-CG 4.06Å; F502-E527 HydrophobicContact CE1-CG 4.25Å; F502-E527 HydrophobicContact CE2-CB 3.8Å; F502-E527 HydrophobicContact CE2-CG 4.28Å; F502-E527 HydrophobicContact CG-CB 4.07Å; F502-E527 HydrophobicContact CG-CG 3.92Å; F502-E527 HydrophobicContact CZ-CB 4.28Å; F502-E527 HydrophobicContact CZ-CG 4.38Å; K504-E527 WeakPolarHBondContact CE-OE1 3.4Å; K504-E527 WeakPolarHBondContact CE-OE2 3.43Å; K504-E527 IonicContact NZ-OE1 2.76Å; K504-E527 PolarHBondContact NZ-OE1 2.86Å; K504-E527 IonicContact NZ-OE2 2.67Å; K504-E527 PolarHBondContact NZ-OE2 2.99Å; F525-E527 PolarHBondContact O-N 2.77Å; F525-E527 VanDerWaalsContact O-N 3.08Å; E527-K529 PolarHBondContact O-N 2.81Å; E527-Q580 PolarHBondContact O-OE1 2.9Å; E527-V582 HydrophobicContact CB-CG2 4.2Å
528	L	87.2	Confident	85.3	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-79.3	4	176.6	-56.4	-176.4	0	0	0	113.2	F525 K526 T530 L536 A573 N575 L578 Q580 V582	F525-L528 HydrophobicContact CB-CD1 4.32Å; F525-L528 HydrophobicContact CD1-CD1 4.38Å; F525-L528 WeakPolarHBondContact O-CB 3.48Å; F525-L528 PolarHBondContact O-N 2.83Å; K526-L528 PolarHBondContact O-N 3.17Å; L528-T530 PolarHBondContact O-N 3.17Å; L528-L536 HydrophobicContact CB-CD2 3.92Å; L528-L536 HydrophobicContact CD1-CD1 4.41Å; L528-L536 HydrophobicContact CD1-CD2 3.55Å; L528-L536 HydrophobicContact CG-CD2 4.37Å; L528-A573 HydrophobicContact CD1-CB 3.66Å; L528-N575 HydrophobicContact CB-CB 4.1Å; L528-N575 HydrophobicContact CD2-CB 4.23Å; L528-N575 PolarHBondContact O-ND2 3.19Å; L528-L578 VanDerWaalsContact O-CD1 3.28Å; L528-L578 WeakPolarHBondContact O-CD1 3.29Å; L528-Q580 HydrophobicContact CD2-CB 3.64Å; L528-Q580 WeakPolarHBondContact CD2-O 3.32Å; L528-V582 HydrophobicContact CD1-CB 4.25Å; L528-V582 HydrophobicContact CD1-CG2 3.91Å; L528-V582 HydrophobicContact CD2-CG2 3.81Å; L528-V582 HydrophobicContact CG-CB 4.43Å; L528-V582 HydrophobicContact CG-CG2 3.56Å
529	K	84	Confident	85.2	Confident	172 Å²	172	72.7 Å²	72.7	75%	0.748	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.3	36.4	176.5	-55.7	179.7	-180	177.1	0	114	K526 E527 L578	K526-K529 PolarHBondContact O-N 3.14Å; E527-K529 PolarHBondContact O-N 2.81Å; K529-L578 HydrophobicContact CB-CD1 4.06Å; K529-L578 HydrophobicContact CD-CD1 4.3Å; K529-L578 HydrophobicContact CG-CD1 4.28Å
530	T	81.3	Confident	85.1	Confident	13 Å²	13	67.3 Å²	67.3	8%	0.08	33%	0.325	C	S	.	.			trans	-104	156.8	173.7	-172.6	0	0	0	0	110.7	I522 L528 S532 L536	I522-T530 HydrophobicContact CD1-CG2 4.1Å; L528-T530 PolarHBondContact O-N 3.17Å; T530-S532 PolarHBondContact OG1-N 2.84Å; T530-S532 PolarHBondContact OG1-O 3.38Å; T530-L536 HydrophobicContact CG2-CD1 3.69Å; T530-L536 HydrophobicContact CG2-CD2 3.59Å; T530-L536 HydrophobicContact CG2-CG 3.68Å
531	L	80.5	Confident	85	Confident	166 Å²	166	73 Å²	73	87%	0.869	35%	0.349	S	S	*	.	S	Bend	trans	-115	-3.5	172.2	-62.7	171.8	0	0	0	112.2
532	S	81.2	Confident	84.8	Confident	40 Å²	40	73.3 Å²	73.3	28%	0.28	36%	0.358	S	S	.	.	S	Bend	trans	-140.1	150.1	176.6	-177.3	0	0	0	0	111.2	T530 D534	T530-S532 PolarHBondContact OG1-N 2.84Å; T530-S532 PolarHBondContact OG1-O 3.38Å; S532-D534 VanDerWaalsContact C-N 3.32Å; S532-D534 PolarHBondContact OG-N 2.98Å; S532-D534 PolarHBondContact OG-OD2 2.86Å
533	F	81.9	Confident	84.5	Confident	20 Å²	20	75.3 Å²	75.3	9%	0.088	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-66.3	-30.1	173.5	-73.1	-72.8	0	0	0	112.8	I520 I522 F525 K535 L536 L538 W548 V550	I520-F533 HydrophobicContact CG2-CZ 4.38Å; I520-F533 WeakPolarHBondContact O-CZ 3.01Å; I522-F533 HydrophobicContact CB-CE2 4.41Å; I522-F533 HydrophobicContact CD1-CD1 3.94Å; I522-F533 HydrophobicContact CD1-CD2 4.04Å; I522-F533 HydrophobicContact CD1-CE1 3.93Å; I522-F533 HydrophobicContact CD1-CE2 4.02Å; I522-F533 HydrophobicContact CD1-CG 3.99Å; I522-F533 HydrophobicContact CD1-CZ 3.97Å; F525-F533 AromaticContact CD2-CE1 3.8Å; F525-F533 HydrophobicContact CD2-CE1 3.8Å; F525-F533 HydrophobicContact CD2-CZ 4.44Å; F525-F533 AromaticContact CE2-CE1 3.58Å; F525-F533 HydrophobicContact CE2-CE1 3.58Å; F525-F533 HydrophobicContact CE2-CZ 4.25Å; F533-K535 PolarHBondContact O-N 3.05Å; F533-L536 HydrophobicContact CD1-CD1 4.35Å; F533-L536 WeakPolarHBondContact O-CB 3.31Å; F533-L536 PolarHBondContact O-N 3.11Å; F533-L538 HydrophobicContact CD1-CD2 4.27Å; F533-W548 HydrophobicContact CE1-CH2 4.42Å; F533-V550 HydrophobicContact CB-CG1 4.49Å
534	D	79.8	Confident	84.1	Confident	126 Å²	126	69.7 Å²	69.7	67%	0.674	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-62.3	-16.7	-177.1	-41.4	-50.9	0	0	0	114.1	S532	S532-D534 VanDerWaalsContact C-N 3.32Å; S532-D534 PolarHBondContact OG-N 2.98Å; S532-D534 PolarHBondContact OG-OD2 2.86Å
535	K	79	Confident	83.5	Confident	156 Å²	156	71.9 Å²	71.9	68%	0.678	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-96.5	-1.5	178.6	-63.5	-179.2	-179.2	174.4	0	112.8	F533	F533-K535 PolarHBondContact O-N 3.05Å
536	L	84.1	Confident	83.2	Confident	16 Å²	16	74.7 Å²	74.7	8%	0.084	38%	0.379	C	S	.	.	S	Bend	trans	-105.2	136.4	176.9	-61.1	179.9	0	0	0	109	I522 F525 L528 T530 F533 L538 A573 N575	I522-L536 HydrophobicContact CD1-CD1 4.46Å; F525-L536 HydrophobicContact CB-CD1 3.91Å; F525-L536 HydrophobicContact CD1-CD1 4.38Å; F525-L536 HydrophobicContact CD2-CD1 4.32Å; F525-L536 HydrophobicContact CG-CD1 3.93Å; L528-L536 HydrophobicContact CB-CD2 3.92Å; L528-L536 HydrophobicContact CD1-CD1 4.41Å; L528-L536 HydrophobicContact CD1-CD2 3.55Å; L528-L536 HydrophobicContact CG-CD2 4.37Å; T530-L536 HydrophobicContact CG2-CD1 3.69Å; T530-L536 HydrophobicContact CG2-CD2 3.59Å; T530-L536 HydrophobicContact CG2-CG 3.68Å; F533-L536 HydrophobicContact CD1-CD1 4.35Å; F533-L536 WeakPolarHBondContact O-CB 3.31Å; F533-L536 PolarHBondContact O-N 3.11Å; L536-L538 PolarHBondContact O-N 2.69Å; L536-A573 HydrophobicContact CD1-CB 4.29Å; L536-N575 HydrophobicContact CD2-CB 4.25Å
537	D	84.1	Confident	82.9	Confident	116 Å²	116	67.7 Å²	67.7	62%	0.62	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	99.2	161.8	-176.3	19.9	0	0	0	106.9	A573 T574	D537-A573 CarbonylContact O-C 3.49Å; D537-A573 WeakPolarHBondContact O-CA 3.41Å; D537-T574 PolarHBondContact N-O 3.4Å; D537-T574 PolarHBondContact O-N 3.41Å
538	L	85.3	Confident	82.7	Confident	26 Å²	26	67.1 Å²	67.1	14%	0.136	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	118.7	-171.6	-178.9	78.5	0	0	0	110.4	F525 F533 L536 V540 W548 F571 H572 A573	F525-L538 HydrophobicContact CE1-CD1 3.98Å; F525-L538 HydrophobicContact CZ-CD1 3.88Å; F533-L538 HydrophobicContact CD1-CD2 4.27Å; L536-L538 PolarHBondContact O-N 2.69Å; L538-V540 HydrophobicContact CD2-CG2 4.1Å; L538-V540 HydrophobicContact CG-CG2 4.1Å; L538-W548 HydrophobicContact CD2-CH2 4Å; L538-W548 HydrophobicContact CD2-CZ2 3.11Å; L538-F571 HydrophobicContact CD1-CB 4.27Å; L538-F571 HydrophobicContact CD1-CD1 4.38Å; L538-H572 WeakPolarHBondContact CA-O 3.39Å; L538-A573 HydrophobicContact CD1-CB 3.63Å
539	E	86.9	Confident	82.4	Confident	94 Å²	94	68.6 Å²	68.6	44%	0.439	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132	171.5	-168.7	-178.2	-173.2	0	0	109.2	K541 H572	E539-K541 WeakPolarHBondContact OE1-CE 3.16Å; E539-K541 IonicContact OE1-NZ 3.21Å; E539-K541 PolarHBondContact OE1-NZ 2.76Å; E539-K541 IonicContact OE2-NZ 3.48Å; E539-H572 PolarHBondContact N-O 3.25Å; E539-H572 PolarHBondContact O-N 3.37Å
540	V	87.6	Confident	82.1	Confident	23 Å²	23	63.4 Å²	63.4	14%	0.139	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.5	177.4	-170.5	0	0	0	0	109.3	L538 F546 W548 F570 F571	L538-V540 HydrophobicContact CD2-CG2 4.1Å; L538-V540 HydrophobicContact CG-CG2 4.1Å; V540-F546 HydrophobicContact CB-CE2 4.15Å; V540-F546 HydrophobicContact CB-CZ 4.39Å; V540-F546 HydrophobicContact CG1-CE2 3.61Å; V540-F546 HydrophobicContact CG1-CZ 3.97Å; V540-W548 HydrophobicContact CB-CG 4.29Å; V540-W548 HydrophobicContact CG2-CD2 3.95Å; V540-W548 HydrophobicContact CG2-CG 3.89Å; V540-F570 WeakPolarHBondContact CA-O 3.41Å; V540-F571 HydrophobicContact CB-CD1 4.35Å; V540-F571 HydrophobicContact CB-CE1 4.36Å; V540-F571 HydrophobicContact CG1-CD1 3.99Å; V540-F571 HydrophobicContact CG1-CE1 3.69Å; V540-F571 HydrophobicContact CG1-CG 4.48Å; V540-F571 HydrophobicContact CG1-CZ 3.95Å; V540-F571 HydrophobicContact CG2-CD1 3.47Å; V540-F571 VanDerWaalsContact CG2-CD1 3.47Å; V540-F571 HydrophobicContact CG2-CE1 3.66Å; V540-F571 HydrophobicContact CG2-CG 4.38Å
541	K	87.4	Confident	81.8	Confident	119 Å²	119	70.9 Å²	70.9	52%	0.517	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	150.4	176.4	-69.3	178.3	174.7	149.4	0	109.9	E539 L569 F570	E539-K541 WeakPolarHBondContact OE1-CE 3.16Å; E539-K541 IonicContact OE1-NZ 3.21Å; E539-K541 PolarHBondContact OE1-NZ 2.76Å; E539-K541 IonicContact OE2-NZ 3.48Å; K541-L569 CarbonylContact O-C 3.52Å; K541-L569 VanDerWaalsContact O-CA 3.32Å; K541-L569 WeakPolarHBondContact O-CA 3.13Å; K541-F570 PolarHBondContact N-O 3.42Å; K541-F570 PolarHBondContact O-N 2.7Å
542	G	84.3	Confident	81.8	Confident	34 Å²	34	65.8 Å²	65.8	35%	0.351	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	152.1	-178.6	0	0	0	0	0	112.7	T568	G542-T568 WeakPolarHBondContact CA-O 3.23Å
543	D	80.6	Confident	81.7	Confident	91 Å²	91	63.9 Å²	63.9	49%	0.487	33%	0.332	S	S	.	.	S	Bend	trans	-82	-19.5	175.4	57	15.3	0	0	0	113.6	T568	D543-T568 VanDerWaalsContact CG-N 3.26Å; D543-T568 PolarHBondContact N-O 3.1Å; D543-T568 PolarHBondContact OD1-N 3.02Å; D543-T568 VanDerWaalsContact OD2-CB 3.24Å; D543-T568 WeakPolarHBondContact OD2-CB 3.46Å; D543-T568 PolarHBondContact OD2-N 2.87Å; D543-T568 PolarHBondContact OD2-OG1 3.39Å; D543-T568 VanDerWaalsContact OD2-OG1 3.13Å
544	S	78.8	Confident	81.9	Confident	28 Å²	28	65.4 Å²	65.4	20%	0.196	34%	0.339	C	S	.	.	S	Bend	trans	-125.5	156	-175.2	-51.9	0	0	0	0	110.5	F546	S544-F546 WeakPolarHBondContact O-CD1 3.36Å; S544-F546 PolarHBondContact O-N 3.17Å; S544-F546 VanDerWaalsContact O-N 3.11Å
545	P	75.7	Confident	82.4	Confident	54 Å²	54	59.4 Å²	59.4	35%	0.351	31%	0.307	S	S	.	.			trans	-54.4	119.4	176.1	-24.5	33.7	0	0	0	111.7	F654	P545-F654 HydrophobicContact CB-CD1 4.01Å; P545-F654 HydrophobicContact CB-CE1 3.99Å; P545-F654 HydrophobicContact CB-CG 4.43Å; P545-F654 HydrophobicContact CB-CZ 4.43Å; P545-F654 HydrophobicContact CG-CD1 4.15Å; P545-F654 HydrophobicContact CG-CG 4.37Å
546	F	84.2	Confident	82.7	Confident	58 Å²	58	52 Å²	52	25%	0.254	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	160.8	179.3	75.7	-80.1	0	0	0	110.4	V540 S544 W548 C556 V557 L569	V540-F546 HydrophobicContact CB-CE2 4.15Å; V540-F546 HydrophobicContact CB-CZ 4.39Å; V540-F546 HydrophobicContact CG1-CE2 3.61Å; V540-F546 HydrophobicContact CG1-CZ 3.97Å; S544-F546 WeakPolarHBondContact O-CD1 3.36Å; S544-F546 PolarHBondContact O-N 3.17Å; S544-F546 VanDerWaalsContact O-N 3.11Å; F546-W548 HydrophobicContact CD2-CB 4.24Å; F546-W548 HydrophobicContact CE2-CB 3.91Å; F546-C556 CarbonylContact C-O 3.54Å; F546-C556 VanDerWaalsContact CA-O 3.25Å; F546-C556 WeakPolarHBondContact CA-O 3.49Å; F546-C556 WeakPolarHBondContact CB-O 3.43Å; F546-V557 HydrophobicContact CB-CG1 3.88Å; F546-L569 HydrophobicContact CB-CD2 4.06Å; F546-L569 HydrophobicContact CD1-CD2 3.75Å; F546-L569 HydrophobicContact CD2-CD2 3.93Å; F546-L569 HydrophobicContact CE1-CD2 4.16Å; F546-L569 HydrophobicContact CE2-CD2 4.32Å; F546-L569 HydrophobicContact CG-CD2 3.63Å; F546-L569 HydrophobicContact CZ-CD2 4.43Å
547	S	80.5	Confident	83	Confident	11 Å²	11	51.3 Å²	51.3	8%	0.077	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	142.2	166.9	165.2	0	0	0	0	109.3	V555 C556 Y617	S547-V555 WeakPolarHBondContact O-CA 3.41Å; S547-C556 PolarHBondContact N-O 3.33Å; S547-C556 PolarHBondContact O-N 3.46Å; S547-Y617 WeakPolarHBondContact CB-O 3.34Å; S547-Y617 PolarHBondContact OG-O 3.14Å
548	W	81.6	Confident	83	Confident	46 Å²	46	46.1 Å²	46.1	17%	0.174	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	121.9	176.1	167.5	-113	0	0	0	108.7	I520 F533 L538 V540 F546 G553 V555 F571	I520-W548 HydrophobicContact CB-CH2 4.35Å; I520-W548 HydrophobicContact CB-CZ3 4.19Å; I520-W548 HydrophobicContact CG1-CH2 4.4Å; I520-W548 HydrophobicContact CG1-CZ3 3.8Å; F533-W548 HydrophobicContact CE1-CH2 4.42Å; L538-W548 HydrophobicContact CD2-CH2 4Å; L538-W548 HydrophobicContact CD2-CZ2 3.11Å; V540-W548 HydrophobicContact CB-CG 4.29Å; V540-W548 HydrophobicContact CG2-CD2 3.95Å; V540-W548 HydrophobicContact CG2-CG 3.89Å; F546-W548 HydrophobicContact CD2-CB 4.24Å; F546-W548 HydrophobicContact CE2-CB 3.91Å; W548-G553 WeakPolarHBondContact CZ3-O 3.43Å; W548-V555 HydrophobicContact CD2-CG2 4.47Å; W548-V555 HydrophobicContact CE3-CB 4.32Å; W548-V555 HydrophobicContact CE3-CG2 3.29Å; W548-V555 HydrophobicContact CZ3-CG2 3.49Å; W548-V555 VanDerWaalsContact CZ3-CG2 3.49Å; W548-F571 HydrophobicContact CE3-CE1 4.25Å; W548-F571 HydrophobicContact CH2-CE1 4.45Å; W548-F571 HydrophobicContact CZ3-CE1 4.12Å
549	N	81.1	Confident	83.2	Confident	31 Å²	31	44.9 Å²	44.9	17%	0.166	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	110.8	172.6	-176.7	-33.2	0	0	0	109.1	Q551 T552 G553 E554	N549-Q551 VanDerWaalsContact C-N 3.29Å; N549-Q551 PolarHBondContact O-N 2.96Å; N549-Q551 WeakPolarHBondContact OD1-CB 3.08Å; N549-Q551 PolarHBondContact OD1-N 3.07Å; N549-T552 WeakPolarHBondContact CB-OG1 3.4Å; N549-T552 VanDerWaalsContact CG-OG1 3.29Å; N549-T552 PolarHBondContact OD1-N 2.91Å; N549-T552 VanDerWaalsContact OD1-N 3.15Å; N549-G553 VanDerWaalsContact O-CA 3.31Å; N549-G553 WeakPolarHBondContact O-CA 3.47Å; N549-G553 PolarHBondContact O-N 2.97Å; N549-E554 PolarHBondContact N-O 3.32Å; N549-E554 PolarHBondContact O-N 3.36Å
550	V	78	Confident	83.2	Confident	63 Å²	63	41 Å²	41	38%	0.382	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-35.4	-178.7	178.6	0	0	0	0	112	F533	F533-V550 HydrophobicContact CB-CG1 4.49Å
551	Q	75.1	Confident	83.3	Confident	170 Å²	170	40.1 Å²	40.1	79%	0.794	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-43.5	-175.8	-63.8	-178.8	-5.3	0	0	111.8	N549	N549-Q551 VanDerWaalsContact C-N 3.29Å; N549-Q551 PolarHBondContact O-N 2.96Å; N549-Q551 WeakPolarHBondContact OD1-CB 3.08Å; N549-Q551 PolarHBondContact OD1-N 3.07Å
552	T	79.9	Confident	83.2	Confident	59 Å²	59	38.7 Å²	38.7	36%	0.362	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-19.9	178.7	61.3	0	0	0	0	112.6	Q519 N549 E554	Q519-T552 PolarHBondContact NE2-O 3.41Å; Q519-T552 VanDerWaalsContact NE2-O 3.09Å; N549-T552 WeakPolarHBondContact CB-OG1 3.4Å; N549-T552 VanDerWaalsContact CG-OG1 3.29Å; N549-T552 PolarHBondContact OD1-N 2.91Å; N549-T552 VanDerWaalsContact OD1-N 3.15Å; T552-E554 VanDerWaalsContact OG1-CB 3.24Å; T552-E554 WeakPolarHBondContact OG1-CB 3.45Å; T552-E554 PolarHBondContact OG1-N 2.82Å
553	G	81	Confident	83	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	21.2	-169.9	0	0	0	0	0	112.4	I520 W548 N549	I520-G553 PolarHBondContact N-O 3.11Å; W548-G553 WeakPolarHBondContact CZ3-O 3.43Å; N549-G553 VanDerWaalsContact O-CA 3.31Å; N549-G553 WeakPolarHBondContact O-CA 3.47Å; N549-G553 PolarHBondContact O-N 2.97Å
554	E	86	Confident	83.2	Confident	53 Å²	53	39.5 Å²	39.5	25%	0.248	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.9	-174.5	-164.7	177.6	-147.5	0	0	111.2	C517 N549 T552 N620	C517-E554 HydrophobicContact CB-CG 3.96Å; C517-E554 VanDerWaalsContact CB-OE1 3.26Å; C517-E554 WeakPolarHBondContact CB-OE1 3.31Å; N549-E554 PolarHBondContact N-O 3.32Å; N549-E554 PolarHBondContact O-N 3.36Å; T552-E554 VanDerWaalsContact OG1-CB 3.24Å; T552-E554 WeakPolarHBondContact OG1-CB 3.45Å; T552-E554 PolarHBondContact OG1-N 2.82Å; E554-N620 PolarHBondContact OE2-ND2 2.81Å
555	V	88.4	Confident	83.4	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.5	170.9	174	0	0	0	0	108.2	C517 Y518 I520 S547 W548 V557 L569 F571	C517-V555 CarbonylContact C-O 3.55Å; C517-V555 VanDerWaalsContact CA-O 3.24Å; C517-V555 WeakPolarHBondContact CA-O 3.19Å; Y518-V555 PolarHBondContact N-O 2.68Å; Y518-V555 PolarHBondContact O-N 2.82Å; I520-V555 HydrophobicContact CD1-CG2 3.85Å; I520-V555 HydrophobicContact CG1-CB 4.4Å; I520-V555 HydrophobicContact CG1-CG2 3.44Å; I520-V555 VanDerWaalsContact CG1-CG2 3.44Å; S547-V555 WeakPolarHBondContact O-CA 3.41Å; W548-V555 HydrophobicContact CD2-CG2 4.47Å; W548-V555 HydrophobicContact CE3-CB 4.32Å; W548-V555 HydrophobicContact CE3-CG2 3.29Å; W548-V555 HydrophobicContact CZ3-CG2 3.49Å; W548-V555 VanDerWaalsContact CZ3-CG2 3.49Å; V555-V557 HydrophobicContact CG1-CG1 4.41Å; V555-L569 HydrophobicContact CG1-CD1 3.27Å; V555-F571 HydrophobicContact CG2-CE1 3.94Å; V555-F571 HydrophobicContact CG2-CZ 3.63Å
556	C	87	Confident	83.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138	174.5	-56.2	0	0	0	0	112.3	F515 W516 C517 F546 S547 L619 N620	F515-C556 HydrophobicContact CE1-CB 4.49Å; F515-C556 HydrophobicContact CE2-CB 3.66Å; F515-C556 HydrophobicContact CZ-CB 3.49Å; F515-C556 VanDerWaalsContact CZ-CB 3.49Å; W516-C556 CarbonylContact O-C 3.47Å; W516-C556 VanDerWaalsContact O-CA 3.26Å; W516-C556 WeakPolarHBondContact O-CA 3.25Å; C517-C556 HydrophobicContact CB-CB 4.17Å; C517-C556 WeakPolarHBondContact CB-SG 3.32Å; C517-C556 WeakPolarHBondContact SG-CB 3.42Å; C517-C556 CovalentContact SG-SG 2.03Å; C517-C556 PolarHBondContact SG-SG 2.71Å; F546-C556 CarbonylContact C-O 3.54Å; F546-C556 VanDerWaalsContact CA-O 3.25Å; F546-C556 WeakPolarHBondContact CA-O 3.49Å; F546-C556 WeakPolarHBondContact CB-O 3.43Å; S547-C556 PolarHBondContact N-O 3.33Å; S547-C556 PolarHBondContact O-N 3.46Å; C556-L619 HydrophobicContact CB-CB 4.36Å; C556-N620 PolarHBondContact SG-OD1 3.33Å
557	V	88.8	Confident	84.1	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	158.7	-179.9	-61.3	0	0	0	0	110.3	I510 W516 F546 V555 I567 L569 L588	I510-V557 HydrophobicContact CD1-CG2 4.09Å; W516-V557 HydrophobicContact CB-CG2 4.45Å; W516-V557 HydrophobicContact CE3-CG2 4.05Å; W516-V557 PolarHBondContact N-O 3.48Å; W516-V557 PolarHBondContact O-N 3.23Å; F546-V557 HydrophobicContact CB-CG1 3.88Å; V555-V557 HydrophobicContact CG1-CG1 4.41Å; V557-I567 HydrophobicContact CB-CD1 4.15Å; V557-I567 HydrophobicContact CG1-CG2 4.23Å; V557-I567 HydrophobicContact CG2-CD1 4.15Å; V557-L569 HydrophobicContact CG1-CD1 4.27Å; V557-L588 HydrophobicContact CB-CD1 4.43Å; V557-L588 HydrophobicContact CG1-CD1 3.97Å; V557-L588 HydrophobicContact CG2-CD1 3.62Å
558	I	85.3	Confident	84.5	Confident	7 Å²	7	38 Å²	38	4%	0.036	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	119.7	171.6	-56.3	161.9	0	0	0	107.6	F515 L619 L622 V648 I651	F515-I558 HydrophobicContact CD2-CG1 4.05Å; I558-L619 HydrophobicContact CD1-CD1 4.21Å; I558-L619 HydrophobicContact CD1-CD2 3.99Å; I558-L619 HydrophobicContact CD1-CG 4.14Å; I558-L619 HydrophobicContact CG1-CD2 3.82Å; I558-L619 HydrophobicContact CG1-CG 4.32Å; I558-L622 HydrophobicContact CD1-CD1 3.35Å; I558-L622 HydrophobicContact CG1-CD1 4.14Å; I558-V648 HydrophobicContact CG2-CB 4.4Å; I558-V648 HydrophobicContact CG2-CG1 4.16Å; I558-V648 HydrophobicContact CG2-CG2 4.23Å; I558-I651 HydrophobicContact CB-CD1 4.09Å; I558-I651 HydrophobicContact CG2-CD1 3.89Å; I558-I651 HydrophobicContact CG2-CG1 4.3Å
559	S	88.3	Confident	85	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.187	C	C	.	.			trans	-90.1	151.8	173	66.5	0	0	0	0	111.3	P511 P512 G513 I514	P511-S559 PolarHBondContact O-OG 3.3Å; P512-S559 VanDerWaalsContact C-OG 3.3Å; P512-S559 WeakPolarHBondContact CA-OG 3.38Å; G513-S559 CarbonylContact C-O 3.54Å; G513-S559 VanDerWaalsContact CA-O 3.24Å; G513-S559 WeakPolarHBondContact CA-O 3.47Å; G513-S559 PolarHBondContact N-O 2.81Å; G513-S559 PolarHBondContact N-OG 2.85Å; I514-S559 PolarHBondContact N-OG 3.26Å; I514-S559 PolarHBondContact O-N 2.85Å; I514-S559 PolarHBondContact O-OG 3.15Å
560	N	88	Confident	85.5	Confident	14 Å²	14	39.3 Å²	39.3	8%	0.075	20%	0.2	C	C	.	.			trans	-105	142.5	-178.2	-174.9	-31.1	0	0	0	109.7	K562 V592 Y649	N560-K562 WeakPolarHBondContact OD1-CA 3.21Å; N560-K562 VanDerWaalsContact OD1-CB 3.25Å; N560-K562 WeakPolarHBondContact OD1-CB 3.34Å; N560-K562 PolarHBondContact OD1-N 2.84Å; N560-V592 VanDerWaalsContact O-CG1 3.31Å; N560-V592 WeakPolarHBondContact O-CG1 3.46Å; N560-Y649 PolarHBondContact OD1-O 3.07Å
561	L	88.6	Confident	86.2	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.016	18%	0.183	C	C	.	.	S	Bend	trans	-94.3	-14	176.6	-167.4	61.3	0	0	0	113.8	P512 V592 P593 L598 V648 Y649 L673 L677	P512-L561 HydrophobicContact CB-CD1 3.74Å; P512-L561 HydrophobicContact CG-CD1 3.59Å; L561-V592 HydrophobicContact CD1-CB 4.47Å; L561-V592 VanDerWaalsContact O-CB 3.29Å; L561-V592 WeakPolarHBondContact O-CB 3.32Å; L561-V592 WeakPolarHBondContact O-CG1 3.25Å; L561-P593 HydrophobicContact CD1-CG 4.31Å; L561-L598 HydrophobicContact CD2-CD1 4.04Å; L561-L598 HydrophobicContact CD2-CD2 4.23Å; L561-L598 HydrophobicContact CG-CD1 4.49Å; L561-V648 PolarHBondContact N-O 3.48Å; L561-Y649 HydrophobicContact CB-CD2 4.23Å; L561-Y649 PolarHBondContact N-O 2.95Å; L561-L673 HydrophobicContact CD2-CD1 4.12Å; L561-L677 HydrophobicContact CD1-CD2 3.46Å; L561-L677 VanDerWaalsContact CD1-CD2 3.46Å; L561-L677 HydrophobicContact CD2-CD2 4.02Å; L561-L677 HydrophobicContact CG-CD2 4.41Å
562	K	85.8	Confident	86.9	Confident	90 Å²	90	31.4 Å²	31.4	39%	0.391	16%	0.159	S	C	.	.	S	Bend	trans	-77.3	-37.9	179.2	-175.3	-177.9	178.1	-178.4	0	113.3	N560 Y649 E650	N560-K562 WeakPolarHBondContact OD1-CA 3.21Å; N560-K562 VanDerWaalsContact OD1-CB 3.25Å; N560-K562 WeakPolarHBondContact OD1-CB 3.34Å; N560-K562 PolarHBondContact OD1-N 2.84Å; K562-Y649 HydrophobicContact CB-CD2 4.5Å; K562-Y649 HydrophobicContact CB-CE1 4.1Å; K562-Y649 HydrophobicContact CB-CE2 4.12Å; K562-Y649 WeakPolarHBondContact CB-O 3.39Å; K562-Y649 HydrophobicContact CD-CE1 4.07Å; K562-Y649 HydrophobicContact CG-CE1 4.14Å; K562-Y649 PolarHBondContact N-O 2.97Å; K562-E650 HydrophobicContact CD-CB 4.23Å; K562-E650 HydrophobicContact CD-CG 4.03Å; K562-E650 WeakPolarHBondContact CD-OE1 3.18Å; K562-E650 VanDerWaalsContact CD-OE2 3.25Å; K562-E650 WeakPolarHBondContact CD-OE2 3.44Å; K562-E650 IonicContact NZ-OE1 3.33Å; K562-E650 PolarHBondContact NZ-OE1 2.97Å; K562-E650 IonicContact NZ-OE2 2.77Å; K562-E650 PolarHBondContact NZ-OE2 2.96Å
563	I	80.5	Confident	87.5	Confident	87 Å²	87	28.6 Å²	28.6	45%	0.446	14%	0.142	S	C	.	.	S	Bend	trans	-131.4	131.4	-172.3	-53.2	175.6	0	0	0	109.3	Q565 V592	I563-Q565 PolarHBondContact O-N 2.85Å; I563-V592 WeakPolarHBondContact O-CG1 3.32Å
564	S	84	Confident	87.8	Confident	55 Å²	55	29.7 Å²	29.7	39%	0.385	15%	0.149	S	C	.	.			trans	-66	126.5	170	-71.5	0	0	0	0	109.1	A590 V592	S564-A590 WeakPolarHBondContact CA-O 3.15Å; S564-V592 PolarHBondContact OG-N 3.42Å; S564-V592 VanDerWaalsContact OG-N 3.07Å
565	Q	83.9	Confident	87.8	Confident	47 Å²	47	28 Å²	28	22%	0.22	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	150.2	-175	64.3	-175.3	20	0	0	111.5	I563 I567 A590	I563-Q565 PolarHBondContact O-N 2.85Å; Q565-I567 HydrophobicContact CG-CG1 4.38Å; Q565-A590 HydrophobicContact CG-CB 4.49Å; Q565-A590 PolarHBondContact N-O 2.87Å; Q565-A590 VanDerWaalsContact N-O 3.16Å; Q565-A590 PolarHBondContact O-N 3.12Å
566	I	86.5	Confident	87.2	Confident	56 Å²	56	31.9 Å²	31.9	29%	0.287	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115	169.5	-59.2	174.7	0	0	0	106	R587 L588 L1678	I566-R587 HydrophobicContact CG2-CB 4.06Å; I566-R587 HydrophobicContact CG2-CG 4.4Å; I566-L588 CarbonylContact C-O 3.56Å; I566-L588 WeakPolarHBondContact CA-O 3.42Å; I566-L1678 HydrophobicContact CD1-CD2 4.11Å
567	I	86.8	Confident	86.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.4	176.8	-57.5	165.9	0	0	0	107.4	V557 Q565 R587 L588	V557-I567 HydrophobicContact CB-CD1 4.15Å; V557-I567 HydrophobicContact CG1-CG2 4.23Å; V557-I567 HydrophobicContact CG2-CD1 4.15Å; Q565-I567 HydrophobicContact CG-CG1 4.38Å; I567-R587 CarbonylContact O-C 3.36Å; I567-R587 WeakPolarHBondContact O-CA 3.48Å; I567-L588 HydrophobicContact CB-CB 4.22Å; I567-L588 PolarHBondContact N-O 2.82Å; I567-L588 PolarHBondContact O-N 3.26Å
568	T	90.6	Very high	86.2	Confident	17 Å²	17	41.9 Å²	41.9	10%	0.104	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.6	-177.5	-45	0	0	0	0	110.3	G542 D543 F570 E585 R587	G542-T568 WeakPolarHBondContact CA-O 3.23Å; D543-T568 VanDerWaalsContact CG-N 3.26Å; D543-T568 PolarHBondContact N-O 3.1Å; D543-T568 PolarHBondContact OD1-N 3.02Å; D543-T568 VanDerWaalsContact OD2-CB 3.24Å; D543-T568 WeakPolarHBondContact OD2-CB 3.46Å; D543-T568 PolarHBondContact OD2-N 2.87Å; D543-T568 PolarHBondContact OD2-OG1 3.39Å; D543-T568 VanDerWaalsContact OD2-OG1 3.13Å; T568-F570 HydrophobicContact CG2-CD2 4.26Å; T568-F570 HydrophobicContact CG2-CE1 4.09Å; T568-F570 HydrophobicContact CG2-CE2 3.55Å; T568-F570 HydrophobicContact CG2-CZ 3.46Å; T568-F570 VanDerWaalsContact CG2-CZ 3.46Å; T568-E585 HydrophobicContact CG2-CG 3.82Å; T568-R587 HydrophobicContact CG2-CG 4.05Å
569	L	91.2	Very high	85.8	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129	174.9	-60.6	173.4	0	0	0	109.6	K541 F546 V555 V557 F571 F586 L588	K541-L569 CarbonylContact O-C 3.52Å; K541-L569 VanDerWaalsContact O-CA 3.32Å; K541-L569 WeakPolarHBondContact O-CA 3.13Å; F546-L569 HydrophobicContact CB-CD2 4.06Å; F546-L569 HydrophobicContact CD1-CD2 3.75Å; F546-L569 HydrophobicContact CD2-CD2 3.93Å; F546-L569 HydrophobicContact CE1-CD2 4.16Å; F546-L569 HydrophobicContact CE2-CD2 4.32Å; F546-L569 HydrophobicContact CG-CD2 3.63Å; F546-L569 HydrophobicContact CZ-CD2 4.43Å; V555-L569 HydrophobicContact CG1-CD1 3.27Å; V557-L569 HydrophobicContact CG1-CD1 4.27Å; L569-F571 HydrophobicContact CB-CE2 3.8Å; L569-F571 HydrophobicContact CB-CZ 4.27Å; L569-F586 HydrophobicContact CB-CB 4.39Å; L569-F586 HydrophobicContact CD1-CD1 4.2Å; L569-F586 PolarHBondContact N-O 3.44Å; L569-F586 PolarHBondContact O-N 2.76Å; L569-L588 HydrophobicContact CD1-CD1 4.5Å
570	F	92	Very high	85.7	Confident	104 Å²	104	44.1 Å²	44.1	46%	0.456	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	118	178	-62.9	-82.6	0	0	0	109.3	V540 K541 T568 I584 E585	V540-F570 WeakPolarHBondContact CA-O 3.41Å; K541-F570 PolarHBondContact N-O 3.42Å; K541-F570 PolarHBondContact O-N 2.7Å; T568-F570 HydrophobicContact CG2-CD2 4.26Å; T568-F570 HydrophobicContact CG2-CE1 4.09Å; T568-F570 HydrophobicContact CG2-CE2 3.55Å; T568-F570 HydrophobicContact CG2-CZ 3.46Å; T568-F570 VanDerWaalsContact CG2-CZ 3.46Å; F570-I584 CarbonylContact C-O 3.58Å; F570-I584 WeakPolarHBondContact CA-O 3.31Å; F570-E585 HydrophobicContact CD1-CB 4.21Å; F570-E585 HydrophobicContact CD1-CG 4.14Å; F570-E585 HydrophobicContact CE1-CB 4.09Å; F570-E585 HydrophobicContact CE1-CG 3.63Å; F570-E585 HydrophobicContact CZ-CG 4.29Å
571	F	91.9	Very high	85.7	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.3	172.9	-57.1	-101.6	0	0	0	108.5	I520 F525 L538 V540 W548 V555 L569 E583 I584 F586	I520-F571 HydrophobicContact CD1-CE1 4.47Å; I520-F571 HydrophobicContact CD1-CE2 4.49Å; I520-F571 HydrophobicContact CD1-CZ 3.98Å; I520-F571 HydrophobicContact CG1-CE1 4.2Å; I520-F571 HydrophobicContact CG1-CZ 4.17Å; F525-F571 HydrophobicContact CE1-CB 4.41Å; F525-F571 HydrophobicContact CZ-CB 4.18Å; L538-F571 HydrophobicContact CD1-CB 4.27Å; L538-F571 HydrophobicContact CD1-CD1 4.38Å; V540-F571 HydrophobicContact CB-CD1 4.35Å; V540-F571 HydrophobicContact CB-CE1 4.36Å; V540-F571 HydrophobicContact CG1-CD1 3.99Å; V540-F571 HydrophobicContact CG1-CE1 3.69Å; V540-F571 HydrophobicContact CG1-CG 4.48Å; V540-F571 HydrophobicContact CG1-CZ 3.95Å; V540-F571 HydrophobicContact CG2-CD1 3.47Å; V540-F571 VanDerWaalsContact CG2-CD1 3.47Å; V540-F571 HydrophobicContact CG2-CE1 3.66Å; V540-F571 HydrophobicContact CG2-CG 4.38Å; W548-F571 HydrophobicContact CE3-CE1 4.25Å; W548-F571 HydrophobicContact CH2-CE1 4.45Å; W548-F571 HydrophobicContact CZ3-CE1 4.12Å; V555-F571 HydrophobicContact CG2-CE1 3.94Å; V555-F571 HydrophobicContact CG2-CZ 3.63Å; L569-F571 HydrophobicContact CB-CE2 3.8Å; L569-F571 HydrophobicContact CB-CZ 4.27Å; F571-E583 CarbonylContact O-C 3.47Å; F571-E583 WeakPolarHBondContact O-CA 3.12Å; F571-I584 HydrophobicContact CB-CB 4.08Å; F571-I584 HydrophobicContact CD2-CB 4.3Å; F571-I584 PolarHBondContact N-O 3.17Å; F571-I584 PolarHBondContact O-N 3.1Å; F571-F586 HydrophobicContact CD2-CB 4.38Å; F571-F586 HydrophobicContact CE2-CB 3.85Å; F571-F586 HydrophobicContact CE2-CD1 4.22Å; F571-F586 HydrophobicContact CE2-CG 4.49Å
572	H	91.3	Very high	85.8	Confident	64 Å²	64	44.3 Å²	44.3	30%	0.296	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	108.3	169.1	175.6	-108.6	0	0	0	107.8	L538 E539 T574	L538-H572 WeakPolarHBondContact CA-O 3.39Å; E539-H572 PolarHBondContact N-O 3.25Å; E539-H572 PolarHBondContact O-N 3.37Å; H572-T574 WeakPolarHBondContact CE1-CG2 3.16Å
573	A	90.7	Very high	86.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.2	177.2	0	0	0	0	0	109.7	F525 L528 L536 D537 L538 S581 V582	F525-A573 HydrophobicContact CD1-CB 3.38Å; F525-A573 HydrophobicContact CE1-CB 3.41Å; F525-A573 VanDerWaalsContact CE1-CB 3.41Å; F525-A573 HydrophobicContact CG-CB 4.39Å; F525-A573 HydrophobicContact CZ-CB 4.44Å; L528-A573 HydrophobicContact CD1-CB 3.66Å; L536-A573 HydrophobicContact CD1-CB 4.29Å; D537-A573 CarbonylContact O-C 3.49Å; D537-A573 WeakPolarHBondContact O-CA 3.41Å; L538-A573 HydrophobicContact CD1-CB 3.63Å; A573-S581 CarbonylContact O-C 3.36Å; A573-S581 WeakPolarHBondContact O-CA 3.4Å; A573-S581 WeakPolarHBondContact O-CB 3.21Å; A573-V582 PolarHBondContact N-O 3.48Å; A573-V582 PolarHBondContact O-N 2.71Å
574	T	88.2	Confident	86.7	Confident	24 Å²	24	38.3 Å²	38.3	15%	0.147	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	143.3	171	80.6	0	0	0	0	111.1	D537 H572 Q580	D537-T574 PolarHBondContact N-O 3.4Å; D537-T574 PolarHBondContact O-N 3.41Å; H572-T574 WeakPolarHBondContact CE1-CG2 3.16Å; T574-Q580 WeakPolarHBondContact CA-O 3.47Å
575	N	85.8	Confident	87.1	Confident	18 Å²	18	38 Å²	38	10%	0.096	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	102.3	167.6	-176.1	-26.7	0	0	0	108.2	L528 L536 K577 L578 A579 Q580	L528-N575 HydrophobicContact CB-CB 4.1Å; L528-N575 HydrophobicContact CD2-CB 4.23Å; L528-N575 PolarHBondContact O-ND2 3.19Å; L536-N575 HydrophobicContact CD2-CB 4.25Å; N575-K577 PolarHBondContact O-N 3.4Å; N575-K577 WeakPolarHBondContact OD1-CB 3.43Å; N575-K577 PolarHBondContact OD1-N 2.8Å; N575-L578 HydrophobicContact CB-CB 4.24Å; N575-L578 CarbonylContact O-C 3.52Å; N575-L578 PolarHBondContact O-N 3.01Å; N575-L578 PolarHBondContact OD1-N 3.45Å; N575-A579 PolarHBondContact O-N 2.74Å; N575-Q580 PolarHBondContact N-O 2.99Å
576	A	76.8	Confident	87.5	Confident	80 Å²	80	36 Å²	36	66%	0.661	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-36.4	-178.6	0	0	0	0	0	112.6	L578 A579	A576-L578 VanDerWaalsContact C-N 3.31Å; A576-L578 PolarHBondContact O-N 2.67Å; A576-A579 PolarHBondContact O-N 3.31Å
577	K	76.8	Confident	87.7	Confident	175 Å²	175	37.7 Å²	37.7	76%	0.761	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-26	177.9	-67.2	-173.9	-179.7	-177.7	0	113	Y391 N575	Y391-K577 PolarHBondContact OH-O 2.89Å; N575-K577 PolarHBondContact O-N 3.4Å; N575-K577 WeakPolarHBondContact OD1-CB 3.43Å; N575-K577 PolarHBondContact OD1-N 2.8Å
578	L	76.8	Confident	87.9	Confident	36 Å²	36	37.7 Å²	37.7	19%	0.188	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-8.7	178.7	-64.5	178.4	0	0	0	113	Y391 L528 K529 N575 A576 Q580	Y391-L578 VanDerWaalsContact CE2-O 3.3Å; Y391-L578 WeakPolarHBondContact CE2-O 3.48Å; L528-L578 VanDerWaalsContact O-CD1 3.28Å; L528-L578 WeakPolarHBondContact O-CD1 3.29Å; K529-L578 HydrophobicContact CB-CD1 4.06Å; K529-L578 HydrophobicContact CD-CD1 4.3Å; K529-L578 HydrophobicContact CG-CD1 4.28Å; N575-L578 HydrophobicContact CB-CB 4.24Å; N575-L578 CarbonylContact O-C 3.52Å; N575-L578 PolarHBondContact O-N 3.01Å; N575-L578 PolarHBondContact OD1-N 3.45Å; A576-L578 VanDerWaalsContact C-N 3.31Å; A576-L578 PolarHBondContact O-N 2.67Å; L578-Q580 HydrophobicContact CB-CB 4.22Å; L578-Q580 HydrophobicContact CB-CG 4.3Å; L578-Q580 PolarHBondContact O-N 3.25Å; L578-Q580 VanDerWaalsContact O-N 3.07Å
579	A	77.9	Confident	87.7	Confident	10 Å²	10	38 Å²	38	8%	0.083	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	24.4	-167.9	0	0	0	0	0	114	V390 P468 R498 P499 N575 A576	V390-A579 HydrophobicContact CB-CB 4.06Å; V390-A579 HydrophobicContact CG1-CB 3.88Å; V390-A579 HydrophobicContact CG2-CB 4Å; P468-A579 HydrophobicContact CB-CB 3.88Å; P468-A579 HydrophobicContact CG-CB 3.89Å; R498-A579 HydrophobicContact CG-CB 4.43Å; P499-A579 WeakPolarHBondContact CD-O 3.5Å; N575-A579 PolarHBondContact O-N 2.74Å; A576-A579 PolarHBondContact O-N 3.31Å
580	Q	84.9	Confident	87.5	Confident	45 Å²	45	38 Å²	38	21%	0.21	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	147.7	178.9	-74.9	178.2	-19.1	0	0	109.9	P499 E527 L528 T574 N575 L578	P499-Q580 HydrophobicContact CG-CG 3.71Å; E527-Q580 PolarHBondContact O-OE1 2.9Å; L528-Q580 HydrophobicContact CD2-CB 3.64Å; L528-Q580 WeakPolarHBondContact CD2-O 3.32Å; T574-Q580 WeakPolarHBondContact CA-O 3.47Å; N575-Q580 PolarHBondContact N-O 2.99Å; L578-Q580 HydrophobicContact CB-CB 4.22Å; L578-Q580 HydrophobicContact CB-CG 4.3Å; L578-Q580 PolarHBondContact O-N 3.25Å; L578-Q580 VanDerWaalsContact O-N 3.07Å
581	S	88.8	Confident	87.1	Confident	20 Å²	20	37.7 Å²	37.7	14%	0.14	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.4	174.1	54	0	0	0	0	111.6	P501 F502 A573	P501-S581 WeakPolarHBondContact CA-O 3.48Å; P501-S581 WeakPolarHBondContact CB-OG 3.41Å; F502-S581 PolarHBondContact N-O 3.1Å; A573-S581 CarbonylContact O-C 3.36Å; A573-S581 WeakPolarHBondContact O-CA 3.4Å; A573-S581 WeakPolarHBondContact O-CB 3.21Å
582	V	90.8	Very high	86.7	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	128.9	173.1	175.5	0	0	0	0	107	F502 F525 E527 L528 A573 I584	F502-V582 HydrophobicContact CB-CG2 4.07Å; F502-V582 HydrophobicContact CD2-CG2 4.26Å; F502-V582 CarbonylContact O-C 3.57Å; F502-V582 WeakPolarHBondContact O-CA 3.44Å; F525-V582 HydrophobicContact CD1-CB 4.06Å; F525-V582 HydrophobicContact CD1-CG1 4.06Å; F525-V582 HydrophobicContact CE1-CG1 4.4Å; E527-V582 HydrophobicContact CB-CG2 4.2Å; L528-V582 HydrophobicContact CD1-CB 4.25Å; L528-V582 HydrophobicContact CD1-CG2 3.91Å; L528-V582 HydrophobicContact CD2-CG2 3.81Å; L528-V582 HydrophobicContact CG-CB 4.43Å; L528-V582 HydrophobicContact CG-CG2 3.56Å; A573-V582 PolarHBondContact N-O 3.48Å; A573-V582 PolarHBondContact O-N 2.71Å; V582-I584 HydrophobicContact CG1-CD1 3.98Å; V582-I584 HydrophobicContact CG1-CG1 3.65Å
583	E	92.1	Very high	86.2	Confident	49 Å²	49	37.2 Å²	37.2	23%	0.229	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	121.2	174.2	-74.3	173.4	178.8	0	0	108.1	P501 F502 R503 K504 F571	P501-E583 HydrophobicContact CB-CB 4.45Å; P501-E583 HydrophobicContact CB-CG 3.83Å; P501-E583 HydrophobicContact CG-CG 4.34Å; F502-E583 PolarHBondContact O-N 3.44Å; R503-E583 CarbonylContact C-O 3.46Å; R503-E583 VanDerWaalsContact CA-O 3.3Å; R503-E583 WeakPolarHBondContact CA-O 3.24Å; R503-E583 HydrophobicContact CG-CB 4.13Å; R503-E583 IonicContact CZ-OE2 2.68Å; R503-E583 IonicContact NE-OE2 2.8Å; R503-E583 PolarHBondContact NE-OE2 2.81Å; R503-E583 IonicContact NH2-OE2 3.09Å; R503-E583 PolarHBondContact NH2-OE2 3.31Å; K504-E583 PolarHBondContact N-O 3.2Å; F571-E583 CarbonylContact O-C 3.47Å; F571-E583 WeakPolarHBondContact O-CA 3.12Å
584	I	91.9	Very high	85.7	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.015	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124	-179.9	-48.8	-175.2	0	0	0	109.7	K504 F506 W524 F525 F570 F571 V582	K504-I584 HydrophobicContact CB-CG1 4.35Å; K504-I584 HydrophobicContact CB-CG2 4.42Å; K504-I584 WeakPolarHBondContact O-CA 3.25Å; F506-I584 HydrophobicContact CD2-CG2 3.37Å; F506-I584 HydrophobicContact CE2-CD1 4.34Å; F506-I584 HydrophobicContact CE2-CG2 3.53Å; W524-I584 HydrophobicContact CB-CD1 3.71Å; W524-I584 HydrophobicContact CD2-CD1 4.39Å; W524-I584 HydrophobicContact CE3-CD1 3.9Å; W524-I584 HydrophobicContact CE3-CG2 4.08Å; W524-I584 HydrophobicContact CG-CD1 4.36Å; W524-I584 HydrophobicContact CZ3-CG2 4.23Å; F525-I584 HydrophobicContact CD1-CD1 4.13Å; F525-I584 HydrophobicContact CE1-CD1 3.56Å; F525-I584 HydrophobicContact CE1-CG1 4.21Å; F525-I584 HydrophobicContact CE2-CD1 4.31Å; F525-I584 HydrophobicContact CZ-CD1 3.68Å; F570-I584 CarbonylContact C-O 3.58Å; F570-I584 WeakPolarHBondContact CA-O 3.31Å; F571-I584 HydrophobicContact CB-CB 4.08Å; F571-I584 HydrophobicContact CD2-CB 4.3Å; F571-I584 PolarHBondContact N-O 3.17Å; F571-I584 PolarHBondContact O-N 3.1Å; V582-I584 HydrophobicContact CG1-CD1 3.98Å; V582-I584 HydrophobicContact CG1-CG1 3.65Å
585	E	92.4	Very high	85.4	Confident	48 Å²	48	40.6 Å²	40.6	22%	0.224	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	112.7	168	-175.9	178.8	-173.3	0	0	109.5	K504 N505 F506 T568 F570 R587	K504-E585 PolarHBondContact O-N 3.17Å; N505-E585 CarbonylContact C-O 3.11Å; N505-E585 VanDerWaalsContact CA-O 3.29Å; N505-E585 WeakPolarHBondContact CA-O 3.28Å; F506-E585 PolarHBondContact N-O 3.49Å; T568-E585 HydrophobicContact CG2-CG 3.82Å; F570-E585 HydrophobicContact CD1-CB 4.21Å; F570-E585 HydrophobicContact CD1-CG 4.14Å; F570-E585 HydrophobicContact CE1-CB 4.09Å; F570-E585 HydrophobicContact CE1-CG 3.63Å; F570-E585 HydrophobicContact CZ-CG 4.29Å; E585-R587 HydrophobicContact CG-CG 4.26Å; E585-R587 IonicContact OE1-CZ 2.88Å; E585-R587 IonicContact OE1-NE 2.72Å; E585-R587 PolarHBondContact OE1-NE 3.03Å; E585-R587 IonicContact OE1-NH2 2.76Å; E585-R587 PolarHBondContact OE1-NH2 3.09Å; E585-R587 IonicContact OE2-NH2 3.77Å
586	F	93	Very high	85.2	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	110.8	179	-176.9	-140.7	0	0	0	110.3	F506 L508 W516 Y518 I520 W524 L569 F571 L588	F506-F586 HydrophobicContact CB-CD2 3.7Å; F506-F586 HydrophobicContact CB-CE2 4.27Å; F506-F586 CarbonylContact O-C 3.58Å; F506-F586 WeakPolarHBondContact O-CA 3.31Å; L508-F586 HydrophobicContact CB-CE2 3.96Å; L508-F586 HydrophobicContact CB-CZ 4.34Å; L508-F586 HydrophobicContact CD2-CZ 4.3Å; W516-F586 HydrophobicContact CH2-CE1 4.48Å; W516-F586 HydrophobicContact CH2-CZ 4.12Å; W516-F586 HydrophobicContact CZ3-CE1 4.39Å; W516-F586 HydrophobicContact CZ3-CZ 4.44Å; Y518-F586 HydrophobicContact CD1-CE1 4.39Å; Y518-F586 HydrophobicContact CD1-CZ 4.19Å; Y518-F586 HydrophobicContact CE1-CZ 4.48Å; I520-F586 HydrophobicContact CD1-CD1 4.23Å; I520-F586 HydrophobicContact CD1-CE1 4.11Å; W524-F586 HydrophobicContact CH2-CD1 4.33Å; W524-F586 AromaticContact CH2-CD2 3.82Å; W524-F586 HydrophobicContact CH2-CD2 3.82Å; W524-F586 HydrophobicContact CH2-CE1 4.4Å; W524-F586 AromaticContact CH2-CE2 3.87Å; W524-F586 HydrophobicContact CH2-CE2 3.87Å; W524-F586 HydrophobicContact CH2-CG 4.03Å; W524-F586 HydrophobicContact CH2-CZ 4.15Å; W524-F586 HydrophobicContact CZ3-CB 4.41Å; W524-F586 HydrophobicContact CZ3-CD2 4.41Å; W524-F586 HydrophobicContact CZ3-CG 4.22Å; L569-F586 HydrophobicContact CB-CB 4.39Å; L569-F586 HydrophobicContact CD1-CD1 4.2Å; L569-F586 PolarHBondContact N-O 3.44Å; L569-F586 PolarHBondContact O-N 2.76Å; F571-F586 HydrophobicContact CD2-CB 4.38Å; F571-F586 HydrophobicContact CE2-CB 3.85Å; F571-F586 HydrophobicContact CE2-CD1 4.22Å; F571-F586 HydrophobicContact CE2-CG 4.49Å; F586-L588 HydrophobicContact CD1-CD2 4.38Å; F586-L588 HydrophobicContact CD1-CG 4.44Å; F586-L588 HydrophobicContact CE1-CD1 4.26Å; F586-L588 HydrophobicContact CE1-CD2 3.63Å; F586-L588 HydrophobicContact CE1-CG 4.07Å; F586-L588 HydrophobicContact CE2-CD2 3.87Å; F586-L588 HydrophobicContact CZ-CD2 3.35Å; F586-L588 HydrophobicContact CZ-CG 4.24Å
587	R	91.3	Very high	85.4	Confident	92 Å²	92	42.1 Å²	42.1	35%	0.347	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	123.6	-179.4	-62.6	-179.2	-178.7	-176.4	1.9	110.6	F506 I507 L508 I566 I567 T568 E585	F506-R587 PolarHBondContact O-N 2.77Å; I507-R587 CarbonylContact C-O 3.45Å; I507-R587 VanDerWaalsContact CA-O 3.31Å; I507-R587 WeakPolarHBondContact CA-O 3.25Å; I507-R587 HydrophobicContact CG1-CB 4.21Å; I507-R587 HydrophobicContact CG2-CB 4.42Å; L508-R587 PolarHBondContact N-O 2.74Å; I566-R587 HydrophobicContact CG2-CB 4.06Å; I566-R587 HydrophobicContact CG2-CG 4.4Å; I567-R587 CarbonylContact O-C 3.36Å; I567-R587 WeakPolarHBondContact O-CA 3.48Å; T568-R587 HydrophobicContact CG2-CG 4.05Å; E585-R587 HydrophobicContact CG-CG 4.26Å; E585-R587 IonicContact OE1-CZ 2.88Å; E585-R587 IonicContact OE1-NE 2.72Å; E585-R587 PolarHBondContact OE1-NE 3.03Å; E585-R587 IonicContact OE1-NH2 2.76Å; E585-R587 PolarHBondContact OE1-NH2 3.09Å; E585-R587 IonicContact OE2-NH2 3.77Å
588	L	90.1	Very high	85.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115	174.2	-59.7	171.9	0	0	0	108.9	L508 I510 W516 V557 I566 I567 L569 F586	L508-L588 HydrophobicContact CB-CD2 3.97Å; L508-L588 HydrophobicContact CD2-CD2 4.22Å; L508-L588 CarbonylContact O-C 3.54Å; L508-L588 WeakPolarHBondContact O-CA 3.42Å; I510-L588 HydrophobicContact CD1-CB 3.99Å; I510-L588 HydrophobicContact CD1-CD1 4.45Å; I510-L588 HydrophobicContact CG1-CB 4.35Å; I510-L588 HydrophobicContact CG2-CD2 4.04Å; W516-L588 HydrophobicContact CE3-CD1 4.08Å; W516-L588 HydrophobicContact CE3-CD2 4.38Å; W516-L588 HydrophobicContact CH2-CD2 3.77Å; W516-L588 HydrophobicContact CZ3-CD1 3.74Å; W516-L588 HydrophobicContact CZ3-CD2 3.57Å; W516-L588 HydrophobicContact CZ3-CG 4.32Å; V557-L588 HydrophobicContact CB-CD1 4.43Å; V557-L588 HydrophobicContact CG1-CD1 3.97Å; V557-L588 HydrophobicContact CG2-CD1 3.62Å; I566-L588 CarbonylContact C-O 3.56Å; I566-L588 WeakPolarHBondContact CA-O 3.42Å; I567-L588 HydrophobicContact CB-CB 4.22Å; I567-L588 PolarHBondContact N-O 2.82Å; I567-L588 PolarHBondContact O-N 3.26Å; L569-L588 HydrophobicContact CD1-CD1 4.5Å; F586-L588 HydrophobicContact CD1-CD2 4.38Å; F586-L588 HydrophobicContact CD1-CG 4.44Å; F586-L588 HydrophobicContact CE1-CD1 4.26Å; F586-L588 HydrophobicContact CE1-CD2 3.63Å; F586-L588 HydrophobicContact CE1-CG 4.07Å; F586-L588 HydrophobicContact CE2-CD2 3.87Å; F586-L588 HydrophobicContact CZ-CD2 3.35Å; F586-L588 HydrophobicContact CZ-CG 4.24Å
589	S	87.4	Confident	86.4	Confident	23 Å²	23	33 Å²	33	16%	0.161	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.8	179.3	-178.8	0	0	0	0	110.5	L508 R509 I510	L508-S589 PolarHBondContact O-N 2.77Å; R509-S589 WeakPolarHBondContact CA-O 3.39Å; I510-S589 PolarHBondContact N-O 2.83Å
590	A	87.4	Confident	87	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	108.9	172.4	0	0	0	0	0	109.1	I510 P512 S564 Q565	I510-A590 HydrophobicContact CG1-CB 4.19Å; P512-A590 HydrophobicContact CB-CB 4.35Å; S564-A590 WeakPolarHBondContact CA-O 3.15Å; Q565-A590 HydrophobicContact CG-CB 4.49Å; Q565-A590 PolarHBondContact N-O 2.87Å; Q565-A590 VanDerWaalsContact N-O 3.16Å; Q565-A590 PolarHBondContact O-N 3.12Å
591	K	82.1	Confident	87	Confident	99 Å²	99	32.4 Å²	32.4	43%	0.43	17%	0.167	S	C	.	.	P	Polyproline II helix	trans	-94.2	122.8	177	-174.2	-173.9	174.3	-153.5	0	108.9	P512 D680	P512-K591 WeakPolarHBondContact CG-O 3.38Å; K591-D680 IonicContact NZ-OD1 2.73Å; K591-D680 PolarHBondContact NZ-OD1 3.31Å
592	V	84.6	Confident	87	Confident	28 Å²	28	31.6 Å²	31.6	17%	0.17	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-95.4	141.2	-178.5	-52.2	0	0	0	0	111.5	P512 N560 L561 I563 S564	P512-V592 HydrophobicContact CB-CB 4.46Å; P512-V592 HydrophobicContact CB-CG1 3.69Å; P512-V592 HydrophobicContact CG-CG1 4.5Å; N560-V592 VanDerWaalsContact O-CG1 3.31Å; N560-V592 WeakPolarHBondContact O-CG1 3.46Å; L561-V592 HydrophobicContact CD1-CB 4.47Å; L561-V592 VanDerWaalsContact O-CB 3.29Å; L561-V592 WeakPolarHBondContact O-CB 3.32Å; L561-V592 WeakPolarHBondContact O-CG1 3.25Å; I563-V592 WeakPolarHBondContact O-CG1 3.32Å; S564-V592 PolarHBondContact OG-N 3.42Å; S564-V592 VanDerWaalsContact OG-N 3.07Å
593	P	80.7	Confident	87.1	Confident	27 Å²	27	33 Å²	33	18%	0.175	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-72.2	160.7	166.9	32.1	-34.5	0	0	0	110.8	L561 L597 L598 L677 P678	L561-P593 HydrophobicContact CD1-CG 4.31Å; P593-L597 HydrophobicContact CB-CD1 4.35Å; P593-L598 HydrophobicContact CG-CD2 3.96Å; P593-L677 HydrophobicContact CG-CD2 4.32Å; P593-P678 HydrophobicContact CB-CG 3.46Å; P593-P678 VanDerWaalsContact CB-CG 3.46Å; P593-P678 HydrophobicContact CG-CG 3.74Å
594	S	79.6	Confident	87.2	Confident	57 Å²	57	30.8 Å²	30.8	40%	0.399	16%	0.157	S	C	.	.	P	Polyproline II helix	trans	-66.4	145.2	175.1	64.4	0	0	0	0	110.6	Q596 L597	S594-Q596 PolarHBondContact O-N 3.16Å; S594-L597 PolarHBondContact O-N 3.14Å; S594-L597 WeakPolarHBondContact OG-CD1 3.48Å; S594-L597 WeakPolarHBondContact OG-CG 3.46Å
595	V	83.1	Confident	87.4	Confident	38 Å²	38	33.7 Å²	33.7	23%	0.23	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-55.8	-29.5	-178.4	70.4	0	0	0	0	112.5	L597 L598 L765 N767 S768	V595-L597 PolarHBondContact O-N 3.21Å; V595-L598 HydrophobicContact CG2-CD1 4.28Å; V595-L598 WeakPolarHBondContact O-CB 3.35Å; V595-L598 PolarHBondContact O-N 3.34Å; V595-L598 VanDerWaalsContact O-N 3.08Å; V595-L765 HydrophobicContact CG2-CD1 4.19Å; V595-L765 HydrophobicContact CG2-CD2 4.06Å; V595-L765 HydrophobicContact CG2-CG 4.03Å; V595-N767 HydrophobicContact CG1-CB 4.05Å; V595-S768 WeakPolarHBondContact O-CA 3.31Å
596	Q	80.4	Confident	87.4	Confident	105 Å²	105	31.4 Å²	31.4	49%	0.491	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-65.5	-19	179.7	-63.4	165.1	-10	0	0	113.5	S594 N767 A769 L772	S594-Q596 PolarHBondContact O-N 3.16Å; Q596-N767 WeakPolarHBondContact CA-O 3.38Å; Q596-N767 WeakPolarHBondContact CG-O 3.49Å; Q596-A769 WeakPolarHBondContact O-CA 3.35Å; Q596-A769 VanDerWaalsContact O-CB 3.23Å; Q596-A769 WeakPolarHBondContact O-CB 3.48Å; Q596-A769 PolarHBondContact O-N 3.03Å; Q596-L772 HydrophobicContact CB-CD1 4.4Å; Q596-L772 HydrophobicContact CG-CD1 4.11Å
597	L	80.6	Confident	87.4	Confident	26 Å²	26	33.4 Å²	33.4	14%	0.136	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-91.5	-10.2	177.2	-55.7	172	0	0	0	112.4	P593 S594 V595 V599 P678 I684	P593-L597 HydrophobicContact CB-CD1 4.35Å; S594-L597 PolarHBondContact O-N 3.14Å; S594-L597 WeakPolarHBondContact OG-CD1 3.48Å; S594-L597 WeakPolarHBondContact OG-CG 3.46Å; V595-L597 PolarHBondContact O-N 3.21Å; L597-V599 PolarHBondContact O-N 2.9Å; L597-P678 HydrophobicContact CB-CB 4.44Å; L597-P678 HydrophobicContact CB-CG 3.99Å; L597-I684 HydrophobicContact CB-CD1 4.41Å; L597-I684 HydrophobicContact CD2-CB 3.57Å; L597-I684 HydrophobicContact CD2-CD1 3.86Å; L597-I684 HydrophobicContact CD2-CG1 3.45Å; L597-I684 VanDerWaalsContact CD2-CG1 3.45Å
598	L	86.6	Confident	87.3	Confident	2 Å²	2	29 Å²	29	1%	0.01	15%	0.149	C	C	.	.			trans	-78.6	111.8	-178.3	-57.1	-177.3	0	0	0	109.9	L561 P593 V595 T600 Y649 L673 L765 A769	L561-L598 HydrophobicContact CD2-CD1 4.04Å; L561-L598 HydrophobicContact CD2-CD2 4.23Å; L561-L598 HydrophobicContact CG-CD1 4.49Å; P593-L598 HydrophobicContact CG-CD2 3.96Å; V595-L598 HydrophobicContact CG2-CD1 4.28Å; V595-L598 WeakPolarHBondContact O-CB 3.35Å; V595-L598 PolarHBondContact O-N 3.34Å; V595-L598 VanDerWaalsContact O-N 3.08Å; L598-T600 HydrophobicContact CB-CG2 4.17Å; L598-T600 PolarHBondContact O-N 3.5Å; L598-Y649 HydrophobicContact CD1-CE2 4.41Å; L598-L673 HydrophobicContact CB-CD2 4.01Å; L598-L673 HydrophobicContact CD2-CD1 3.96Å; L598-L673 HydrophobicContact CD2-CD2 4.24Å; L598-L765 HydrophobicContact CD1-CD2 4.36Å; L598-A769 WeakPolarHBondContact O-CB 3.38Å; L598-A769 PolarHBondContact O-N 2.91Å; L598-A769 VanDerWaalsContact O-N 3.13Å
599	V	88.4	Confident	87.1	Confident	18 Å²	18	31.1 Å²	31.1	11%	0.109	16%	0.159	C	C	.	.			trans	-78	74	177.8	-173.4	0	0	0	0	110	L597 P674 L675 L729 D732 S736 A769	L597-V599 PolarHBondContact O-N 2.9Å; V599-P674 WeakPolarHBondContact O-CD 3.34Å; V599-L675 HydrophobicContact CB-CD1 4.43Å; V599-L675 HydrophobicContact CG1-CD1 4.35Å; V599-L675 HydrophobicContact CG2-CD1 4.21Å; V599-L729 HydrophobicContact CG1-CD1 4.37Å; V599-L729 HydrophobicContact CG2-CD1 4.19Å; V599-D732 HydrophobicContact CG1-CB 3.93Å; V599-S736 WeakPolarHBondContact O-CB 3.09Å; V599-A769 HydrophobicContact CG2-CB 4.43Å
600	T	89.9	Confident	86.8	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.			trans	-159.7	153.3	177.5	-172.9	0	0	0	0	109.8	L598 S602 I671 F672 L673 S736 L765 S768 C770	L598-T600 HydrophobicContact CB-CG2 4.17Å; L598-T600 PolarHBondContact O-N 3.5Å; T600-S602 PolarHBondContact OG1-O 2.95Å; T600-I671 HydrophobicContact CG2-CG2 3.61Å; T600-F672 WeakPolarHBondContact CB-O 3.38Å; T600-F672 PolarHBondContact OG1-O 3.26Å; T600-L673 HydrophobicContact CG2-CD2 3.8Å; T600-S736 WeakPolarHBondContact CA-OG 3.43Å; T600-L765 HydrophobicContact CG2-CD2 3.56Å; T600-S768 WeakPolarHBondContact O-CB 3.13Å; T600-S768 PolarHBondContact O-OG 3.12Å; T600-C770 PolarHBondContact N-SG 3.23Å; T600-C770 VanDerWaalsContact N-SG 3.35Å; T600-C770 WeakPolarHBondContact O-CB 3.32Å
601	N	85.7	Confident	85.9	Confident	41 Å²	41	33.6 Å²	33.6	22%	0.219	17%	0.172	C	C	.	.	S	Bend	trans	-108	-12.8	178.2	67.3	-7.3	0	0	0	113.6	N764 L765 C770	N601-N764 WeakPolarHBondContact O-CA 3.27Å; N601-L765 PolarHBondContact O-N 3.12Å; N601-C770 HydrophobicContact CB-CB 3.97Å
602	S	88.9	Confident	85	Confident	4 Å²	4	35.6 Å²	35.6	3%	0.028	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	156	-166.3	56.2	0	0	0	0	111.9	T600 L763	T600-S602 PolarHBondContact OG1-O 2.95Å; S602-L763 CarbonylContact C-O 2.87Å; S602-L763 WeakPolarHBondContact CA-O 3.27Å; S602-L763 WeakPolarHBondContact CB-O 3.43Å
603	K	93.6	Very high	83.6	Confident	29 Å²	29	41.6 Å²	41.6	13%	0.126	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	143.6	172.2	66	-179.8	-177.3	163.9	0	109.2	Y649 D669 W670 I671 L763 L765	K603-Y649 HydrophobicContact CD-CD1 4.1Å; K603-Y649 HydrophobicContact CD-CE1 4.4Å; K603-D669 HydrophobicContact CD-CB 4.28Å; K603-D669 WeakPolarHBondContact CD-OD2 3.17Å; K603-D669 VanDerWaalsContact CE-OD2 3.31Å; K603-D669 WeakPolarHBondContact CE-OD2 3.48Å; K603-D669 IonicContact NZ-OD2 2.8Å; K603-D669 PolarHBondContact NZ-OD2 3.2Å; K603-W670 CarbonylContact C-O 3.36Å; K603-W670 VanDerWaalsContact CA-O 3.27Å; K603-W670 WeakPolarHBondContact CA-O 3.49Å; K603-I671 HydrophobicContact CB-CD1 4.28Å; K603-I671 HydrophobicContact CB-CG1 3.68Å; K603-L763 HydrophobicContact CG-CB 3.84Å; K603-L763 PolarHBondContact N-O 3.17Å; K603-L763 PolarHBondContact O-N 3.32Å; K603-L765 HydrophobicContact CD-CD1 4.13Å
604	L	93.8	Very high	82.2	Confident	3 Å²	3	44 Å²	44	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107.8	-175.9	-177.3	76.7	0	0	0	109.4	M606 L629 W670 A741 L745 V760 L762	L604-M606 HydrophobicContact CD2-CG 4.05Å; L604-M606 HydrophobicContact CD2-SD 3.64Å; L604-M606 HydrophobicContact CG-CG 3.99Å; L604-M606 HydrophobicContact CG-SD 4.26Å; L604-L629 HydrophobicContact CD2-CD1 3.91Å; L604-L629 HydrophobicContact CD2-CD2 4.45Å; L604-W670 HydrophobicContact CB-CB 4.26Å; L604-W670 PolarHBondContact N-O 3.29Å; L604-W670 PolarHBondContact O-N 3.14Å; L604-A741 HydrophobicContact CD1-CB 4.38Å; L604-L745 HydrophobicContact CD1-CD1 3.99Å; L604-L745 HydrophobicContact CD2-CD1 3.4Å; L604-L745 VanDerWaalsContact CD2-CD1 3.4Å; L604-L745 HydrophobicContact CG-CD1 4.25Å; L604-V760 HydrophobicContact CD1-CG1 3.52Å; L604-V760 HydrophobicContact CG-CG1 4.23Å; L604-L762 HydrophobicContact CD1-CD1 4.2Å
605	R	95	Very high	80.9	Confident	63 Å²	63	47.4 Å²	47.4	24%	0.238	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	124.1	176.5	-177.2	164.5	-70	-163.8	-2.1	109.9	I652 E667 L668 D669 V760 K761 L763	R605-I652 VanDerWaalsContact NH2-CD1 3.28Å; R605-E667 VanDerWaalsContact CD-OE1 3.23Å; R605-E667 WeakPolarHBondContact CD-OE1 3.42Å; R605-E667 HydrophobicContact CG-CG 4.18Å; R605-L668 WeakPolarHBondContact CA-O 3.45Å; R605-D669 VanDerWaalsContact CB-OD1 3.23Å; R605-D669 WeakPolarHBondContact CB-OD1 3.4Å; R605-D669 WeakPolarHBondContact CG-OD1 3.01Å; R605-D669 IonicContact CZ-OD1 3.49Å; R605-D669 IonicContact CZ-OD2 3.78Å; R605-D669 IonicContact NE-OD1 2.82Å; R605-D669 PolarHBondContact NE-OD1 3.13Å; R605-D669 IonicContact NE-OD2 2.99Å; R605-D669 IonicContact NH2-OD1 3.74Å; R605-D669 PolarHBondContact NH2-OD1 2.7Å; R605-D669 IonicContact NH2-OD2 3.24Å; R605-D669 PolarHBondContact NH2-OD2 2.98Å; R605-V760 CarbonylContact O-C 3.3Å; R605-V760 WeakPolarHBondContact O-CA 3.05Å; R605-K761 HydrophobicContact CB-CB 4.36Å; R605-K761 PolarHBondContact N-O 2.86Å; R605-K761 PolarHBondContact O-N 3.27Å; R605-L763 HydrophobicContact CB-CD1 4.17Å
606	M	93.6	Very high	79.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.2	179.8	-60	-179.6	75.5	0	0	110.4	L604 F608 L629 E667 L668 L745 F752 L757 S759 V760	L604-M606 HydrophobicContact CD2-CG 4.05Å; L604-M606 HydrophobicContact CD2-SD 3.64Å; L604-M606 HydrophobicContact CG-CG 3.99Å; L604-M606 HydrophobicContact CG-SD 4.26Å; M606-F608 HydrophobicContact CB-CD2 4.27Å; M606-F608 HydrophobicContact CB-CE2 3.58Å; M606-F608 HydrophobicContact CB-CZ 4.21Å; M606-F608 HydrophobicContact CE-CE1 4.37Å; M606-F608 HydrophobicContact CE-CE2 4.11Å; M606-F608 HydrophobicContact CE-CZ 3.53Å; M606-F608 HydrophobicContact SD-CE2 4.37Å; M606-F608 HydrophobicContact SD-CZ 4.26Å; M606-L629 HydrophobicContact CE-CD1 4.31Å; M606-L629 HydrophobicContact SD-CD1 3.95Å; M606-L629 HydrophobicContact SD-CD2 4.12Å; M606-E667 WeakPolarHBondContact O-CA 3.37Å; M606-L668 PolarHBondContact N-O 3.33Å; M606-L668 PolarHBondContact O-N 3.38Å; M606-L745 HydrophobicContact CE-CD1 4.48Å; M606-F752 HydrophobicContact CE-CE1 4.19Å; M606-F752 HydrophobicContact CE-CE2 4.3Å; M606-F752 HydrophobicContact CE-CZ 3.84Å; M606-L757 HydrophobicContact CB-CD1 4.23Å; M606-L757 HydrophobicContact CE-CD1 3.72Å; M606-L757 HydrophobicContact CE-CD2 3.73Å; M606-L757 HydrophobicContact CE-CG 4.41Å; M606-S759 WeakPolarHBondContact CA-O 3.24Å; M606-V760 HydrophobicContact CE-CG2 4.29Å; M606-V760 HydrophobicContact CG-CG1 4.4Å; M606-V760 HydrophobicContact CG-CG2 4.47Å
607	K	92.5	Very high	78.3	Confident	46 Å²	46	48.6 Å²	48.6	20%	0.2	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	126.5	175.9	-172.4	-179.1	176.3	-151.6	0	110.3	F666 E667 E758 S759	K607-F666 WeakPolarHBondContact CA-O 3.38Å; K607-E667 HydrophobicContact CB-CB 4.4Å; K607-E667 HydrophobicContact CB-CG 4.18Å; K607-E667 HydrophobicContact CG-CB 4.28Å; K607-E667 HydrophobicContact CG-CG 4.48Å; K607-E758 HydrophobicContact CB-CB 4.45Å; K607-E758 VanDerWaalsContact CD-OE2 3.25Å; K607-E758 WeakPolarHBondContact CD-OE2 3.21Å; K607-E758 WeakPolarHBondContact CE-OE2 3.31Å; K607-E758 HydrophobicContact CG-CB 4.44Å; K607-E758 IonicContact NZ-OE1 2.85Å; K607-E758 PolarHBondContact NZ-OE1 3.17Å; K607-E758 IonicContact NZ-OE2 2.72Å; K607-E758 PolarHBondContact NZ-OE2 3.31Å; K607-E758 PolarHBondContact O-N 3.21Å; K607-S759 WeakPolarHBondContact CB-OG 3.38Å; K607-S759 PolarHBondContact N-O 3.12Å
608	F	89.8	Confident	77.3	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.5	-178.3	-66.4	-88.8	0	0	0	111.4	M606 I625 S665 F666 F752 F755 L757	M606-F608 HydrophobicContact CB-CD2 4.27Å; M606-F608 HydrophobicContact CB-CE2 3.58Å; M606-F608 HydrophobicContact CB-CZ 4.21Å; M606-F608 HydrophobicContact CE-CE1 4.37Å; M606-F608 HydrophobicContact CE-CE2 4.11Å; M606-F608 HydrophobicContact CE-CZ 3.53Å; M606-F608 HydrophobicContact SD-CE2 4.37Å; M606-F608 HydrophobicContact SD-CZ 4.26Å; F608-I625 HydrophobicContact CD1-CD1 4.48Å; F608-I625 HydrophobicContact CE1-CD1 4.35Å; F608-I625 HydrophobicContact CE1-CG2 4.22Å; F608-I625 HydrophobicContact CE2-CD1 4.39Å; F608-I625 HydrophobicContact CE2-CG2 4.03Å; F608-I625 HydrophobicContact CZ-CD1 4.29Å; F608-I625 HydrophobicContact CZ-CG2 3.53Å; F608-S665 VanDerWaalsContact O-CA 3.25Å; F608-S665 WeakPolarHBondContact O-CA 3.39Å; F608-S665 WeakPolarHBondContact O-CB 3.36Å; F608-F666 HydrophobicContact CB-CD1 4.19Å; F608-F666 HydrophobicContact CB-CD2 4.17Å; F608-F666 HydrophobicContact CB-CE1 3.65Å; F608-F666 HydrophobicContact CB-CE2 3.65Å; F608-F666 HydrophobicContact CB-CG 4.42Å; F608-F666 HydrophobicContact CB-CZ 3.35Å; F608-F666 HydrophobicContact CD2-CD2 4.12Å; F608-F666 AromaticContact CD2-CE2 3.42Å; F608-F666 HydrophobicContact CD2-CE2 3.42Å; F608-F666 VanDerWaalsContact CD2-CE2 3.42Å; F608-F666 AromaticContact CD2-CZ 3.88Å; F608-F666 HydrophobicContact CD2-CZ 3.88Å; F608-F666 HydrophobicContact CE2-CE2 4.27Å; F608-F666 HydrophobicContact CG-CE1 4.49Å; F608-F666 AromaticContact CG-CE2 3.78Å; F608-F666 HydrophobicContact CG-CE2 3.78Å; F608-F666 AromaticContact CG-CZ 3.73Å; F608-F666 HydrophobicContact CG-CZ 3.73Å; F608-F666 PolarHBondContact N-O 3.47Å; F608-F666 PolarHBondContact O-N 3.32Å; F608-F752 HydrophobicContact CE1-CB 4.12Å; F608-F752 AromaticContact CE1-CD1 3.79Å; F608-F752 HydrophobicContact CE1-CD1 3.79Å; F608-F752 HydrophobicContact CE1-CE1 4.41Å; F608-F752 AromaticContact CE1-CG 3.96Å; F608-F752 HydrophobicContact CE1-CG 3.96Å; F608-F752 HydrophobicContact CZ-CD1 4.11Å; F608-F752 HydrophobicContact CZ-CE1 4.31Å; F608-F755 HydrophobicContact CD1-CB 3.81Å; F608-L757 HydrophobicContact CD1-CB 4.21Å; F608-L757 HydrophobicContact CD1-CD1 4.06Å; F608-L757 HydrophobicContact CE1-CB 4.06Å; F608-L757 HydrophobicContact CE1-CD1 3.75Å; F608-L757 HydrophobicContact CE1-CG 4.38Å; F608-L757 HydrophobicContact CE2-CD1 4.31Å; F608-L757 HydrophobicContact CG-CD1 4.49Å; F608-L757 HydrophobicContact CZ-CD1 3.9Å
609	Q	86.4	Confident	76.4	Confident	45 Å²	45	52.1 Å²	52.1	21%	0.21	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.4	170.4	-174	179.2	10	0	0	108.8	I663 K756	Q609-I663 HydrophobicContact CG-CB 4.48Å; Q609-I663 HydrophobicContact CG-CG2 3.54Å; Q609-I663 VanDerWaalsContact NE2-CG2 3.3Å; Q609-K756 HydrophobicContact CB-CB 4.31Å; Q609-K756 PolarHBondContact N-O 3.38Å; Q609-K756 PolarHBondContact O-N 2.9Å
610	W	80.4	Confident	75.3	Confident	18 Å²	18	53.6 Å²	53.6	7%	0.068	27%	0.266	C	S	.	.			trans	-69.8	148.3	178.2	-100.3	74.9	0	0	0	112	E612 L614 Y617 A664 F666 F755	W610-E612 PolarHBondContact O-N 3.17Å; W610-L614 HydrophobicContact CE3-CD1 4.19Å; W610-L614 HydrophobicContact CZ3-CD1 3.8Å; W610-Y617 AromaticContact CD2-CD1 3.62Å; W610-Y617 HydrophobicContact CD2-CD1 3.62Å; W610-Y617 AromaticContact CD2-CE1 3.91Å; W610-Y617 HydrophobicContact CD2-CE1 3.91Å; W610-Y617 AromaticContact CE2-CD1 3.51Å; W610-Y617 AromaticContact CE3-CD1 3.88Å; W610-Y617 HydrophobicContact CE3-CD1 3.88Å; W610-Y617 HydrophobicContact CE3-CE1 4.19Å; W610-Y617 HydrophobicContact CG-CD1 4.2Å; W610-Y617 HydrophobicContact CG-CE1 4.1Å; W610-Y617 HydrophobicContact CH2-CD1 4.02Å; W610-Y617 AromaticContact CZ2-CD1 3.74Å; W610-Y617 HydrophobicContact CZ2-CD1 3.74Å; W610-Y617 HydrophobicContact CZ2-CG 4.41Å; W610-Y617 HydrophobicContact CZ3-CD1 4.08Å; W610-Y617 AromaticContact NE1-CD1 3.93Å; W610-A664 HydrophobicContact CB-CB 4.13Å; W610-A664 HydrophobicContact CG-CB 4.39Å; W610-A664 PolarHBondContact N-O 3.48Å; W610-F666 AromaticContact CD1-CD1 3.84Å; W610-F666 AromaticContact CD1-CE1 3.65Å; W610-F666 AromaticContact NE1-CD1 3.94Å; W610-F666 AromaticContact NE1-CE1 3.63Å; W610-F755 HydrophobicContact CD2-CE1 4.03Å; W610-F755 AromaticContact CE2-CE1 3.57Å; W610-F755 HydrophobicContact CG-CD1 4.47Å; W610-F755 HydrophobicContact CG-CE1 4.3Å; W610-F755 AromaticContact CZ2-CE1 3.89Å; W610-F755 HydrophobicContact CZ2-CE1 3.89Å; W610-F755 HydrophobicContact CZ2-CZ 4.29Å; W610-F755 AromaticContact NE1-CE1 3.62Å
611	P	68.2	Low	74.4	Confident	56 Å²	56	54.6 Å²	54.6	36%	0.364	27%	0.272	S	S	.	.	S	Bend	trans	-60.5	-38.2	-177.7	20.2	-33.5	0	0	0	114.4	P754	P611-P754 HydrophobicContact CB-CB 4.05Å; P611-P754 VanDerWaalsContact CB-O 3.31Å; P611-P754 WeakPolarHBondContact CB-O 3.31Å; P611-P754 HydrophobicContact CG-CB 3.82Å; P611-P754 HydrophobicContact CG-CG 4.18Å
612	E	63	Low	73.8	Confident	141 Å²	141	53.1 Å²	53.1	66%	0.659	26%	0.264	S	S	*	.	S	Bend	trans	-154.3	168.9	-169.5	-67.7	-173.7	167.3	0	0	113	W610 L614	W610-E612 PolarHBondContact O-N 3.17Å; E612-L614 PolarHBondContact O-N 2.86Å
613	K	56.5	Low	73.1	Confident	155 Å²	155	56.6 Å²	56.6	67%	0.674	28%	0.282	S	S	*	.			trans	-70.6	60.6	174.8	-60.6	-175.2	-171.7	-169.7	0	111.5	E660	K613-E660 VanDerWaalsContact CD-O 3.28Å; K613-E660 WeakPolarHBondContact CD-O 3.26Å; K613-E660 WeakPolarHBondContact CE-O 3.47Å; K613-E660 PolarHBondContact NZ-O 2.89Å
614	L	50.3	Low	72.5	Confident	78 Å²	78	61 Å²	61	41%	0.408	30%	0.301	S	S	.	.			trans	-81	130.3	174.6	-75.6	158.5	0	0	0	109.3	W610 E612 N616 Y617	W610-L614 HydrophobicContact CE3-CD1 4.19Å; W610-L614 HydrophobicContact CZ3-CD1 3.8Å; E612-L614 PolarHBondContact O-N 2.86Å; L614-N616 VanDerWaalsContact C-N 3.3Å; L614-Y617 PolarHBondContact O-OH 3.19Å
615	T	52.5	Low	72	Confident	127 Å²	127	61 Å²	61	78%	0.779	30%	0.301	S	S	*	.	S	Bend	trans	-74.3	-23.3	175.9	54.4	0	0	0	0	112.2
616	N	51.4	Low	71.5	Confident	130 Å²	130	58.5 Å²	58.5	70%	0.695	29%	0.293	S	S	*	.	S	Bend	trans	-122.2	110.3	-178.2	-65.2	-2.6	0	0	0	109.9	L614 E618	L614-N616 VanDerWaalsContact C-N 3.3Å; N616-E618 PolarHBondContact O-N 3.45Å
617	Y	56.4	Low	71.2	Confident	38 Å²	38	62.3 Å²	62.3	15%	0.149	31%	0.312	C	S	.	.			trans	-84.6	106.1	179.6	-60.2	-81.1	0	0	0	110.1	S547 W610 L614 L619 M656 P657 A664	S547-Y617 WeakPolarHBondContact CB-O 3.34Å; S547-Y617 PolarHBondContact OG-O 3.14Å; W610-Y617 AromaticContact CD2-CD1 3.62Å; W610-Y617 HydrophobicContact CD2-CD1 3.62Å; W610-Y617 AromaticContact CD2-CE1 3.91Å; W610-Y617 HydrophobicContact CD2-CE1 3.91Å; W610-Y617 AromaticContact CE2-CD1 3.51Å; W610-Y617 AromaticContact CE3-CD1 3.88Å; W610-Y617 HydrophobicContact CE3-CD1 3.88Å; W610-Y617 HydrophobicContact CE3-CE1 4.19Å; W610-Y617 HydrophobicContact CG-CD1 4.2Å; W610-Y617 HydrophobicContact CG-CE1 4.1Å; W610-Y617 HydrophobicContact CH2-CD1 4.02Å; W610-Y617 AromaticContact CZ2-CD1 3.74Å; W610-Y617 HydrophobicContact CZ2-CD1 3.74Å; W610-Y617 HydrophobicContact CZ2-CG 4.41Å; W610-Y617 HydrophobicContact CZ3-CD1 4.08Å; W610-Y617 AromaticContact NE1-CD1 3.93Å; L614-Y617 PolarHBondContact O-OH 3.19Å; Y617-L619 VanDerWaalsContact C-N 3.33Å; Y617-L619 PolarHBondContact O-N 3.02Å; Y617-M656 HydrophobicContact CD2-CE 4.37Å; Y617-M656 HydrophobicContact CD2-SD 3.51Å; Y617-M656 VanDerWaalsContact CD2-SD 3.51Å; Y617-M656 HydrophobicContact CE2-CE 4.24Å; Y617-M656 HydrophobicContact CE2-SD 3.39Å; Y617-M656 WeakPolarHBondContact CE2-SD 3.24Å; Y617-M656 HydrophobicContact CG-SD 4.24Å; Y617-P657 WeakPolarHBondContact OH-CD 3.29Å; Y617-P657 WeakPolarHBondContact OH-CG 3.19Å; Y617-A664 HydrophobicContact CE1-CB 3.68Å; Y617-A664 WeakPolarHBondContact OH-CB 3.33Å
618	E	61.2	Low	71	Confident	97 Å²	97	61.4 Å²	61.4	45%	0.453	31%	0.311	S	S	.	.			trans	-74.1	91.5	170.2	-67.8	-170.3	166.1	0	0	109.3	N616 N620 T621	N616-E618 PolarHBondContact O-N 3.45Å; E618-N620 PolarHBondContact O-N 3.1Å; E618-T621 HydrophobicContact CB-CG2 4.44Å; E618-T621 WeakPolarHBondContact O-CB 3.36Å; E618-T621 PolarHBondContact O-N 2.93Å; E618-T621 PolarHBondContact O-OG1 2.79Å
619	L	66.4	Low	71.1	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.026	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-53.6	-21.4	176.9	-140.6	72.8	0	0	0	111.6	F515 C556 I558 Y617 T621 L622 F654	F515-L619 HydrophobicContact CD2-CD2 4.44Å; F515-L619 HydrophobicContact CD2-CG 4.4Å; F515-L619 VanDerWaalsContact CE2-C 3.43Å; F515-L619 HydrophobicContact CE2-CB 3.72Å; F515-L619 HydrophobicContact CE2-CD2 3.93Å; F515-L619 HydrophobicContact CE2-CG 3.76Å; F515-L619 WeakPolarHBondContact CE2-O 3.27Å; F515-L619 HydrophobicContact CZ-CB 4.31Å; F515-L619 WeakPolarHBondContact CZ-O 3.48Å; C556-L619 HydrophobicContact CB-CB 4.36Å; I558-L619 HydrophobicContact CD1-CD1 4.21Å; I558-L619 HydrophobicContact CD1-CD2 3.99Å; I558-L619 HydrophobicContact CD1-CG 4.14Å; I558-L619 HydrophobicContact CG1-CD2 3.82Å; I558-L619 HydrophobicContact CG1-CG 4.32Å; Y617-L619 VanDerWaalsContact C-N 3.33Å; Y617-L619 PolarHBondContact O-N 3.02Å; L619-T621 PolarHBondContact O-N 3.34Å; L619-T621 VanDerWaalsContact O-N 3.11Å; L619-L622 HydrophobicContact CD1-CD1 3.73Å; L619-L622 HydrophobicContact CG-CD1 3.7Å; L619-L622 HydrophobicContact CG-CG 4.47Å; L619-L622 WeakPolarHBondContact O-CB 3.16Å; L619-L622 WeakPolarHBondContact O-CG 3.45Å; L619-L622 PolarHBondContact O-N 2.85Å; L619-F654 HydrophobicContact CD1-CE2 4.4Å; L619-F654 HydrophobicContact CD1-CZ 4Å
620	N	66.4	Low	71.3	Confident	50 Å²	50	59.5 Å²	59.5	27%	0.267	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-48.4	-34.5	169.5	-70.9	15	0	0	0	113.5	F515 C517 E554 C556 E618 L622 N623	F515-N620 VanDerWaalsContact CZ-CA 3.49Å; C517-N620 PolarHBondContact SG-OD1 3.14Å; C517-N620 VanDerWaalsContact SG-OD1 3.35Å; E554-N620 PolarHBondContact OE2-ND2 2.81Å; C556-N620 PolarHBondContact SG-OD1 3.33Å; E618-N620 PolarHBondContact O-N 3.1Å; N620-L622 PolarHBondContact O-N 2.92Å; N620-N623 WeakPolarHBondContact O-CB 3.3Å; N620-N623 PolarHBondContact O-N 2.75Å
621	T	71.2	Confident	71.8	Confident	21 Å²	21	64.2 Å²	64.2	13%	0.129	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-66.5	-22.9	178.1	55.4	0	0	0	0	112.8	E618 L619 N623 K624 F755	E618-T621 HydrophobicContact CB-CG2 4.44Å; E618-T621 WeakPolarHBondContact O-CB 3.36Å; E618-T621 PolarHBondContact O-N 2.93Å; E618-T621 PolarHBondContact O-OG1 2.79Å; L619-T621 PolarHBondContact O-N 3.34Å; L619-T621 VanDerWaalsContact O-N 3.11Å; T621-N623 VanDerWaalsContact C-N 3.25Å; T621-N623 PolarHBondContact O-N 3.35Å; T621-K624 VanDerWaalsContact O-CB 3.29Å; T621-K624 WeakPolarHBondContact O-CB 3.37Å; T621-K624 PolarHBondContact O-N 3.03Å; T621-K624 VanDerWaalsContact O-N 3.14Å; T621-F755 WeakPolarHBondContact O-CE2 3.37Å; T621-F755 VanDerWaalsContact OG1-CZ 3.3Å; T621-F755 WeakPolarHBondContact OG1-CZ 3.5Å
622	L	72	Confident	72.8	Confident	10 Å²	10	62 Å²	62	5%	0.052	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-28.6	175	-63.6	-179.7	0	0	0	112.5	I558 L619 N620 K624 I625 F666 F755	I558-L622 HydrophobicContact CD1-CD1 3.35Å; I558-L622 HydrophobicContact CG1-CD1 4.14Å; L619-L622 HydrophobicContact CD1-CD1 3.73Å; L619-L622 HydrophobicContact CG-CD1 3.7Å; L619-L622 HydrophobicContact CG-CG 4.47Å; L619-L622 WeakPolarHBondContact O-CB 3.16Å; L619-L622 WeakPolarHBondContact O-CG 3.45Å; L619-L622 PolarHBondContact O-N 2.85Å; N620-L622 PolarHBondContact O-N 2.92Å; L622-K624 PolarHBondContact O-N 2.94Å; L622-I625 HydrophobicContact CD2-CD1 3.59Å; L622-I625 WeakPolarHBondContact O-CA 3.21Å; L622-I625 VanDerWaalsContact O-CB 3.24Å; L622-I625 WeakPolarHBondContact O-CB 3.02Å; L622-I625 PolarHBondContact O-N 3.35Å; L622-F666 HydrophobicContact CD2-CE1 3.95Å; L622-F666 HydrophobicContact CD2-CE2 3.69Å; L622-F666 HydrophobicContact CD2-CZ 3.35Å; L622-F755 HydrophobicContact CD2-CE1 4.39Å; L622-F755 HydrophobicContact CD2-CZ 4.08Å
623	N	75.5	Confident	74.2	Confident	77 Å²	77	55.4 Å²	55.4	41%	0.412	28%	0.28	S	S	.	.	H	α-helix	trans	-62.9	-28	176.4	-159.1	17.9	0	0	0	111.8	F515 N620 T621 I625 N626 L627	F515-N623 HydrophobicContact CD1-CB 3.88Å; F515-N623 HydrophobicContact CE1-CB 4.08Å; N620-N623 WeakPolarHBondContact O-CB 3.3Å; N620-N623 PolarHBondContact O-N 2.75Å; T621-N623 VanDerWaalsContact C-N 3.25Å; T621-N623 PolarHBondContact O-N 3.35Å; N623-I625 PolarHBondContact O-N 2.91Å; N623-N626 PolarHBondContact O-N 2.95Å; N623-L627 PolarHBondContact O-N 2.97Å
624	K	79.8	Confident	75.8	Confident	121 Å²	121	52.2 Å²	52.2	53%	0.526	27%	0.268	S	S	.	.	H	α-helix	trans	-65.1	-29.9	172.6	-59.2	-178.5	178.3	178.3	0	112	T621 L622 L627 T628	T621-K624 VanDerWaalsContact O-CB 3.29Å; T621-K624 WeakPolarHBondContact O-CB 3.37Å; T621-K624 PolarHBondContact O-N 3.03Å; T621-K624 VanDerWaalsContact O-N 3.14Å; L622-K624 PolarHBondContact O-N 2.94Å; K624-L627 PolarHBondContact O-N 3.42Å; K624-T628 WeakPolarHBondContact O-CB 3.49Å; K624-T628 PolarHBondContact O-N 3.24Å; K624-T628 PolarHBondContact O-OG1 3Å
625	I	84.2	Confident	77.5	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.015	28%	0.281	C	S	.	.	H	α-helix	trans	-65.4	-43.5	176.3	-57	178.5	0	0	0	109.7	F608 L622 N623 L627 T628 L629 F666 F752 F755	F608-I625 HydrophobicContact CD1-CD1 4.48Å; F608-I625 HydrophobicContact CE1-CD1 4.35Å; F608-I625 HydrophobicContact CE1-CG2 4.22Å; F608-I625 HydrophobicContact CE2-CD1 4.39Å; F608-I625 HydrophobicContact CE2-CG2 4.03Å; F608-I625 HydrophobicContact CZ-CD1 4.29Å; F608-I625 HydrophobicContact CZ-CG2 3.53Å; L622-I625 HydrophobicContact CD2-CD1 3.59Å; L622-I625 WeakPolarHBondContact O-CA 3.21Å; L622-I625 VanDerWaalsContact O-CB 3.24Å; L622-I625 WeakPolarHBondContact O-CB 3.02Å; L622-I625 PolarHBondContact O-N 3.35Å; N623-I625 PolarHBondContact O-N 2.91Å; I625-L627 PolarHBondContact O-N 3.27Å; I625-T628 PolarHBondContact O-N 3.1Å; I625-L629 WeakPolarHBondContact O-CB 3.43Å; I625-L629 PolarHBondContact O-N 3.26Å; I625-F666 HydrophobicContact CD1-CE2 3.96Å; I625-F666 HydrophobicContact CD1-CZ 3.61Å; I625-F752 HydrophobicContact CG2-CD1 4.16Å; I625-F752 HydrophobicContact CG2-CE1 4.07Å; I625-F755 HydrophobicContact CD1-CD2 3.68Å; I625-F755 HydrophobicContact CD1-CE2 3.71Å; I625-F755 HydrophobicContact CD1-CG 4.12Å; I625-F755 HydrophobicContact CD1-CZ 4.17Å; I625-F755 HydrophobicContact CG1-CD2 3.7Å; I625-F755 HydrophobicContact CG1-CE2 3.72Å
626	N	84.7	Confident	79.1	Confident	11 Å²	11	56.4 Å²	56.4	6%	0.059	27%	0.273	C	S	.	.	H	α-helix	trans	-62.1	-44.3	178.5	-66.8	29.7	0	0	0	111.7	N623 L629 A630 W670	N623-N626 PolarHBondContact O-N 2.95Å; N626-L629 PolarHBondContact O-N 3.08Å; N626-A630 VanDerWaalsContact O-CB 3.27Å; N626-A630 WeakPolarHBondContact O-CB 3.37Å; N626-A630 PolarHBondContact O-N 2.71Å; N626-W670 VanDerWaalsContact CG-CZ3 3.47Å; N626-W670 WeakPolarHBondContact ND2-CH2 3.46Å; N626-W670 VanDerWaalsContact ND2-CZ3 3.33Å; N626-W670 WeakPolarHBondContact ND2-CZ3 3.45Å; N626-W670 WeakPolarHBondContact OD1-CH2 3.33Å; N626-W670 WeakPolarHBondContact OD1-CZ2 3.05Å; N626-W670 VanDerWaalsContact OD1-CZ3 3.26Å; N626-W670 WeakPolarHBondContact OD1-CZ3 3.4Å
627	L	86.3	Confident	80.9	Confident	79 Å²	79	52 Å²	52	41%	0.414	25%	0.25	S	C	.	.	H	α-helix	trans	-62.9	-50.8	178.2	-68.2	169.9	0	0	0	110.9	N623 K624 I625 L629 A630 E631	N623-L627 PolarHBondContact O-N 2.97Å; K624-L627 PolarHBondContact O-N 3.42Å; I625-L627 PolarHBondContact O-N 3.27Å; L627-L629 VanDerWaalsContact C-N 3.32Å; L627-L629 PolarHBondContact O-N 2.95Å; L627-A630 PolarHBondContact O-N 2.79Å; L627-E631 WeakPolarHBondContact O-CG 3.35Å; L627-E631 PolarHBondContact O-N 2.96Å
628	T	89.2	Confident	82.4	Confident	28 Å²	28	51 Å²	51	17%	0.172	25%	0.247	C	C	.	.	H	α-helix	trans	-61.5	-41.8	178.5	-50.6	0	0	0	0	111.3	K624 I625 E631 I632 L751 F752	K624-T628 WeakPolarHBondContact O-CB 3.49Å; K624-T628 PolarHBondContact O-N 3.24Å; K624-T628 PolarHBondContact O-OG1 3Å; I625-T628 PolarHBondContact O-N 3.1Å; T628-E631 PolarHBondContact O-N 2.91Å; T628-I632 HydrophobicContact CG2-CD1 3.93Å; T628-I632 WeakPolarHBondContact O-CD1 3.37Å; T628-I632 VanDerWaalsContact O-CG1 3.24Å; T628-I632 WeakPolarHBondContact O-CG1 3.25Å; T628-I632 PolarHBondContact O-N 3.21Å; T628-I632 VanDerWaalsContact O-N 3.08Å; T628-L751 HydrophobicContact CG2-CB 4.14Å; T628-F752 HydrophobicContact CG2-CD1 4.01Å; T628-F752 HydrophobicContact CG2-CE1 3.97Å; T628-F752 HydrophobicContact CG2-CG 4.42Å; T628-F752 HydrophobicContact CG2-CZ 4.32Å
629	L	91.2	Very high	83.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.2	-46.7	177	-179.9	60.8	0	0	0	110.7	L604 M606 I625 N626 L627 I632 L633 L646 W670 L745 F752	L604-L629 HydrophobicContact CD2-CD1 3.91Å; L604-L629 HydrophobicContact CD2-CD2 4.45Å; M606-L629 HydrophobicContact CE-CD1 4.31Å; M606-L629 HydrophobicContact SD-CD1 3.95Å; M606-L629 HydrophobicContact SD-CD2 4.12Å; I625-L629 WeakPolarHBondContact O-CB 3.43Å; I625-L629 PolarHBondContact O-N 3.26Å; N626-L629 PolarHBondContact O-N 3.08Å; L627-L629 VanDerWaalsContact C-N 3.32Å; L627-L629 PolarHBondContact O-N 2.95Å; L629-I632 PolarHBondContact O-N 3.33Å; L629-L633 HydrophobicContact CD1-CD1 3.8Å; L629-L633 HydrophobicContact CD1-CG 4.04Å; L629-L633 HydrophobicContact CG-CD1 3.89Å; L629-L633 HydrophobicContact CG-CG 4.45Å; L629-L633 WeakPolarHBondContact O-CB 3.33Å; L629-L633 WeakPolarHBondContact O-CG 3.32Å; L629-L633 PolarHBondContact O-N 3.46Å; L629-L646 HydrophobicContact CB-CD1 4.41Å; L629-L646 HydrophobicContact CD2-CD1 4.16Å; L629-L646 HydrophobicContact CG-CD1 4.08Å; L629-W670 HydrophobicContact CD2-CB 4.38Å; L629-W670 HydrophobicContact CD2-CD2 3.94Å; L629-W670 HydrophobicContact CD2-CE3 4.22Å; L629-W670 HydrophobicContact CD2-CG 3.99Å; L629-L745 HydrophobicContact CD1-CD1 3.87Å; L629-L745 HydrophobicContact CD1-CD2 3.66Å; L629-L745 HydrophobicContact CD1-CG 4.44Å; L629-F752 HydrophobicContact CB-CE1 4.33Å; L629-F752 HydrophobicContact CD1-CZ 4.44Å
630	A	90.4	Very high	84.7	Confident	5 Å²	5	55.2 Å²	55.2	4%	0.041	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-48.5	176.7	0	0	0	0	0	111.5	N626 L627 I632 L633 Q634 V641 L646	N626-A630 VanDerWaalsContact O-CB 3.27Å; N626-A630 WeakPolarHBondContact O-CB 3.37Å; N626-A630 PolarHBondContact O-N 2.71Å; L627-A630 PolarHBondContact O-N 2.79Å; A630-I632 PolarHBondContact O-N 2.94Å; A630-L633 PolarHBondContact O-N 2.89Å; A630-Q634 WeakPolarHBondContact O-CB 3.43Å; A630-Q634 PolarHBondContact O-N 3.2Å; A630-V641 HydrophobicContact CB-CG1 4.45Å; A630-L646 HydrophobicContact CB-CD1 3.86Å
631	E	90.2	Very high	85.9	Confident	116 Å²	116	52.9 Å²	52.9	54%	0.542	26%	0.262	S	S	.	.	H	α-helix	trans	-59.8	-41.9	179.7	-74.7	175.8	-175	0	0	112.8	L627 T628 N635	L627-E631 WeakPolarHBondContact O-CG 3.35Å; L627-E631 PolarHBondContact O-N 2.96Å; T628-E631 PolarHBondContact O-N 2.91Å; E631-N635 WeakPolarHBondContact O-CB 3.47Å; E631-N635 PolarHBondContact O-N 2.92Å; E631-N635 PolarHBondContact O-ND2 3.33Å
632	I	90.5	Very high	86.7	Confident	11 Å²	11	53.6 Å²	53.6	6%	0.056	27%	0.268	C	S	.	.	H	α-helix	trans	-68.1	-44.9	179	-64.9	165.4	0	0	0	110.9	T628 L629 A630 R636 T744 L745 N748 L751 F752	T628-I632 HydrophobicContact CG2-CD1 3.93Å; T628-I632 WeakPolarHBondContact O-CD1 3.37Å; T628-I632 VanDerWaalsContact O-CG1 3.24Å; T628-I632 WeakPolarHBondContact O-CG1 3.25Å; T628-I632 PolarHBondContact O-N 3.21Å; T628-I632 VanDerWaalsContact O-N 3.08Å; L629-I632 PolarHBondContact O-N 3.33Å; A630-I632 PolarHBondContact O-N 2.94Å; I632-R636 PolarHBondContact O-N 3.04Å; I632-T744 HydrophobicContact CG2-CG2 4.06Å; I632-L745 HydrophobicContact CB-CD2 4.22Å; I632-L745 HydrophobicContact CD1-CD2 4.2Å; I632-L745 HydrophobicContact CG2-CD2 3.79Å; I632-N748 HydrophobicContact CD1-CB 4.29Å; I632-L751 HydrophobicContact CD1-CB 4.15Å; I632-L751 HydrophobicContact CD1-CD1 3.9Å; I632-L751 HydrophobicContact CG1-CD1 3.92Å; I632-F752 HydrophobicContact CD1-CE2 3.66Å; I632-F752 HydrophobicContact CD1-CZ 3.75Å
633	L	92	Very high	87.4	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-68.8	-41.5	-179.5	-67.2	178.7	0	0	0	111.4	L629 A630 I637 N638 V641 L646 L738 A741 L745	L629-L633 HydrophobicContact CD1-CD1 3.8Å; L629-L633 HydrophobicContact CD1-CG 4.04Å; L629-L633 HydrophobicContact CG-CD1 3.89Å; L629-L633 HydrophobicContact CG-CG 4.45Å; L629-L633 WeakPolarHBondContact O-CB 3.33Å; L629-L633 WeakPolarHBondContact O-CG 3.32Å; L629-L633 PolarHBondContact O-N 3.46Å; A630-L633 PolarHBondContact O-N 2.89Å; L633-I637 HydrophobicContact CD2-CD1 3.53Å; L633-I637 HydrophobicContact CD2-CG1 4.36Å; L633-I637 WeakPolarHBondContact O-CA 3.46Å; L633-I637 VanDerWaalsContact O-CB 3.28Å; L633-I637 WeakPolarHBondContact O-CB 3.26Å; L633-I637 PolarHBondContact O-N 3.19Å; L633-N638 PolarHBondContact O-N 3Å; L633-V641 HydrophobicContact CB-CB 4.22Å; L633-V641 HydrophobicContact CB-CG1 3.86Å; L633-V641 HydrophobicContact CB-CG2 4.23Å; L633-V641 HydrophobicContact CD1-CG1 4.2Å; L633-L646 HydrophobicContact CD1-CD2 4.44Å; L633-L738 HydrophobicContact CD1-CD2 4.38Å; L633-A741 HydrophobicContact CD2-CB 3.91Å; L633-L745 HydrophobicContact CD2-CD1 4.23Å; L633-L745 HydrophobicContact CD2-CG 4.46Å
634	Q	90.1	Very high	87.9	Confident	89 Å²	89	59.2 Å²	59.2	42%	0.416	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-48.1	-179.4	-169.3	178	23.5	0	0	111.9	A630 R636 N638 P639 V641	A630-Q634 WeakPolarHBondContact O-CB 3.43Å; A630-Q634 PolarHBondContact O-N 3.2Å; Q634-R636 PolarHBondContact O-N 3.16Å; Q634-N638 WeakPolarHBondContact CA-O 3.3Å; Q634-P639 PolarHBondContact NE2-O 3.41Å; Q634-V641 WeakPolarHBondContact CG-O 3.28Å
635	N	86.4	Confident	88.4	Confident	131 Å²	131	56.2 Å²	56.2	70%	0.701	28%	0.283	S	S	*	.	H	α-helix	trans	-74.1	-24.6	-174.1	-73.6	-38.4	0	0	0	114.2	E631	E631-N635 WeakPolarHBondContact O-CB 3.47Å; E631-N635 PolarHBondContact O-N 2.92Å; E631-N635 PolarHBondContact O-ND2 3.33Å
636	R	85.8	Confident	88.7	Confident	161 Å²	161	56.4 Å²	56.4	61%	0.608	28%	0.284	S	S	*	.	H	α-helix	trans	-122.6	-14.7	-169.5	-64.3	-166.9	-179.6	-174.5	9.9	115.2	I632 Q634 T744 N748	I632-R636 PolarHBondContact O-N 3.04Å; Q634-R636 PolarHBondContact O-N 3.16Å; R636-T744 HydrophobicContact CB-CG2 3.85Å; R636-T744 HydrophobicContact CG-CG2 4.37Å; R636-N748 PolarHBondContact NH1-ND2 3.42Å; R636-N748 PolarHBondContact NH1-OD1 2.99Å
637	I	88.7	Confident	89.1	Confident	39 Å²	39	57 Å²	57	20%	0.2	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	-62.5	-167.8	-47.6	-164.9	0	0	0	111.4	L633 D739 A741 T744	L633-I637 HydrophobicContact CD2-CD1 3.53Å; L633-I637 HydrophobicContact CD2-CG1 4.36Å; L633-I637 WeakPolarHBondContact O-CA 3.46Å; L633-I637 VanDerWaalsContact O-CB 3.28Å; L633-I637 WeakPolarHBondContact O-CB 3.26Å; L633-I637 PolarHBondContact O-N 3.19Å; I637-D739 WeakPolarHBondContact CG2-O 3.47Å; I637-A741 HydrophobicContact CD1-CB 3.72Å; I637-T744 HydrophobicContact CD1-CG2 4.17Å; I637-T744 HydrophobicContact CG1-CG2 4.34Å
638	N	88.5	Confident	89.3	Confident	16 Å²	16	53.4 Å²	53.4	9%	0.086	27%	0.266	C	S	.	.			trans	-144.7	110.4	-173	-176.9	-13.1	0	0	0	109.9	L633 Q634 E640 V641 L735 N737	L633-N638 PolarHBondContact O-N 3Å; Q634-N638 WeakPolarHBondContact CA-O 3.3Å; N638-E640 PolarHBondContact O-N 2.65Å; N638-E640 VanDerWaalsContact O-N 3.14Å; N638-E640 WeakPolarHBondContact OD1-CB 3.49Å; N638-E640 PolarHBondContact OD1-N 3.07Å; N638-E640 VanDerWaalsContact OD1-N 3.08Å; N638-V641 HydrophobicContact CB-CG2 3.86Å; N638-V641 WeakPolarHBondContact O-CB 3.34Å; N638-V641 WeakPolarHBondContact O-CG2 3.21Å; N638-V641 PolarHBondContact O-N 3.19Å; N638-V641 VanDerWaalsContact O-N 3.11Å; N638-L735 PolarHBondContact ND2-O 3.44Å; N638-N737 PolarHBondContact ND2-O 2.67Å
639	P	88.3	Confident	89.5	Confident	94 Å²	94	53.1 Å²	53.1	61%	0.61	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-17	-175.1	28.1	-35.4	0	0	0	113.7	Q634 V641	Q634-P639 PolarHBondContact NE2-O 3.41Å; P639-V641 PolarHBondContact O-N 2.99Å
640	E	87.2	Confident	89.5	Confident	97 Å²	97	54.8 Å²	54.8	45%	0.453	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-10.4	176.9	-65.3	-62.8	146.9	0	0	113.3	N638 S642 F672	N638-E640 PolarHBondContact O-N 2.65Å; N638-E640 VanDerWaalsContact O-N 3.14Å; N638-E640 WeakPolarHBondContact OD1-CB 3.49Å; N638-E640 PolarHBondContact OD1-N 3.07Å; N638-E640 VanDerWaalsContact OD1-N 3.08Å; E640-S642 PolarHBondContact O-N 3.14Å; E640-F672 HydrophobicContact CB-CZ 4.19Å; E640-F672 WeakPolarHBondContact O-CZ 3.45Å
641	V	90.8	Very high	89.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.278	C	S	.	.			trans	-70.4	124.5	178.9	178.3	0	0	0	0	109.8	A630 L633 Q634 N638 P639 L646 F672 L738	A630-V641 HydrophobicContact CB-CG1 4.45Å; L633-V641 HydrophobicContact CB-CB 4.22Å; L633-V641 HydrophobicContact CB-CG1 3.86Å; L633-V641 HydrophobicContact CB-CG2 4.23Å; L633-V641 HydrophobicContact CD1-CG1 4.2Å; Q634-V641 WeakPolarHBondContact CG-O 3.28Å; N638-V641 HydrophobicContact CB-CG2 3.86Å; N638-V641 WeakPolarHBondContact O-CB 3.34Å; N638-V641 WeakPolarHBondContact O-CG2 3.21Å; N638-V641 PolarHBondContact O-N 3.19Å; N638-V641 VanDerWaalsContact O-N 3.11Å; P639-V641 PolarHBondContact O-N 2.99Å; V641-L646 HydrophobicContact CG1-CD1 4.22Å; V641-L646 HydrophobicContact CG1-CD2 4.39Å; V641-L646 HydrophobicContact CG1-CG 4.34Å; V641-F672 HydrophobicContact CB-CE2 4.22Å; V641-F672 HydrophobicContact CB-CZ 4.35Å; V641-F672 HydrophobicContact CG1-CD2 4.39Å; V641-F672 HydrophobicContact CG1-CE2 4.46Å; V641-F672 HydrophobicContact CG2-CD1 3.95Å; V641-F672 HydrophobicContact CG2-CD2 4.1Å; V641-F672 HydrophobicContact CG2-CE1 3.76Å; V641-F672 HydrophobicContact CG2-CE2 3.95Å; V641-F672 HydrophobicContact CG2-CG 4.12Å; V641-F672 HydrophobicContact CG2-CZ 3.77Å; V641-L738 HydrophobicContact CG2-CD2 4.03Å
642	S	89.7	Confident	89.3	Confident	36 Å²	36	53.7 Å²	53.7	25%	0.252	27%	0.266	S	S	.	.			trans	-129.9	158.4	170.6	72	0	0	0	0	110.2	E640 E644 K645	E640-S642 PolarHBondContact O-N 3.14Å; S642-E644 PolarHBondContact O-N 2.83Å; S642-K645 PolarHBondContact O-N 3.2Å; S642-K645 WeakPolarHBondContact OG-CG 3.39Å
643	S	85.3	Confident	89	Confident	42 Å²	42	55.8 Å²	55.8	29%	0.294	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-61.3	-33	178.8	53.2	0	0	0	0	112.9	K645 L646	S643-K645 VanDerWaalsContact C-N 3.26Å; S643-K645 PolarHBondContact O-N 3.34Å; S643-L646 PolarHBondContact O-N 2.84Å
644	E	86.5	Confident	88.5	Confident	163 Å²	163	58.1 Å²	58.1	76%	0.762	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-70.4	-20.3	178.8	-61.4	-178.6	175	0	0	113.6	S642 Y647	S642-E644 PolarHBondContact O-N 2.83Å; E644-Y647 PolarHBondContact O-OH 3.06Å
645	K	90.2	Very high	87.8	Confident	59 Å²	59	59.4 Å²	59.4	26%	0.257	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-100.4	3.3	-178.8	-68.3	-179.4	-177.3	-173.1	0	113.4	S642 S643 Y647 F672 L673 P674	S642-K645 PolarHBondContact O-N 3.2Å; S642-K645 WeakPolarHBondContact OG-CG 3.39Å; S643-K645 VanDerWaalsContact C-N 3.26Å; S643-K645 PolarHBondContact O-N 3.34Å; K645-Y647 WeakPolarHBondContact O-CD2 3.41Å; K645-Y647 WeakPolarHBondContact O-CE2 3.39Å; K645-F672 HydrophobicContact CB-CD2 4.01Å; K645-F672 HydrophobicContact CB-CE2 3.71Å; K645-F672 HydrophobicContact CD-CE2 4.08Å; K645-L673 WeakPolarHBondContact CB-O 3.42Å; K645-L673 PolarHBondContact O-N 3.43Å; K645-P674 WeakPolarHBondContact CD-O 3.39Å; K645-P674 WeakPolarHBondContact CE-O 3.28Å; K645-P674 PolarHBondContact NZ-O 3.16Å
646	L	91	Very high	87	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.1	176.3	-73.4	173	0	0	0	110.3	L629 A630 L633 V641 S643 W670 F672	L629-L646 HydrophobicContact CB-CD1 4.41Å; L629-L646 HydrophobicContact CD2-CD1 4.16Å; L629-L646 HydrophobicContact CG-CD1 4.08Å; A630-L646 HydrophobicContact CB-CD1 3.86Å; L633-L646 HydrophobicContact CD1-CD2 4.44Å; V641-L646 HydrophobicContact CG1-CD1 4.22Å; V641-L646 HydrophobicContact CG1-CD2 4.39Å; V641-L646 HydrophobicContact CG1-CG 4.34Å; S643-L646 PolarHBondContact O-N 2.84Å; L646-W670 HydrophobicContact CB-CE3 4.32Å; L646-F672 HydrophobicContact CD2-CB 3.92Å; L646-F672 HydrophobicContact CD2-CD2 4.27Å
647	Y	92.7	Very high	86	Confident	25 Å²	25	51.2 Å²	51.2	10%	0.098	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	143.5	-176.7	-60.6	-89.3	0	0	0	111.3	G513 I514 E644 K645 Y649 W670 I671 L673 L677	G513-Y647 CarbonylContact O-C 3.46Å; G513-Y647 WeakPolarHBondContact O-CA 3.34Å; G513-Y647 WeakPolarHBondContact O-CB 3.47Å; I514-Y647 HydrophobicContact CG2-CD1 3.64Å; I514-Y647 HydrophobicContact CG2-CE1 3.81Å; E644-Y647 PolarHBondContact O-OH 3.06Å; K645-Y647 WeakPolarHBondContact O-CD2 3.41Å; K645-Y647 WeakPolarHBondContact O-CE2 3.39Å; Y647-Y649 PolarHBondContact O-N 2.88Å; Y647-W670 CarbonylContact O-C 3.59Å; Y647-W670 WeakPolarHBondContact O-CA 3.4Å; Y647-I671 PolarHBondContact N-O 2.96Å; Y647-I671 PolarHBondContact O-N 3.23Å; Y647-L673 HydrophobicContact CD2-CB 4.09Å; Y647-L673 HydrophobicContact CD2-CD1 3.66Å; Y647-L673 HydrophobicContact CD2-CG 3.88Å; Y647-L673 HydrophobicContact CE2-CB 3.95Å; Y647-L673 HydrophobicContact CE2-CD1 3.85Å; Y647-L673 HydrophobicContact CE2-CG 4.18Å; Y647-L673 HydrophobicContact CG-CD1 4.35Å; Y647-L677 HydrophobicContact CD1-CD1 4.2Å; Y647-L677 HydrophobicContact CD1-CD2 4.4Å; Y647-L677 HydrophobicContact CD1-CG 4.26Å; Y647-L677 HydrophobicContact CE1-CD1 3.61Å; Y647-L677 HydrophobicContact CE1-CD2 4.29Å; Y647-L677 HydrophobicContact CE1-CG 3.67Å; Y647-L677 HydrophobicContact CE2-CG 4.42Å
648	V	91.6	Very high	84.8	Confident	2 Å²	2	58 Å²	58	1%	0.012	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	108.7	167.4	-178.7	0	0	0	0	108.4	G513 I558 L561 I651 L668 D669 W670	G513-V648 WeakPolarHBondContact CA-O 3.33Å; G513-V648 PolarHBondContact O-N 2.67Å; I558-V648 HydrophobicContact CG2-CB 4.4Å; I558-V648 HydrophobicContact CG2-CG1 4.16Å; I558-V648 HydrophobicContact CG2-CG2 4.23Å; L561-V648 PolarHBondContact N-O 3.48Å; V648-I651 HydrophobicContact CG1-CG1 4.34Å; V648-L668 HydrophobicContact CG1-CD2 4.16Å; V648-D669 CarbonylContact C-O 3.54Å; V648-W670 HydrophobicContact CG2-CE3 4.29Å; V648-W670 HydrophobicContact CG2-CH2 3.34Å; V648-W670 HydrophobicContact CG2-CZ2 3.79Å; V648-W670 HydrophobicContact CG2-CZ3 3.69Å
649	Y	92	Very high	83.4	Confident	23 Å²	23	62.3 Å²	62.3	9%	0.09	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	-44.3	177.8	-178	-110.1	0	0	0	113	N560 L561 K562 L598 K603 Y647 D669 I671 L765	N560-Y649 PolarHBondContact OD1-O 3.07Å; L561-Y649 HydrophobicContact CB-CD2 4.23Å; L561-Y649 PolarHBondContact N-O 2.95Å; K562-Y649 HydrophobicContact CB-CD2 4.5Å; K562-Y649 HydrophobicContact CB-CE1 4.1Å; K562-Y649 HydrophobicContact CB-CE2 4.12Å; K562-Y649 WeakPolarHBondContact CB-O 3.39Å; K562-Y649 HydrophobicContact CD-CE1 4.07Å; K562-Y649 HydrophobicContact CG-CE1 4.14Å; K562-Y649 PolarHBondContact N-O 2.97Å; L598-Y649 HydrophobicContact CD1-CE2 4.41Å; K603-Y649 HydrophobicContact CD-CD1 4.1Å; K603-Y649 HydrophobicContact CD-CE1 4.4Å; Y647-Y649 PolarHBondContact O-N 2.88Å; Y649-D669 HydrophobicContact CD1-CB 4.29Å; Y649-D669 PolarHBondContact N-O 3.28Å; Y649-I671 VanDerWaalsContact CB-CD1 3.44Å; Y649-I671 HydrophobicContact CD1-CD1 4.25Å; Y649-I671 HydrophobicContact CD2-CD1 3.18Å; Y649-I671 HydrophobicContact CD2-CG1 4.37Å; Y649-I671 HydrophobicContact CE2-CD1 3.93Å; Y649-I671 HydrophobicContact CG-CD1 3.34Å; Y649-I671 HydrophobicContact CG-CG1 4.16Å; Y649-L765 HydrophobicContact CD1-CD1 4.47Å; Y649-L765 HydrophobicContact CE1-CD1 3.95Å; Y649-L765 HydrophobicContact CE2-CD1 4.03Å
650	E	91.4	Very high	82.1	Confident	35 Å²	35	65.8 Å²	65.8	16%	0.164	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	141.6	-178.1	-175.5	172.1	-157.4	0	0	110.3	K562 I652 D669	K562-E650 HydrophobicContact CD-CB 4.23Å; K562-E650 HydrophobicContact CD-CG 4.03Å; K562-E650 WeakPolarHBondContact CD-OE1 3.18Å; K562-E650 VanDerWaalsContact CD-OE2 3.25Å; K562-E650 WeakPolarHBondContact CD-OE2 3.44Å; K562-E650 IonicContact NZ-OE1 3.33Å; K562-E650 PolarHBondContact NZ-OE1 2.97Å; K562-E650 IonicContact NZ-OE2 2.77Å; K562-E650 PolarHBondContact NZ-OE2 2.96Å; E650-I652 HydrophobicContact CB-CD1 4.27Å; E650-I652 HydrophobicContact CG-CD1 3.9Å; E650-D669 HydrophobicContact CB-CB 4.4Å; E650-D669 PolarHBondContact O-N 3.22Å
651	I	87.7	Confident	81	Confident	40 Å²	40	65.4 Å²	65.4	21%	0.205	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	104.8	168.6	-53.2	173.5	0	0	0	107.3	I558 V648 F654 L668	I558-I651 HydrophobicContact CB-CD1 4.09Å; I558-I651 HydrophobicContact CG2-CD1 3.89Å; I558-I651 HydrophobicContact CG2-CG1 4.3Å; V648-I651 HydrophobicContact CG1-CG1 4.34Å; I651-F654 HydrophobicContact CG2-CB 4.17Å; I651-L668 HydrophobicContact CB-CD2 4.02Å; I651-L668 HydrophobicContact CG1-CD2 3.76Å; I651-L668 HydrophobicContact CG2-CD2 3.9Å
652	I	88.4	Confident	80	Confident	57 Å²	57	69.2 Å²	69.2	29%	0.292	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-45.9	-176.4	-58.8	-60.9	0	0	0	110.4	R605 E650 E667	R605-I652 VanDerWaalsContact NH2-CD1 3.28Å; E650-I652 HydrophobicContact CB-CD1 4.27Å; E650-I652 HydrophobicContact CG-CD1 3.9Å; I652-E667 HydrophobicContact CB-CB 4.12Å; I652-E667 HydrophobicContact CB-CG 3.99Å; I652-E667 WeakPolarHBondContact CB-O 3.18Å; I652-E667 HydrophobicContact CG1-CG 4.43Å; I652-E667 HydrophobicContact CG2-CB 4.48Å; I652-E667 HydrophobicContact CG2-CG 4.2Å; I652-E667 PolarHBondContact N-O 3.1Å
653	Q	84.3	Confident	79.1	Confident	56 Å²	56	72.1 Å²	72.1	26%	0.262	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	135.5	-178.2	-162.5	-173.4	-85.6	0	0	109.4	K655 F666 E667	Q653-K655 HydrophobicContact CG-CD 4.37Å; Q653-K655 HydrophobicContact CG-CG 3.97Å; Q653-F666 CarbonylContact O-C 3.48Å; Q653-F666 VanDerWaalsContact O-CA 3.24Å; Q653-F666 WeakPolarHBondContact O-CA 2.87Å; Q653-E667 HydrophobicContact CB-CB 4.11Å; Q653-E667 PolarHBondContact N-O 3.16Å; Q653-E667 PolarHBondContact O-N 3.42Å
654	F	81.6	Confident	78.7	Confident	50 Å²	50	70.3 Å²	70.3	22%	0.219	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	92.6	172	-161.7	-93.6	0	0	0	107.5	P545 L619 I651 M656 F666	P545-F654 HydrophobicContact CB-CD1 4.01Å; P545-F654 HydrophobicContact CB-CE1 3.99Å; P545-F654 HydrophobicContact CB-CG 4.43Å; P545-F654 HydrophobicContact CB-CZ 4.43Å; P545-F654 HydrophobicContact CG-CD1 4.15Å; P545-F654 HydrophobicContact CG-CG 4.37Å; L619-F654 HydrophobicContact CD1-CE2 4.4Å; L619-F654 HydrophobicContact CD1-CZ 4Å; I651-F654 HydrophobicContact CG2-CB 4.17Å; F654-M656 HydrophobicContact CD1-CE 3.54Å; F654-M656 HydrophobicContact CD1-CG 4.25Å; F654-M656 HydrophobicContact CD1-SD 4.22Å; F654-M656 HydrophobicContact CE1-CE 3.07Å; F654-M656 HydrophobicContact CE1-CG 4.15Å; F654-M656 HydrophobicContact CE1-SD 3.58Å; F654-M656 VanDerWaalsContact CE1-SD 3.58Å; F654-M656 HydrophobicContact CE2-CE 4.46Å; F654-M656 HydrophobicContact CG-CE 4.41Å; F654-M656 HydrophobicContact CZ-CE 3.6Å; F654-M656 HydrophobicContact CZ-SD 4.38Å; F654-F666 HydrophobicContact CD2-CB 3.63Å; F654-F666 HydrophobicContact CD2-CG 4.49Å; F654-F666 HydrophobicContact CE2-CB 4.04Å; F654-F666 HydrophobicContact CE2-CG 4.47Å; F654-F666 HydrophobicContact CG-CB 4.5Å
655	K	76.1	Confident	78.6	Confident	116 Å²	116	63.4 Å²	63.4	50%	0.504	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	111.3	-178.2	-80.5	-176.4	-174.3	162.3	0	109.5	Q653 A664 S665	Q653-K655 HydrophobicContact CG-CD 4.37Å; Q653-K655 HydrophobicContact CG-CG 3.97Å; K655-A664 WeakPolarHBondContact O-CA 3.41Å; K655-S665 PolarHBondContact N-O 3.47Å; K655-S665 PolarHBondContact O-N 2.89Å
656	M	68.9	Low	78.5	Confident	76 Å²	76	60.7 Å²	60.7	37%	0.374	31%	0.307	S	S	.	.			trans	-84.4	140.7	164.9	-60.7	-67.1	89.2	0	0	109	Y617 F654 Q658 A664	Y617-M656 HydrophobicContact CD2-CE 4.37Å; Y617-M656 HydrophobicContact CD2-SD 3.51Å; Y617-M656 VanDerWaalsContact CD2-SD 3.51Å; Y617-M656 HydrophobicContact CE2-CE 4.24Å; Y617-M656 HydrophobicContact CE2-SD 3.39Å; Y617-M656 WeakPolarHBondContact CE2-SD 3.24Å; Y617-M656 HydrophobicContact CG-SD 4.24Å; F654-M656 HydrophobicContact CD1-CE 3.54Å; F654-M656 HydrophobicContact CD1-CG 4.25Å; F654-M656 HydrophobicContact CD1-SD 4.22Å; F654-M656 HydrophobicContact CE1-CE 3.07Å; F654-M656 HydrophobicContact CE1-CG 4.15Å; F654-M656 HydrophobicContact CE1-SD 3.58Å; F654-M656 VanDerWaalsContact CE1-SD 3.58Å; F654-M656 HydrophobicContact CE2-CE 4.46Å; F654-M656 HydrophobicContact CG-CE 4.41Å; F654-M656 HydrophobicContact CZ-CE 3.6Å; F654-M656 HydrophobicContact CZ-SD 4.38Å; M656-Q658 PolarHBondContact O-N 3.04Å; M656-A664 HydrophobicContact CE-CB 4.36Å
657	P	65.1	Low	78.5	Confident	43 Å²	43	62.1 Å²	62.1	28%	0.279	31%	0.313	S	S	.	.			trans	-69.2	126	177.3	29.7	-32.1	0	0	0	109.1	Y617 D662 A664	Y617-P657 WeakPolarHBondContact OH-CD 3.29Å; Y617-P657 WeakPolarHBondContact OH-CG 3.19Å; P657-D662 HydrophobicContact CB-CB 3.83Å; P657-D662 WeakPolarHBondContact CB-O 3.14Å; P657-A664 HydrophobicContact CG-CB 4.42Å
658	Q	62.7	Low	78.4	Confident	181 Å²	181	61.1 Å²	61.1	85%	0.846	31%	0.31	S	S	*	.	S	Bend	trans	-87	-29.6	172.9	-66.3	-167.6	-12.8	0	0	111.2	M656	M656-Q658 PolarHBondContact O-N 3.04Å
659	N	60.1	Low	78.5	Confident	107 Å²	107	61 Å²	61	57%	0.572	31%	0.309	S	S	*	.	S	Bend	trans	-116	152.5	178.6	-68.7	-22.7	0	0	0	110.6	S661 D662	N659-S661 PolarHBondContact O-N 2.93Å; N659-D662 PolarHBondContact O-N 3.37Å
660	E	60.5	Low	78.6	Confident	168 Å²	168	60.3 Å²	60.3	79%	0.785	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-16.7	177.9	-69.2	-174.8	172.5	0	0	113.9	K613	K613-E660 VanDerWaalsContact CD-O 3.28Å; K613-E660 WeakPolarHBondContact CD-O 3.26Å; K613-E660 WeakPolarHBondContact CE-O 3.47Å; K613-E660 PolarHBondContact NZ-O 2.89Å
661	S	65.5	Low	78.6	Confident	89 Å²	89	58.7 Å²	58.7	62%	0.622	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-23.7	177.4	55.7	0	0	0	0	114.3	N659	N659-S661 PolarHBondContact O-N 2.93Å
662	D	68.3	Low	78.9	Confident	79 Å²	79	56.9 Å²	56.9	42%	0.422	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-82.7	139.2	-169.9	-65.2	-17.2	0	0	0	110.3	P657 N659	P657-D662 HydrophobicContact CB-CB 3.83Å; P657-D662 WeakPolarHBondContact CB-O 3.14Å; N659-D662 PolarHBondContact O-N 3.37Å
663	I	70.8	Confident	79.1	Confident	98 Å²	98	54.2 Å²	54.2	50%	0.503	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-98.1	127.5	177.6	-51.1	170	0	0	0	108.5	Q609 S665	Q609-I663 HydrophobicContact CG-CB 4.48Å; Q609-I663 HydrophobicContact CG-CG2 3.54Å; Q609-I663 VanDerWaalsContact NE2-CG2 3.3Å; I663-S665 PolarHBondContact O-N 2.93Å
664	A	76.6	Confident	79.3	Confident	4 Å²	4	51.8 Å²	51.8	3%	0.033	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-62.3	135.6	177.7	0	0	0	0	0	110.8	W610 Y617 K655 M656 P657	W610-A664 HydrophobicContact CB-CB 4.13Å; W610-A664 HydrophobicContact CG-CB 4.39Å; W610-A664 PolarHBondContact N-O 3.48Å; Y617-A664 HydrophobicContact CE1-CB 3.68Å; Y617-A664 WeakPolarHBondContact OH-CB 3.33Å; K655-A664 WeakPolarHBondContact O-CA 3.41Å; M656-A664 HydrophobicContact CE-CB 4.36Å; P657-A664 HydrophobicContact CG-CB 4.42Å
665	S	85.2	Confident	79.5	Confident	18 Å²	18	54.2 Å²	54.2	13%	0.126	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	147	176.6	57	0	0	0	0	111.1	F608 K655 I663	F608-S665 VanDerWaalsContact O-CA 3.25Å; F608-S665 WeakPolarHBondContact O-CA 3.39Å; F608-S665 WeakPolarHBondContact O-CB 3.36Å; K655-S665 PolarHBondContact N-O 3.47Å; K655-S665 PolarHBondContact O-N 2.89Å; I663-S665 PolarHBondContact O-N 2.93Å
666	F	87.2	Confident	80	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.009	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	146.5	175.5	62.4	-88.1	0	0	0	111.1	K607 F608 W610 L622 I625 Q653 F654 L668 F755	K607-F666 WeakPolarHBondContact CA-O 3.38Å; F608-F666 HydrophobicContact CB-CD1 4.19Å; F608-F666 HydrophobicContact CB-CD2 4.17Å; F608-F666 HydrophobicContact CB-CE1 3.65Å; F608-F666 HydrophobicContact CB-CE2 3.65Å; F608-F666 HydrophobicContact CB-CG 4.42Å; F608-F666 HydrophobicContact CB-CZ 3.35Å; F608-F666 HydrophobicContact CD2-CD2 4.12Å; F608-F666 AromaticContact CD2-CE2 3.42Å; F608-F666 HydrophobicContact CD2-CE2 3.42Å; F608-F666 VanDerWaalsContact CD2-CE2 3.42Å; F608-F666 AromaticContact CD2-CZ 3.88Å; F608-F666 HydrophobicContact CD2-CZ 3.88Å; F608-F666 HydrophobicContact CE2-CE2 4.27Å; F608-F666 HydrophobicContact CG-CE1 4.49Å; F608-F666 AromaticContact CG-CE2 3.78Å; F608-F666 HydrophobicContact CG-CE2 3.78Å; F608-F666 AromaticContact CG-CZ 3.73Å; F608-F666 HydrophobicContact CG-CZ 3.73Å; F608-F666 PolarHBondContact N-O 3.47Å; F608-F666 PolarHBondContact O-N 3.32Å; W610-F666 AromaticContact CD1-CD1 3.84Å; W610-F666 AromaticContact CD1-CE1 3.65Å; W610-F666 AromaticContact NE1-CD1 3.94Å; W610-F666 AromaticContact NE1-CE1 3.63Å; L622-F666 HydrophobicContact CD2-CE1 3.95Å; L622-F666 HydrophobicContact CD2-CE2 3.69Å; L622-F666 HydrophobicContact CD2-CZ 3.35Å; I625-F666 HydrophobicContact CD1-CE2 3.96Å; I625-F666 HydrophobicContact CD1-CZ 3.61Å; Q653-F666 CarbonylContact O-C 3.48Å; Q653-F666 VanDerWaalsContact O-CA 3.24Å; Q653-F666 WeakPolarHBondContact O-CA 2.87Å; F654-F666 HydrophobicContact CD2-CB 3.63Å; F654-F666 HydrophobicContact CD2-CG 4.49Å; F654-F666 HydrophobicContact CE2-CB 4.04Å; F654-F666 HydrophobicContact CE2-CG 4.47Å; F654-F666 HydrophobicContact CG-CB 4.5Å; F666-L668 HydrophobicContact CD2-CD1 3.76Å; F666-L668 HydrophobicContact CD2-CG 3.98Å; F666-L668 HydrophobicContact CE2-CD1 3.92Å; F666-F755 AromaticContact CE1-CD1 3.92Å; F666-F755 HydrophobicContact CE1-CD1 3.92Å; F666-F755 AromaticContact CE1-CE1 3.95Å; F666-F755 HydrophobicContact CE1-CE1 3.95Å; F666-F755 HydrophobicContact CZ-CD1 4.06Å; F666-F755 HydrophobicContact CZ-CE1 4.14Å
667	E	91.9	Very high	80.7	Confident	35 Å²	35	48 Å²	48	16%	0.164	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	123.1	-178.7	-172.3	175.2	-178	0	0	109	R605 M606 K607 I652 Q653	R605-E667 VanDerWaalsContact CD-OE1 3.23Å; R605-E667 WeakPolarHBondContact CD-OE1 3.42Å; R605-E667 HydrophobicContact CG-CG 4.18Å; M606-E667 WeakPolarHBondContact O-CA 3.37Å; K607-E667 HydrophobicContact CB-CB 4.4Å; K607-E667 HydrophobicContact CB-CG 4.18Å; K607-E667 HydrophobicContact CG-CB 4.28Å; K607-E667 HydrophobicContact CG-CG 4.48Å; I652-E667 HydrophobicContact CB-CB 4.12Å; I652-E667 HydrophobicContact CB-CG 3.99Å; I652-E667 WeakPolarHBondContact CB-O 3.18Å; I652-E667 HydrophobicContact CG1-CG 4.43Å; I652-E667 HydrophobicContact CG2-CB 4.48Å; I652-E667 HydrophobicContact CG2-CG 4.2Å; I652-E667 PolarHBondContact N-O 3.1Å; Q653-E667 HydrophobicContact CB-CB 4.11Å; Q653-E667 PolarHBondContact N-O 3.16Å; Q653-E667 PolarHBondContact O-N 3.42Å
668	L	91.3	Very high	81.3	Confident	4 Å²	4	47.3 Å²	47.3	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	140	-172.7	-60.8	172	0	0	0	110.1	R605 M606 V648 I651 F666 W670	R605-L668 WeakPolarHBondContact CA-O 3.45Å; M606-L668 PolarHBondContact N-O 3.33Å; M606-L668 PolarHBondContact O-N 3.38Å; V648-L668 HydrophobicContact CG1-CD2 4.16Å; I651-L668 HydrophobicContact CB-CD2 4.02Å; I651-L668 HydrophobicContact CG1-CD2 3.76Å; I651-L668 HydrophobicContact CG2-CD2 3.9Å; F666-L668 HydrophobicContact CD2-CD1 3.76Å; F666-L668 HydrophobicContact CD2-CG 3.98Å; F666-L668 HydrophobicContact CE2-CD1 3.92Å; L668-W670 HydrophobicContact CD1-CZ2 4.07Å
669	D	93.5	Very high	81.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	124.7	165	-77.4	-8.8	0	0	0	108.9	K603 R605 V648 Y649 E650	K603-D669 HydrophobicContact CD-CB 4.28Å; K603-D669 WeakPolarHBondContact CD-OD2 3.17Å; K603-D669 VanDerWaalsContact CE-OD2 3.31Å; K603-D669 WeakPolarHBondContact CE-OD2 3.48Å; K603-D669 IonicContact NZ-OD2 2.8Å; K603-D669 PolarHBondContact NZ-OD2 3.2Å; R605-D669 VanDerWaalsContact CB-OD1 3.23Å; R605-D669 WeakPolarHBondContact CB-OD1 3.4Å; R605-D669 WeakPolarHBondContact CG-OD1 3.01Å; R605-D669 IonicContact CZ-OD1 3.49Å; R605-D669 IonicContact CZ-OD2 3.78Å; R605-D669 IonicContact NE-OD1 2.82Å; R605-D669 PolarHBondContact NE-OD1 3.13Å; R605-D669 IonicContact NE-OD2 2.99Å; R605-D669 IonicContact NH2-OD1 3.74Å; R605-D669 PolarHBondContact NH2-OD1 2.7Å; R605-D669 IonicContact NH2-OD2 3.24Å; R605-D669 PolarHBondContact NH2-OD2 2.98Å; V648-D669 CarbonylContact C-O 3.54Å; Y649-D669 HydrophobicContact CD1-CB 4.29Å; Y649-D669 PolarHBondContact N-O 3.28Å; E650-D669 HydrophobicContact CB-CB 4.4Å; E650-D669 PolarHBondContact O-N 3.22Å
670	W	93.1	Very high	81.3	Confident	9 Å²	9	43.5 Å²	43.5	3%	0.034	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	144.4	175.2	-69.5	84.9	0	0	0	110.9	K603 L604 N626 L629 L646 Y647 V648 L668	K603-W670 CarbonylContact C-O 3.36Å; K603-W670 VanDerWaalsContact CA-O 3.27Å; K603-W670 WeakPolarHBondContact CA-O 3.49Å; L604-W670 HydrophobicContact CB-CB 4.26Å; L604-W670 PolarHBondContact N-O 3.29Å; L604-W670 PolarHBondContact O-N 3.14Å; N626-W670 VanDerWaalsContact CG-CZ3 3.47Å; N626-W670 WeakPolarHBondContact ND2-CH2 3.46Å; N626-W670 VanDerWaalsContact ND2-CZ3 3.33Å; N626-W670 WeakPolarHBondContact ND2-CZ3 3.45Å; N626-W670 WeakPolarHBondContact OD1-CH2 3.33Å; N626-W670 WeakPolarHBondContact OD1-CZ2 3.05Å; N626-W670 VanDerWaalsContact OD1-CZ3 3.26Å; N626-W670 WeakPolarHBondContact OD1-CZ3 3.4Å; L629-W670 HydrophobicContact CD2-CB 4.38Å; L629-W670 HydrophobicContact CD2-CD2 3.94Å; L629-W670 HydrophobicContact CD2-CE3 4.22Å; L629-W670 HydrophobicContact CD2-CG 3.99Å; L646-W670 HydrophobicContact CB-CE3 4.32Å; Y647-W670 CarbonylContact O-C 3.59Å; Y647-W670 WeakPolarHBondContact O-CA 3.4Å; V648-W670 HydrophobicContact CG2-CE3 4.29Å; V648-W670 HydrophobicContact CG2-CH2 3.34Å; V648-W670 HydrophobicContact CG2-CZ2 3.79Å; V648-W670 HydrophobicContact CG2-CZ3 3.69Å; L668-W670 HydrophobicContact CD1-CZ2 4.07Å
671	I	92.8	Very high	80.7	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	138	172.8	-73.6	176	0	0	0	109.2	T600 K603 Y647 Y649 L673 L765	T600-I671 HydrophobicContact CG2-CG2 3.61Å; K603-I671 HydrophobicContact CB-CD1 4.28Å; K603-I671 HydrophobicContact CB-CG1 3.68Å; Y647-I671 PolarHBondContact N-O 2.96Å; Y647-I671 PolarHBondContact O-N 3.23Å; Y649-I671 VanDerWaalsContact CB-CD1 3.44Å; Y649-I671 HydrophobicContact CD1-CD1 4.25Å; Y649-I671 HydrophobicContact CD2-CD1 3.18Å; Y649-I671 HydrophobicContact CD2-CG1 4.37Å; Y649-I671 HydrophobicContact CE2-CD1 3.93Å; Y649-I671 HydrophobicContact CG-CD1 3.34Å; Y649-I671 HydrophobicContact CG-CG1 4.16Å; I671-L673 HydrophobicContact CG2-CD2 3.55Å; I671-L673 HydrophobicContact CG2-CG 3.86Å; I671-L765 HydrophobicContact CD1-CD1 4.05Å; I671-L765 HydrophobicContact CD1-CD2 3.6Å; I671-L765 HydrophobicContact CD1-CG 4.44Å
672	F	93.8	Very high	79.8	Confident	1 Å²	1	39.7 Å²	39.7	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.7	167.6	173.6	-125.9	0	0	0	109.9	T600 E640 V641 K645 L646 P674 L735 L738	T600-F672 WeakPolarHBondContact CB-O 3.38Å; T600-F672 PolarHBondContact OG1-O 3.26Å; E640-F672 HydrophobicContact CB-CZ 4.19Å; E640-F672 WeakPolarHBondContact O-CZ 3.45Å; V641-F672 HydrophobicContact CB-CE2 4.22Å; V641-F672 HydrophobicContact CB-CZ 4.35Å; V641-F672 HydrophobicContact CG1-CD2 4.39Å; V641-F672 HydrophobicContact CG1-CE2 4.46Å; V641-F672 HydrophobicContact CG2-CD1 3.95Å; V641-F672 HydrophobicContact CG2-CD2 4.1Å; V641-F672 HydrophobicContact CG2-CE1 3.76Å; V641-F672 HydrophobicContact CG2-CE2 3.95Å; V641-F672 HydrophobicContact CG2-CG 4.12Å; V641-F672 HydrophobicContact CG2-CZ 3.77Å; K645-F672 HydrophobicContact CB-CD2 4.01Å; K645-F672 HydrophobicContact CB-CE2 3.71Å; K645-F672 HydrophobicContact CD-CE2 4.08Å; L646-F672 HydrophobicContact CD2-CB 3.92Å; L646-F672 HydrophobicContact CD2-CD2 4.27Å; F672-P674 HydrophobicContact CE1-CB 4.03Å; F672-P674 HydrophobicContact CZ-CB 3.88Å; F672-L735 WeakPolarHBondContact CE1-O 3.33Å; F672-L738 HydrophobicContact CB-CD1 3.89Å; F672-L738 HydrophobicContact CD1-CD2 4.28Å
673	L	92.4	Very high	78.7	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	24%	0.238	C	C	.	.			trans	-113.9	98.9	175.4	-60.1	178.8	0	0	0	109	L561 L598 T600 K645 Y647 I671 L675 G676 L677	L561-L673 HydrophobicContact CD2-CD1 4.12Å; L598-L673 HydrophobicContact CB-CD2 4.01Å; L598-L673 HydrophobicContact CD2-CD1 3.96Å; L598-L673 HydrophobicContact CD2-CD2 4.24Å; T600-L673 HydrophobicContact CG2-CD2 3.8Å; K645-L673 WeakPolarHBondContact CB-O 3.42Å; K645-L673 PolarHBondContact O-N 3.43Å; Y647-L673 HydrophobicContact CD2-CB 4.09Å; Y647-L673 HydrophobicContact CD2-CD1 3.66Å; Y647-L673 HydrophobicContact CD2-CG 3.88Å; Y647-L673 HydrophobicContact CE2-CB 3.95Å; Y647-L673 HydrophobicContact CE2-CD1 3.85Å; Y647-L673 HydrophobicContact CE2-CG 4.18Å; Y647-L673 HydrophobicContact CG-CD1 4.35Å; I671-L673 HydrophobicContact CG2-CD2 3.55Å; I671-L673 HydrophobicContact CG2-CG 3.86Å; L673-L675 PolarHBondContact O-N 3.03Å; L673-L675 VanDerWaalsContact O-N 3.16Å; L673-G676 PolarHBondContact O-N 3.11Å; L673-L677 HydrophobicContact CD1-CD2 3.75Å; L673-L677 HydrophobicContact CD1-CG 4.45Å
674	P	87.3	Confident	77.3	Confident	6 Å²	6	39 Å²	39	4%	0.039	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-28	-175.2	24.9	-34.8	0	0	0	113.2	V599 K645 F672 L735	V599-P674 WeakPolarHBondContact O-CD 3.34Å; K645-P674 WeakPolarHBondContact CD-O 3.39Å; K645-P674 WeakPolarHBondContact CE-O 3.28Å; K645-P674 PolarHBondContact NZ-O 3.16Å; F672-P674 HydrophobicContact CE1-CB 4.03Å; F672-P674 HydrophobicContact CZ-CB 3.88Å; P674-L735 HydrophobicContact CB-CB 3.96Å; P674-L735 HydrophobicContact CG-CB 4.11Å
675	L	85.9	Confident	75.8	Confident	100 Å²	100	42.4 Å²	42.4	52%	0.524	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	3.5	178.3	-56.6	-178.5	0	0	0	113.5	V599 L673 D732	V599-L675 HydrophobicContact CB-CD1 4.43Å; V599-L675 HydrophobicContact CG1-CD1 4.35Å; V599-L675 HydrophobicContact CG2-CD1 4.21Å; L673-L675 PolarHBondContact O-N 3.03Å; L673-L675 VanDerWaalsContact O-N 3.16Å; L675-D732 HydrophobicContact CD1-CB 4.13Å
676	G	86.7	Confident	73.5	Confident	20 Å²	20	42.2 Å²	42.2	21%	0.206	24%	0.237	C	C	.	.			trans	74	-166.5	-173.8	0	0	0	0	0	113.7	L673	L673-G676 PolarHBondContact O-N 3.11Å
677	L	84.7	Confident	71.2	Confident	41 Å²	41	44 Å²	44	22%	0.215	25%	0.246	C	C	.	.	S	Bend	trans	-75.9	137.4	174.3	-68.5	170.4	0	0	0	110.5	P512 L561 P593 Y647 L673	P512-L677 HydrophobicContact CG-CD1 3.77Å; P512-L677 HydrophobicContact CG-CD2 4.43Å; L561-L677 HydrophobicContact CD1-CD2 3.46Å; L561-L677 VanDerWaalsContact CD1-CD2 3.46Å; L561-L677 HydrophobicContact CD2-CD2 4.02Å; L561-L677 HydrophobicContact CG-CD2 4.41Å; P593-L677 HydrophobicContact CG-CD2 4.32Å; Y647-L677 HydrophobicContact CD1-CD1 4.2Å; Y647-L677 HydrophobicContact CD1-CD2 4.4Å; Y647-L677 HydrophobicContact CD1-CG 4.26Å; Y647-L677 HydrophobicContact CE1-CD1 3.61Å; Y647-L677 HydrophobicContact CE1-CD2 4.29Å; Y647-L677 HydrophobicContact CE1-CG 3.67Å; Y647-L677 HydrophobicContact CE2-CG 4.42Å; L673-L677 HydrophobicContact CD1-CD2 3.75Å; L673-L677 HydrophobicContact CD1-CG 4.45Å
678	P	76.2	Confident	68.4	Low	30 Å²	30	44.9 Å²	44.9	20%	0.195	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-62.4	147.3	174.2	27.1	-35.4	0	0	0	111.1	P593 L597	P593-P678 HydrophobicContact CB-CG 3.46Å; P593-P678 VanDerWaalsContact CB-CG 3.46Å; P593-P678 HydrophobicContact CG-CG 3.74Å; L597-P678 HydrophobicContact CB-CB 4.44Å; L597-P678 HydrophobicContact CB-CG 3.99Å
679	N	67.3	Low	65.6	Low	109 Å²	109	49.3 Å²	49.3	58%	0.583	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-71.1	150.2	179.6	-64.1	-49.1	0	0	0	111.1	G681 E682	N679-G681 PolarHBondContact O-N 3.01Å; N679-E682 HydrophobicContact CB-CG 4.14Å; N679-E682 PolarHBondContact N-OE2 3.2Å; N679-E682 VanDerWaalsContact N-OE2 3.08Å; N679-E682 PolarHBondContact ND2-OE1 2.85Å; N679-E682 PolarHBondContact O-N 3.41Å; N679-E682 VanDerWaalsContact O-N 3.08Å
680	D	57.3	Low	62.6	Low	98 Å²	98	54.3 Å²	54.3	52%	0.524	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	112.6	171.6	-84.4	-51.5	0	0	0	110.1	R509 K591	R509-D680 IonicContact CZ-OD2 3.38Å; R509-D680 IonicContact NH1-OD2 3.94Å; R509-D680 PolarHBondContact NH1-OD2 2.86Å; R509-D680 IonicContact NH2-OD1 3.2Å; R509-D680 PolarHBondContact NH2-OD1 2.84Å; R509-D680 IonicContact NH2-OD2 2.78Å; R509-D680 PolarHBondContact NH2-OD2 3.46Å; K591-D680 IonicContact NZ-OD1 2.73Å; K591-D680 PolarHBondContact NZ-OD1 3.31Å
681	G	47.8	Very low	59.8	Low	76 Å²	76	60 Å²	60	78%	0.784	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.6	-6.6	179.4	0	0	0	0	0	114.8	N679 E683	N679-G681 PolarHBondContact O-N 3.01Å; G681-E683 PolarHBondContact O-N 3.5Å
682	E	44.7	Very low	57.1	Low	101 Å²	101	62.9 Å²	62.9	47%	0.472	37%	0.372	S	S	.	.			trans	-78.2	100	169	-75.7	172.4	-178.1	0	0	109.9	N679	N679-E682 HydrophobicContact CB-CG 4.14Å; N679-E682 PolarHBondContact N-OE2 3.2Å; N679-E682 VanDerWaalsContact N-OE2 3.08Å; N679-E682 PolarHBondContact ND2-OE1 2.85Å; N679-E682 PolarHBondContact O-N 3.41Å; N679-E682 VanDerWaalsContact O-N 3.08Å
683	E	45.6	Very low	54.1	Low	118 Å²	118	69.1 Å²	69.1	55%	0.551	40%	0.404	S	S	*	.			trans	-94.6	119.2	169.8	-69.7	-176.9	179.9	0	0	109.5	G681 F685	G681-E683 PolarHBondContact O-N 3.5Å; E683-F685 HydrophobicContact CB-CE2 4.14Å; E683-F685 HydrophobicContact CB-CZ 4.08Å; E683-F685 WeakPolarHBondContact O-CD2 3.41Å; E683-F685 PolarHBondContact O-N 3.43Å
684	I	42.6	Very low	51.3	Low	44 Å²	44	75.1 Å²	75.1	23%	0.226	44%	0.441	C	S	.	.			trans	-83.1	106	168.5	-53	173.3	0	0	0	107.8	L597 L686 P724	L597-I684 HydrophobicContact CB-CD1 4.41Å; L597-I684 HydrophobicContact CD2-CB 3.57Å; L597-I684 HydrophobicContact CD2-CD1 3.86Å; L597-I684 HydrophobicContact CD2-CG1 3.45Å; L597-I684 VanDerWaalsContact CD2-CG1 3.45Å; I684-L686 VanDerWaalsContact C-N 3.32Å; I684-L686 HydrophobicContact CB-CG 4.29Å; I684-L686 HydrophobicContact CG2-CD1 4.13Å; I684-L686 HydrophobicContact CG2-CD2 3.41Å; I684-L686 VanDerWaalsContact CG2-CD2 3.41Å; I684-L686 HydrophobicContact CG2-CG 3.43Å; I684-L686 VanDerWaalsContact CG2-CG 3.43Å; I684-L686 PolarHBondContact O-N 3.47Å; I684-P724 HydrophobicContact CG2-CG 4.37Å
685	F	44.2	Very low	48.5	Very low	76 Å²	76	80.6 Å²	80.6	33%	0.333	47%	0.469	S	S	.	.			trans	-74.4	69.5	178.2	-64.9	-81.2	0	0	0	112.2	E683 L687 I723 L806 Y807	E683-F685 HydrophobicContact CB-CE2 4.14Å; E683-F685 HydrophobicContact CB-CZ 4.08Å; E683-F685 WeakPolarHBondContact O-CD2 3.41Å; E683-F685 PolarHBondContact O-N 3.43Å; F685-L687 PolarHBondContact O-N 2.8Å; F685-I723 HydrophobicContact CD2-CG1 4.45Å; F685-L806 WeakPolarHBondContact CB-O 3.49Å; F685-L806 CarbonylContact O-C 3.59Å; F685-L806 VanDerWaalsContact O-CB 3.23Å; F685-L806 WeakPolarHBondContact O-CB 3.21Å; F685-Y807 CarbonylContact O-C 3.48Å; F685-Y807 WeakPolarHBondContact O-CA 3.21Å; F685-Y807 PolarHBondContact O-N 3.06Å
686	L	36.5	Very low	45.7	Very low	15 Å²	15	81.6 Å²	81.6	8%	0.079	47%	0.474	C	S	.	.			trans	-82.9	87.6	-171.4	-69.2	-177.7	0	0	0	116.7	I684 L729 L772 L806 M808	I684-L686 VanDerWaalsContact C-N 3.32Å; I684-L686 HydrophobicContact CB-CG 4.29Å; I684-L686 HydrophobicContact CG2-CD1 4.13Å; I684-L686 HydrophobicContact CG2-CD2 3.41Å; I684-L686 VanDerWaalsContact CG2-CD2 3.41Å; I684-L686 HydrophobicContact CG2-CG 3.43Å; I684-L686 VanDerWaalsContact CG2-CG 3.43Å; I684-L686 PolarHBondContact O-N 3.47Å; L686-L729 HydrophobicContact CD1-CD2 4.37Å; L686-L729 HydrophobicContact CD2-CD2 3.91Å; L686-L772 HydrophobicContact CD1-CD1 4.35Å; L686-L806 HydrophobicContact CD2-CB 4.48Å; L686-L806 HydrophobicContact CD2-CD1 3.55Å; L686-L806 HydrophobicContact CD2-CD2 4.28Å; L686-L806 HydrophobicContact CD2-CG 4.33Å; L686-M808 WeakPolarHBondContact O-CE 3.38Å; L686-M808 WeakPolarHBondContact O-CG 3.24Å
687	L	39.4	Very low	42.9	Very low	38 Å²	38	86.7 Å²	86.7	20%	0.199	50%	0.497	C	S	.	.			trans	88.9	130.2	149.1	-55	154.6	0	0	0	123.8	F685 I776 L806 Y807 M808	F685-L687 PolarHBondContact O-N 2.8Å; L687-I776 HydrophobicContact CD1-CB 4.14Å; L687-I776 HydrophobicContact CD1-CD1 3.06Å; L687-I776 HydrophobicContact CD1-CG1 3.62Å; L687-I776 HydrophobicContact CD1-CG2 3.92Å; L687-L806 HydrophobicContact CD2-CD2 3.57Å; L687-L806 HydrophobicContact CG-CD2 3.95Å; L687-Y807 CarbonylContact C-O 2.81Å; L687-Y807 WeakPolarHBondContact CA-O 3.32Å; L687-Y807 VanDerWaalsContact N-C 3.3Å; L687-Y807 PolarHBondContact N-O 3.19Å; L687-M808 HydrophobicContact CB-CE 4.14Å; L687-M808 WeakPolarHBondContact O-CA 2.76Å; L687-M808 WeakPolarHBondContact O-CE 3.15Å; L687-M808 WeakPolarHBondContact O-CG 3.42Å
688	S	33.4	Very low	40.1	Very low	54 Å²	54	89.3 Å²	89.3	38%	0.378	52%	0.518	S	S	.	.			trans	-150.8	146.6	132.9	90.2	0	0	0	0	112.2	Y807 P809	S688-Y807 PolarHBondContact N-O 3.02Å; S688-P809 WeakPolarHBondContact CB-O 3.36Å; S688-P809 WeakPolarHBondContact OG-CD 3.29Å; S688-P809 WeakPolarHBondContact OG-CG 3.33Å
689	N	32.2	Very low	37.7	Very low	98 Å²	98	96.7 Å²	96.7	52%	0.524	55%	0.548	S	S	.	.			trans	-62	142	162	-91.4	-15.7	0	0	0	110
690	D	31.5	Very low	35.7	Very low	105 Å²	105	100.8 Å²	100.8	56%	0.561	56%	0.563	S	S	*	*				-177.7	121.6	114.5	-91.3	-19.4	0	0	0	110.4	A692	D690-A692 HydrophobicContact CB-CB 4.2Å; D690-A692 PolarHBondContact O-N 3.4Å
691	S	34.2	Very low	34.2	Very low	129 Å²	129	103.2 Å²	103.2	90%	0.902	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	25.1	164.4	48.6	0	0	0	0	113.1
692	A	34.5	Very low	33.2	Very low	61 Å²	61	107.1 Å²	107.1	50%	0.504	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.9	3.2	176.3	0	0	0	0	0	113.4	D690 T694 N695	D690-A692 HydrophobicContact CB-CB 4.2Å; D690-A692 PolarHBondContact O-N 3.4Å; A692-T694 PolarHBondContact O-N 3.25Å; A692-N695 PolarHBondContact O-N 3.34Å; A692-N695 VanDerWaalsContact O-N 3.1Å
693	I	32.5	Very low	32.2	Very low	131 Å²	131	110.9 Å²	110.9	67%	0.672	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-71.3	-11.3	178.8	-61.6	177.8	0	0	0	112.8	N695 I696	I693-N695 VanDerWaalsContact C-N 3.27Å; I693-N695 PolarHBondContact O-N 3.03Å; I693-I696 HydrophobicContact CG2-CD1 4.3Å
694	T	33.1	Very low	31.3	Very low	128 Å²	128	112.3 Å²	112.3	79%	0.785	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-77.5	-9.9	169.3	54.4	0	0	0	0	113.9	A692	A692-T694 PolarHBondContact O-N 3.25Å
695	N	28.4	Very low	30.7	Very low	120 Å²	120	116.5 Å²	116.5	64%	0.642	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-119.7	42.5	178	-79.7	-7.1	0	0	0	112.9	A692 I693 N697	A692-N695 PolarHBondContact O-N 3.34Å; A692-N695 VanDerWaalsContact O-N 3.1Å; I693-N695 VanDerWaalsContact C-N 3.27Å; I693-N695 PolarHBondContact O-N 3.03Å; N695-N697 PolarHBondContact O-N 3.45Å
696	I	27.5	Very low	29.9	Very low	121 Å²	121	121.1 Å²	121.1	62%	0.621	66%	0.66	S	S	*	*			trans	-72.1	63.6	151.6	-51.7	175.9	0	0	0	107.3	I693 S698	I693-I696 HydrophobicContact CG2-CD1 4.3Å; I696-S698 VanDerWaalsContact C-N 3.27Å; I696-S698 PolarHBondContact O-N 3.36Å
697	N	27.3	Very low	29.5	Very low	128 Å²	128	128 Å²	128	68%	0.684	70%	0.695	S	S	*	*			trans	-66.8	101.7	156.3	-81.5	-20.8	0	0	0	104.9	N695 F699	N695-N697 PolarHBondContact O-N 3.45Å; N697-F699 PolarHBondContact O-N 2.88Å
698	S	26	Very low	29.1	Very low	95 Å²	95	135.1 Å²	135.1	66%	0.664	73%	0.728	S	S	*	*			trans	22.3	98.4	150.6	56.2	0	0	0	0	113.5	I696 Q700	I696-S698 VanDerWaalsContact C-N 3.27Å; I696-S698 PolarHBondContact O-N 3.36Å; S698-Q700 PolarHBondContact O-N 2.74Å
699	F	25.8	Very low	28.9	Very low	186 Å²	186	138.9 Å²	138.9	82%	0.816	74%	0.743	S	S	*	*			trans	-28.2	109.5	161.5	-78.8	-94.6	0	0	0	110.2	N697 M701	N697-F699 PolarHBondContact O-N 2.88Å; F699-M701 PolarHBondContact O-N 2.81Å
700	Q	25.4	Very low	28.7	Very low	194 Å²	194	140.6 Å²	140.6	91%	0.907	76%	0.757	S	S	*	*			trans	-65.7	90.2	165.2	-82.7	-176.7	-30	0	0	106.2	S698 I702	S698-Q700 PolarHBondContact O-N 2.74Å; Q700-I702 PolarHBondContact O-N 3.18Å; Q700-I702 VanDerWaalsContact O-N 3.1Å
701	M	24.9	Very low	28.4	Very low	149 Å²	149	141.5 Å²	141.5	73%	0.734	76%	0.762	S	S	*	*			trans	-43.7	115.5	165.1	-91.1	-88.2	-127.4	0	0	107.8	F699 Q703	F699-M701 PolarHBondContact O-N 2.81Å; M701-Q703 VanDerWaalsContact C-N 3.32Å; M701-Q703 PolarHBondContact O-N 3.47Å
702	I	27.1	Very low	28.1	Very low	159 Å²	159	143.2 Å²	143.2	82%	0.815	76%	0.756	S	S	*	*			trans	-56.8	102.6	167.8	-65.7	169.2	0	0	0	105.7	Q700 N704	Q700-I702 PolarHBondContact O-N 3.18Å; Q700-I702 VanDerWaalsContact O-N 3.1Å; I702-N704 VanDerWaalsContact C-N 3.29Å; I702-N704 PolarHBondContact O-N 3.46Å
703	Q	24.7	Very low	27.7	Very low	180 Å²	180	145.5 Å²	145.5	84%	0.841	77%	0.765	S	S	*	*	S	Bend	trans	-64.1	91.7	173.3	-72.9	-177.1	-20	0	0	107.6	M701	M701-Q703 VanDerWaalsContact C-N 3.32Å; M701-Q703 PolarHBondContact O-N 3.47Å
704	N	26.5	Very low	27.4	Very low	147 Å²	147	146.2 Å²	146.2	79%	0.786	77%	0.769	S	S	*	*			trans	174.7	74.6	147	-91.2	-19.2	0	0	0	110.3	I702	I702-N704 VanDerWaalsContact C-N 3.29Å; I702-N704 PolarHBondContact O-N 3.46Å
705	T	29.9	Very low	27	Very low	132 Å²	132	145.9 Å²	145.9	81%	0.81	76%	0.763	S	S	*	*			trans	-163.5	115.8	140.7	42.6	0	0	0	0	107	L707	T705-L707 PolarHBondContact O-N 3.19Å
706	N	28.2	Very low	26.9	Very low	174 Å²	174	147.2 Å²	147.2	93%	0.93	77%	0.769	S	S	*	*			trans	-66.3	75.3	-179.3	-69.3	-33.4	0	0	0	111.8
707	L	27.5	Very low	26.7	Very low	158 Å²	158	151.8 Å²	151.8	83%	0.827	78%	0.78	S	S	*	*			trans	-118.5	123.4	168.9	-130.9	80.6	0	0	0	109.9	T705	T705-L707 PolarHBondContact O-N 3.19Å
708	H	29.6	Very low	26.7	Very low	189 Å²	189	149.5 Å²	149.5	88%	0.875	77%	0.77	S	S	*	*			trans	-46.5	132.4	-173.3	-91.8	-76.3	0	0	0	115	V710	H708-V710 PolarHBondContact O-N 3.15Å
709	N	29.2	Very low	26.8	Very low	133 Å²	133	153.8 Å²	153.8	71%	0.711	78%	0.78	S	S	*	*			trans	-31	108.4	169.6	-74	-22.4	0	0	0	115
710	V	28.9	Very low	27	Very low	134 Å²	134	147.9 Å²	147.9	81%	0.812	76%	0.762	S	S	*	*			trans	-118.9	84.7	152.1	-177.8	0	0	0	0	107	H708 Q712	H708-V710 PolarHBondContact O-N 3.15Å; V710-Q712 PolarHBondContact O-N 3.3Å
711	N	26	Very low	27.4	Very low	124 Å²	124	145.2 Å²	145.2	66%	0.663	75%	0.754	S	S	*	*			trans	-91.1	62.1	-179.8	-75.9	-8.8	0	0	0	111.5
712	Q	27.3	Very low	28.2	Very low	165 Å²	165	145.5 Å²	145.5	77%	0.771	76%	0.758	S	S	*	*			trans	-130.9	116.4	165.2	-75.8	-171.8	-11.7	0	0	110.6	V710 I714	V710-Q712 PolarHBondContact O-N 3.3Å; Q712-I714 PolarHBondContact O-N 3.34Å
713	P	26.3	Very low	29	Very low	109 Å²	109	139 Å²	139	71%	0.708	73%	0.725	S	S	*	*			trans	-67.6	124.8	176.1	27.1	-31	0	0	0	109.6	N715	P713-N715 PolarHBondContact O-N 3.1Å
714	I	26.1	Very low	30.2	Very low	146 Å²	146	132.3 Å²	132.3	75%	0.749	70%	0.697	S	S	*	*			trans	-73.4	96.1	179.1	-60.5	167.6	0	0	0	107.9	Q712 L716	Q712-I714 PolarHBondContact O-N 3.34Å; I714-L716 PolarHBondContact O-N 2.83Å
715	N	24.4	Very low	32.1	Very low	121 Å²	121	129.1 Å²	129.1	65%	0.647	68%	0.676	S	S	*	*			trans	-78.4	102.7	170.5	-77.2	-20.5	0	0	0	109.4	P713 Y717	P713-N715 PolarHBondContact O-N 3.1Å; N715-Y717 HydrophobicContact CB-CE2 4.37Å; N715-Y717 PolarHBondContact O-N 2.84Å
716	L	25.6	Very low	34	Very low	148 Å²	148	123.8 Å²	123.8	78%	0.775	64%	0.643	S	S	*	*			trans	-82.2	98.6	173.9	-147.1	89.9	0	0	0	108.9	I714 V718	I714-L716 PolarHBondContact O-N 2.83Å; L716-V718 PolarHBondContact O-N 2.83Å
717	Y	23.9	Very low	36.2	Very low	217 Å²	217	117.8 Å²	117.8	85%	0.851	61%	0.614	S	S	*	*			trans	-72.4	109.6	173.6	-79.7	-86	0	0	0	110.2	N715	N715-Y717 HydrophobicContact CB-CE2 4.37Å; N715-Y717 PolarHBondContact O-N 2.84Å
718	V	28.1	Very low	38.6	Very low	80 Å²	80	115.9 Å²	115.9	49%	0.485	60%	0.599	S	S	.	*			trans	-93.5	131	163.2	179.1	0	0	0	0	107.9	L716 S720	L716-V718 PolarHBondContact O-N 2.83Å; V718-S720 PolarHBondContact O-N 3.2Å
719	Q	26.4	Very low	41	Very low	184 Å²	184	107.1 Å²	107.1	86%	0.86	56%	0.559	S	S	*	*			trans	-68.2	116.9	-173.5	-140.4	167.1	-8.7	0	0	110.6	N721	Q719-N721 PolarHBondContact O-N 3.17Å
720	S	31.2	Very low	43.6	Very low	63 Å²	63	103.5 Å²	103.5	44%	0.441	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-74.3	-8.6	-165.2	49.5	0	0	0	0	117.2	V718 N722	V718-S720 PolarHBondContact O-N 3.2Å; S720-N722 PolarHBondContact O-N 3.4Å
721	N	33.6	Very low	46.1	Very low	138 Å²	138	100.7 Å²	100.7	74%	0.738	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-82.9	-5.2	-156.1	-70.4	1.7	0	0	0	116.6	Q719	Q719-N721 PolarHBondContact O-N 3.17Å
722	N	41.4	Very low	48.9	Very low	154 Å²	154	96.1 Å²	96.1	82%	0.824	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-118.5	12.9	-174.5	-74.4	-2.1	0	0	0	115.4	S720 P724	S720-N722 PolarHBondContact O-N 3.4Å; N722-P724 WeakPolarHBondContact O-CD 3.38Å
723	I	44.3	Very low	51.9	Low	22 Å²	22	89 Å²	89	11%	0.113	47%	0.467	C	S	.	.			trans	-86.7	115.7	-176.6	-56.9	172.7	0	0	0	109.9	F685 L806 Y807	F685-I723 HydrophobicContact CD2-CG1 4.45Å; I723-L806 HydrophobicContact CG2-CB 3.74Å; I723-L806 WeakPolarHBondContact CG2-O 3.46Å; I723-Y807 HydrophobicContact CD1-CD2 4.34Å; I723-Y807 HydrophobicContact CD1-CE1 4.03Å; I723-Y807 HydrophobicContact CD1-CE2 3.68Å; I723-Y807 VanDerWaalsContact CD1-CZ 3.5Å
724	P	50.9	Low	54.7	Low	40 Å²	40	91 Å²	91	26%	0.26	47%	0.466	S	S	.	.			trans	-64.5	144.6	178	24	-30	0	0	0	111	I684 N722 L806	I684-P724 HydrophobicContact CG2-CG 4.37Å; N722-P724 WeakPolarHBondContact O-CD 3.38Å; P724-L806 WeakPolarHBondContact O-CD1 3.47Å; P724-L806 WeakPolarHBondContact O-CG 3.39Å
725	K	66.1	Low	57.7	Low	80 Å²	80	87.3 Å²	87.3	35%	0.348	45%	0.448	S	S	.	.	B	Isolated β-bridge	trans	-76.1	148.8	175.1	-66.2	-176.9	175.3	-173.2	0	110.5	S727 K728 L729 D803	K725-S727 PolarHBondContact O-N 3.38Å; K725-K728 HydrophobicContact CB-CB 4.46Å; K725-K728 WeakPolarHBondContact O-CA 3.36Å; K725-K728 WeakPolarHBondContact O-CB 3.41Å; K725-K728 PolarHBondContact O-N 2.9Å; K725-L729 PolarHBondContact O-N 2.92Å; K725-D803 IonicContact NZ-OD1 2.73Å; K725-D803 PolarHBondContact NZ-OD1 2.97Å
726	L	68.7	Low	60.7	Low	21 Å²	21	81.6 Å²	81.6	11%	0.11	42%	0.417	C	S	.	.	H	α-helix	trans	-56.8	-39.1	177.3	-176.8	60.6	0	0	0	112.2	K728 L729 L730 A773 L806	L726-K728 VanDerWaalsContact C-N 3.32Å; L726-K728 PolarHBondContact O-N 2.77Å; L726-L729 PolarHBondContact O-N 3.43Å; L726-L730 HydrophobicContact CG-CD1 4.23Å; L726-L730 WeakPolarHBondContact O-CG 3.2Å; L726-L730 PolarHBondContact O-N 2.99Å; L726-A773 HydrophobicContact CD1-CB 4.21Å; L726-L806 HydrophobicContact CB-CD2 4.1Å
727	S	73.9	Confident	63.7	Low	48 Å²	48	77 Å²	77	34%	0.336	39%	0.394	S	S	.	.	H	α-helix	trans	-57.2	-45.1	174.8	49	0	0	0	0	111.9	K725 L730 T731 S802	K725-S727 PolarHBondContact O-N 3.38Å; S727-L730 PolarHBondContact O-N 2.66Å; S727-T731 PolarHBondContact O-N 3.42Å; S727-T731 VanDerWaalsContact O-N 3.07Å; S727-T731 PolarHBondContact O-OG1 2.98Å; S727-S802 PolarHBondContact OG-O 3.24Å
728	K	78.6	Confident	66.8	Low	117 Å²	117	66.9 Å²	66.9	51%	0.509	35%	0.354	S	S	.	.	H	α-helix	trans	-64.1	-43.5	175.3	-174.5	179.2	177.5	-178	0	111.8	K725 L726 L730 T731 D732	K725-K728 HydrophobicContact CB-CB 4.46Å; K725-K728 WeakPolarHBondContact O-CA 3.36Å; K725-K728 WeakPolarHBondContact O-CB 3.41Å; K725-K728 PolarHBondContact O-N 2.9Å; L726-K728 VanDerWaalsContact C-N 3.32Å; L726-K728 PolarHBondContact O-N 2.77Å; K728-L730 VanDerWaalsContact C-N 3.33Å; K728-L730 PolarHBondContact O-N 3.18Å; K728-T731 WeakPolarHBondContact CA-OG1 3.37Å; K728-T731 PolarHBondContact O-N 2.85Å; K728-T731 PolarHBondContact O-OG1 2.91Å; K728-D732 WeakPolarHBondContact O-CB 3.23Å; K728-D732 PolarHBondContact O-N 2.85Å
729	L	81	Confident	69.6	Low	6 Å²	6	67.7 Å²	67.7	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-62.4	-40.9	177.3	-178.5	61.7	0	0	0	111.6	V599 L686 K725 L726 D732 C733 A769 A773	V599-L729 HydrophobicContact CG1-CD1 4.37Å; V599-L729 HydrophobicContact CG2-CD1 4.19Å; L686-L729 HydrophobicContact CD1-CD2 4.37Å; L686-L729 HydrophobicContact CD2-CD2 3.91Å; K725-L729 PolarHBondContact O-N 2.92Å; L726-L729 PolarHBondContact O-N 3.43Å; L729-D732 PolarHBondContact O-N 3.48Å; L729-C733 WeakPolarHBondContact O-CB 3.43Å; L729-C733 PolarHBondContact O-N 2.93Å; L729-C733 PolarHBondContact O-SG 3.44Å; L729-A769 HydrophobicContact CD1-CB 4.18Å; L729-A773 HydrophobicContact CD2-CB 4.02Å; L729-A773 HydrophobicContact CG-CB 4.35Å
730	L	82.3	Confident	72.4	Confident	56 Å²	56	66.7 Å²	66.7	29%	0.293	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-39.8	176.6	-73.6	169	0	0	0	112.2	L726 S727 K728 C733 Q734 A773	L726-L730 HydrophobicContact CG-CD1 4.23Å; L726-L730 WeakPolarHBondContact O-CG 3.2Å; L726-L730 PolarHBondContact O-N 2.99Å; S727-L730 PolarHBondContact O-N 2.66Å; K728-L730 VanDerWaalsContact C-N 3.33Å; K728-L730 PolarHBondContact O-N 3.18Å; L730-C733 PolarHBondContact O-N 3.3Å; L730-Q734 PolarHBondContact O-N 3.2Å; L730-A773 HydrophobicContact CD2-CB 3.93Å
731	T	82.6	Confident	75.3	Confident	75 Å²	75	63.7 Å²	63.7	46%	0.46	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-42.8	173.3	50.5	0	0	0	0	111.5	S727 K728 C733 Q734	S727-T731 PolarHBondContact O-N 3.42Å; S727-T731 VanDerWaalsContact O-N 3.07Å; S727-T731 PolarHBondContact O-OG1 2.98Å; K728-T731 WeakPolarHBondContact CA-OG1 3.37Å; K728-T731 PolarHBondContact O-N 2.85Å; K728-T731 PolarHBondContact O-OG1 2.91Å; T731-C733 VanDerWaalsContact C-N 3.26Å; T731-C733 PolarHBondContact O-N 3.31Å; T731-Q734 WeakPolarHBondContact O-CB 3.36Å; T731-Q734 PolarHBondContact O-N 2.78Å; T731-Q734 VanDerWaalsContact O-N 3.17Å
732	D	85.2	Confident	78	Confident	29 Å²	29	60.9 Å²	60.9	16%	0.155	31%	0.31	C	S	.	.	H	α-helix	trans	-64.3	-33.7	177.4	-64.2	-16.8	0	0	0	111.1	V599 L675 K728 L729 Q734 L735	V599-D732 HydrophobicContact CG1-CB 3.93Å; L675-D732 HydrophobicContact CD1-CB 4.13Å; K728-D732 WeakPolarHBondContact O-CB 3.23Å; K728-D732 PolarHBondContact O-N 2.85Å; L729-D732 PolarHBondContact O-N 3.48Å; D732-Q734 PolarHBondContact O-N 2.84Å; D732-L735 WeakPolarHBondContact O-CB 3.38Å; D732-L735 PolarHBondContact O-N 3.47Å
733	C	88.7	Confident	80.3	Confident	16 Å²	16	58.9 Å²	58.9	11%	0.108	30%	0.298	C	S	.	.	H	α-helix	trans	-67.8	-31.1	175.7	-73.5	0	0	0	0	113.8	L729 L730 T731 L735 S736 C770	L729-C733 WeakPolarHBondContact O-CB 3.43Å; L729-C733 PolarHBondContact O-N 2.93Å; L729-C733 PolarHBondContact O-SG 3.44Å; L730-C733 PolarHBondContact O-N 3.3Å; T731-C733 VanDerWaalsContact C-N 3.26Å; T731-C733 PolarHBondContact O-N 3.31Å; C733-L735 PolarHBondContact O-N 2.8Å; C733-S736 PolarHBondContact O-N 3.39Å; C733-S736 VanDerWaalsContact O-N 3.16Å; C733-S736 PolarHBondContact O-OG 3.24Å; C733-C770 WeakPolarHBondContact CA-SG 3.48Å; C733-C770 HydrophobicContact CB-CB 3.7Å; C733-C770 WeakPolarHBondContact CB-SG 2.9Å; C733-C770 WeakPolarHBondContact SG-CA 3.39Å; C733-C770 WeakPolarHBondContact SG-CB 3.43Å; C733-C770 CovalentContact SG-SG 2.03Å; C733-C770 PolarHBondContact SG-SG 3.34Å
734	Q	86.2	Confident	82.5	Confident	149 Å²	149	58.7 Å²	58.7	70%	0.696	30%	0.298	S	S	*	.	H	α-helix	trans	-64	-32.8	174.3	-70.7	177.6	-16	0	0	111.6	L730 T731 D732 S736 N737	L730-Q734 PolarHBondContact O-N 3.2Å; T731-Q734 WeakPolarHBondContact O-CB 3.36Å; T731-Q734 PolarHBondContact O-N 2.78Å; T731-Q734 VanDerWaalsContact O-N 3.17Å; D732-Q734 PolarHBondContact O-N 2.84Å; Q734-S736 PolarHBondContact O-N 2.69Å; Q734-N737 WeakPolarHBondContact O-CB 3.25Å; Q734-N737 PolarHBondContact O-N 3.3Å
735	L	88	Confident	84.4	Confident	70 Å²	70	56.8 Å²	56.8	37%	0.366	29%	0.286	S	S	.	.	H	α-helix	trans	-64.3	-25.1	175.9	-56.9	174.5	0	0	0	112.6	N638 F672 P674 D732 C733 N737	N638-L735 PolarHBondContact ND2-O 3.44Å; F672-L735 WeakPolarHBondContact CE1-O 3.33Å; P674-L735 HydrophobicContact CB-CB 3.96Å; P674-L735 HydrophobicContact CG-CB 4.11Å; D732-L735 WeakPolarHBondContact O-CB 3.38Å; D732-L735 PolarHBondContact O-N 3.47Å; C733-L735 PolarHBondContact O-N 2.8Å; L735-N737 VanDerWaalsContact C-N 3.3Å; L735-N737 PolarHBondContact O-N 2.81Å
736	S	88.7	Confident	85.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	0.7	-178.8	73.8	0	0	0	0	114.5	V599 T600 C733 Q734 L738	V599-S736 WeakPolarHBondContact O-CB 3.09Å; T600-S736 WeakPolarHBondContact CA-OG 3.43Å; C733-S736 PolarHBondContact O-N 3.39Å; C733-S736 VanDerWaalsContact O-N 3.16Å; C733-S736 PolarHBondContact O-OG 3.24Å; Q734-S736 PolarHBondContact O-N 2.69Å; S736-L738 PolarHBondContact O-N 3.39Å
737	N	88.7	Confident	86.5	Confident	53 Å²	53	61.6 Å²	61.6	28%	0.283	31%	0.313	S	S	.	.			trans	-68.1	133.7	-171.9	-166.2	2.2	0	0	0	112.4	N638 Q734 L735 D739	N638-N737 PolarHBondContact ND2-O 2.67Å; Q734-N737 WeakPolarHBondContact O-CB 3.25Å; Q734-N737 PolarHBondContact O-N 3.3Å; L735-N737 VanDerWaalsContact C-N 3.3Å; L735-N737 PolarHBondContact O-N 2.81Å; N737-D739 PolarHBondContact ND2-OD2 3.3Å; N737-D739 WeakPolarHBondContact OD1-CB 3.45Å; N737-D739 PolarHBondContact OD1-N 2.72Å; N737-D739 PolarHBondContact OD1-OD1 2.95Å; N737-D739 PolarHBondContact OD1-OD2 2.91Å
738	L	89.2	Confident	87.2	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	30%	0.302	C	S	.	.			trans	-126.4	27	176.7	-65.8	179.2	0	0	0	112.1	L633 V641 F672 S736 K740 A741 L762	L633-L738 HydrophobicContact CD1-CD2 4.38Å; V641-L738 HydrophobicContact CG2-CD2 4.03Å; F672-L738 HydrophobicContact CB-CD1 3.89Å; F672-L738 HydrophobicContact CD1-CD2 4.28Å; S736-L738 PolarHBondContact O-N 3.39Å; L738-K740 PolarHBondContact O-N 3Å; L738-A741 HydrophobicContact CB-CB 4.13Å; L738-A741 WeakPolarHBondContact O-CB 3.38Å; L738-A741 PolarHBondContact O-N 2.86Å; L738-L762 HydrophobicContact CB-CD1 4.43Å
739	D	85.3	Confident	87.7	Confident	97 Å²	97	57.5 Å²	57.5	52%	0.519	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	135	174.1	-73.5	-25.9	0	0	0	110.7	I637 N737 A741	I637-D739 WeakPolarHBondContact CG2-O 3.47Å; N737-D739 PolarHBondContact ND2-OD2 3.3Å; N737-D739 WeakPolarHBondContact OD1-CB 3.45Å; N737-D739 PolarHBondContact OD1-N 2.72Å; N737-D739 PolarHBondContact OD1-OD1 2.95Å; N737-D739 PolarHBondContact OD1-OD2 2.91Å; D739-A741 VanDerWaalsContact C-N 3.31Å; D739-A741 PolarHBondContact O-N 2.92Å
740	K	86.7	Confident	87.9	Confident	162 Å²	162	66 Å²	66	70%	0.704	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	5.1	-174.5	-45.7	170.4	-177	173.3	0	116	L738 E742 I743 T744	L738-K740 PolarHBondContact O-N 3Å; K740-E742 VanDerWaalsContact C-N 3.35Å; K740-E742 PolarHBondContact O-N 2.85Å; K740-I743 PolarHBondContact O-N 3.16Å; K740-T744 WeakPolarHBondContact O-CB 3.46Å; K740-T744 PolarHBondContact O-N 2.68Å; K740-T744 VanDerWaalsContact O-N 3.13Å; K740-T744 PolarHBondContact O-OG1 3.33Å
741	A	90.5	Very high	88.2	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-57.8	-43	175.1	0	0	0	0	0	114	L604 L633 I637 L738 D739 I743 T744 L745	L604-A741 HydrophobicContact CD1-CB 4.38Å; L633-A741 HydrophobicContact CD2-CB 3.91Å; I637-A741 HydrophobicContact CD1-CB 3.72Å; L738-A741 HydrophobicContact CB-CB 4.13Å; L738-A741 WeakPolarHBondContact O-CB 3.38Å; L738-A741 PolarHBondContact O-N 2.86Å; D739-A741 VanDerWaalsContact C-N 3.31Å; D739-A741 PolarHBondContact O-N 2.92Å; A741-I743 PolarHBondContact O-N 2.85Å; A741-T744 PolarHBondContact O-N 3.2Å; A741-L745 WeakPolarHBondContact O-CB 3.47Å; A741-L745 WeakPolarHBondContact O-CG 3.35Å; A741-L745 PolarHBondContact O-N 3.17Å
742	E	91	Very high	88.3	Confident	80 Å²	80	64.6 Å²	64.6	37%	0.374	32%	0.316	S	S	.	.	H	α-helix	trans	-58.8	-51.1	-179.2	-171.7	169.2	158.4	0	0	112.3	K740 T744 Q746 V760 L762	K740-E742 VanDerWaalsContact C-N 3.35Å; K740-E742 PolarHBondContact O-N 2.85Å; E742-T744 PolarHBondContact O-N 3.06Å; E742-Q746 VanDerWaalsContact O-CB 3.23Å; E742-Q746 WeakPolarHBondContact O-CB 3.34Å; E742-Q746 PolarHBondContact O-N 3.47Å; E742-V760 HydrophobicContact CG-CG1 4.42Å; E742-L762 HydrophobicContact CB-CB 4.43Å; E742-L762 PolarHBondContact OE2-N 2.85Å
743	I	89.4	Confident	88.1	Confident	111 Å²	111	69.7 Å²	69.7	57%	0.569	34%	0.342	S	S	*	.	H	α-helix	trans	-64.1	-43.2	-180	-58.5	170.5	0	0	0	110.6	K740 A741 Q746 N747	K740-I743 PolarHBondContact O-N 3.16Å; A741-I743 PolarHBondContact O-N 2.85Å; I743-Q746 PolarHBondContact O-N 3.39Å; I743-N747 WeakPolarHBondContact O-CB 3.35Å; I743-N747 PolarHBondContact O-N 3.13Å; I743-N747 PolarHBondContact O-ND2 3.34Å
744	T	90.4	Very high	87.5	Confident	19 Å²	19	71.5 Å²	71.5	12%	0.117	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-43.3	-177.2	-56	0	0	0	0	111.9	I632 R636 I637 K740 A741 E742 N747 N748	I632-T744 HydrophobicContact CG2-CG2 4.06Å; R636-T744 HydrophobicContact CB-CG2 3.85Å; R636-T744 HydrophobicContact CG-CG2 4.37Å; I637-T744 HydrophobicContact CD1-CG2 4.17Å; I637-T744 HydrophobicContact CG1-CG2 4.34Å; K740-T744 WeakPolarHBondContact O-CB 3.46Å; K740-T744 PolarHBondContact O-N 2.68Å; K740-T744 VanDerWaalsContact O-N 3.13Å; K740-T744 PolarHBondContact O-OG1 3.33Å; A741-T744 PolarHBondContact O-N 3.2Å; E742-T744 PolarHBondContact O-N 3.06Å; T744-N747 PolarHBondContact O-N 3.06Å; T744-N748 PolarHBondContact O-N 2.83Å; T744-N748 PolarHBondContact O-ND2 2.83Å
745	L	91.8	Very high	87.5	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-71.9	-36.8	178.4	-70.3	166.5	0	0	0	111.8	L604 M606 L629 I632 L633 A741 N747 N748 K749 F752 V760	L604-L745 HydrophobicContact CD1-CD1 3.99Å; L604-L745 HydrophobicContact CD2-CD1 3.4Å; L604-L745 VanDerWaalsContact CD2-CD1 3.4Å; L604-L745 HydrophobicContact CG-CD1 4.25Å; M606-L745 HydrophobicContact CE-CD1 4.48Å; L629-L745 HydrophobicContact CD1-CD1 3.87Å; L629-L745 HydrophobicContact CD1-CD2 3.66Å; L629-L745 HydrophobicContact CD1-CG 4.44Å; I632-L745 HydrophobicContact CB-CD2 4.22Å; I632-L745 HydrophobicContact CD1-CD2 4.2Å; I632-L745 HydrophobicContact CG2-CD2 3.79Å; L633-L745 HydrophobicContact CD2-CD1 4.23Å; L633-L745 HydrophobicContact CD2-CG 4.46Å; A741-L745 WeakPolarHBondContact O-CB 3.47Å; A741-L745 WeakPolarHBondContact O-CG 3.35Å; A741-L745 PolarHBondContact O-N 3.17Å; L745-N747 VanDerWaalsContact C-N 3.29Å; L745-N747 PolarHBondContact O-N 2.82Å; L745-N748 CarbonylContact O-C 3.57Å; L745-N748 PolarHBondContact O-N 3.36Å; L745-N748 VanDerWaalsContact O-N 3.15Å; L745-K749 PolarHBondContact O-N 2.9Å; L745-F752 HydrophobicContact CD2-CE2 4.09Å; L745-F752 HydrophobicContact CD2-CZ 3.9Å; L745-V760 HydrophobicContact CB-CG1 4.15Å; L745-V760 HydrophobicContact CB-CG2 4.02Å; L745-V760 HydrophobicContact CD1-CG1 3.97Å
746	Q	88.4	Confident	87.4	Confident	80 Å²	80	68 Å²	68	37%	0.374	33%	0.332	S	S	.	.	H	α-helix	trans	-61	-39.1	174.8	-165.7	79.3	-12.7	0	0	111.9	E742 I743 N748 K749	E742-Q746 VanDerWaalsContact O-CB 3.23Å; E742-Q746 WeakPolarHBondContact O-CB 3.34Å; E742-Q746 PolarHBondContact O-N 3.47Å; I743-Q746 PolarHBondContact O-N 3.39Å; Q746-N748 VanDerWaalsContact C-N 3.3Å; Q746-N748 PolarHBondContact O-N 2.86Å; Q746-K749 WeakPolarHBondContact O-CG 3.3Å
747	N	89.4	Confident	87.5	Confident	121 Å²	121	68.2 Å²	68.2	65%	0.647	33%	0.334	S	S	*	.	H	α-helix	trans	-72.2	-24.2	177.7	-70.5	-15.9	0	0	0	113	I743 T744 L745	I743-N747 WeakPolarHBondContact O-CB 3.35Å; I743-N747 PolarHBondContact O-N 3.13Å; I743-N747 PolarHBondContact O-ND2 3.34Å; T744-N747 PolarHBondContact O-N 3.06Å; L745-N747 VanDerWaalsContact C-N 3.29Å; L745-N747 PolarHBondContact O-N 2.82Å
748	N	89.7	Confident	87.6	Confident	21 Å²	21	69.8 Å²	69.8	11%	0.112	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	22.8	-177.2	-65.2	-62.2	0	0	0	113.7	I632 R636 T744 L745 Q746 K750 L751	I632-N748 HydrophobicContact CD1-CB 4.29Å; R636-N748 PolarHBondContact NH1-ND2 3.42Å; R636-N748 PolarHBondContact NH1-OD1 2.99Å; T744-N748 PolarHBondContact O-N 2.83Å; T744-N748 PolarHBondContact O-ND2 2.83Å; L745-N748 CarbonylContact O-C 3.57Å; L745-N748 PolarHBondContact O-N 3.36Å; L745-N748 VanDerWaalsContact O-N 3.15Å; Q746-N748 VanDerWaalsContact C-N 3.3Å; Q746-N748 PolarHBondContact O-N 2.86Å; N748-K750 PolarHBondContact O-N 3.45Å; N748-L751 HydrophobicContact CB-CD1 3.88Å; N748-L751 HydrophobicContact CB-CG 4.31Å; N748-L751 WeakPolarHBondContact O-CB 3.28Å; N748-L751 PolarHBondContact O-N 3.28Å
749	K	88.1	Confident	87.7	Confident	58 Å²	58	71.9 Å²	71.9	25%	0.252	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-49.1	-32.4	178.6	-78.5	178.8	178.1	-169.7	0	114.8	L745 Q746 L751 F752 L757 E758	L745-K749 PolarHBondContact O-N 2.9Å; Q746-K749 WeakPolarHBondContact O-CG 3.3Å; K749-L751 PolarHBondContact O-N 3.06Å; K749-F752 PolarHBondContact O-N 3.38Å; K749-L757 HydrophobicContact CB-CB 4.41Å; K749-L757 WeakPolarHBondContact CD-O 2.92Å; K749-L757 HydrophobicContact CG-CB 4.09Å; K749-L757 HydrophobicContact CG-CD2 3.99Å; K749-L757 HydrophobicContact CG-CG 4.05Å; K749-E758 PolarHBondContact NZ-O 3.46Å
750	K	86.1	Confident	88.1	Confident	186 Å²	186	67.6 Å²	67.6	81%	0.809	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-67.9	-14.8	-178.6	-62.5	-176.2	-178.8	-179	0	113.8	N748 I753	N748-K750 PolarHBondContact O-N 3.45Å; K750-I753 VanDerWaalsContact O-CD1 3.27Å; K750-I753 WeakPolarHBondContact O-CD1 3.45Å; K750-I753 WeakPolarHBondContact O-CG1 3.49Å
751	L	87.3	Confident	88.4	Confident	97 Å²	97	65.5 Å²	65.5	51%	0.508	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-80.1	-17	-179.7	-62.9	-179.5	0	0	0	113.2	T628 I632 N748 K749 I753	T628-L751 HydrophobicContact CG2-CB 4.14Å; I632-L751 HydrophobicContact CD1-CB 4.15Å; I632-L751 HydrophobicContact CD1-CD1 3.9Å; I632-L751 HydrophobicContact CG1-CD1 3.92Å; N748-L751 HydrophobicContact CB-CD1 3.88Å; N748-L751 HydrophobicContact CB-CG 4.31Å; N748-L751 WeakPolarHBondContact O-CB 3.28Å; N748-L751 PolarHBondContact O-N 3.28Å; K749-L751 PolarHBondContact O-N 3.06Å; L751-I753 PolarHBondContact O-N 3.16Å; L751-I753 VanDerWaalsContact O-N 3.14Å
752	F	86.5	Confident	88.5	Confident	3 Å²	3	67.6 Å²	67.6	1%	0.013	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-81.7	18.7	-176.2	-71.8	-82.3	0	0	0	114.7	M606 F608 I625 T628 L629 I632 L745 K749 F755 L757	M606-F752 HydrophobicContact CE-CE1 4.19Å; M606-F752 HydrophobicContact CE-CE2 4.3Å; M606-F752 HydrophobicContact CE-CZ 3.84Å; F608-F752 HydrophobicContact CE1-CB 4.12Å; F608-F752 AromaticContact CE1-CD1 3.79Å; F608-F752 HydrophobicContact CE1-CD1 3.79Å; F608-F752 HydrophobicContact CE1-CE1 4.41Å; F608-F752 AromaticContact CE1-CG 3.96Å; F608-F752 HydrophobicContact CE1-CG 3.96Å; F608-F752 HydrophobicContact CZ-CD1 4.11Å; F608-F752 HydrophobicContact CZ-CE1 4.31Å; I625-F752 HydrophobicContact CG2-CD1 4.16Å; I625-F752 HydrophobicContact CG2-CE1 4.07Å; T628-F752 HydrophobicContact CG2-CD1 4.01Å; T628-F752 HydrophobicContact CG2-CE1 3.97Å; T628-F752 HydrophobicContact CG2-CG 4.42Å; T628-F752 HydrophobicContact CG2-CZ 4.32Å; L629-F752 HydrophobicContact CB-CE1 4.33Å; L629-F752 HydrophobicContact CD1-CZ 4.44Å; I632-F752 HydrophobicContact CD1-CE2 3.66Å; I632-F752 HydrophobicContact CD1-CZ 3.75Å; L745-F752 HydrophobicContact CD2-CE2 4.09Å; L745-F752 HydrophobicContact CD2-CZ 3.9Å; K749-F752 PolarHBondContact O-N 3.38Å; F752-F755 CarbonylContact C-O 3.6Å; F752-F755 CarbonylContact O-C 3.48Å; F752-F755 WeakPolarHBondContact O-CA 3.36Å; F752-F755 WeakPolarHBondContact O-CB 3.22Å; F752-F755 PolarHBondContact O-N 2.9Å; F752-L757 HydrophobicContact CD2-CB 4.27Å; F752-L757 HydrophobicContact CD2-CD2 3.62Å; F752-L757 HydrophobicContact CE2-CD2 3.61Å; F752-L757 HydrophobicContact CG-CD2 4.44Å; F752-L757 HydrophobicContact CZ-CD2 4.43Å
753	I	79.5	Confident	88.6	Confident	137 Å²	137	65.6 Å²	65.6	70%	0.703	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	131.4	-179.6	-65.4	167.1	0	0	0	109.5	K750 L751	K750-I753 VanDerWaalsContact O-CD1 3.27Å; K750-I753 WeakPolarHBondContact O-CD1 3.45Å; K750-I753 WeakPolarHBondContact O-CG1 3.49Å; L751-I753 PolarHBondContact O-N 3.16Å; L751-I753 VanDerWaalsContact O-N 3.14Å
754	P	77.5	Confident	88.6	Confident	54 Å²	54	65.7 Å²	65.7	35%	0.351	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.4	-2.8	16.5	39.2	-39.1	0	0	0	115.1	P611	P611-P754 HydrophobicContact CB-CB 4.05Å; P611-P754 VanDerWaalsContact CB-O 3.31Å; P611-P754 WeakPolarHBondContact CB-O 3.31Å; P611-P754 HydrophobicContact CG-CB 3.82Å; P611-P754 HydrophobicContact CG-CG 4.18Å
755	F	85.4	Confident	88.6	Confident	7 Å²	7	64.9 Å²	64.9	3%	0.031	32%	0.322	C	S	.	.	S	Bend	trans	-76.4	139.9	178.8	-53.4	-78.9	0	0	0	112.4	F608 W610 T621 L622 I625 F666 F752	F608-F755 HydrophobicContact CD1-CB 3.81Å; W610-F755 HydrophobicContact CD2-CE1 4.03Å; W610-F755 AromaticContact CE2-CE1 3.57Å; W610-F755 HydrophobicContact CG-CD1 4.47Å; W610-F755 HydrophobicContact CG-CE1 4.3Å; W610-F755 AromaticContact CZ2-CE1 3.89Å; W610-F755 HydrophobicContact CZ2-CE1 3.89Å; W610-F755 HydrophobicContact CZ2-CZ 4.29Å; W610-F755 AromaticContact NE1-CE1 3.62Å; T621-F755 WeakPolarHBondContact O-CE2 3.37Å; T621-F755 VanDerWaalsContact OG1-CZ 3.3Å; T621-F755 WeakPolarHBondContact OG1-CZ 3.5Å; L622-F755 HydrophobicContact CD2-CE1 4.39Å; L622-F755 HydrophobicContact CD2-CZ 4.08Å; I625-F755 HydrophobicContact CD1-CD2 3.68Å; I625-F755 HydrophobicContact CD1-CE2 3.71Å; I625-F755 HydrophobicContact CD1-CG 4.12Å; I625-F755 HydrophobicContact CD1-CZ 4.17Å; I625-F755 HydrophobicContact CG1-CD2 3.7Å; I625-F755 HydrophobicContact CG1-CE2 3.72Å; F666-F755 AromaticContact CE1-CD1 3.92Å; F666-F755 HydrophobicContact CE1-CD1 3.92Å; F666-F755 AromaticContact CE1-CE1 3.95Å; F666-F755 HydrophobicContact CE1-CE1 3.95Å; F666-F755 HydrophobicContact CZ-CD1 4.06Å; F666-F755 HydrophobicContact CZ-CE1 4.14Å; F752-F755 CarbonylContact C-O 3.6Å; F752-F755 CarbonylContact O-C 3.48Å; F752-F755 WeakPolarHBondContact O-CA 3.36Å; F752-F755 WeakPolarHBondContact O-CB 3.22Å; F752-F755 PolarHBondContact O-N 2.9Å
756	K	86.7	Confident	88.2	Confident	137 Å²	137	69.8 Å²	69.8	60%	0.596	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	110.3	170.8	-176.1	-178.7	177.2	-172.1	0	109.2	Q609 E758	Q609-K756 HydrophobicContact CB-CB 4.31Å; Q609-K756 PolarHBondContact N-O 3.38Å; Q609-K756 PolarHBondContact O-N 2.9Å; K756-E758 PolarHBondContact O-N 2.89Å
757	L	90.2	Very high	87.9	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.026	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	112	174.5	179	57.2	0	0	0	110.3	M606 F608 K749 F752 V760	M606-L757 HydrophobicContact CB-CD1 4.23Å; M606-L757 HydrophobicContact CE-CD1 3.72Å; M606-L757 HydrophobicContact CE-CD2 3.73Å; M606-L757 HydrophobicContact CE-CG 4.41Å; F608-L757 HydrophobicContact CD1-CB 4.21Å; F608-L757 HydrophobicContact CD1-CD1 4.06Å; F608-L757 HydrophobicContact CE1-CB 4.06Å; F608-L757 HydrophobicContact CE1-CD1 3.75Å; F608-L757 HydrophobicContact CE1-CG 4.38Å; F608-L757 HydrophobicContact CE2-CD1 4.31Å; F608-L757 HydrophobicContact CG-CD1 4.49Å; F608-L757 HydrophobicContact CZ-CD1 3.9Å; K749-L757 HydrophobicContact CB-CB 4.41Å; K749-L757 WeakPolarHBondContact CD-O 2.92Å; K749-L757 HydrophobicContact CG-CB 4.09Å; K749-L757 HydrophobicContact CG-CD2 3.99Å; K749-L757 HydrophobicContact CG-CG 4.05Å; F752-L757 HydrophobicContact CD2-CB 4.27Å; F752-L757 HydrophobicContact CD2-CD2 3.62Å; F752-L757 HydrophobicContact CE2-CD2 3.61Å; F752-L757 HydrophobicContact CG-CD2 4.44Å; F752-L757 HydrophobicContact CZ-CD2 4.43Å; L757-V760 HydrophobicContact CD1-CG2 3.88Å; L757-V760 HydrophobicContact CD2-CG2 3.65Å; L757-V760 HydrophobicContact CG-CG2 3.97Å
758	E	90.1	Very high	87.7	Confident	86 Å²	86	62.9 Å²	62.9	40%	0.402	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	-53.5	-175.1	-168.9	-175.2	154.3	0	0	111.1	K607 K749 K756	K607-E758 HydrophobicContact CB-CB 4.45Å; K607-E758 VanDerWaalsContact CD-OE2 3.25Å; K607-E758 WeakPolarHBondContact CD-OE2 3.21Å; K607-E758 WeakPolarHBondContact CE-OE2 3.31Å; K607-E758 HydrophobicContact CG-CB 4.44Å; K607-E758 IonicContact NZ-OE1 2.85Å; K607-E758 PolarHBondContact NZ-OE1 3.17Å; K607-E758 IonicContact NZ-OE2 2.72Å; K607-E758 PolarHBondContact NZ-OE2 3.31Å; K607-E758 PolarHBondContact O-N 3.21Å; K749-E758 PolarHBondContact NZ-O 3.46Å; K756-E758 PolarHBondContact O-N 2.89Å
759	S	92.4	Very high	87.5	Confident	48 Å²	48	61.9 Å²	61.9	34%	0.336	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	153.8	-178	63.4	0	0	0	0	112.3	M606 K607	M606-S759 WeakPolarHBondContact CA-O 3.24Å; K607-S759 WeakPolarHBondContact CB-OG 3.38Å; K607-S759 PolarHBondContact N-O 3.12Å
760	V	93.5	Very high	87.5	Confident	8 Å²	8	59.4 Å²	59.4	5%	0.048	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136.9	174.6	-176.7	0	0	0	0	107.3	L604 R605 M606 E742 L745 L757	L604-V760 HydrophobicContact CD1-CG1 3.52Å; L604-V760 HydrophobicContact CG-CG1 4.23Å; R605-V760 CarbonylContact O-C 3.3Å; R605-V760 WeakPolarHBondContact O-CA 3.05Å; M606-V760 HydrophobicContact CE-CG2 4.29Å; M606-V760 HydrophobicContact CG-CG1 4.4Å; M606-V760 HydrophobicContact CG-CG2 4.47Å; E742-V760 HydrophobicContact CG-CG1 4.42Å; L745-V760 HydrophobicContact CB-CG1 4.15Å; L745-V760 HydrophobicContact CB-CG2 4.02Å; L745-V760 HydrophobicContact CD1-CG1 3.97Å; L757-V760 HydrophobicContact CD1-CG2 3.88Å; L757-V760 HydrophobicContact CD2-CG2 3.65Å; L757-V760 HydrophobicContact CG-CG2 3.97Å
761	K	93.5	Very high	87.5	Confident	117 Å²	117	52.8 Å²	52.8	51%	0.509	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	128.3	175.2	-170.5	176.2	-175.5	-178	0	110.8	R605 L763	R605-K761 HydrophobicContact CB-CB 4.36Å; R605-K761 PolarHBondContact N-O 2.86Å; R605-K761 PolarHBondContact O-N 3.27Å; K761-L763 HydrophobicContact CD-CD2 3.73Å; K761-L763 HydrophobicContact CD-CG 4.34Å; K761-L763 VanDerWaalsContact CE-CD2 3.5Å; K761-L763 HydrophobicContact CG-CD2 3.92Å; K761-L763 HydrophobicContact CG-CG 4.2Å
762	L	92.7	Very high	87.2	Confident	44 Å²	44	49.9 Å²	49.9	23%	0.23	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	124.9	171.5	-168.1	68.3	0	0	0	109.6	L604 L738 E742	L604-L762 HydrophobicContact CD1-CD1 4.2Å; L738-L762 HydrophobicContact CB-CD1 4.43Å; E742-L762 HydrophobicContact CB-CB 4.43Å; E742-L762 PolarHBondContact OE2-N 2.85Å
763	L	92.8	Very high	86.9	Confident	39 Å²	39	49.8 Å²	49.8	20%	0.204	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.4	-177.3	-63.5	173.9	0	0	0	109.9	S602 K603 R605 K761	S602-L763 CarbonylContact C-O 2.87Å; S602-L763 WeakPolarHBondContact CA-O 3.27Å; S602-L763 WeakPolarHBondContact CB-O 3.43Å; K603-L763 HydrophobicContact CG-CB 3.84Å; K603-L763 PolarHBondContact N-O 3.17Å; K603-L763 PolarHBondContact O-N 3.32Å; R605-L763 HydrophobicContact CB-CD1 4.17Å; K761-L763 HydrophobicContact CD-CD2 3.73Å; K761-L763 HydrophobicContact CD-CG 4.34Å; K761-L763 VanDerWaalsContact CE-CD2 3.5Å; K761-L763 HydrophobicContact CG-CD2 3.92Å; K761-L763 HydrophobicContact CG-CG 4.2Å
764	N	89.3	Confident	87	Confident	112 Å²	112	50.4 Å²	50.4	60%	0.599	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	139.1	170.4	-69.5	-29.8	0	0	0	110.3	N601 E766	N601-N764 WeakPolarHBondContact O-CA 3.27Å; N764-E766 PolarHBondContact O-N 2.81Å
765	L	89.6	Confident	87.1	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.016	25%	0.25	C	C	.	.			trans	-89.3	95.9	169.8	-173.1	66.9	0	0	0	108.7	V595 L598 T600 N601 K603 Y649 I671 S768 F771	V595-L765 HydrophobicContact CG2-CD1 4.19Å; V595-L765 HydrophobicContact CG2-CD2 4.06Å; V595-L765 HydrophobicContact CG2-CG 4.03Å; L598-L765 HydrophobicContact CD1-CD2 4.36Å; T600-L765 HydrophobicContact CG2-CD2 3.56Å; N601-L765 PolarHBondContact O-N 3.12Å; K603-L765 HydrophobicContact CD-CD1 4.13Å; Y649-L765 HydrophobicContact CD1-CD1 4.47Å; Y649-L765 HydrophobicContact CE1-CD1 3.95Å; Y649-L765 HydrophobicContact CE2-CD1 4.03Å; I671-L765 HydrophobicContact CD1-CD1 4.05Å; I671-L765 HydrophobicContact CD1-CD2 3.6Å; I671-L765 HydrophobicContact CD1-CG 4.44Å; L765-S768 PolarHBondContact O-N 3.05Å; L765-S768 PolarHBondContact O-OG 2.55Å; L765-F771 WeakPolarHBondContact O-CB 3.42Å
766	E	84.7	Confident	86.3	Confident	102 Å²	102	53 Å²	53	48%	0.477	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	142.7	179.1	-60.9	-166.5	137.9	0	0	111.1	N764 S768 K899	N764-E766 PolarHBondContact O-N 2.81Å; E766-S768 PolarHBondContact O-N 2.98Å; E766-K899 IonicContact OE1-NZ 3.04Å; E766-K899 PolarHBondContact OE1-NZ 3Å
767	N	82.1	Confident	85.8	Confident	56 Å²	56	48.1 Å²	48.1	30%	0.299	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	11.5	179.2	-54.3	-34.9	0	0	0	116.2	V595 Q596	V595-N767 HydrophobicContact CG1-CB 4.05Å; Q596-N767 WeakPolarHBondContact CA-O 3.38Å; Q596-N767 WeakPolarHBondContact CG-O 3.49Å
768	S	85.2	Confident	85.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.262	C	S	.	.			trans	-68.5	165	170.4	75.6	0	0	0	0	112.8	V595 T600 L765 E766 C770 F771 L772	V595-S768 WeakPolarHBondContact O-CA 3.31Å; T600-S768 WeakPolarHBondContact O-CB 3.13Å; T600-S768 PolarHBondContact O-OG 3.12Å; L765-S768 PolarHBondContact O-N 3.05Å; L765-S768 PolarHBondContact O-OG 2.55Å; E766-S768 PolarHBondContact O-N 2.98Å; S768-C770 VanDerWaalsContact C-N 3.26Å; S768-C770 PolarHBondContact O-N 3.29Å; S768-F771 PolarHBondContact O-N 2.89Å; S768-F771 VanDerWaalsContact OG-CB 3.25Å; S768-F771 WeakPolarHBondContact OG-CB 3.38Å; S768-F771 PolarHBondContact OG-N 3.22Å; S768-F771 VanDerWaalsContact OG-N 3.08Å; S768-L772 WeakPolarHBondContact O-CB 3.32Å; S768-L772 WeakPolarHBondContact O-CG 3.28Å; S768-L772 PolarHBondContact O-N 2.74Å
769	A	84.1	Confident	84.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-54.8	-44.9	178.8	0	0	0	0	0	111.4	Q596 L598 V599 L729 A773	Q596-A769 WeakPolarHBondContact O-CA 3.35Å; Q596-A769 VanDerWaalsContact O-CB 3.23Å; Q596-A769 WeakPolarHBondContact O-CB 3.48Å; Q596-A769 PolarHBondContact O-N 3.03Å; L598-A769 WeakPolarHBondContact O-CB 3.38Å; L598-A769 PolarHBondContact O-N 2.91Å; L598-A769 VanDerWaalsContact O-N 3.13Å; V599-A769 HydrophobicContact CG2-CB 4.43Å; L729-A769 HydrophobicContact CD1-CB 4.18Å; A769-A773 WeakPolarHBondContact O-CB 3.34Å; A769-A773 PolarHBondContact O-N 3.06Å
770	C	88.3	Confident	83	Confident	6 Å²	6	53.3 Å²	53.3	4%	0.041	26%	0.255	C	S	.	.	H	α-helix	trans	-75.3	-34.1	-179.3	-60.2	0	0	0	0	113.5	T600 N601 C733 S768 L772 K774	T600-C770 PolarHBondContact N-SG 3.23Å; T600-C770 VanDerWaalsContact N-SG 3.35Å; T600-C770 WeakPolarHBondContact O-CB 3.32Å; N601-C770 HydrophobicContact CB-CB 3.97Å; C733-C770 WeakPolarHBondContact CA-SG 3.48Å; C733-C770 HydrophobicContact CB-CB 3.7Å; C733-C770 WeakPolarHBondContact CB-SG 2.9Å; C733-C770 WeakPolarHBondContact SG-CA 3.39Å; C733-C770 WeakPolarHBondContact SG-CB 3.43Å; C733-C770 CovalentContact SG-SG 2.03Å; C733-C770 PolarHBondContact SG-SG 3.34Å; S768-C770 VanDerWaalsContact C-N 3.26Å; S768-C770 PolarHBondContact O-N 3.29Å; C770-L772 VanDerWaalsContact C-N 3.34Å; C770-K774 WeakPolarHBondContact O-CB 3.13Å; C770-K774 PolarHBondContact O-N 3.34Å
771	F	85.4	Confident	81.8	Confident	48 Å²	48	58.6 Å²	58.6	21%	0.211	28%	0.279	C	S	.	.	H	α-helix	trans	-63.8	-43.5	173.9	-176.8	-90.4	0	0	0	110.7	L765 S768 K775	L765-F771 WeakPolarHBondContact O-CB 3.42Å; S768-F771 PolarHBondContact O-N 2.89Å; S768-F771 VanDerWaalsContact OG-CB 3.25Å; S768-F771 WeakPolarHBondContact OG-CB 3.38Å; S768-F771 PolarHBondContact OG-N 3.22Å; S768-F771 VanDerWaalsContact OG-N 3.08Å; F771-K775 WeakPolarHBondContact O-CB 3.44Å; F771-K775 PolarHBondContact O-N 2.9Å
772	L	81.1	Confident	80.7	Confident	35 Å²	35	57.9 Å²	57.9	18%	0.183	28%	0.278	C	S	.	.	H	α-helix	trans	-64.4	-51.2	174.9	-69.2	172.9	0	0	0	111	Q596 L686 S768 C770 K774 K775 I776	Q596-L772 HydrophobicContact CB-CD1 4.4Å; Q596-L772 HydrophobicContact CG-CD1 4.11Å; L686-L772 HydrophobicContact CD1-CD1 4.35Å; S768-L772 WeakPolarHBondContact O-CB 3.32Å; S768-L772 WeakPolarHBondContact O-CG 3.28Å; S768-L772 PolarHBondContact O-N 2.74Å; C770-L772 VanDerWaalsContact C-N 3.34Å; L772-K774 VanDerWaalsContact C-N 3.31Å; L772-K774 PolarHBondContact O-N 2.69Å; L772-K775 WeakPolarHBondContact O-CB 3.5Å; L772-K775 PolarHBondContact O-N 2.84Å; L772-I776 HydrophobicContact CB-CD1 4.24Å; L772-I776 WeakPolarHBondContact O-CD1 3.33Å; L772-I776 PolarHBondContact O-N 2.81Å
773	A	80.8	Confident	79.3	Confident	2 Å²	2	60.4 Å²	60.4	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-52.9	-49	178.4	0	0	0	0	0	111.6	L726 L729 L730 A769 K775 I776 T777	L726-A773 HydrophobicContact CD1-CB 4.21Å; L729-A773 HydrophobicContact CD2-CB 4.02Å; L729-A773 HydrophobicContact CG-CB 4.35Å; L730-A773 HydrophobicContact CD2-CB 3.93Å; A769-A773 WeakPolarHBondContact O-CB 3.34Å; A769-A773 PolarHBondContact O-N 3.06Å; A773-K775 PolarHBondContact O-N 2.85Å; A773-I776 PolarHBondContact O-N 2.91Å; A773-T777 PolarHBondContact O-N 2.7Å; A773-T777 PolarHBondContact O-OG1 3.08Å
774	K	81.9	Confident	77.6	Confident	150 Å²	150	59.3 Å²	59.3	65%	0.652	29%	0.285	S	S	*	.	H	α-helix	trans	-62.5	-41.5	177.3	-173.2	175.4	-177.9	175	0	112.9	C770 L772 I776 K778	C770-K774 WeakPolarHBondContact O-CB 3.13Å; C770-K774 PolarHBondContact O-N 3.34Å; L772-K774 VanDerWaalsContact C-N 3.31Å; L772-K774 PolarHBondContact O-N 2.69Å; K774-I776 VanDerWaalsContact C-N 3.32Å; K774-I776 PolarHBondContact O-N 2.92Å; K774-K778 WeakPolarHBondContact O-CB 3.48Å; K774-K778 PolarHBondContact O-N 2.86Å
775	K	78.7	Confident	75.8	Confident	85 Å²	85	62.3 Å²	62.3	37%	0.37	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-43	176.8	-175.9	-176	176.8	-171.5	0	111	F771 L772 A773 Q779	F771-K775 WeakPolarHBondContact O-CB 3.44Å; F771-K775 PolarHBondContact O-N 2.9Å; L772-K775 WeakPolarHBondContact O-CB 3.5Å; L772-K775 PolarHBondContact O-N 2.84Å; A773-K775 PolarHBondContact O-N 2.85Å; K775-Q779 WeakPolarHBondContact O-CG 2.96Å; K775-Q779 PolarHBondContact O-N 3.14Å
776	I	70	Confident	74.3	Confident	30 Å²	30	66.6 Å²	66.6	15%	0.154	32%	0.319	C	S	.	.	H	α-helix	trans	-69.8	-45	179.1	-75	127.2	0	0	0	111.7	L687 L772 A773 K774 K778 Q779 L780	L687-I776 HydrophobicContact CD1-CB 4.14Å; L687-I776 HydrophobicContact CD1-CD1 3.06Å; L687-I776 HydrophobicContact CD1-CG1 3.62Å; L687-I776 HydrophobicContact CD1-CG2 3.92Å; L772-I776 HydrophobicContact CB-CD1 4.24Å; L772-I776 WeakPolarHBondContact O-CD1 3.33Å; L772-I776 PolarHBondContact O-N 2.81Å; A773-I776 PolarHBondContact O-N 2.91Å; K774-I776 VanDerWaalsContact C-N 3.32Å; K774-I776 PolarHBondContact O-N 2.92Å; I776-K778 VanDerWaalsContact C-N 3.25Å; I776-K778 PolarHBondContact O-N 2.84Å; I776-Q779 PolarHBondContact O-N 3.12Å; I776-Q779 VanDerWaalsContact O-N 3.12Å; I776-L780 HydrophobicContact CG2-CD1 3.82Å; I776-L780 HydrophobicContact CG2-CG 4.33Å; I776-L780 WeakPolarHBondContact O-CG 3.37Å; I776-L780 PolarHBondContact O-N 2.88Å
777	T	75	Confident	72.7	Confident	34 Å²	34	65.9 Å²	65.9	21%	0.209	32%	0.322	C	S	.	.	H	α-helix	trans	-55.9	-44	174.9	-53.9	0	0	0	0	110.9	A773 Q779 L780 E781	A773-T777 PolarHBondContact O-N 2.7Å; A773-T777 PolarHBondContact O-OG1 3.08Å; T777-Q779 PolarHBondContact O-N 2.58Å; T777-L780 PolarHBondContact O-N 3.06Å; T777-E781 WeakPolarHBondContact O-CB 3.27Å; T777-E781 VanDerWaalsContact O-CG 3.31Å; T777-E781 WeakPolarHBondContact O-CG 3.35Å; T777-E781 PolarHBondContact O-N 2.9Å
778	K	76.3	Confident	71.1	Confident	124 Å²	124	65.9 Å²	65.9	54%	0.539	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-43.3	176.2	-167.1	-175.2	-177.5	-156.8	0	112.7	K774 I776 L780 E781 E782	K774-K778 WeakPolarHBondContact O-CB 3.48Å; K774-K778 PolarHBondContact O-N 2.86Å; I776-K778 VanDerWaalsContact C-N 3.25Å; I776-K778 PolarHBondContact O-N 2.84Å; K778-L780 VanDerWaalsContact C-N 3.33Å; K778-L780 PolarHBondContact O-N 3.05Å; K778-E781 PolarHBondContact O-N 2.99Å; K778-E782 WeakPolarHBondContact CE-OE1 3.4Å; K778-E782 IonicContact NZ-OE1 2.86Å; K778-E782 WeakPolarHBondContact O-CB 3.44Å; K778-E782 VanDerWaalsContact O-CG 3.31Å; K778-E782 WeakPolarHBondContact O-CG 3.45Å; K778-E782 PolarHBondContact O-N 3.37Å
779	Q	72.8	Confident	69.8	Low	95 Å²	95	74.2 Å²	74.2	44%	0.444	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-39.4	176.6	-75.9	179.1	-31.7	0	0	112.2	K775 I776 T777 E782 Q783	K775-Q779 WeakPolarHBondContact O-CG 2.96Å; K775-Q779 PolarHBondContact O-N 3.14Å; I776-Q779 PolarHBondContact O-N 3.12Å; I776-Q779 VanDerWaalsContact O-N 3.12Å; T777-Q779 PolarHBondContact O-N 2.58Å; Q779-E782 PolarHBondContact O-N 3.06Å; Q779-Q783 WeakPolarHBondContact O-CB 2.97Å; Q779-Q783 WeakPolarHBondContact O-CG 3.49Å; Q779-Q783 PolarHBondContact O-N 3.33Å
780	L	65.1	Low	68.2	Low	30 Å²	30	85.4 Å²	85.4	16%	0.157	41%	0.407	C	S	.	.	H	α-helix	trans	-69	-39.6	176.7	-70.8	169.6	0	0	0	111.9	I776 T777 K778 Q783 A784 W801	I776-L780 HydrophobicContact CG2-CD1 3.82Å; I776-L780 HydrophobicContact CG2-CG 4.33Å; I776-L780 WeakPolarHBondContact O-CG 3.37Å; I776-L780 PolarHBondContact O-N 2.88Å; T777-L780 PolarHBondContact O-N 3.06Å; K778-L780 VanDerWaalsContact C-N 3.33Å; K778-L780 PolarHBondContact O-N 3.05Å; L780-Q783 PolarHBondContact O-N 3.45Å; L780-A784 WeakPolarHBondContact O-CB 3.3Å; L780-A784 PolarHBondContact O-N 2.91Å; L780-W801 HydrophobicContact CB-CZ3 4.24Å; L780-W801 HydrophobicContact CD2-CE3 4.17Å; L780-W801 HydrophobicContact CD2-CH2 4.33Å; L780-W801 HydrophobicContact CD2-CZ3 3.98Å
781	E	69.6	Low	66.1	Low	119 Å²	119	88.7 Å²	88.7	56%	0.556	43%	0.43	S	S	*	.	H	α-helix	trans	-62.9	-43.5	173.3	-75.3	170.7	-177.7	0	0	111.6	T777 K778 Q783 A784 Y785	T777-E781 WeakPolarHBondContact O-CB 3.27Å; T777-E781 VanDerWaalsContact O-CG 3.31Å; T777-E781 WeakPolarHBondContact O-CG 3.35Å; T777-E781 PolarHBondContact O-N 2.9Å; K778-E781 PolarHBondContact O-N 2.99Å; E781-Q783 PolarHBondContact O-N 3.06Å; E781-A784 PolarHBondContact O-N 2.94Å; E781-Y785 WeakPolarHBondContact O-CB 3.01Å; E781-Y785 PolarHBondContact O-N 2.8Å
782	E	70.3	Confident	64.2	Low	101 Å²	101	92.5 Å²	92.5	47%	0.472	46%	0.463	S	S	.	.	H	α-helix	trans	-64.1	-38.4	176.1	-74.2	171.6	-174.5	0	0	112	K778 Q779 S786	K778-E782 WeakPolarHBondContact CE-OE1 3.4Å; K778-E782 IonicContact NZ-OE1 2.86Å; K778-E782 WeakPolarHBondContact O-CB 3.44Å; K778-E782 VanDerWaalsContact O-CG 3.31Å; K778-E782 WeakPolarHBondContact O-CG 3.45Å; K778-E782 PolarHBondContact O-N 3.37Å; Q779-E782 PolarHBondContact O-N 3.06Å; E782-S786 WeakPolarHBondContact O-CB 3.39Å; E782-S786 PolarHBondContact O-N 3.39Å; E782-S786 PolarHBondContact O-OG 3.3Å
783	Q	62.2	Low	62.6	Low	98 Å²	98	98.3 Å²	98.3	46%	0.458	49%	0.489	S	S	.	.	H	α-helix	trans	-67.5	-43	173.5	-77.6	-178.8	-18	0	0	112.3	Q779 L780 E781 S786 T787	Q779-Q783 WeakPolarHBondContact O-CB 2.97Å; Q779-Q783 WeakPolarHBondContact O-CG 3.49Å; Q779-Q783 PolarHBondContact O-N 3.33Å; L780-Q783 PolarHBondContact O-N 3.45Å; E781-Q783 PolarHBondContact O-N 3.06Å; Q783-S786 PolarHBondContact O-N 3.22Å; Q783-T787 PolarHBondContact O-N 2.76Å; Q783-T787 PolarHBondContact O-OG1 3.28Å
784	A	56.5	Low	61	Low	15 Å²	15	100.6 Å²	100.6	12%	0.124	50%	0.501	C	S	.	.	H	α-helix	trans	-64.2	-40.3	175.7	0	0	0	0	0	111.4	L780 E781 T787 S788	L780-A784 WeakPolarHBondContact O-CB 3.3Å; L780-A784 PolarHBondContact O-N 2.91Å; E781-A784 PolarHBondContact O-N 2.94Å; A784-T787 WeakPolarHBondContact CA-OG1 3.38Å; A784-T787 PolarHBondContact O-N 2.92Å; A784-T787 PolarHBondContact O-OG1 2.95Å; A784-T787 VanDerWaalsContact O-OG1 3.09Å; A784-S788 VanDerWaalsContact O-CB 3.29Å; A784-S788 WeakPolarHBondContact O-CB 3.13Å; A784-S788 PolarHBondContact O-N 2.82Å
785	Y	52.2	Low	59.2	Low	176 Å²	176	97 Å²	97	69%	0.69	51%	0.506	S	S	*	.	H	α-helix	trans	-65.7	-42.3	176.8	-159.1	-90.9	0	0	0	111.5	E781 T787 S788	E781-Y785 WeakPolarHBondContact O-CB 3.01Å; E781-Y785 PolarHBondContact O-N 2.8Å; Y785-T787 VanDerWaalsContact C-N 3.31Å; Y785-T787 PolarHBondContact O-N 2.73Å; Y785-S788 PolarHBondContact O-N 2.86Å; Y785-S788 PolarHBondContact O-OG 2.73Å
786	S	57.4	Low	57.7	Low	93 Å²	93	97.5 Å²	97.5	65%	0.65	52%	0.516	S	S	*	.	H	α-helix	trans	-65.9	-32.3	177.4	-58.4	0	0	0	0	112.9	E782 Q783	E782-S786 WeakPolarHBondContact O-CB 3.39Å; E782-S786 PolarHBondContact O-N 3.39Å; E782-S786 PolarHBondContact O-OG 3.3Å; Q783-S786 PolarHBondContact O-N 3.22Å
787	T	51.2	Low	56.6	Low	87 Å²	87	99.8 Å²	99.8	53%	0.534	53%	0.529	S	S	.	.	H	α-helix	trans	-83	-25.4	176.1	42.9	0	0	0	0	113.1	Q783 A784 Y785 Q789 R790	Q783-T787 PolarHBondContact O-N 2.76Å; Q783-T787 PolarHBondContact O-OG1 3.28Å; A784-T787 WeakPolarHBondContact CA-OG1 3.38Å; A784-T787 PolarHBondContact O-N 2.92Å; A784-T787 PolarHBondContact O-OG1 2.95Å; A784-T787 VanDerWaalsContact O-OG1 3.09Å; Y785-T787 VanDerWaalsContact C-N 3.31Å; Y785-T787 PolarHBondContact O-N 2.73Å; T787-Q789 PolarHBondContact O-N 3.49Å; T787-Q789 VanDerWaalsContact O-N 3.16Å; T787-R790 PolarHBondContact O-N 3.35Å
788	S	49.4	Very low	55.1	Low	55 Å²	55	103.2 Å²	103.2	39%	0.385	55%	0.545	S	S	.	.	H	α-helix	trans	-63.5	-16.4	178.9	75.3	0	0	0	0	115.7	A784 Y785 R790 I794	A784-S788 VanDerWaalsContact O-CB 3.29Å; A784-S788 WeakPolarHBondContact O-CB 3.13Å; A784-S788 PolarHBondContact O-N 2.82Å; Y785-S788 PolarHBondContact O-N 2.86Å; Y785-S788 PolarHBondContact O-OG 2.73Å; S788-R790 PolarHBondContact O-N 3.34Å; S788-I794 VanDerWaalsContact CB-CD1 3.5Å
789	Q	56.9	Low	53.8	Low	176 Å²	176	100.6 Å²	100.6	82%	0.822	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-6.2	169.3	-71.6	-168.3	-11.4	0	0	113.6	T787	T787-Q789 PolarHBondContact O-N 3.49Å; T787-Q789 VanDerWaalsContact O-N 3.16Å
790	R	50.7	Low	52.6	Low	234 Å²	234	105.3 Å²	105.3	88%	0.883	56%	0.556	S	S	*	*	S	Bend	trans	-124.6	-7.8	-173.3	-124.8	176.9	-170.8	-179	2.3	118.7	T787 S788	T787-R790 PolarHBondContact O-N 3.35Å; S788-R790 PolarHBondContact O-N 3.34Å
791	S	44.3	Very low	51.8	Low	75 Å²	75	108.9 Å²	108.9	52%	0.524	57%	0.568	S	S	.	*			trans	-170.9	143.8	172.8	47.7	0	0	0	0	114.1	E793	S791-E793 VanDerWaalsContact C-N 3.33Å; S791-E793 PolarHBondContact O-N 3.32Å
792	S	46.9	Very low	50.8	Low	128 Å²	128	105.3 Å²	105.3	90%	0.895	56%	0.556	S	S	*	*	S	Bend	trans	-86.5	33.1	-174.7	56.3	0	0	0	0	115
793	E	45.5	Very low	49.5	Very low	157 Å²	157	104.8 Å²	104.8	73%	0.734	56%	0.556	S	S	*	*			trans	-112.2	22.9	-178.6	-73	-171.1	159.4	0	0	113.8	S791 T796	S791-E793 VanDerWaalsContact C-N 3.33Å; S791-E793 PolarHBondContact O-N 3.32Å; E793-T796 PolarHBondContact O-OG1 2.84Å
794	I	47.6	Very low	48.4	Very low	51 Å²	51	103.7 Å²	103.7	26%	0.262	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82	-22.5	-166.4	-65.8	172.4	0	0	0	114.1	S788 T796 N797	S788-I794 VanDerWaalsContact CB-CD1 3.5Å; I794-T796 PolarHBondContact O-N 2.86Å; I794-N797 PolarHBondContact O-N 2.89Å; I794-N797 VanDerWaalsContact O-N 3.09Å
795	G	45.5	Very low	47.5	Very low	74 Å²	74	107.9 Å²	107.9	76%	0.763	58%	0.576	S	S	*	*	H	α-helix	trans	-57.7	-22.8	-176.4	0	0	0	0	0	114.6
796	T	47	Very low	47.3	Very low	96 Å²	96	99.7 Å²	99.7	59%	0.589	55%	0.545	S	S	*	.	H	α-helix	trans	-92.6	-19.8	-178.5	57.3	0	0	0	0	114	E793 I794 S799 R800	E793-T796 PolarHBondContact O-OG1 2.84Å; I794-T796 PolarHBondContact O-N 2.86Å; T796-S799 PolarHBondContact O-OG 2.74Å; T796-R800 PolarHBondContact O-N 2.79Å
797	N	45.4	Very low	46.1	Very low	78 Å²	78	99.7 Å²	99.7	42%	0.417	53%	0.531	S	S	.	.	H	α-helix	trans	-80.8	-32.7	-177.6	-79.5	-21.6	0	0	0	112.7	I794 R800 W801	I794-N797 PolarHBondContact O-N 2.89Å; I794-N797 VanDerWaalsContact O-N 3.09Å; N797-R800 PolarHBondContact O-N 2.89Å; N797-W801 PolarHBondContact O-N 3.41Å
798	L	44.4	Very low	45.1	Very low	105 Å²	105	100.9 Å²	100.9	55%	0.55	53%	0.532	S	S	.	.	H	α-helix	trans	-68.7	-38.6	-179	-141.8	83.3	0	0	0	112.3	W801	L798-W801 HydrophobicContact CD1-CE3 4.41Å; L798-W801 HydrophobicContact CD1-CZ3 4.48Å; L798-W801 PolarHBondContact O-N 3.28Å
799	S	49.5	Very low	44.4	Very low	69 Å²	69	101.4 Å²	101.4	48%	0.483	53%	0.534	S	S	.	.	H	α-helix	trans	-69	-39.7	175.7	55.8	0	0	0	0	111.7	T796 W801 S802	T796-S799 PolarHBondContact O-OG 2.74Å; S799-W801 VanDerWaalsContact C-N 3.25Å; S799-W801 PolarHBondContact O-N 2.9Å; S799-S802 PolarHBondContact O-N 2.92Å; S799-S802 PolarHBondContact O-OG 3.3Å
800	R	47.5	Very low	43.5	Very low	194 Å²	194	94.7 Å²	94.7	73%	0.732	51%	0.508	S	S	*	.	H	α-helix	trans	-62.5	-29.1	177.6	-164.5	177.5	176.4	100.4	0.4	113.1	T796 N797	T796-R800 PolarHBondContact O-N 2.79Å; N797-R800 PolarHBondContact O-N 2.89Å
801	W	48.4	Very low	43.3	Very low	105 Å²	105	89 Å²	89	40%	0.398	50%	0.495	S	S	.	.	H	α-helix	trans	-77.8	-28	176.6	-69.4	-16.6	0	0	0	114	L780 N797 L798 S799 D803 S804	L780-W801 HydrophobicContact CB-CZ3 4.24Å; L780-W801 HydrophobicContact CD2-CE3 4.17Å; L780-W801 HydrophobicContact CD2-CH2 4.33Å; L780-W801 HydrophobicContact CD2-CZ3 3.98Å; N797-W801 PolarHBondContact O-N 3.41Å; L798-W801 HydrophobicContact CD1-CE3 4.41Å; L798-W801 HydrophobicContact CD1-CZ3 4.48Å; L798-W801 PolarHBondContact O-N 3.28Å; S799-W801 VanDerWaalsContact C-N 3.25Å; S799-W801 PolarHBondContact O-N 2.9Å; W801-D803 PolarHBondContact O-N 3.41Å; W801-S804 PolarHBondContact O-N 3.42Å
802	S	48.6	Very low	43.6	Very low	44 Å²	44	87 Å²	87	31%	0.308	48%	0.48	S	S	.	.	H	α-helix	trans	-65.6	-20.3	178.8	75.5	0	0	0	0	113.9	S727 S799	S727-S802 PolarHBondContact OG-O 3.24Å; S799-S802 PolarHBondContact O-N 2.92Å; S799-S802 PolarHBondContact O-OG 3.3Å
803	D	41.9	Very low	44.5	Very low	91 Å²	91	86.3 Å²	86.3	49%	0.487	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-0.2	-179.6	-80.5	-35.8	0	0	0	114.4	K725 W801	K725-D803 IonicContact NZ-OD1 2.73Å; K725-D803 PolarHBondContact NZ-OD1 2.97Å; W801-D803 PolarHBondContact O-N 3.41Å
804	S	39.7	Very low	45.8	Very low	75 Å²	75	83.6 Å²	83.6	52%	0.524	45%	0.449	S	S	.	.			trans	-73.9	127.8	179.2	-171.5	0	0	0	0	111.8	W801	W801-S804 PolarHBondContact O-N 3.42Å
805	H	38.4	Very low	47.3	Very low	103 Å²	103	83.4 Å²	83.4	48%	0.477	45%	0.447	S	S	.	.	B	Isolated β-bridge	trans	-68.7	130.9	176.6	-69.4	-74.1	0	0	0	111.1	Y807	H805-Y807 PolarHBondContact O-N 3.29Å
806	L	46.4	Very low	49	Very low	4 Å²	4	83.8 Å²	83.8	2%	0.021	44%	0.436	C	S	.	.			trans	-71.2	110.7	-177.8	-58.7	170.7	0	0	0	109.7	F685 L686 L687 I723 P724 L726	F685-L806 WeakPolarHBondContact CB-O 3.49Å; F685-L806 CarbonylContact O-C 3.59Å; F685-L806 VanDerWaalsContact O-CB 3.23Å; F685-L806 WeakPolarHBondContact O-CB 3.21Å; L686-L806 HydrophobicContact CD2-CB 4.48Å; L686-L806 HydrophobicContact CD2-CD1 3.55Å; L686-L806 HydrophobicContact CD2-CD2 4.28Å; L686-L806 HydrophobicContact CD2-CG 4.33Å; L687-L806 HydrophobicContact CD2-CD2 3.57Å; L687-L806 HydrophobicContact CG-CD2 3.95Å; I723-L806 HydrophobicContact CG2-CB 3.74Å; I723-L806 WeakPolarHBondContact CG2-O 3.46Å; P724-L806 WeakPolarHBondContact O-CD1 3.47Å; P724-L806 WeakPolarHBondContact O-CG 3.39Å; L726-L806 HydrophobicContact CB-CD2 4.1Å
807	Y	33.7	Very low	50.7	Low	93 Å²	93	85 Å²	85	37%	0.365	44%	0.439	S	S	.	.			trans	-126	132.6	163.6	-81.4	-83.7	0	0	0	108.7	F685 L687 S688 I723 H805 P809	F685-Y807 CarbonylContact O-C 3.48Å; F685-Y807 WeakPolarHBondContact O-CA 3.21Å; F685-Y807 PolarHBondContact O-N 3.06Å; L687-Y807 CarbonylContact C-O 2.81Å; L687-Y807 WeakPolarHBondContact CA-O 3.32Å; L687-Y807 VanDerWaalsContact N-C 3.3Å; L687-Y807 PolarHBondContact N-O 3.19Å; S688-Y807 PolarHBondContact N-O 3.02Å; I723-Y807 HydrophobicContact CD1-CD2 4.34Å; I723-Y807 HydrophobicContact CD1-CE1 4.03Å; I723-Y807 HydrophobicContact CD1-CE2 3.68Å; I723-Y807 VanDerWaalsContact CD1-CZ 3.5Å; H805-Y807 PolarHBondContact O-N 3.29Å; Y807-P809 WeakPolarHBondContact O-CD 3.44Å
808	M	29.8	Very low	52.6	Low	112 Å²	112	81.5 Å²	81.5	55%	0.552	42%	0.42	S	S	*	.			trans	-89.7	102.5	158.6	-94.5	-99.8	163.3	0	0	109.5	L686 L687 A810	L686-M808 WeakPolarHBondContact O-CE 3.38Å; L686-M808 WeakPolarHBondContact O-CG 3.24Å; L687-M808 HydrophobicContact CB-CE 4.14Å; L687-M808 WeakPolarHBondContact O-CA 2.76Å; L687-M808 WeakPolarHBondContact O-CE 3.15Å; L687-M808 WeakPolarHBondContact O-CG 3.42Å; M808-A810 VanDerWaalsContact C-N 3.27Å; M808-A810 PolarHBondContact O-N 3.02Å
809	P	34.1	Very low	54.7	Low	65 Å²	65	76.5 Å²	76.5	42%	0.422	40%	0.395	S	S	.	.			trans	-67.9	99.4	130.3	-4.6	22.4	0	0	0	105.4	S688 Y807 N811	S688-P809 WeakPolarHBondContact CB-O 3.36Å; S688-P809 WeakPolarHBondContact OG-CD 3.29Å; S688-P809 WeakPolarHBondContact OG-CG 3.33Å; Y807-P809 WeakPolarHBondContact O-CD 3.44Å; P809-N811 VanDerWaalsContact C-N 3.31Å; P809-N811 PolarHBondContact O-N 3.17Å
810	A	38.9	Very low	56.5	Low	35 Å²	35	75.4 Å²	75.4	29%	0.289	39%	0.385	S	S	.	.			trans	-52	118	143.5	0	0	0	0	0	103.2	M808 V812	M808-A810 VanDerWaalsContact C-N 3.27Å; M808-A810 PolarHBondContact O-N 3.02Å; A810-V812 HydrophobicContact CB-CG2 4.29Å; A810-V812 WeakPolarHBondContact O-CG2 2.96Å; A810-V812 PolarHBondContact O-N 2.81Å
811	N	45.1	Very low	58.4	Low	115 Å²	115	70.1 Å²	70.1	62%	0.615	37%	0.372	S	S	*	.			trans	-59.5	87.4	167	-98.3	-20.2	0	0	0	104.5	P809 Q813	P809-N811 VanDerWaalsContact C-N 3.31Å; P809-N811 PolarHBondContact O-N 3.17Å; N811-Q813 PolarHBondContact O-N 3Å
812	V	51.3	Low	60.3	Low	34 Å²	34	66.3 Å²	66.3	21%	0.206	36%	0.358	C	S	.	.			trans	-68.2	91.3	175.1	174	0	0	0	0	102.4	A810 F814	A810-V812 HydrophobicContact CB-CG2 4.29Å; A810-V812 WeakPolarHBondContact O-CG2 2.96Å; A810-V812 PolarHBondContact O-N 2.81Å; V812-F814 HydrophobicContact CB-CE2 4.37Å; V812-F814 HydrophobicContact CG1-CD2 4.21Å; V812-F814 HydrophobicContact CG1-CE2 3.79Å; V812-F814 HydrophobicContact CG1-CZ 3.99Å; V812-F814 WeakPolarHBondContact O-CD2 3.08Å; V812-F814 PolarHBondContact O-N 2.91Å
813	Q	66.3	Low	62.3	Low	113 Å²	113	68 Å²	68	53%	0.528	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-69.9	106.5	173.6	-78	-174.4	-16.8	0	0	105.4	N811 M815 G905	N811-Q813 PolarHBondContact O-N 3Å; Q813-M815 HydrophobicContact CB-CG 3.9Å; Q813-M815 HydrophobicContact CB-SD 4.46Å; Q813-M815 PolarHBondContact O-N 3.25Å; Q813-M815 VanDerWaalsContact O-N 3.11Å; Q813-G905 PolarHBondContact O-N 2.77Å
814	F	72.3	Confident	64.5	Low	99 Å²	99	64 Å²	64	43%	0.434	35%	0.346	S	S	.	.			trans	-69.2	104.4	161.7	-70.2	-87.3	0	0	0	105.5	V812 P816 L888 G905 T907	V812-F814 HydrophobicContact CB-CE2 4.37Å; V812-F814 HydrophobicContact CG1-CD2 4.21Å; V812-F814 HydrophobicContact CG1-CE2 3.79Å; V812-F814 HydrophobicContact CG1-CZ 3.99Å; V812-F814 WeakPolarHBondContact O-CD2 3.08Å; V812-F814 PolarHBondContact O-N 2.91Å; F814-P816 VanDerWaalsContact O-CD 3.29Å; F814-P816 WeakPolarHBondContact O-CD 3.36Å; F814-L888 HydrophobicContact CE1-CD1 4.26Å; F814-L888 HydrophobicContact CZ-CD1 3.93Å; F814-G905 WeakPolarHBondContact CD1-O 3.25Å; F814-T907 HydrophobicContact CE1-CG2 4.18Å
815	M	80.1	Confident	66.6	Low	47 Å²	47	63.2 Å²	63.2	23%	0.232	34%	0.335	C	S	.	.			trans	-109	88.9	176.4	-63	-175.2	76.5	0	0	108	Q813 N817 V818 L819 V839 I904	Q813-M815 HydrophobicContact CB-CG 3.9Å; Q813-M815 HydrophobicContact CB-SD 4.46Å; Q813-M815 PolarHBondContact O-N 3.25Å; Q813-M815 VanDerWaalsContact O-N 3.11Å; M815-N817 PolarHBondContact O-N 3.35Å; M815-N817 VanDerWaalsContact O-N 3.08Å; M815-V818 HydrophobicContact CB-CB 4.16Å; M815-V818 HydrophobicContact CB-CG2 3.74Å; M815-V818 HydrophobicContact CE-CG2 4.11Å; M815-V818 PolarHBondContact O-N 3.2Å; M815-V818 HydrophobicContact SD-CG2 4.19Å; M815-L819 PolarHBondContact O-N 2.94Å; M815-L819 VanDerWaalsContact O-N 3.11Å; M815-V839 HydrophobicContact CE-CG2 3.84Å; M815-V839 HydrophobicContact SD-CG1 4.48Å; M815-V839 HydrophobicContact SD-CG2 3.97Å; M815-I904 HydrophobicContact CB-CG2 4.17Å; M815-I904 HydrophobicContact SD-CD1 4.38Å; M815-I904 HydrophobicContact SD-CG1 4.34Å
816	P	80	Confident	68.8	Low	82 Å²	82	58.4 Å²	58.4	53%	0.532	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-26.6	-177	-21.1	31.6	0	0	0	113	F814 V818 P820	F814-P816 VanDerWaalsContact O-CD 3.29Å; F814-P816 WeakPolarHBondContact O-CD 3.36Å; P816-V818 PolarHBondContact O-N 3.11Å; P816-P820 HydrophobicContact CB-CB 4.38Å; P816-P820 WeakPolarHBondContact O-CD 3.39Å
817	N	83.2	Confident	70.6	Confident	123 Å²	123	58.3 Å²	58.3	66%	0.658	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-22.4	177.2	-60.7	-2.5	0	0	0	112.6	M815 N838	M815-N817 PolarHBondContact O-N 3.35Å; M815-N817 VanDerWaalsContact O-N 3.08Å; N817-N838 PolarHBondContact O-ND2 3.35Å
818	V	85.6	Confident	73.1	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.018	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-50.3	179.2	-176.3	0	0	0	0	110.2	M815 P816 I834 N835 N838 V839 I904	M815-V818 HydrophobicContact CB-CB 4.16Å; M815-V818 HydrophobicContact CB-CG2 3.74Å; M815-V818 HydrophobicContact CE-CG2 4.11Å; M815-V818 PolarHBondContact O-N 3.2Å; M815-V818 HydrophobicContact SD-CG2 4.19Å; P816-V818 PolarHBondContact O-N 3.11Å; V818-I834 HydrophobicContact CG1-CG2 4.4Å; V818-N835 WeakPolarHBondContact CG1-O 3.24Å; V818-N835 PolarHBondContact O-N 2.83Å; V818-N838 HydrophobicContact CG2-CB 4.09Å; V818-V839 HydrophobicContact CB-CG2 4.31Å; V818-V839 HydrophobicContact CG1-CG2 4.26Å; V818-V839 HydrophobicContact CG2-CG2 3.17Å; V818-I904 HydrophobicContact CB-CD1 3.78Å; V818-I904 HydrophobicContact CG1-CD1 3.3Å; V818-I904 HydrophobicContact CG2-CD1 3.95Å
819	L	87.9	Confident	75.9	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.284	C	S	.	.	S	Bend	trans	-154.3	108.8	174.4	-171.7	58.2	0	0	0	108.8	M815 F822 K832 I834 F906	M815-L819 PolarHBondContact O-N 2.94Å; M815-L819 VanDerWaalsContact O-N 3.11Å; L819-F822 HydrophobicContact CD1-CE1 4.49Å; L819-K832 HydrophobicContact CD1-CG 3.73Å; L819-I834 HydrophobicContact CD1-CG1 4.47Å; L819-F906 HydrophobicContact CD2-CB 4.5Å; L819-F906 HydrophobicContact CD2-CD1 3.46Å; L819-F906 VanDerWaalsContact CD2-CD1 3.46Å; L819-F906 HydrophobicContact CD2-CD2 3.91Å; L819-F906 HydrophobicContact CD2-CE1 3.42Å; L819-F906 VanDerWaalsContact CD2-CE1 3.42Å; L819-F906 HydrophobicContact CD2-CE2 3.88Å; L819-F906 HydrophobicContact CD2-CG 3.7Å; L819-F906 HydrophobicContact CD2-CZ 3.62Å; L819-F906 HydrophobicContact CG-CB 4.42Å; L819-F906 HydrophobicContact CG-CD1 4.25Å; L819-F906 HydrophobicContact CG-CD2 4.34Å; L819-F906 HydrophobicContact CG-CG 4.09Å
820	P	86.7	Confident	78.4	Confident	45 Å²	45	50.2 Å²	50.2	29%	0.292	27%	0.27	S	S	.	.			trans	-72.1	159.4	177.7	30.5	-34.7	0	0	0	110.9	P816 F822	P816-P820 HydrophobicContact CB-CB 4.38Å; P816-P820 WeakPolarHBondContact O-CD 3.39Å; P820-F822 VanDerWaalsContact O-CD1 3.3Å; P820-F822 WeakPolarHBondContact O-CD1 3.32Å
821	N	87.9	Confident	80.8	Confident	83 Å²	83	54.4 Å²	54.4	44%	0.444	28%	0.282	S	S	.	.			trans	-63.7	141	164.1	-64.4	-15.7	0	0	0	109	F906 T907	N821-F906 VanDerWaalsContact OD1-CA 3.23Å; N821-F906 WeakPolarHBondContact OD1-CA 3.48Å; N821-T907 WeakPolarHBondContact CA-O 3.46Å; N821-T907 WeakPolarHBondContact CB-OG1 3.48Å; N821-T907 PolarHBondContact ND2-OG1 3.03Å; N821-T907 PolarHBondContact OD1-N 2.92Å; N821-T907 PolarHBondContact OD1-OG1 2.88Å
822	F	89.7	Confident	83	Confident	26 Å²	26	52.3 Å²	52.3	11%	0.114	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	160.4	-177.4	62.8	-79.4	0	0	0	111.8	L819 P820 V824 F830 K832 L873 F906 T907 V908 E909	L819-F822 HydrophobicContact CD1-CE1 4.49Å; P820-F822 VanDerWaalsContact O-CD1 3.3Å; P820-F822 WeakPolarHBondContact O-CD1 3.32Å; F822-V824 HydrophobicContact CD2-CG1 3.53Å; F822-V824 HydrophobicContact CE2-CG1 3.32Å; F822-F830 AromaticContact CE2-CD2 3.99Å; F822-F830 HydrophobicContact CE2-CD2 3.99Å; F822-F830 AromaticContact CE2-CE2 3.72Å; F822-F830 HydrophobicContact CE2-CE2 3.72Å; F822-F830 HydrophobicContact CE2-CZ 4.28Å; F822-F830 AromaticContact CZ-CE2 3.97Å; F822-F830 HydrophobicContact CZ-CE2 3.97Å; F822-K832 HydrophobicContact CD1-CG 4.46Å; F822-K832 HydrophobicContact CE1-CG 4.31Å; F822-K832 HydrophobicContact CZ-CB 4.45Å; F822-K832 HydrophobicContact CZ-CG 4.49Å; F822-L873 HydrophobicContact CE1-CD2 4.18Å; F822-L873 HydrophobicContact CZ-CD2 3.64Å; F822-F906 AromaticContact CE1-CD2 3.81Å; F822-F906 HydrophobicContact CE1-CD2 3.81Å; F822-F906 AromaticContact CE1-CE2 3.92Å; F822-F906 HydrophobicContact CE1-CE2 3.92Å; F822-F906 HydrophobicContact CZ-CE2 4.35Å; F822-T907 PolarHBondContact N-O 3.03Å; F822-T907 VanDerWaalsContact N-O 3.15Å; F822-V908 HydrophobicContact CD1-CG2 4.33Å; F822-V908 HydrophobicContact CD2-CG1 4.45Å; F822-V908 HydrophobicContact CE1-CG2 3.67Å; F822-V908 HydrophobicContact CE2-CG1 4.02Å; F822-V908 HydrophobicContact CE2-CG2 4.09Å; F822-V908 HydrophobicContact CZ-CG1 4.27Å; F822-V908 HydrophobicContact CZ-CG2 3.51Å; F822-V908 VanDerWaalsContact O-CA 3.31Å; F822-V908 WeakPolarHBondContact O-CA 3.4Å; F822-E909 PolarHBondContact O-N 3.48Å; F822-E909 VanDerWaalsContact O-N 3.13Å
823	T	88.5	Confident	84.7	Confident	78 Å²	78	54.2 Å²	54.2	48%	0.479	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	144.5	173.1	62.7	0	0	0	0	108.9	E909	T823-E909 CarbonylContact C-O 3.54Å; T823-E909 WeakPolarHBondContact CA-O 3.41Å; T823-E909 HydrophobicContact CG2-CB 3.76Å
824	V	89.4	Confident	85.8	Confident	8 Å²	8	49.3 Å²	49.3	5%	0.048	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	153.5	173.8	-62	0	0	0	0	108.8	F822 F830 W863 P877 V908 E909 V910 Q911	F822-V824 HydrophobicContact CD2-CG1 3.53Å; F822-V824 HydrophobicContact CE2-CG1 3.32Å; V824-F830 HydrophobicContact CB-CD1 4.02Å; V824-F830 HydrophobicContact CB-CE1 4.2Å; V824-F830 HydrophobicContact CG1-CB 4.49Å; V824-F830 HydrophobicContact CG1-CD1 3.59Å; V824-F830 HydrophobicContact CG1-CD2 4.09Å; V824-F830 HydrophobicContact CG1-CE1 3.72Å; V824-F830 HydrophobicContact CG1-CE2 4.22Å; V824-F830 HydrophobicContact CG1-CG 3.78Å; V824-F830 HydrophobicContact CG1-CZ 4.04Å; V824-F830 HydrophobicContact CG2-CE1 4.39Å; V824-W863 HydrophobicContact CG2-CH2 4.34Å; V824-W863 HydrophobicContact CG2-CZ3 4.12Å; V824-P877 HydrophobicContact CB-CG 4.42Å; V824-P877 HydrophobicContact CG2-CG 3.88Å; V824-V908 HydrophobicContact CB-CG1 4.37Å; V824-V908 HydrophobicContact CG1-CG1 3.94Å; V824-V908 HydrophobicContact CG2-CG1 3.57Å; V824-E909 PolarHBondContact N-O 3.04Å; V824-V910 HydrophobicContact CG2-CB 4.29Å; V824-V910 HydrophobicContact CG2-CG1 4.46Å; V824-V910 HydrophobicContact CG2-CG2 3.73Å; V824-V910 WeakPolarHBondContact O-CA 3.25Å; V824-Q911 PolarHBondContact O-N 3.05Å
825	I	84	Confident	86.6	Confident	58 Å²	58	47.8 Å²	47.8	30%	0.297	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.6	-176.1	-65	178.3	0	0	0	107.9	G827 L828 Q911 W913	I825-G827 PolarHBondContact O-N 3.07Å; I825-L828 HydrophobicContact CB-CB 4.41Å; I825-L828 HydrophobicContact CB-CD1 3.86Å; I825-L828 HydrophobicContact CB-CG 4.12Å; I825-L828 HydrophobicContact CD1-CD1 4.15Å; I825-L828 HydrophobicContact CG2-CD1 3.79Å; I825-L828 HydrophobicContact CG2-CG 3.91Å; I825-L828 PolarHBondContact O-N 2.7Å; I825-L828 VanDerWaalsContact O-N 3.14Å; I825-Q911 WeakPolarHBondContact CA-O 3.03Å; I825-W913 HydrophobicContact CG2-CB 3.24Å; I825-W913 HydrophobicContact CG2-CG 4.34Å
826	A	84.5	Confident	86.8	Confident	3 Å²	3	46.1 Å²	46.1	3%	0.025	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	133.3	176.1	0	0	0	0	0	110.7	L828 P877 I882 V910 Q911	A826-L828 VanDerWaalsContact C-N 3.33Å; A826-P877 CarbonylContact C-O 3.57Å; A826-P877 WeakPolarHBondContact CA-O 3.27Å; A826-I882 HydrophobicContact CB-CD1 3.67Å; A826-I882 HydrophobicContact CB-CG1 3.59Å; A826-V910 HydrophobicContact CB-CG1 4.2Å; A826-Q911 PolarHBondContact N-O 3.03Å
827	G	83.5	Confident	86.9	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.01	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	-9.8	-177.7	0	0	0	0	0	115.3	I825 P877 G983 I984	I825-G827 PolarHBondContact O-N 3.07Å; G827-P877 PolarHBondContact N-O 3.28Å; G827-G983 CarbonylContact O-C 3.59Å; G827-G983 WeakPolarHBondContact O-CA 3.41Å; G827-I984 WeakPolarHBondContact CA-O 3.37Å; G827-I984 PolarHBondContact O-N 3.14Å
828	L	86.5	Confident	86.8	Confident	34 Å²	34	44.7 Å²	44.7	18%	0.178	24%	0.237	C	C	.	.			trans	-100	130.5	176.9	-57	-168.7	0	0	0	111	I825 A826 L876 L1002	I825-L828 HydrophobicContact CB-CB 4.41Å; I825-L828 HydrophobicContact CB-CD1 3.86Å; I825-L828 HydrophobicContact CB-CG 4.12Å; I825-L828 HydrophobicContact CD1-CD1 4.15Å; I825-L828 HydrophobicContact CG2-CD1 3.79Å; I825-L828 HydrophobicContact CG2-CG 3.91Å; I825-L828 PolarHBondContact O-N 2.7Å; I825-L828 VanDerWaalsContact O-N 3.14Å; A826-L828 VanDerWaalsContact C-N 3.33Å; L828-L876 VanDerWaalsContact C-CD1 3.48Å; L828-L1002 HydrophobicContact CD1-CD1 4.24Å; L828-L1002 HydrophobicContact CD2-CD1 3.23Å; L828-L1002 HydrophobicContact CD2-CD2 3.9Å; L828-L1002 HydrophobicContact CD2-CG 4.12Å; L828-L1002 HydrophobicContact CG-CD1 4.4Å
829	R	87.9	Confident	86.7	Confident	35 Å²	35	46.5 Å²	46.5	13%	0.132	25%	0.247	C	C	.	.			trans	-70.5	140.5	171.3	66.5	173	-171.7	-114.4	3.8	109	G875 L876 W960 S963 N964 D967 P980	R829-G875 WeakPolarHBondContact CA-O 3.47Å; R829-L876 HydrophobicContact CB-CD1 3.88Å; R829-L876 VanDerWaalsContact N-CD1 3.28Å; R829-W960 HydrophobicContact CB-CE3 3.97Å; R829-W960 HydrophobicContact CB-CH2 4.32Å; R829-W960 HydrophobicContact CB-CZ3 3.7Å; R829-W960 HydrophobicContact CG-CZ3 4.4Å; R829-S963 PolarHBondContact NH1-O 3.3Å; R829-S963 PolarHBondContact NH1-OG 3.29Å; R829-N964 VanDerWaalsContact CD-OD1 3.3Å; R829-N964 WeakPolarHBondContact CD-OD1 3.03Å; R829-N964 PolarHBondContact NE-OD1 3.27Å; R829-N964 VanDerWaalsContact NH1-CA 3.31Å; R829-N964 PolarHBondContact NH1-OD1 3.18Å; R829-D967 IonicContact CZ-OD2 3.87Å; R829-D967 IonicContact NH1-OD2 3.7Å; R829-D967 IonicContact NH2-OD2 2.77Å; R829-D967 PolarHBondContact NH2-OD2 3.01Å; R829-P980 HydrophobicContact CG-CB 3.77Å; R829-P980 HydrophobicContact CG-CG 3.79Å
830	F	88.2	Confident	86.4	Confident	31 Å²	31	46.7 Å²	46.7	14%	0.136	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	150.6	174.3	71.4	-88.4	0	0	0	110.9	F822 V824 W863 I864 L873 I874 G875 P877 W960	F822-F830 AromaticContact CE2-CD2 3.99Å; F822-F830 HydrophobicContact CE2-CD2 3.99Å; F822-F830 AromaticContact CE2-CE2 3.72Å; F822-F830 HydrophobicContact CE2-CE2 3.72Å; F822-F830 HydrophobicContact CE2-CZ 4.28Å; F822-F830 AromaticContact CZ-CE2 3.97Å; F822-F830 HydrophobicContact CZ-CE2 3.97Å; V824-F830 HydrophobicContact CB-CD1 4.02Å; V824-F830 HydrophobicContact CB-CE1 4.2Å; V824-F830 HydrophobicContact CG1-CB 4.49Å; V824-F830 HydrophobicContact CG1-CD1 3.59Å; V824-F830 HydrophobicContact CG1-CD2 4.09Å; V824-F830 HydrophobicContact CG1-CE1 3.72Å; V824-F830 HydrophobicContact CG1-CE2 4.22Å; V824-F830 HydrophobicContact CG1-CG 3.78Å; V824-F830 HydrophobicContact CG1-CZ 4.04Å; V824-F830 HydrophobicContact CG2-CE1 4.39Å; F830-W863 HydrophobicContact CE1-CE3 4.28Å; F830-W863 AromaticContact CE1-CZ3 3.81Å; F830-W863 HydrophobicContact CE1-CZ3 3.81Å; F830-W863 HydrophobicContact CZ-CZ3 4.02Å; F830-I864 HydrophobicContact CE2-CD1 4.37Å; F830-I864 HydrophobicContact CZ-CD1 3.75Å; F830-I864 HydrophobicContact CZ-CG1 3.92Å; F830-L873 HydrophobicContact CE2-CD2 4.12Å; F830-I874 WeakPolarHBondContact O-CA 3.38Å; F830-G875 WeakPolarHBondContact CD1-O 3.35Å; F830-G875 PolarHBondContact N-O 2.77Å; F830-G875 PolarHBondContact O-N 3.25Å; F830-P877 HydrophobicContact CE1-CG 4.49Å; F830-W960 WeakPolarHBondContact O-CZ3 3.35Å
831	K	89.1	Confident	86.1	Confident	124 Å²	124	47.8 Å²	47.8	54%	0.539	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	116.6	172.5	-175.5	174.3	175.6	178	0	107.7	H872 L873 I874 W960	K831-H872 HydrophobicContact CD-CB 4.35Å; K831-H872 WeakPolarHBondContact CE-CD2 3.19Å; K831-H872 WeakPolarHBondContact CE-ND1 3.33Å; K831-H872 HydrophobicContact CG-CB 3.8Å; K831-L873 CarbonylContact C-O 3.55Å; K831-L873 WeakPolarHBondContact CA-O 3.38Å; K831-I874 HydrophobicContact CB-CG2 4.3Å; K831-I874 HydrophobicContact CG-CG2 4.01Å; K831-W960 HydrophobicContact CB-CH2 4.23Å
832	K	89.8	Confident	85.7	Confident	70 Å²	70	46.7 Å²	46.7	30%	0.304	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.9	-179.2	-166.5	66.1	175.7	179.1	0	109.9	L819 F822 H872 L873	L819-K832 HydrophobicContact CD1-CG 3.73Å; F822-K832 HydrophobicContact CD1-CG 4.46Å; F822-K832 HydrophobicContact CE1-CG 4.31Å; F822-K832 HydrophobicContact CZ-CB 4.45Å; F822-K832 HydrophobicContact CZ-CG 4.49Å; K832-H872 CarbonylContact O-C 3.54Å; K832-H872 VanDerWaalsContact O-CA 3.25Å; K832-H872 WeakPolarHBondContact O-CA 3.42Å; K832-L873 HydrophobicContact CB-CB 4.24Å; K832-L873 PolarHBondContact N-O 2.56Å; K832-L873 PolarHBondContact O-N 3.28Å
833	S	88.8	Confident	85.2	Confident	74 Å²	74	55.5 Å²	55.5	52%	0.517	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	136.6	177.4	55.4	0	0	0	0	111	H872	S833-H872 VanDerWaalsContact CA-CD2 3.45Å; S833-H872 WeakPolarHBondContact CA-CD2 3.37Å
834	I	89.1	Confident	84.9	Confident	11 Å²	11	57.7 Å²	57.7	6%	0.056	29%	0.293	C	S	.	.			trans	-103.2	128.9	171.7	-57.1	170.5	0	0	0	106.3	V818 L819 P836 L866 S871 L873 L891	V818-I834 HydrophobicContact CG1-CG2 4.4Å; L819-I834 HydrophobicContact CD1-CG1 4.47Å; I834-P836 VanDerWaalsContact C-CD 3.48Å; I834-P836 WeakPolarHBondContact O-CD 3.21Å; I834-L866 HydrophobicContact CD1-CD2 3.36Å; I834-S871 PolarHBondContact N-O 3.48Å; I834-L873 HydrophobicContact CD1-CB 4.46Å; I834-L891 HydrophobicContact CD1-CD1 4.49Å; I834-L891 HydrophobicContact CD1-CD2 4.35Å; I834-L891 HydrophobicContact CG2-CD2 3.66Å
835	N	89	Confident	84.6	Confident	66 Å²	66	58.9 Å²	58.9	35%	0.353	30%	0.298	S	S	.	.			trans	-108	81.7	176.7	-173.1	-2.7	0	0	0	110.6	V818 D837 N838	V818-N835 WeakPolarHBondContact CG1-O 3.24Å; V818-N835 PolarHBondContact O-N 2.83Å; N835-D837 VanDerWaalsContact C-N 3.28Å; N835-D837 PolarHBondContact O-N 2.02Å; N835-D837 PolarHBondContact OD1-N 2.04Å; N835-N838 PolarHBondContact ND2-ND2 3.26Å
836	P	83.8	Confident	84.5	Confident	13 Å²	13	61.9 Å²	61.9	8%	0.084	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-73.6	-20.1	-175.1	35.1	-40.5	0	0	0	113.2	I834 N838 V839 T840 I845 M848 I893	I834-P836 VanDerWaalsContact C-CD 3.48Å; I834-P836 WeakPolarHBondContact O-CD 3.21Å; P836-N838 PolarHBondContact O-N 2.72Å; P836-N838 VanDerWaalsContact O-N 3.13Å; P836-V839 PolarHBondContact O-N 3.24Å; P836-T840 CarbonylContact C-O 3.57Å; P836-T840 PolarHBondContact O-N 2.8Å; P836-I845 HydrophobicContact CB-CD1 3.46Å; P836-I845 VanDerWaalsContact CB-CD1 3.46Å; P836-I845 HydrophobicContact CG-CD1 3.76Å; P836-M848 HydrophobicContact CB-CE 3.5Å; P836-M848 HydrophobicContact CG-CE 3.69Å; P836-I893 HydrophobicContact CB-CD1 4.22Å
837	D	82.8	Confident	84.5	Confident	88 Å²	88	66.3 Å²	66.3	47%	0.471	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-60.4	-25.2	-178.2	-74.5	-34.3	0	0	0	112.8	N835 V839 T840 S842	N835-D837 VanDerWaalsContact C-N 3.28Å; N835-D837 PolarHBondContact O-N 2.02Å; N835-D837 PolarHBondContact OD1-N 2.04Å; D837-V839 PolarHBondContact O-N 2.6Å; D837-T840 WeakPolarHBondContact CA-O 3.5Å; D837-S842 VanDerWaalsContact CG-OG 3.27Å; D837-S842 VanDerWaalsContact OD1-CB 3.3Å; D837-S842 WeakPolarHBondContact OD1-CB 3.28Å; D837-S842 PolarHBondContact OD1-N 3.07Å; D837-S842 PolarHBondContact OD1-OG 3.36Å; D837-S842 PolarHBondContact OD2-OG 2.69Å
838	N	81	Confident	84.7	Confident	87 Å²	87	67 Å²	67	47%	0.465	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-65.7	-14.4	174.3	-76.5	-17.6	0	0	0	113.7	N817 V818 N835 P836	N817-N838 PolarHBondContact O-ND2 3.35Å; V818-N838 HydrophobicContact CG2-CB 4.09Å; N835-N838 PolarHBondContact ND2-ND2 3.26Å; P836-N838 PolarHBondContact O-N 2.72Å; P836-N838 VanDerWaalsContact O-N 3.13Å
839	V	82.1	Confident	84.8	Confident	40 Å²	40	67.2 Å²	67.2	24%	0.242	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-41.3	-178.8	-161.3	0	0	0	0	111.7	M815 V818 P836 D837 I902 I904	M815-V839 HydrophobicContact CE-CG2 3.84Å; M815-V839 HydrophobicContact SD-CG1 4.48Å; M815-V839 HydrophobicContact SD-CG2 3.97Å; V818-V839 HydrophobicContact CB-CG2 4.31Å; V818-V839 HydrophobicContact CG1-CG2 4.26Å; V818-V839 HydrophobicContact CG2-CG2 3.17Å; P836-V839 PolarHBondContact O-N 3.24Å; D837-V839 PolarHBondContact O-N 2.6Å; V839-I902 HydrophobicContact CB-CD1 4.39Å; V839-I902 HydrophobicContact CG1-CB 4.33Å; V839-I902 HydrophobicContact CG1-CD1 3.47Å; V839-I902 VanDerWaalsContact CG1-CD1 3.47Å; V839-I902 HydrophobicContact CG1-CG1 4.38Å; V839-I902 HydrophobicContact CG1-CG2 3.58Å; V839-I904 HydrophobicContact CG2-CD1 3.98Å
840	T	82.4	Confident	84.9	Confident	5 Å²	5	65.8 Å²	65.8	3%	0.031	33%	0.326	C	S	.	.	S	Bend	trans	-152	132.2	179.7	-70.4	0	0	0	0	108.7	P836 D837 S842 R844 I845 I902	P836-T840 CarbonylContact C-O 3.57Å; P836-T840 PolarHBondContact O-N 2.8Å; D837-T840 WeakPolarHBondContact CA-O 3.5Å; T840-S842 PolarHBondContact O-N 2.71Å; T840-R844 HydrophobicContact CG2-CB 3.71Å; T840-I845 HydrophobicContact CG2-CG1 4.21Å; T840-I902 WeakPolarHBondContact OG1-CD1 3.08Å
841	P	79.7	Confident	84.9	Confident	68 Å²	68	67.4 Å²	67.4	44%	0.442	33%	0.331	S	S	.	.			trans	-53.2	133.2	177.5	-24.1	31.3	0	0	0	111.2	K843 R844	P841-K843 PolarHBondContact O-N 3.43Å; P841-R844 WeakPolarHBondContact O-CB 3.43Å; P841-R844 PolarHBondContact O-N 3.36Å
842	S	79.1	Confident	84.6	Confident	61 Å²	61	62.8 Å²	62.8	43%	0.427	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-49.7	-33.3	-175.2	-69.2	0	0	0	0	113.8	D837 T840 R844 I845	D837-S842 VanDerWaalsContact CG-OG 3.27Å; D837-S842 VanDerWaalsContact OD1-CB 3.3Å; D837-S842 WeakPolarHBondContact OD1-CB 3.28Å; D837-S842 PolarHBondContact OD1-N 3.07Å; D837-S842 PolarHBondContact OD1-OG 3.36Å; D837-S842 PolarHBondContact OD2-OG 2.69Å; T840-S842 PolarHBondContact O-N 2.71Å; S842-R844 PolarHBondContact O-N 3.4Å; S842-I845 PolarHBondContact O-N 3.11Å
843	K	80.1	Confident	83.7	Confident	211 Å²	211	61.2 Å²	61.2	92%	0.917	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-63.5	-17.6	177.1	-62	-173.5	179.8	-179.8	0	114.6	P841	P841-K843 PolarHBondContact O-N 3.43Å
844	R	82.8	Confident	82.7	Confident	124 Å²	124	66.1 Å²	66.1	47%	0.468	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-101.8	-2.5	-178.2	-63.7	-177.9	178.5	-168.9	8.4	113	T840 P841 S842 S895 V896 D897	T840-R844 HydrophobicContact CG2-CB 3.71Å; P841-R844 WeakPolarHBondContact O-CB 3.43Å; P841-R844 PolarHBondContact O-N 3.36Å; S842-R844 PolarHBondContact O-N 3.4Å; R844-S895 CarbonylContact O-C 3.48Å; R844-S895 VanDerWaalsContact O-CA 3.28Å; R844-S895 WeakPolarHBondContact O-CA 3.46Å; R844-V896 WeakPolarHBondContact O-CG2 3.27Å; R844-V896 PolarHBondContact O-N 3.48Å; R844-D897 VanDerWaalsContact CD-OD2 3.23Å; R844-D897 WeakPolarHBondContact CD-OD2 3.33Å; R844-D897 IonicContact CZ-OD2 3.27Å; R844-D897 VanDerWaalsContact CZ-OD2 3.26Å; R844-D897 IonicContact NE-OD2 3.33Å; R844-D897 PolarHBondContact NE-OD2 3.36Å; R844-D897 IonicContact NH1-OD2 2.74Å; R844-D897 PolarHBondContact NH1-OD2 3.01Å
845	I	81.7	Confident	81.7	Confident	33 Å²	33	66.5 Å²	66.5	17%	0.169	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.7	-179	-55.8	175.4	0	0	0	108.3	P836 T840 S842 M848 I893	P836-I845 HydrophobicContact CB-CD1 3.46Å; P836-I845 VanDerWaalsContact CB-CD1 3.46Å; P836-I845 HydrophobicContact CG-CD1 3.76Å; T840-I845 HydrophobicContact CG2-CG1 4.21Å; S842-I845 PolarHBondContact O-N 3.11Å; I845-M848 HydrophobicContact CD1-CE 3.73Å; I845-M848 HydrophobicContact CG2-CE 3.97Å; I845-M848 HydrophobicContact CG2-CG 4.12Å; I845-I893 HydrophobicContact CD1-CG2 4.14Å; I845-I893 HydrophobicContact CG1-CG2 4.06Å; I845-I893 HydrophobicContact CG2-CG2 3.89Å
846	Q	82.1	Confident	80.9	Confident	120 Å²	120	68.8 Å²	68.8	56%	0.561	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	-52.2	175.6	-67.2	-176.5	-15.3	0	0	110.9	H894 V896	Q846-H894 PolarHBondContact N-O 2.74Å; Q846-V896 HydrophobicContact CG-CG2 3.6Å
847	Y	85.5	Confident	80.7	Confident	96 Å²	96	72.6 Å²	72.6	38%	0.376	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	167.2	176.8	62.2	-86.9	0	0	0	109.9	E849 H894	Y847-E849 HydrophobicContact CD2-CG 3.94Å; Y847-E849 HydrophobicContact CE2-CG 3.73Å; Y847-E849 VanDerWaalsContact CE2-OE1 3.31Å; Y847-E849 WeakPolarHBondContact CE2-OE1 3.47Å; Y847-H894 HydrophobicContact CD1-CB 4.1Å; Y847-H894 HydrophobicContact CD2-CB 4.39Å; Y847-H894 AromaticContact CD2-CD2 3.8Å; Y847-H894 HydrophobicContact CE1-CB 3.87Å; Y847-H894 AromaticContact CE1-CG 3.93Å; Y847-H894 HydrophobicContact CE2-CB 4.18Å; Y847-H894 AromaticContact CE2-CD2 3.28Å; Y847-H894 WeakPolarHBondContact CE2-CD2 3.19Å; Y847-H894 AromaticContact CE2-CE1 3.96Å; Y847-H894 AromaticContact CE2-CG 3.56Å; Y847-H894 AromaticContact CE2-ND1 3.97Å; Y847-H894 AromaticContact CE2-NE2 3.6Å; Y847-H894 HydrophobicContact CG-CB 4.35Å; Y847-H894 AromaticContact CZ-CD2 3.68Å; Y847-H894 AromaticContact CZ-CE1 3.83Å; Y847-H894 AromaticContact CZ-CG 3.45Å; Y847-H894 VanDerWaalsContact CZ-CG 3.45Å; Y847-H894 AromaticContact CZ-ND1 3.56Å; Y847-H894 AromaticContact CZ-NE2 3.95Å; Y847-H894 WeakPolarHBondContact O-CB 3.29Å; Y847-H894 PolarHBondContact O-N 3.35Å; Y847-H894 PolarHBondContact OH-CE1 3.42Å; Y847-H894 PolarHBondContact OH-ND1 2.91Å
848	M	87.2	Confident	80.7	Confident	17 Å²	17	69.7 Å²	69.7	8%	0.084	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	147.8	173.4	-58.3	-176.4	-167.6	0	0	110.3	P836 I845 L866 N870 L891 Y892 I893	P836-M848 HydrophobicContact CB-CE 3.5Å; P836-M848 HydrophobicContact CG-CE 3.69Å; I845-M848 HydrophobicContact CD1-CE 3.73Å; I845-M848 HydrophobicContact CG2-CE 3.97Å; I845-M848 HydrophobicContact CG2-CG 4.12Å; M848-L866 HydrophobicContact CB-CD1 3.98Å; M848-N870 HydrophobicContact CB-CB 4.13Å; M848-N870 HydrophobicContact CG-CB 4.08Å; M848-N870 PolarHBondContact N-ND2 2.88Å; M848-N870 HydrophobicContact SD-CB 4.01Å; M848-L891 HydrophobicContact CB-CD1 4.25Å; M848-L891 HydrophobicContact SD-CD1 4.44Å; M848-Y892 CarbonylContact C-O 3.55Å; M848-Y892 VanDerWaalsContact CA-O 3.24Å; M848-Y892 WeakPolarHBondContact CA-O 3.46Å; M848-I893 HydrophobicContact CG-CG1 4.31Å; M848-I893 HydrophobicContact CG-CG2 4.49Å; M848-I893 HydrophobicContact SD-CG1 4.36Å
849	E	88.3	Confident	80.6	Confident	38 Å²	38	67.6 Å²	67.6	18%	0.178	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.7	172.8	-60.3	-180	176.5	0	0	110.1	Y847 R851 Y892	Y847-E849 HydrophobicContact CD2-CG 3.94Å; Y847-E849 HydrophobicContact CE2-CG 3.73Å; Y847-E849 VanDerWaalsContact CE2-OE1 3.31Å; Y847-E849 WeakPolarHBondContact CE2-OE1 3.47Å; E849-R851 IonicContact OE2-CZ 2.69Å; E849-R851 IonicContact OE2-NE 3.58Å; E849-R851 PolarHBondContact OE2-NE 3.19Å; E849-R851 VanDerWaalsContact OE2-NE 3.08Å; E849-R851 IonicContact OE2-NH2 2.66Å; E849-R851 PolarHBondContact OE2-NH2 3.16Å; E849-Y892 PolarHBondContact N-O 3.11Å; E849-Y892 PolarHBondContact O-N 3.11Å
850	L	90.6	Very high	80.6	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.021	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.9	171.8	-175.4	70.4	0	0	0	109.5	L858 I864 L866 L873 F889 F906	L850-L858 HydrophobicContact CD2-CB 4.29Å; L850-L858 HydrophobicContact CD2-CD1 3.79Å; L850-L858 HydrophobicContact CG-CB 4.48Å; L850-L858 HydrophobicContact CG-CD1 3.92Å; L850-L858 PolarHBondContact O-N 2.78Å; L850-I864 HydrophobicContact CD2-CG1 4.31Å; L850-I864 HydrophobicContact CD2-CG2 4.33Å; L850-L866 HydrophobicContact CB-CD1 3.96Å; L850-L866 HydrophobicContact CB-CG 4.01Å; L850-L873 HydrophobicContact CD1-CD1 3.89Å; L850-L873 HydrophobicContact CD2-CD1 3.56Å; L850-L873 HydrophobicContact CG-CD1 4.32Å; L850-F889 HydrophobicContact CD1-CB 4.23Å; L850-F906 HydrophobicContact CD1-CE1 3.84Å; L850-F906 HydrophobicContact CD1-CZ 3.68Å
851	R	87.4	Confident	80.5	Confident	66 Å²	66	70.4 Å²	70.4	25%	0.249	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149.9	179.5	-64.6	178.4	179.8	-116.4	5	111.7	E849 G855 L856 I857 F889 R890 Y892	E849-R851 IonicContact OE2-CZ 2.69Å; E849-R851 IonicContact OE2-NE 3.58Å; E849-R851 PolarHBondContact OE2-NE 3.19Å; E849-R851 VanDerWaalsContact OE2-NE 3.08Å; E849-R851 IonicContact OE2-NH2 2.66Å; E849-R851 PolarHBondContact OE2-NH2 3.16Å; R851-G855 PolarHBondContact NH1-O 3Å; R851-L856 CarbonylContact C-O 3.56Å; R851-L856 WeakPolarHBondContact CA-O 3.41Å; R851-I857 HydrophobicContact CG-CG1 4.16Å; R851-F889 WeakPolarHBondContact O-CA 3.49Å; R851-R890 PolarHBondContact N-O 3.39Å; R851-R890 PolarHBondContact O-N 3.11Å; R851-Y892 HydrophobicContact CB-CD2 4.36Å; R851-Y892 HydrophobicContact CB-CE2 4.14Å; R851-Y892 HydrophobicContact CG-CD2 4.17Å; R851-Y892 HydrophobicContact CG-CE2 4.22Å
852	D	83.6	Confident	80.9	Confident	26 Å²	26	67.9 Å²	67.9	14%	0.139	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	-177.9	173.4	72.6	6.3	0	0	0	113	Y854 G855 L856 L858 F889	D852-Y854 PolarHBondContact O-N 2.81Å; D852-Y854 VanDerWaalsContact OD1-C 3.28Å; D852-Y854 VanDerWaalsContact OD1-CA 3.32Å; D852-Y854 WeakPolarHBondContact OD1-CA 3.15Å; D852-Y854 WeakPolarHBondContact OD1-CB 3.2Å; D852-Y854 PolarHBondContact OD1-N 3.42Å; D852-G855 PolarHBondContact O-N 2.84Å; D852-G855 PolarHBondContact OD1-N 2.9Å; D852-L856 PolarHBondContact N-O 3.38Å; D852-L856 PolarHBondContact OD1-N 2.84Å; D852-L858 HydrophobicContact CB-CD2 4.21Å; D852-F889 HydrophobicContact CB-CD1 4.33Å; D852-F889 HydrophobicContact CB-CE1 4.29Å
853	A	71	Confident	81.4	Confident	38 Å²	38	65.6 Å²	65.6	31%	0.314	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-24.5	177.7	0	0	0	0	0	113.5	L888 R890	A853-L888 HydrophobicContact CB-CB 4.18Å; A853-L888 PolarHBondContact N-O 2.99Å; A853-L888 VanDerWaalsContact N-O 3.08Å; A853-R890 PolarHBondContact O-NH2 2.75Å
854	Y	67.8	Low	82	Confident	176 Å²	176	55.6 Å²	55.6	69%	0.69	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.3	180	-50.1	-73.9	0	0	0	112.3	D852 L856	D852-Y854 PolarHBondContact O-N 2.81Å; D852-Y854 VanDerWaalsContact OD1-C 3.28Å; D852-Y854 VanDerWaalsContact OD1-CA 3.32Å; D852-Y854 WeakPolarHBondContact OD1-CA 3.15Å; D852-Y854 WeakPolarHBondContact OD1-CB 3.2Å; D852-Y854 PolarHBondContact OD1-N 3.42Å; Y854-L856 VanDerWaalsContact C-N 3.35Å
855	G	66.9	Low	82.5	Confident	20 Å²	20	50.9 Å²	50.9	21%	0.206	26%	0.258	C	S	.	.			trans	82.4	6.6	179.1	0	0	0	0	0	115	R851 D852	R851-G855 PolarHBondContact NH1-O 3Å; D852-G855 PolarHBondContact O-N 2.84Å; D852-G855 PolarHBondContact OD1-N 2.9Å
856	L	73.5	Confident	82.8	Confident	113 Å²	113	50.3 Å²	50.3	59%	0.592	26%	0.256	S	S	*	.	P	Polyproline II helix	trans	-72.5	135.5	174.7	-65.6	169.3	0	0	0	109.9	R851 D852 Y854	R851-L856 CarbonylContact C-O 3.56Å; R851-L856 WeakPolarHBondContact CA-O 3.41Å; D852-L856 PolarHBondContact N-O 3.38Å; D852-L856 PolarHBondContact OD1-N 2.84Å; Y854-L856 VanDerWaalsContact C-N 3.35Å
857	I	78.7	Confident	83	Confident	94 Å²	94	45.6 Å²	45.6	48%	0.482	24%	0.235	S	C	.	.	B	Isolated β-bridge	trans	-72.1	131.5	175.6	-58.2	170.7	0	0	0	108.3	R851	R851-I857 HydrophobicContact CG-CG1 4.16Å
858	L	82.9	Confident	82.7	Confident	27 Å²	27	49.3 Å²	49.3	14%	0.141	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-89.7	126.5	179.1	-60.9	179	0	0	0	110.4	L850 D852 I864 F889	L850-L858 HydrophobicContact CD2-CB 4.29Å; L850-L858 HydrophobicContact CD2-CD1 3.79Å; L850-L858 HydrophobicContact CG-CB 4.48Å; L850-L858 HydrophobicContact CG-CD1 3.92Å; L850-L858 PolarHBondContact O-N 2.78Å; D852-L858 HydrophobicContact CB-CD2 4.21Å; L858-I864 HydrophobicContact CD1-CG2 3.73Å; L858-F889 HydrophobicContact CD1-CD1 3.51Å; L858-F889 HydrophobicContact CD1-CE1 3.34Å; L858-F889 HydrophobicContact CD1-CZ 4.36Å
859	D	79.7	Confident	82.4	Confident	43 Å²	43	53.7 Å²	53.7	23%	0.23	28%	0.284	C	S	.	.			trans	-120.2	-167.6	-178.1	59.8	32.4	0	0	0	111.5	S861 S862 P1680	D859-S861 PolarHBondContact O-N 2.9Å; D859-S861 VanDerWaalsContact O-N 3.11Å; D859-S861 WeakPolarHBondContact OD1-CA 3.13Å; D859-S861 VanDerWaalsContact OD1-CB 3.24Å; D859-S861 WeakPolarHBondContact OD1-CB 3.45Å; D859-S861 PolarHBondContact OD1-N 3.13Å; D859-S861 PolarHBondContact OD1-OG 2.67Å; D859-S862 VanDerWaalsContact O-CB 3.26Å; D859-S862 WeakPolarHBondContact O-CB 3.39Å; D859-S862 PolarHBondContact O-N 2.72Å; D859-P1680 HydrophobicContact CB-CG 3.78Å; D859-P1680 VanDerWaalsContact CG-CG 3.43Å; D859-P1680 WeakPolarHBondContact OD2-CD 3.38Å; D859-P1680 WeakPolarHBondContact OD2-CG 3.46Å
860	D	82	Confident	82.1	Confident	37 Å²	37	53.9 Å²	53.9	20%	0.198	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.5	-179.8	-167.7	53.7	0	0	0	114.2	S862 S955 L956 N957	D860-S862 VanDerWaalsContact C-N 3.34Å; D860-S955 CarbonylContact O-C 3.57Å; D860-S955 WeakPolarHBondContact O-CA 3.36Å; D860-S955 WeakPolarHBondContact OD2-CA 3.42Å; D860-S955 WeakPolarHBondContact OD2-CB 3.41Å; D860-S955 PolarHBondContact OD2-OG 2.86Å; D860-L956 PolarHBondContact O-N 2.8Å; D860-L956 WeakPolarHBondContact OD1-CB 3.31Å; D860-L956 PolarHBondContact OD1-N 2.85Å; D860-N957 VanDerWaalsContact OD1-CB 3.29Å; D860-N957 WeakPolarHBondContact OD1-CB 3.36Å; D860-N957 PolarHBondContact OD1-N 3.22Å
861	S	79.6	Confident	81.8	Confident	66 Å²	66	55.3 Å²	55.3	46%	0.462	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-19.5	173.7	75.8	0	0	0	0	113.1	D859	D859-S861 PolarHBondContact O-N 2.9Å; D859-S861 VanDerWaalsContact O-N 3.11Å; D859-S861 WeakPolarHBondContact OD1-CA 3.13Å; D859-S861 VanDerWaalsContact OD1-CB 3.24Å; D859-S861 WeakPolarHBondContact OD1-CB 3.45Å; D859-S861 PolarHBondContact OD1-N 3.13Å; D859-S861 PolarHBondContact OD1-OG 2.67Å
862	S	87.9	Confident	81.9	Confident	16 Å²	16	54.5 Å²	54.5	11%	0.112	30%	0.296	C	S	.	.	S	Bend	trans	-74	161.1	175.3	179.5	0	0	0	0	111.4	D859 D860 I864 L956 R959	D859-S862 VanDerWaalsContact O-CB 3.26Å; D859-S862 WeakPolarHBondContact O-CB 3.39Å; D859-S862 PolarHBondContact O-N 2.72Å; D860-S862 VanDerWaalsContact C-N 3.34Å; S862-I864 WeakPolarHBondContact CB-O 3.27Å; S862-I864 PolarHBondContact OG-N 3.47Å; S862-I864 PolarHBondContact OG-O 3.22Å; S862-L956 WeakPolarHBondContact O-CB 3.31Å; S862-R959 PolarHBondContact O-NH2 2.76Å
863	W	90.1	Very high	82.3	Confident	13 Å²	13	53.3 Å²	53.3	5%	0.049	29%	0.29	C	S	.	.	S	Bend	trans	-80.4	-6	170.9	64.4	-88.3	0	0	0	113.3	V824 F830 G875 L876 P877 H881 Y887 F889 V908 V910	V824-W863 HydrophobicContact CG2-CH2 4.34Å; V824-W863 HydrophobicContact CG2-CZ3 4.12Å; F830-W863 HydrophobicContact CE1-CE3 4.28Å; F830-W863 AromaticContact CE1-CZ3 3.81Å; F830-W863 HydrophobicContact CE1-CZ3 3.81Å; F830-W863 HydrophobicContact CZ-CZ3 4.02Å; W863-G875 CarbonylContact O-C 3.58Å; W863-G875 WeakPolarHBondContact O-CA 3.26Å; W863-L876 PolarHBondContact O-N 3.12Å; W863-P877 HydrophobicContact CD2-CB 4.08Å; W863-P877 HydrophobicContact CE3-CB 3.57Å; W863-P877 HydrophobicContact CE3-CG 4.01Å; W863-P877 HydrophobicContact CZ3-CB 3.95Å; W863-P877 HydrophobicContact CZ3-CG 4.08Å; W863-H881 AromaticContact CD1-CD2 3.15Å; W863-H881 AromaticContact CD1-CG 3.79Å; W863-H881 AromaticContact CD1-NE2 3.63Å; W863-H881 AromaticContact CG-CD2 3.68Å; W863-H881 AromaticContact CG-CG 3.97Å; W863-H881 AromaticContact CG-NE2 3.95Å; W863-H881 AromaticContact NE1-CD2 3.83Å; W863-Y887 HydrophobicContact CZ2-CD1 4.27Å; W863-Y887 AromaticContact CZ2-CD2 3.86Å; W863-Y887 HydrophobicContact CZ2-CD2 3.86Å; W863-Y887 HydrophobicContact CZ2-CE1 4.49Å; W863-Y887 HydrophobicContact CZ2-CE2 4.09Å; W863-Y887 AromaticContact CZ2-CG 3.96Å; W863-Y887 HydrophobicContact CZ2-CG 3.96Å; W863-F889 HydrophobicContact CH2-CE2 4.13Å; W863-F889 HydrophobicContact CH2-CZ 4.38Å; W863-F889 AromaticContact CZ2-CE2 3.89Å; W863-F889 HydrophobicContact CZ2-CE2 3.89Å; W863-F889 AromaticContact CZ2-CZ 3.73Å; W863-F889 HydrophobicContact CZ2-CZ 3.73Å; W863-V908 HydrophobicContact CH2-CB 4.35Å; W863-V908 HydrophobicContact CH2-CG1 3.8Å; W863-V908 HydrophobicContact CZ3-CG1 4.44Å; W863-V910 HydrophobicContact CH2-CG2 3.58Å; W863-V910 HydrophobicContact CZ2-CG2 3.85Å; W863-V910 HydrophobicContact CZ3-CG2 4.2Å
864	I	93.3	Very high	83.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	136.2	-177.7	-165.8	170.7	0	0	0	110.4	F830 L850 L858 S862 L873 I874 F889 V908	F830-I864 HydrophobicContact CE2-CD1 4.37Å; F830-I864 HydrophobicContact CZ-CD1 3.75Å; F830-I864 HydrophobicContact CZ-CG1 3.92Å; L850-I864 HydrophobicContact CD2-CG1 4.31Å; L850-I864 HydrophobicContact CD2-CG2 4.33Å; L858-I864 HydrophobicContact CD1-CG2 3.73Å; S862-I864 WeakPolarHBondContact CB-O 3.27Å; S862-I864 PolarHBondContact OG-N 3.47Å; S862-I864 PolarHBondContact OG-O 3.22Å; I864-L873 HydrophobicContact CD1-CD1 4.44Å; I864-L873 HydrophobicContact CD1-CD2 3.41Å; I864-L873 VanDerWaalsContact CD1-CD2 3.41Å; I864-L873 HydrophobicContact CD1-CG 3.97Å; I864-L873 HydrophobicContact CG1-CD1 4.29Å; I864-L873 HydrophobicContact CG1-CD2 3.9Å; I864-L873 HydrophobicContact CG1-CG 3.86Å; I864-I874 CarbonylContact C-O 3.57Å; I864-I874 WeakPolarHBondContact CA-O 3.42Å; I864-F889 HydrophobicContact CD1-CD2 4.37Å; I864-F889 HydrophobicContact CD1-CE2 4.02Å; I864-F889 HydrophobicContact CG2-CE1 3.98Å; I864-F889 HydrophobicContact CG2-CE2 4.23Å; I864-F889 HydrophobicContact CG2-CZ 3.7Å; I864-V908 HydrophobicContact CD1-CG2 4.5Å
865	S	92.2	Very high	84.4	Confident	25 Å²	25	44.5 Å²	44.5	18%	0.175	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	169.7	179.7	-175.6	0	0	0	0	111.1	I874	S865-I874 PolarHBondContact N-O 3.39Å; S865-I874 PolarHBondContact O-N 3.06Å; S865-I874 VanDerWaalsContact O-O 3.12Å
866	L	89.3	Confident	85.5	Confident	22 Å²	22	43.6 Å²	43.6	12%	0.115	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	150.8	165.8	-67.8	165.2	0	0	0	110.6	I834 M848 L850 L873 L891	I834-L866 HydrophobicContact CD1-CD2 3.36Å; M848-L866 HydrophobicContact CB-CD1 3.98Å; L850-L866 HydrophobicContact CB-CD1 3.96Å; L850-L866 HydrophobicContact CB-CG 4.01Å; L866-L873 HydrophobicContact CD2-CD1 4.16Å; L866-L891 HydrophobicContact CD1-CD1 4.18Å; L866-L891 HydrophobicContact CD2-CD1 4.01Å
867	T	86.5	Confident	86.3	Confident	21 Å²	21	38.2 Å²	38.2	13%	0.129	21%	0.211	C	C	.	.			trans	-70.2	159.2	166.6	51.7	0	0	0	0	111.1	D869 N870 S871 H872 I874	T867-D869 WeakPolarHBondContact CB-OD1 3.35Å; T867-D869 PolarHBondContact O-N 3.36Å; T867-D869 VanDerWaalsContact O-N 3.11Å; T867-D869 PolarHBondContact OG1-OD1 3.15Å; T867-N870 WeakPolarHBondContact O-CA 3.38Å; T867-N870 PolarHBondContact O-N 2.97Å; T867-N870 PolarHBondContact O-OD1 2.94Å; T867-S871 PolarHBondContact OG1-N 3.48Å; T867-H872 HydrophobicContact CG2-CB 3.93Å; T867-H872 PolarHBondContact N-O 2.63Å; T867-H872 PolarHBondContact OG1-N 3.39Å; T867-H872 VanDerWaalsContact OG1-N 3.15Å; T867-H872 PolarHBondContact OG1-O 2.82Å; T867-I874 HydrophobicContact CG2-CB 4.46Å; T867-I874 HydrophobicContact CG2-CD1 4.27Å; T867-I874 HydrophobicContact CG2-CG1 4.17Å; T867-I874 HydrophobicContact CG2-CG2 3.55Å
868	L	78.6	Confident	86.8	Confident	174 Å²	174	34 Å²	34	91%	0.911	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.5	179.8	-79.7	155.3	0	0	0	113.9
869	D	80.4	Confident	86.6	Confident	108 Å²	108	35.4 Å²	35.4	58%	0.578	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	3.5	177.8	65.3	-23	0	0	0	113.5	T867 S871	T867-D869 WeakPolarHBondContact CB-OD1 3.35Å; T867-D869 PolarHBondContact O-N 3.36Å; T867-D869 VanDerWaalsContact O-N 3.11Å; T867-D869 PolarHBondContact OG1-OD1 3.15Å; D869-S871 PolarHBondContact O-N 3.12Å; D869-S871 PolarHBondContact OD1-OG 3.4Å; D869-S871 VanDerWaalsContact OD1-OG 3.09Å; D869-S871 WeakPolarHBondContact OD2-CB 3.36Å; D869-S871 PolarHBondContact OD2-OG 2.83Å
870	N	82.5	Confident	86.6	Confident	43 Å²	43	40.6 Å²	40.6	23%	0.23	22%	0.22	C	C	.	.	S	Bend	trans	55.3	14.9	-177.4	-63.7	-33.2	0	0	0	115.3	M848 T867	M848-N870 HydrophobicContact CB-CB 4.13Å; M848-N870 HydrophobicContact CG-CB 4.08Å; M848-N870 PolarHBondContact N-ND2 2.88Å; M848-N870 HydrophobicContact SD-CB 4.01Å; T867-N870 WeakPolarHBondContact O-CA 3.38Å; T867-N870 PolarHBondContact O-N 2.97Å; T867-N870 PolarHBondContact O-OD1 2.94Å
871	S	83.4	Confident	86.9	Confident	34 Å²	34	40.2 Å²	40.2	24%	0.238	22%	0.217	C	C	.	.	S	Bend	trans	-87.5	-22.3	-175.6	69.3	0	0	0	0	113.2	I834 T867 D869	I834-S871 PolarHBondContact N-O 3.48Å; T867-S871 PolarHBondContact OG1-N 3.48Å; D869-S871 PolarHBondContact O-N 3.12Å; D869-S871 PolarHBondContact OD1-OG 3.4Å; D869-S871 VanDerWaalsContact OD1-OG 3.09Å; D869-S871 WeakPolarHBondContact OD2-CB 3.36Å; D869-S871 PolarHBondContact OD2-OG 2.83Å
872	H	89.8	Confident	86.9	Confident	49 Å²	49	39.6 Å²	39.6	23%	0.227	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	149.5	-178.6	-62	77.6	0	0	0	112	K831 K832 S833 T867	K831-H872 HydrophobicContact CD-CB 4.35Å; K831-H872 WeakPolarHBondContact CE-CD2 3.19Å; K831-H872 WeakPolarHBondContact CE-ND1 3.33Å; K831-H872 HydrophobicContact CG-CB 3.8Å; K832-H872 CarbonylContact O-C 3.54Å; K832-H872 VanDerWaalsContact O-CA 3.25Å; K832-H872 WeakPolarHBondContact O-CA 3.42Å; S833-H872 VanDerWaalsContact CA-CD2 3.45Å; S833-H872 WeakPolarHBondContact CA-CD2 3.37Å; T867-H872 HydrophobicContact CG2-CB 3.93Å; T867-H872 PolarHBondContact N-O 2.63Å; T867-H872 PolarHBondContact OG1-N 3.39Å; T867-H872 VanDerWaalsContact OG1-N 3.15Å; T867-H872 PolarHBondContact OG1-O 2.82Å
873	L	91.7	Very high	86.6	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	130.7	162.3	-156.5	82.5	0	0	0	108.6	F822 F830 K831 K832 I834 L850 I864 L866 F906	F822-L873 HydrophobicContact CE1-CD2 4.18Å; F822-L873 HydrophobicContact CZ-CD2 3.64Å; F830-L873 HydrophobicContact CE2-CD2 4.12Å; K831-L873 CarbonylContact C-O 3.55Å; K831-L873 WeakPolarHBondContact CA-O 3.38Å; K832-L873 HydrophobicContact CB-CB 4.24Å; K832-L873 PolarHBondContact N-O 2.56Å; K832-L873 PolarHBondContact O-N 3.28Å; I834-L873 HydrophobicContact CD1-CB 4.46Å; L850-L873 HydrophobicContact CD1-CD1 3.89Å; L850-L873 HydrophobicContact CD2-CD1 3.56Å; L850-L873 HydrophobicContact CG-CD1 4.32Å; I864-L873 HydrophobicContact CD1-CD1 4.44Å; I864-L873 HydrophobicContact CD1-CD2 3.41Å; I864-L873 VanDerWaalsContact CD1-CD2 3.41Å; I864-L873 HydrophobicContact CD1-CG 3.97Å; I864-L873 HydrophobicContact CG1-CD1 4.29Å; I864-L873 HydrophobicContact CG1-CD2 3.9Å; I864-L873 HydrophobicContact CG1-CG 3.86Å; L866-L873 HydrophobicContact CD2-CD1 4.16Å; L873-F906 HydrophobicContact CD1-CZ 4.16Å; L873-F906 HydrophobicContact CD2-CE2 3.8Å; L873-F906 HydrophobicContact CD2-CZ 3.92Å
874	I	91	Very high	85.7	Confident	29 Å²	29	52.8 Å²	52.8	15%	0.149	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147.6	174.1	54.2	165.3	0	0	0	110.3	F830 K831 I864 S865 T867 W960	F830-I874 WeakPolarHBondContact O-CA 3.38Å; K831-I874 HydrophobicContact CB-CG2 4.3Å; K831-I874 HydrophobicContact CG-CG2 4.01Å; I864-I874 CarbonylContact C-O 3.57Å; I864-I874 WeakPolarHBondContact CA-O 3.42Å; S865-I874 PolarHBondContact N-O 3.39Å; S865-I874 PolarHBondContact O-N 3.06Å; S865-I874 VanDerWaalsContact O-O 3.12Å; T867-I874 HydrophobicContact CG2-CB 4.46Å; T867-I874 HydrophobicContact CG2-CD1 4.27Å; T867-I874 HydrophobicContact CG2-CG1 4.17Å; T867-I874 HydrophobicContact CG2-CG2 3.55Å; I874-W960 HydrophobicContact CB-CE3 4.32Å; I874-W960 HydrophobicContact CB-CH2 4.11Å; I874-W960 HydrophobicContact CB-CZ3 3.88Å; I874-W960 HydrophobicContact CG2-CH2 3.79Å; I874-W960 HydrophobicContact CG2-CZ2 4.18Å; I874-W960 HydrophobicContact CG2-CZ3 4.1Å
875	G	91.4	Very high	84.7	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.6	159.3	174.4	0	0	0	0	0	113.8	R829 F830 W863	R829-G875 WeakPolarHBondContact CA-O 3.47Å; F830-G875 WeakPolarHBondContact CD1-O 3.35Å; F830-G875 PolarHBondContact N-O 2.77Å; F830-G875 PolarHBondContact O-N 3.25Å; W863-G875 CarbonylContact O-C 3.58Å; W863-G875 WeakPolarHBondContact O-CA 3.26Å
876	L	91.3	Very high	84.1	Confident	0 Å²	0	61 Å²	61	0%	0	30%	0.302	C	S	.	.			trans	-138.2	85.2	170.7	-176.2	77.4	0	0	0	108.4	L828 R829 W863 L878 L956 R959 I984	L828-L876 VanDerWaalsContact C-CD1 3.48Å; R829-L876 HydrophobicContact CB-CD1 3.88Å; R829-L876 VanDerWaalsContact N-CD1 3.28Å; W863-L876 PolarHBondContact O-N 3.12Å; L876-L878 HydrophobicContact CD2-CD2 4.25Å; L876-L878 HydrophobicContact CG-CD2 4.47Å; L876-L878 PolarHBondContact O-N 3.49Å; L876-L956 HydrophobicContact CB-CD1 4.11Å; L876-R959 HydrophobicContact CD2-CB 3.73Å; L876-I984 HydrophobicContact CD2-CD1 4.24Å
877	P	91	Very high	84	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.303	C	S	.	.			trans	-67.4	127.9	176	23.9	-26.4	0	0	0	109.3	V824 A826 G827 F830 W863 H881 V910	V824-P877 HydrophobicContact CB-CG 4.42Å; V824-P877 HydrophobicContact CG2-CG 3.88Å; A826-P877 CarbonylContact C-O 3.57Å; A826-P877 WeakPolarHBondContact CA-O 3.27Å; G827-P877 PolarHBondContact N-O 3.28Å; F830-P877 HydrophobicContact CE1-CG 4.49Å; W863-P877 HydrophobicContact CD2-CB 4.08Å; W863-P877 HydrophobicContact CE3-CB 3.57Å; W863-P877 HydrophobicContact CE3-CG 4.01Å; W863-P877 HydrophobicContact CZ3-CB 3.95Å; W863-P877 HydrophobicContact CZ3-CG 4.08Å; P877-H881 HydrophobicContact CB-CB 4.29Å; P877-V910 HydrophobicContact CB-CG1 3.78Å; P877-V910 HydrophobicContact CB-CG2 4.38Å; P877-V910 HydrophobicContact CG-CG1 4.26Å
878	L	87.5	Confident	83.9	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.037	31%	0.31	C	S	.	.			trans	-92.2	173.3	170.8	-58.9	177.6	0	0	0	111.7	L876 E880 H881 I984	L876-L878 HydrophobicContact CD2-CD2 4.25Å; L876-L878 HydrophobicContact CG-CD2 4.47Å; L876-L878 PolarHBondContact O-N 3.49Å; L878-E880 HydrophobicContact CB-CG 4.46Å; L878-E880 PolarHBondContact O-N 2.86Å; L878-E880 VanDerWaalsContact O-N 3.1Å; L878-H881 PolarHBondContact N-ND1 3.01Å; L878-H881 WeakPolarHBondContact O-CB 3.32Å; L878-H881 PolarHBondContact O-N 2.8Å; L878-H881 PolarHBondContact O-ND1 3.39Å; L878-I984 HydrophobicContact CD2-CG2 4.23Å
879	N	79	Confident	84.5	Confident	55 Å²	55	55.1 Å²	55.1	29%	0.294	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-51.9	-34.6	-179	-170.7	11.6	0	0	0	114.1	H881 I882 W985	N879-H881 PolarHBondContact O-N 3.24Å; N879-I882 HydrophobicContact CB-CD1 4.47Å; N879-I882 WeakPolarHBondContact O-CD1 3.41Å; N879-I882 PolarHBondContact O-N 3.16Å; N879-I882 VanDerWaalsContact OD1-CD1 3.3Å; N879-I882 WeakPolarHBondContact OD1-CD1 2.98Å; N879-W985 PolarHBondContact ND2-NE1 3.23Å
880	E	81	Confident	84.8	Confident	153 Å²	153	52.8 Å²	52.8	72%	0.715	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-67	-15.7	177.4	68	-165.8	161.3	0	0	114.8	L878	L878-E880 HydrophobicContact CB-CG 4.46Å; L878-E880 PolarHBondContact O-N 2.86Å; L878-E880 VanDerWaalsContact O-N 3.1Å
881	H	87.1	Confident	85.2	Confident	29 Å²	29	50.7 Å²	50.7	13%	0.134	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-92.2	-5.6	-179.2	-53	94.2	0	0	0	113	W863 P877 L878 N879 R883 Y887	W863-H881 AromaticContact CD1-CD2 3.15Å; W863-H881 AromaticContact CD1-CG 3.79Å; W863-H881 AromaticContact CD1-NE2 3.63Å; W863-H881 AromaticContact CG-CD2 3.68Å; W863-H881 AromaticContact CG-CG 3.97Å; W863-H881 AromaticContact CG-NE2 3.95Å; W863-H881 AromaticContact NE1-CD2 3.83Å; P877-H881 HydrophobicContact CB-CB 4.29Å; L878-H881 PolarHBondContact N-ND1 3.01Å; L878-H881 WeakPolarHBondContact O-CB 3.32Å; L878-H881 PolarHBondContact O-N 2.8Å; L878-H881 PolarHBondContact O-ND1 3.39Å; N879-H881 PolarHBondContact O-N 3.24Å; H881-R883 PolarHBondContact O-N 2.9Å; H881-Y887 VanDerWaalsContact O-CE2 3.27Å; H881-Y887 WeakPolarHBondContact O-CE2 3.24Å; H881-Y887 PolarHBondContact O-OH 2.91Å
882	I	80.9	Confident	85.5	Confident	53 Å²	53	51.1 Å²	51.1	27%	0.272	24%	0.236	S	C	.	.			trans	-68.7	132.5	178.4	-63.8	158.3	0	0	0	109.4	A826 N879 V910 D912	A826-I882 HydrophobicContact CB-CD1 3.67Å; A826-I882 HydrophobicContact CB-CG1 3.59Å; N879-I882 HydrophobicContact CB-CD1 4.47Å; N879-I882 WeakPolarHBondContact O-CD1 3.41Å; N879-I882 PolarHBondContact O-N 3.16Å; N879-I882 VanDerWaalsContact OD1-CD1 3.3Å; N879-I882 WeakPolarHBondContact OD1-CD1 2.98Å; I882-V910 HydrophobicContact CG1-CG1 4.17Å; I882-D912 HydrophobicContact CD1-CB 3.6Å; I882-D912 HydrophobicContact CG1-CB 4.29Å; I882-D912 HydrophobicContact CG2-CB 4.24Å
883	R	80.3	Confident	85.3	Confident	94 Å²	94	48.8 Å²	48.8	36%	0.355	23%	0.226	S	C	.	.			trans	-154.9	156.6	175.5	58.7	176.9	-153.7	-177.5	19.4	111	H881 Q885 P886 Y887	H881-R883 PolarHBondContact O-N 2.9Å; R883-Q885 VanDerWaalsContact C-N 3.32Å; R883-Q885 WeakPolarHBondContact CD-O 3.31Å; R883-Q885 VanDerWaalsContact CG-O 3.26Å; R883-Q885 WeakPolarHBondContact CG-O 3.32Å; R883-Q885 PolarHBondContact NE-O 3.01Å; R883-Q885 PolarHBondContact O-N 2.78Å; R883-P886 PolarHBondContact NH2-O 2.88Å; R883-Y887 VanDerWaalsContact CD-CZ 3.42Å; R883-Y887 HydrophobicContact CG-CD2 4.34Å; R883-Y887 HydrophobicContact CG-CE2 3.6Å; R883-Y887 VanDerWaalsContact CZ-CE1 3.41Å; R883-Y887 VanDerWaalsContact NE-CE2 3.34Å; R883-Y887 VanDerWaalsContact NH1-CD1 3.34Å
884	K	71.4	Confident	85.1	Confident	212 Å²	212	50.3 Å²	50.3	92%	0.922	23%	0.233	S	C	*	.	S	Bend	trans	-69.3	-26	-178.9	-67.6	-173.5	178	-176.6	0	114.1
885	Q	72.6	Confident	84.7	Confident	137 Å²	137	49.2 Å²	49.2	64%	0.64	23%	0.228	S	C	*	.	S	Bend	trans	-102.3	135.6	-177.9	-69.6	178.8	-15.9	0	0	110.3	R883	R883-Q885 VanDerWaalsContact C-N 3.32Å; R883-Q885 WeakPolarHBondContact CD-O 3.31Å; R883-Q885 VanDerWaalsContact CG-O 3.26Å; R883-Q885 WeakPolarHBondContact CG-O 3.32Å; R883-Q885 PolarHBondContact NE-O 3.01Å; R883-Q885 PolarHBondContact O-N 2.78Å
886	P	79.9	Confident	84.1	Confident	59 Å²	59	53.5 Å²	53.5	38%	0.383	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-64.6	150.4	-179.4	28.7	-35.4	0	0	0	111.7	R883 E909	R883-P886 PolarHBondContact NH2-O 2.88Å; P886-E909 HydrophobicContact CB-CB 4.36Å
887	Y	86.7	Confident	83.2	Confident	37 Å²	37	58.1 Å²	58.1	15%	0.145	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125	171.2	-69.5	-95.8	0	0	0	110.2	W863 H881 R883 F889 T907 V908 V910	W863-Y887 HydrophobicContact CZ2-CD1 4.27Å; W863-Y887 AromaticContact CZ2-CD2 3.86Å; W863-Y887 HydrophobicContact CZ2-CD2 3.86Å; W863-Y887 HydrophobicContact CZ2-CE1 4.49Å; W863-Y887 HydrophobicContact CZ2-CE2 4.09Å; W863-Y887 AromaticContact CZ2-CG 3.96Å; W863-Y887 HydrophobicContact CZ2-CG 3.96Å; H881-Y887 VanDerWaalsContact O-CE2 3.27Å; H881-Y887 WeakPolarHBondContact O-CE2 3.24Å; H881-Y887 PolarHBondContact O-OH 2.91Å; R883-Y887 VanDerWaalsContact CD-CZ 3.42Å; R883-Y887 HydrophobicContact CG-CD2 4.34Å; R883-Y887 HydrophobicContact CG-CE2 3.6Å; R883-Y887 VanDerWaalsContact CZ-CE1 3.41Å; R883-Y887 VanDerWaalsContact NE-CE2 3.34Å; R883-Y887 VanDerWaalsContact NH1-CD1 3.34Å; Y887-F889 HydrophobicContact CD1-CZ 4.07Å; Y887-F889 HydrophobicContact CG-CE2 4.16Å; Y887-F889 HydrophobicContact CG-CZ 4.08Å; Y887-T907 CarbonylContact O-C 3.51Å; Y887-T907 WeakPolarHBondContact O-CA 3.42Å; Y887-V908 PolarHBondContact N-O 2.94Å; Y887-V908 PolarHBondContact O-N 2.95Å; Y887-V910 HydrophobicContact CD2-CG2 3.7Å; Y887-V910 HydrophobicContact CE2-CB 4.18Å; Y887-V910 HydrophobicContact CE2-CG2 3.57Å
888	L	84.7	Confident	81.9	Confident	52 Å²	52	62.2 Å²	62.2	27%	0.272	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	122.2	170.6	178.8	66.8	0	0	0	108.6	F814 A853 T907	F814-L888 HydrophobicContact CE1-CD1 4.26Å; F814-L888 HydrophobicContact CZ-CD1 3.93Å; A853-L888 HydrophobicContact CB-CB 4.18Å; A853-L888 PolarHBondContact N-O 2.99Å; A853-L888 VanDerWaalsContact N-O 3.08Å; L888-T907 HydrophobicContact CD1-CG2 3.91Å
889	F	91.3	Very high	80.9	Confident	6 Å²	6	68.7 Å²	68.7	3%	0.026	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	156.8	174.9	-65	-67.3	0	0	0	110.4	L850 R851 D852 L858 W863 I864 Y887 G905 F906 V908	L850-F889 HydrophobicContact CD1-CB 4.23Å; R851-F889 WeakPolarHBondContact O-CA 3.49Å; D852-F889 HydrophobicContact CB-CD1 4.33Å; D852-F889 HydrophobicContact CB-CE1 4.29Å; L858-F889 HydrophobicContact CD1-CD1 3.51Å; L858-F889 HydrophobicContact CD1-CE1 3.34Å; L858-F889 HydrophobicContact CD1-CZ 4.36Å; W863-F889 HydrophobicContact CH2-CE2 4.13Å; W863-F889 HydrophobicContact CH2-CZ 4.38Å; W863-F889 AromaticContact CZ2-CE2 3.89Å; W863-F889 HydrophobicContact CZ2-CE2 3.89Å; W863-F889 AromaticContact CZ2-CZ 3.73Å; W863-F889 HydrophobicContact CZ2-CZ 3.73Å; I864-F889 HydrophobicContact CD1-CD2 4.37Å; I864-F889 HydrophobicContact CD1-CE2 4.02Å; I864-F889 HydrophobicContact CG2-CE1 3.98Å; I864-F889 HydrophobicContact CG2-CE2 4.23Å; I864-F889 HydrophobicContact CG2-CZ 3.7Å; Y887-F889 HydrophobicContact CD1-CZ 4.07Å; Y887-F889 HydrophobicContact CG-CE2 4.16Å; Y887-F889 HydrophobicContact CG-CZ 4.08Å; F889-G905 WeakPolarHBondContact O-CA 3.31Å; F889-F906 HydrophobicContact CB-CD1 4.26Å; F889-F906 HydrophobicContact CB-CD2 4.41Å; F889-F906 HydrophobicContact CB-CE1 3.68Å; F889-F906 HydrophobicContact CB-CE2 3.87Å; F889-F906 HydrophobicContact CB-CZ 3.49Å; F889-F906 VanDerWaalsContact CB-CZ 3.49Å; F889-F906 AromaticContact CD2-CE2 3.98Å; F889-F906 HydrophobicContact CD2-CE2 3.98Å; F889-F906 HydrophobicContact CD2-CZ 4.3Å; F889-F906 HydrophobicContact CG-CE2 4.33Å; F889-F906 HydrophobicContact CG-CZ 4.21Å; F889-F906 PolarHBondContact N-O 3.26Å; F889-F906 PolarHBondContact O-N 2.86Å; F889-V908 HydrophobicContact CD2-CB 4.26Å; F889-V908 HydrophobicContact CD2-CG2 3.77Å; F889-V908 HydrophobicContact CE2-CB 4.05Å; F889-V908 HydrophobicContact CE2-CG2 3.97Å
890	R	87.1	Confident	80.3	Confident	58 Å²	58	69.8 Å²	69.8	22%	0.219	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	121.1	179.3	-60.8	176.3	-171.6	159.1	7.2	108.8	R851 A853 Y892 T903 I904	R851-R890 PolarHBondContact N-O 3.39Å; R851-R890 PolarHBondContact O-N 3.11Å; A853-R890 PolarHBondContact O-NH2 2.75Å; R890-Y892 HydrophobicContact CB-CD2 4.16Å; R890-Y892 HydrophobicContact CB-CE2 3.6Å; R890-T903 HydrophobicContact CB-CG2 4.21Å; R890-I904 CarbonylContact C-O 3.5Å; R890-I904 WeakPolarHBondContact CA-O 3.4Å
891	L	90.9	Very high	80.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	119.3	172	-179	69	0	0	0	108.8	I834 M848 L866 I893 T903 I904 F906	I834-L891 HydrophobicContact CD1-CD1 4.49Å; I834-L891 HydrophobicContact CD1-CD2 4.35Å; I834-L891 HydrophobicContact CG2-CD2 3.66Å; M848-L891 HydrophobicContact CB-CD1 4.25Å; M848-L891 HydrophobicContact SD-CD1 4.44Å; L866-L891 HydrophobicContact CD1-CD1 4.18Å; L866-L891 HydrophobicContact CD2-CD1 4.01Å; L891-I893 HydrophobicContact CD2-CD1 4.3Å; L891-I893 HydrophobicContact CD2-CG1 4.28Å; L891-I893 HydrophobicContact CG-CG1 4.21Å; L891-T903 WeakPolarHBondContact O-CA 3.28Å; L891-I904 HydrophobicContact CB-CB 4.43Å; L891-I904 PolarHBondContact N-O 3.12Å; L891-I904 PolarHBondContact O-N 3.23Å; L891-F906 HydrophobicContact CB-CE1 4.29Å
892	Y	88	Confident	80	Confident	42 Å²	42	63.9 Å²	63.9	17%	0.165	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	116.8	176.8	-75.4	-105.5	0	0	0	109	M848 E849 R851 R890 P901 I902 T903	M848-Y892 CarbonylContact C-O 3.55Å; M848-Y892 VanDerWaalsContact CA-O 3.24Å; M848-Y892 WeakPolarHBondContact CA-O 3.46Å; E849-Y892 PolarHBondContact N-O 3.11Å; E849-Y892 PolarHBondContact O-N 3.11Å; R851-Y892 HydrophobicContact CB-CD2 4.36Å; R851-Y892 HydrophobicContact CB-CE2 4.14Å; R851-Y892 HydrophobicContact CG-CD2 4.17Å; R851-Y892 HydrophobicContact CG-CE2 4.22Å; R890-Y892 HydrophobicContact CB-CD2 4.16Å; R890-Y892 HydrophobicContact CB-CE2 3.6Å; Y892-P901 HydrophobicContact CD1-CB 3.98Å; Y892-P901 HydrophobicContact CD1-CG 3.63Å; Y892-P901 HydrophobicContact CE1-CG 4.28Å; Y892-I902 WeakPolarHBondContact CA-O 3.37Å; Y892-T903 HydrophobicContact CD2-CG2 4.36Å; Y892-T903 HydrophobicContact CE1-CG2 4.06Å; Y892-T903 WeakPolarHBondContact CE1-OG1 3.41Å; Y892-T903 HydrophobicContact CE2-CG2 3.9Å
893	I	87.6	Confident	80.2	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	111.1	177.9	-54.7	177.8	0	0	0	108.4	P836 I845 M848 L891 P901 I902 I904	P836-I893 HydrophobicContact CB-CD1 4.22Å; I845-I893 HydrophobicContact CD1-CG2 4.14Å; I845-I893 HydrophobicContact CG1-CG2 4.06Å; I845-I893 HydrophobicContact CG2-CG2 3.89Å; M848-I893 HydrophobicContact CG-CG1 4.31Å; M848-I893 HydrophobicContact CG-CG2 4.49Å; M848-I893 HydrophobicContact SD-CG1 4.36Å; L891-I893 HydrophobicContact CD2-CD1 4.3Å; L891-I893 HydrophobicContact CD2-CG1 4.28Å; L891-I893 HydrophobicContact CG-CG1 4.21Å; I893-P901 CarbonylContact O-C 3.59Å; I893-P901 WeakPolarHBondContact O-CA 3.43Å; I893-I902 HydrophobicContact CB-CB 4.31Å; I893-I902 PolarHBondContact N-O 3.03Å; I893-I902 PolarHBondContact O-N 3.09Å; I893-I904 HydrophobicContact CD1-CD1 3.73Å
894	H	86.4	Confident	80.4	Confident	33 Å²	33	58.2 Å²	58.2	15%	0.153	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	114.4	177.9	-67.1	-103.2	0	0	0	109.3	Q846 Y847	Q846-H894 PolarHBondContact N-O 2.74Å; Y847-H894 HydrophobicContact CD1-CB 4.1Å; Y847-H894 HydrophobicContact CD2-CB 4.39Å; Y847-H894 AromaticContact CD2-CD2 3.8Å; Y847-H894 HydrophobicContact CE1-CB 3.87Å; Y847-H894 AromaticContact CE1-CG 3.93Å; Y847-H894 HydrophobicContact CE2-CB 4.18Å; Y847-H894 AromaticContact CE2-CD2 3.28Å; Y847-H894 WeakPolarHBondContact CE2-CD2 3.19Å; Y847-H894 AromaticContact CE2-CE1 3.96Å; Y847-H894 AromaticContact CE2-CG 3.56Å; Y847-H894 AromaticContact CE2-ND1 3.97Å; Y847-H894 AromaticContact CE2-NE2 3.6Å; Y847-H894 HydrophobicContact CG-CB 4.35Å; Y847-H894 AromaticContact CZ-CD2 3.68Å; Y847-H894 AromaticContact CZ-CE1 3.83Å; Y847-H894 AromaticContact CZ-CG 3.45Å; Y847-H894 VanDerWaalsContact CZ-CG 3.45Å; Y847-H894 AromaticContact CZ-ND1 3.56Å; Y847-H894 AromaticContact CZ-NE2 3.95Å; Y847-H894 WeakPolarHBondContact O-CB 3.29Å; Y847-H894 PolarHBondContact O-N 3.35Å; Y847-H894 PolarHBondContact OH-CE1 3.42Å; Y847-H894 PolarHBondContact OH-ND1 2.91Å
895	S	82.4	Confident	81	Confident	6 Å²	6	48.1 Å²	48.1	4%	0.042	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	146.9	179.8	172.1	0	0	0	0	110.8	R844 D897 Q898	R844-S895 CarbonylContact O-C 3.48Å; R844-S895 VanDerWaalsContact O-CA 3.28Å; R844-S895 WeakPolarHBondContact O-CA 3.46Å; S895-D897 PolarHBondContact O-N 2.55Å; S895-D897 PolarHBondContact OG-N 3.09Å; S895-Q898 PolarHBondContact O-N 3.17Å
896	V	78.4	Confident	81.8	Confident	89 Å²	89	41.6 Å²	41.6	54%	0.539	21%	0.214	S	C	.	.	S	Bend	trans	-58.8	-34.8	176.6	179.9	0	0	0	0	111.7	R844 Q846	R844-V896 WeakPolarHBondContact O-CG2 3.27Å; R844-V896 PolarHBondContact O-N 3.48Å; Q846-V896 HydrophobicContact CG-CG2 3.6Å
897	D	72.4	Confident	82.1	Confident	98 Å²	98	40.4 Å²	40.4	52%	0.524	21%	0.206	S	C	.	.	S	Bend	trans	-90.5	-17.7	-172.3	-56.2	-20.3	0	0	0	113	R844 S895	R844-D897 VanDerWaalsContact CD-OD2 3.23Å; R844-D897 WeakPolarHBondContact CD-OD2 3.33Å; R844-D897 IonicContact CZ-OD2 3.27Å; R844-D897 VanDerWaalsContact CZ-OD2 3.26Å; R844-D897 IonicContact NE-OD2 3.33Å; R844-D897 PolarHBondContact NE-OD2 3.36Å; R844-D897 IonicContact NH1-OD2 2.74Å; R844-D897 PolarHBondContact NH1-OD2 3.01Å; S895-D897 PolarHBondContact O-N 2.55Å; S895-D897 PolarHBondContact OG-N 3.09Å
898	Q	64.8	Low	82.4	Confident	85 Å²	85	38.6 Å²	38.6	40%	0.397	20%	0.199	S	C	.	.			trans	-107.9	122.2	-172.3	-59.4	-169.7	19	0	0	110.9	S895 T900	S895-Q898 PolarHBondContact O-N 3.17Å; Q898-T900 PolarHBondContact O-N 3.26Å
899	K	65.8	Low	82.5	Confident	143 Å²	143	40 Å²	40	62%	0.622	20%	0.204	S	C	*	.	S	Bend	trans	-63.9	-27.7	175.7	-77.3	-160.9	175.1	-147.5	0	113.5	E766	E766-K899 IonicContact OE1-NZ 3.04Å; E766-K899 PolarHBondContact OE1-NZ 3Å
900	T	67.1	Low	82.4	Confident	78 Å²	78	39.8 Å²	39.8	48%	0.479	20%	0.203	S	C	.	.	S	Bend	trans	-112.3	134	178.8	49.1	0	0	0	0	109.6	Q898	Q898-T900 PolarHBondContact O-N 3.26Å
901	P	80.5	Confident	82.2	Confident	38 Å²	38	39.8 Å²	39.8	25%	0.247	21%	0.206	C	C	.	.			trans	-64.7	143.2	177.6	26.9	-34.2	0	0	0	111.1	Y892 I893 T903	Y892-P901 HydrophobicContact CD1-CB 3.98Å; Y892-P901 HydrophobicContact CD1-CG 3.63Å; Y892-P901 HydrophobicContact CE1-CG 4.28Å; I893-P901 CarbonylContact O-C 3.59Å; I893-P901 WeakPolarHBondContact O-CA 3.43Å; P901-T903 PolarHBondContact O-N 2.85Å; P901-T903 PolarHBondContact O-OG1 3.07Å
902	I	81.1	Confident	81.5	Confident	20 Å²	20	41.4 Å²	41.4	10%	0.103	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	120.6	175.7	-49.5	171.4	0	0	0	107.6	V839 T840 Y892 I893 I904	V839-I902 HydrophobicContact CB-CD1 4.39Å; V839-I902 HydrophobicContact CG1-CB 4.33Å; V839-I902 HydrophobicContact CG1-CD1 3.47Å; V839-I902 VanDerWaalsContact CG1-CD1 3.47Å; V839-I902 HydrophobicContact CG1-CG1 4.38Å; V839-I902 HydrophobicContact CG1-CG2 3.58Å; T840-I902 WeakPolarHBondContact OG1-CD1 3.08Å; Y892-I902 WeakPolarHBondContact CA-O 3.37Å; I893-I902 HydrophobicContact CB-CB 4.31Å; I893-I902 PolarHBondContact N-O 3.03Å; I893-I902 PolarHBondContact O-N 3.09Å; I902-I904 HydrophobicContact CG2-CG1 4.42Å
903	T	84.4	Confident	80.6	Confident	28 Å²	28	40.1 Å²	40.1	17%	0.172	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	115.9	-173.9	-52.7	0	0	0	0	110.1	R890 L891 Y892 P901	R890-T903 HydrophobicContact CB-CG2 4.21Å; L891-T903 WeakPolarHBondContact O-CA 3.28Å; Y892-T903 HydrophobicContact CD2-CG2 4.36Å; Y892-T903 HydrophobicContact CE1-CG2 4.06Å; Y892-T903 WeakPolarHBondContact CE1-OG1 3.41Å; Y892-T903 HydrophobicContact CE2-CG2 3.9Å; P901-T903 PolarHBondContact O-N 2.85Å; P901-T903 PolarHBondContact O-OG1 3.07Å
904	I	84.2	Confident	79.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.2	-178.9	-55	175.1	0	0	0	107.8	M815 V818 V839 R890 L891 I893 I902	M815-I904 HydrophobicContact CB-CG2 4.17Å; M815-I904 HydrophobicContact SD-CD1 4.38Å; M815-I904 HydrophobicContact SD-CG1 4.34Å; V818-I904 HydrophobicContact CB-CD1 3.78Å; V818-I904 HydrophobicContact CG1-CD1 3.3Å; V818-I904 HydrophobicContact CG2-CD1 3.95Å; V839-I904 HydrophobicContact CG2-CD1 3.98Å; R890-I904 CarbonylContact C-O 3.5Å; R890-I904 WeakPolarHBondContact CA-O 3.4Å; L891-I904 HydrophobicContact CB-CB 4.43Å; L891-I904 PolarHBondContact N-O 3.12Å; L891-I904 PolarHBondContact O-N 3.23Å; I893-I904 HydrophobicContact CD1-CD1 3.73Å; I902-I904 HydrophobicContact CG2-CG1 4.42Å
905	G	84.6	Confident	78	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	149.3	174.1	0	0	0	0	0	112.4	Q813 F814 F889	Q813-G905 PolarHBondContact O-N 2.77Å; F814-G905 WeakPolarHBondContact CD1-O 3.25Å; F889-G905 WeakPolarHBondContact O-CA 3.31Å
906	F	88.9	Confident	76.9	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	153.3	172.5	63.4	-79.4	0	0	0	109.4	L819 N821 F822 L850 L873 F889 L891 V908	L819-F906 HydrophobicContact CD2-CB 4.5Å; L819-F906 HydrophobicContact CD2-CD1 3.46Å; L819-F906 VanDerWaalsContact CD2-CD1 3.46Å; L819-F906 HydrophobicContact CD2-CD2 3.91Å; L819-F906 HydrophobicContact CD2-CE1 3.42Å; L819-F906 VanDerWaalsContact CD2-CE1 3.42Å; L819-F906 HydrophobicContact CD2-CE2 3.88Å; L819-F906 HydrophobicContact CD2-CG 3.7Å; L819-F906 HydrophobicContact CD2-CZ 3.62Å; L819-F906 HydrophobicContact CG-CB 4.42Å; L819-F906 HydrophobicContact CG-CD1 4.25Å; L819-F906 HydrophobicContact CG-CD2 4.34Å; L819-F906 HydrophobicContact CG-CG 4.09Å; N821-F906 VanDerWaalsContact OD1-CA 3.23Å; N821-F906 WeakPolarHBondContact OD1-CA 3.48Å; F822-F906 AromaticContact CE1-CD2 3.81Å; F822-F906 HydrophobicContact CE1-CD2 3.81Å; F822-F906 AromaticContact CE1-CE2 3.92Å; F822-F906 HydrophobicContact CE1-CE2 3.92Å; F822-F906 HydrophobicContact CZ-CE2 4.35Å; L850-F906 HydrophobicContact CD1-CE1 3.84Å; L850-F906 HydrophobicContact CD1-CZ 3.68Å; L873-F906 HydrophobicContact CD1-CZ 4.16Å; L873-F906 HydrophobicContact CD2-CE2 3.8Å; L873-F906 HydrophobicContact CD2-CZ 3.92Å; F889-F906 HydrophobicContact CB-CD1 4.26Å; F889-F906 HydrophobicContact CB-CD2 4.41Å; F889-F906 HydrophobicContact CB-CE1 3.68Å; F889-F906 HydrophobicContact CB-CE2 3.87Å; F889-F906 HydrophobicContact CB-CZ 3.49Å; F889-F906 VanDerWaalsContact CB-CZ 3.49Å; F889-F906 AromaticContact CD2-CE2 3.98Å; F889-F906 HydrophobicContact CD2-CE2 3.98Å; F889-F906 HydrophobicContact CD2-CZ 4.3Å; F889-F906 HydrophobicContact CG-CE2 4.33Å; F889-F906 HydrophobicContact CG-CZ 4.21Å; F889-F906 PolarHBondContact N-O 3.26Å; F889-F906 PolarHBondContact O-N 2.86Å; L891-F906 HydrophobicContact CB-CE1 4.29Å; F906-V908 HydrophobicContact CD2-CG2 3.74Å; F906-V908 HydrophobicContact CE2-CG2 3.61Å
907	T	87.6	Confident	75.8	Confident	34 Å²	34	45 Å²	45	21%	0.209	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.6	176.7	61.5	0	0	0	0	111.5	F814 N821 F822 Y887 L888	F814-T907 HydrophobicContact CE1-CG2 4.18Å; N821-T907 WeakPolarHBondContact CA-O 3.46Å; N821-T907 WeakPolarHBondContact CB-OG1 3.48Å; N821-T907 PolarHBondContact ND2-OG1 3.03Å; N821-T907 PolarHBondContact OD1-N 2.92Å; N821-T907 PolarHBondContact OD1-OG1 2.88Å; F822-T907 PolarHBondContact N-O 3.03Å; F822-T907 VanDerWaalsContact N-O 3.15Å; Y887-T907 CarbonylContact O-C 3.51Å; Y887-T907 WeakPolarHBondContact O-CA 3.42Å; L888-T907 HydrophobicContact CD1-CG2 3.91Å
908	V	91.4	Very high	74.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	112.9	176.1	-174.4	0	0	0	0	110	F822 V824 W863 I864 Y887 F889 F906	F822-V908 HydrophobicContact CD1-CG2 4.33Å; F822-V908 HydrophobicContact CD2-CG1 4.45Å; F822-V908 HydrophobicContact CE1-CG2 3.67Å; F822-V908 HydrophobicContact CE2-CG1 4.02Å; F822-V908 HydrophobicContact CE2-CG2 4.09Å; F822-V908 HydrophobicContact CZ-CG1 4.27Å; F822-V908 HydrophobicContact CZ-CG2 3.51Å; F822-V908 VanDerWaalsContact O-CA 3.31Å; F822-V908 WeakPolarHBondContact O-CA 3.4Å; V824-V908 HydrophobicContact CB-CG1 4.37Å; V824-V908 HydrophobicContact CG1-CG1 3.94Å; V824-V908 HydrophobicContact CG2-CG1 3.57Å; W863-V908 HydrophobicContact CH2-CB 4.35Å; W863-V908 HydrophobicContact CH2-CG1 3.8Å; W863-V908 HydrophobicContact CZ3-CG1 4.44Å; I864-V908 HydrophobicContact CD1-CG2 4.5Å; Y887-V908 PolarHBondContact N-O 2.94Å; Y887-V908 PolarHBondContact O-N 2.95Å; F889-V908 HydrophobicContact CD2-CB 4.26Å; F889-V908 HydrophobicContact CD2-CG2 3.77Å; F889-V908 HydrophobicContact CE2-CB 4.05Å; F889-V908 HydrophobicContact CE2-CG2 3.97Å; F906-V908 HydrophobicContact CD2-CG2 3.74Å; F906-V908 HydrophobicContact CE2-CG2 3.61Å
909	E	88.1	Confident	74.2	Confident	80 Å²	80	48.2 Å²	48.2	37%	0.374	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	121.9	172.2	-165.4	-173.7	146.9	0	0	109.3	F822 T823 V824 P886 Q911	F822-E909 PolarHBondContact O-N 3.48Å; F822-E909 VanDerWaalsContact O-N 3.13Å; T823-E909 CarbonylContact C-O 3.54Å; T823-E909 WeakPolarHBondContact CA-O 3.41Å; T823-E909 HydrophobicContact CG2-CB 3.76Å; V824-E909 PolarHBondContact N-O 3.04Å; P886-E909 HydrophobicContact CB-CB 4.36Å; E909-Q911 HydrophobicContact CG-CG 4.2Å; E909-Q911 WeakPolarHBondContact OE1-CG 3.21Å; E909-Q911 PolarHBondContact OE1-NE2 3.15Å
910	V	88.8	Confident	73.7	Confident	3 Å²	3	45.7 Å²	45.7	2%	0.018	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	101.9	176.6	-177.7	0	0	0	0	108.2	V824 A826 W863 P877 I882 Y887	V824-V910 HydrophobicContact CG2-CB 4.29Å; V824-V910 HydrophobicContact CG2-CG1 4.46Å; V824-V910 HydrophobicContact CG2-CG2 3.73Å; V824-V910 WeakPolarHBondContact O-CA 3.25Å; A826-V910 HydrophobicContact CB-CG1 4.2Å; W863-V910 HydrophobicContact CH2-CG2 3.58Å; W863-V910 HydrophobicContact CZ2-CG2 3.85Å; W863-V910 HydrophobicContact CZ3-CG2 4.2Å; P877-V910 HydrophobicContact CB-CG1 3.78Å; P877-V910 HydrophobicContact CB-CG2 4.38Å; P877-V910 HydrophobicContact CG-CG1 4.26Å; I882-V910 HydrophobicContact CG1-CG1 4.17Å; Y887-V910 HydrophobicContact CD2-CG2 3.7Å; Y887-V910 HydrophobicContact CE2-CB 4.18Å; Y887-V910 HydrophobicContact CE2-CG2 3.57Å
911	Q	82.9	Confident	73.1	Confident	58 Å²	58	51.9 Å²	51.9	27%	0.271	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	145.3	178.7	-66.6	-175.8	-13.3	0	0	110.6	V824 I825 A826 E909 W913 T916	V824-Q911 PolarHBondContact O-N 3.05Å; I825-Q911 WeakPolarHBondContact CA-O 3.03Å; A826-Q911 PolarHBondContact N-O 3.03Å; E909-Q911 HydrophobicContact CG-CG 4.2Å; E909-Q911 WeakPolarHBondContact OE1-CG 3.21Å; E909-Q911 PolarHBondContact OE1-NE2 3.15Å; Q911-W913 PolarHBondContact O-N 3.16Å; Q911-T916 HydrophobicContact CB-CG2 4.21Å
912	D	76.5	Confident	71.6	Confident	33 Å²	33	53 Å²	53	18%	0.176	27%	0.265	C	S	.	.			trans	-79.3	118.8	169.8	-168.4	-7.1	0	0	0	109.2	I882 F914 E915 T916	I882-D912 HydrophobicContact CD1-CB 3.6Å; I882-D912 HydrophobicContact CG1-CB 4.29Å; I882-D912 HydrophobicContact CG2-CB 4.24Å; D912-F914 PolarHBondContact O-N 3.01Å; D912-F914 WeakPolarHBondContact OD1-CB 3.47Å; D912-F914 PolarHBondContact OD1-N 3.09Å; D912-E915 HydrophobicContact CB-CB 4.11Å; D912-E915 HydrophobicContact CB-CG 4.36Å; D912-E915 PolarHBondContact O-N 2.7Å; D912-T916 WeakPolarHBondContact O-CG2 3.24Å; D912-T916 PolarHBondContact O-N 2.87Å; D912-T916 PolarHBondContact O-OG1 2.98Å
913	W	68.1	Low	70.1	Confident	16 Å²	16	53.5 Å²	53.5	6%	0.061	27%	0.267	C	S	.	.	H	α-helix	trans	-56.5	-33.1	173.9	75.9	-84	0	0	0	111.1	I825 Q911 T916 M917 F923 L925 W985 L1005	I825-W913 HydrophobicContact CG2-CB 3.24Å; I825-W913 HydrophobicContact CG2-CG 4.34Å; Q911-W913 PolarHBondContact O-N 3.16Å; W913-T916 VanDerWaalsContact C-OG1 3.3Å; W913-T916 VanDerWaalsContact CA-OG1 3.24Å; W913-T916 WeakPolarHBondContact CA-OG1 3.01Å; W913-T916 PolarHBondContact O-OG1 2.79Å; W913-M917 HydrophobicContact CE3-CG 4.1Å; W913-M917 VanDerWaalsContact O-CB 3.25Å; W913-M917 WeakPolarHBondContact O-CB 3.36Å; W913-M917 WeakPolarHBondContact O-CG 3.06Å; W913-M917 PolarHBondContact O-N 3.32Å; W913-F923 HydrophobicContact CZ3-CE1 4.44Å; W913-F923 HydrophobicContact CZ3-CZ 4.19Å; W913-L925 HydrophobicContact CH2-CD2 3.72Å; W913-L925 HydrophobicContact CZ3-CD2 4.13Å; W913-W985 HydrophobicContact CZ2-CE3 4.39Å; W913-L1005 HydrophobicContact CH2-CD1 3.56Å; W913-L1005 HydrophobicContact CH2-CD2 4.43Å; W913-L1005 HydrophobicContact CZ3-CD1 3.63Å
914	F	59.9	Low	68.9	Low	49 Å²	49	54.5 Å²	54.5	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-66.4	-46.8	180	-161.4	-83.2	0	0	0	112.2	D912 M917 K918 L925 W985	D912-F914 PolarHBondContact O-N 3.01Å; D912-F914 WeakPolarHBondContact OD1-CB 3.47Å; D912-F914 PolarHBondContact OD1-N 3.09Å; F914-M917 PolarHBondContact O-N 3.05Å; F914-K918 HydrophobicContact CE1-CD 4.44Å; F914-K918 WeakPolarHBondContact O-CB 3.46Å; F914-K918 PolarHBondContact O-N 2.73Å; F914-L925 HydrophobicContact CD2-CD1 4.22Å; F914-L925 HydrophobicContact CD2-CD2 4.19Å; F914-L925 HydrophobicContact CE2-CD1 3.2Å; F914-L925 HydrophobicContact CE2-CD2 3.92Å; F914-L925 HydrophobicContact CE2-CG 4.09Å; F914-L925 HydrophobicContact CZ-CD1 3.43Å; F914-L925 VanDerWaalsContact CZ-CD1 3.43Å; F914-W985 AromaticContact CD2-CH2 3.78Å; F914-W985 HydrophobicContact CD2-CH2 3.78Å; F914-W985 HydrophobicContact CD2-CZ2 4.16Å; F914-W985 HydrophobicContact CD2-CZ3 4.41Å; F914-W985 AromaticContact CE2-CH2 3.56Å; F914-W985 HydrophobicContact CE2-CH2 3.56Å; F914-W985 HydrophobicContact CE2-CZ2 4.24Å; F914-W985 HydrophobicContact CE2-CZ3 4.27Å
915	E	60.2	Low	67.9	Low	86 Å²	86	55.6 Å²	55.6	40%	0.402	28%	0.276	S	S	.	.	H	α-helix	trans	-70.6	-37.9	176.2	-77.3	-83.3	132.7	0	0	111.6	D912 M917 K918 N919	D912-E915 HydrophobicContact CB-CB 4.11Å; D912-E915 HydrophobicContact CB-CG 4.36Å; D912-E915 PolarHBondContact O-N 2.7Å; E915-M917 PolarHBondContact O-N 3.16Å; E915-K918 PolarHBondContact O-N 3.16Å; E915-K918 IonicContact OE1-NZ 3.03Å; E915-K918 PolarHBondContact OE1-NZ 3.31Å; E915-N919 PolarHBondContact O-N 3.3Å; E915-N919 VanDerWaalsContact O-N 3.16Å; E915-N919 PolarHBondContact O-ND2 2.86Å
916	T	60	Low	67.2	Low	60 Å²	60	55.8 Å²	55.8	37%	0.368	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-38.1	174.6	54.6	0	0	0	0	111.9	Q911 D912 W913	Q911-T916 HydrophobicContact CB-CG2 4.21Å; D912-T916 WeakPolarHBondContact O-CG2 3.24Å; D912-T916 PolarHBondContact O-N 2.87Å; D912-T916 PolarHBondContact O-OG1 2.98Å; W913-T916 VanDerWaalsContact C-OG1 3.3Å; W913-T916 VanDerWaalsContact CA-OG1 3.24Å; W913-T916 WeakPolarHBondContact CA-OG1 3.01Å; W913-T916 PolarHBondContact O-OG1 2.79Å
917	M	53.8	Low	66.7	Low	36 Å²	36	55.9 Å²	55.9	18%	0.177	28%	0.277	C	S	.	.	H	α-helix	trans	-77.7	-39.3	177.9	-72	-79.5	-131.5	0	0	112.1	W913 F914 E915 N919 D920 F923 Q1006	W913-M917 HydrophobicContact CE3-CG 4.1Å; W913-M917 VanDerWaalsContact O-CB 3.25Å; W913-M917 WeakPolarHBondContact O-CB 3.36Å; W913-M917 WeakPolarHBondContact O-CG 3.06Å; W913-M917 PolarHBondContact O-N 3.32Å; F914-M917 PolarHBondContact O-N 3.05Å; E915-M917 PolarHBondContact O-N 3.16Å; M917-N919 VanDerWaalsContact C-N 3.26Å; M917-N919 PolarHBondContact O-N 3.22Å; M917-D920 WeakPolarHBondContact O-CA 2.95Å; M917-D920 WeakPolarHBondContact O-CB 3.4Å; M917-D920 PolarHBondContact O-N 2.95Å; M917-F923 HydrophobicContact CB-CB 4.4Å; M917-F923 HydrophobicContact CB-CD1 3.42Å; M917-F923 VanDerWaalsContact CB-CD1 3.42Å; M917-F923 HydrophobicContact CB-CD2 4.18Å; M917-F923 HydrophobicContact CB-CE1 3.53Å; M917-F923 HydrophobicContact CB-CE2 4.33Å; M917-F923 HydrophobicContact CB-CG 3.73Å; M917-F923 HydrophobicContact CB-CZ 4.01Å; M917-F923 HydrophobicContact CE-CD2 3.86Å; M917-F923 HydrophobicContact CE-CE1 4.38Å; M917-F923 HydrophobicContact CE-CE2 3.12Å; M917-F923 HydrophobicContact CE-CZ 3.42Å; M917-F923 VanDerWaalsContact CE-CZ 3.42Å; M917-F923 HydrophobicContact CG-CD1 4.25Å; M917-F923 HydrophobicContact CG-CD2 4.34Å; M917-F923 HydrophobicContact CG-CE1 4Å; M917-F923 HydrophobicContact CG-CE2 4.16Å; M917-F923 HydrophobicContact CG-CG 4.38Å; M917-F923 HydrophobicContact CG-CZ 3.96Å; M917-F923 WeakPolarHBondContact O-CB 3.46Å; M917-F923 HydrophobicContact SD-CD1 4.43Å; M917-F923 HydrophobicContact SD-CD2 3.49Å; M917-F923 WeakPolarHBondContact SD-CD2 3.43Å; M917-F923 HydrophobicContact SD-CE1 4.32Å; M917-F923 HydrophobicContact SD-CE2 3.41Å; M917-F923 WeakPolarHBondContact SD-CE2 3.32Å; M917-F923 HydrophobicContact SD-CG 4.02Å; M917-F923 HydrophobicContact SD-CZ 3.83Å; M917-Q1006 HydrophobicContact CE-CG 3.92Å
918	K	49.3	Very low	66.4	Low	123 Å²	123	58.2 Å²	58.2	54%	0.535	28%	0.282	S	S	.	.	H	α-helix	trans	-63.2	-28.3	179.2	-178.2	-179.2	168.5	-163.8	0	113.7	F914 E915 D920	F914-K918 HydrophobicContact CE1-CD 4.44Å; F914-K918 WeakPolarHBondContact O-CB 3.46Å; F914-K918 PolarHBondContact O-N 2.73Å; E915-K918 PolarHBondContact O-N 3.16Å; E915-K918 IonicContact OE1-NZ 3.03Å; E915-K918 PolarHBondContact OE1-NZ 3.31Å; K918-D920 PolarHBondContact O-N 2.87Å
919	N	54.4	Low	66.1	Low	128 Å²	128	58.2 Å²	58.2	68%	0.684	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-25.2	173.1	-75.4	-26.3	0	0	0	112.5	E915 M917 K921	E915-N919 PolarHBondContact O-N 3.3Å; E915-N919 VanDerWaalsContact O-N 3.16Å; E915-N919 PolarHBondContact O-ND2 2.86Å; M917-N919 VanDerWaalsContact C-N 3.26Å; M917-N919 PolarHBondContact O-N 3.22Å; N919-K921 PolarHBondContact O-N 3.03Å
920	D	56.3	Low	65.9	Low	89 Å²	89	55.6 Å²	55.6	48%	0.476	27%	0.269	S	S	.	.	S	Bend	trans	-77.4	101.3	166.7	-163	-21.6	0	0	0	108.4	M917 K918 S922 F923	M917-D920 WeakPolarHBondContact O-CA 2.95Å; M917-D920 WeakPolarHBondContact O-CB 3.4Å; M917-D920 PolarHBondContact O-N 2.95Å; K918-D920 PolarHBondContact O-N 2.87Å; D920-S922 PolarHBondContact O-N 3.18Å; D920-S922 WeakPolarHBondContact OD1-CB 3.48Å; D920-S922 PolarHBondContact OD1-N 3.32Å; D920-S922 PolarHBondContact OD1-OG 2.78Å; D920-S922 PolarHBondContact OD2-OG 3.3Å; D920-F923 HydrophobicContact CB-CB 4.3Å; D920-F923 WeakPolarHBondContact O-CB 3.12Å; D920-F923 PolarHBondContact O-N 3.12Å
921	K	54.2	Low	65.9	Low	208 Å²	208	55.5 Å²	55.5	90%	0.904	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-14.3	179.5	-69.4	-176.5	179.9	179	0	113.2	N919	N919-K921 PolarHBondContact O-N 3.03Å
922	S	48.4	Very low	65.9	Low	61 Å²	61	54.1 Å²	54.1	43%	0.427	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-32.8	172.3	68.8	0	0	0	0	112.7	D920 Q924 Q1008	D920-S922 PolarHBondContact O-N 3.18Å; D920-S922 WeakPolarHBondContact OD1-CB 3.48Å; D920-S922 PolarHBondContact OD1-N 3.32Å; D920-S922 PolarHBondContact OD1-OG 2.78Å; D920-S922 PolarHBondContact OD2-OG 3.3Å; S922-Q924 PolarHBondContact O-N 3.38Å; S922-Q1008 VanDerWaalsContact C-OE1 3.29Å; S922-Q1008 PolarHBondContact O-NE2 2.69Å; S922-Q1008 PolarHBondContact O-OE1 3.35Å
923	F	51	Low	66.4	Low	32 Å²	32	52.6 Å²	52.6	14%	0.14	25%	0.252	C	S	.	.			trans	-71.8	127.4	-168.4	-168.8	-96.6	0	0	0	114	W913 M917 D920 L925 L1005	W913-F923 HydrophobicContact CZ3-CE1 4.44Å; W913-F923 HydrophobicContact CZ3-CZ 4.19Å; M917-F923 HydrophobicContact CB-CB 4.4Å; M917-F923 HydrophobicContact CB-CD1 3.42Å; M917-F923 VanDerWaalsContact CB-CD1 3.42Å; M917-F923 HydrophobicContact CB-CD2 4.18Å; M917-F923 HydrophobicContact CB-CE1 3.53Å; M917-F923 HydrophobicContact CB-CE2 4.33Å; M917-F923 HydrophobicContact CB-CG 3.73Å; M917-F923 HydrophobicContact CB-CZ 4.01Å; M917-F923 HydrophobicContact CE-CD2 3.86Å; M917-F923 HydrophobicContact CE-CE1 4.38Å; M917-F923 HydrophobicContact CE-CE2 3.12Å; M917-F923 HydrophobicContact CE-CZ 3.42Å; M917-F923 VanDerWaalsContact CE-CZ 3.42Å; M917-F923 HydrophobicContact CG-CD1 4.25Å; M917-F923 HydrophobicContact CG-CD2 4.34Å; M917-F923 HydrophobicContact CG-CE1 4Å; M917-F923 HydrophobicContact CG-CE2 4.16Å; M917-F923 HydrophobicContact CG-CG 4.38Å; M917-F923 HydrophobicContact CG-CZ 3.96Å; M917-F923 WeakPolarHBondContact O-CB 3.46Å; M917-F923 HydrophobicContact SD-CD1 4.43Å; M917-F923 HydrophobicContact SD-CD2 3.49Å; M917-F923 WeakPolarHBondContact SD-CD2 3.43Å; M917-F923 HydrophobicContact SD-CE1 4.32Å; M917-F923 HydrophobicContact SD-CE2 3.41Å; M917-F923 WeakPolarHBondContact SD-CE2 3.32Å; M917-F923 HydrophobicContact SD-CG 4.02Å; M917-F923 HydrophobicContact SD-CZ 3.83Å; D920-F923 HydrophobicContact CB-CB 4.3Å; D920-F923 WeakPolarHBondContact O-CB 3.12Å; D920-F923 PolarHBondContact O-N 3.12Å; F923-L925 HydrophobicContact CE1-CD2 3.92Å; F923-L925 HydrophobicContact CE1-CG 4.14Å; F923-L925 HydrophobicContact CZ-CD2 4.44Å; F923-L1005 HydrophobicContact CE2-CB 4.41Å; F923-L1005 WeakPolarHBondContact CE2-O 3.24Å; F923-L1005 HydrophobicContact CZ-CB 4.24Å; F923-L1005 HydrophobicContact CZ-CD2 4.32Å
924	Q	58.9	Low	67	Low	49 Å²	49	54.8 Å²	54.8	23%	0.229	27%	0.265	C	S	.	.			trans	-135.8	121.1	177.8	-62.6	-172.9	-15.7	0	0	107.6	Y342 S922 N926 S1094	Y342-Q924 WeakPolarHBondContact OH-CB 3.04Å; Y342-Q924 WeakPolarHBondContact OH-CG 3.18Å; Y342-Q924 PolarHBondContact OH-NE2 3.27Å; Y342-Q924 PolarHBondContact OH-OE1 2.95Å; S922-Q924 PolarHBondContact O-N 3.38Å; Q924-N926 PolarHBondContact O-N 3.26Å; Q924-S1094 VanDerWaalsContact OE1-CB 3.31Å; Q924-S1094 PolarHBondContact OE1-OG 3.01Å
925	L	61.9	Low	67.9	Low	23 Å²	23	53.5 Å²	53.5	12%	0.12	26%	0.261	C	S	.	.			trans	-59	125.3	176.9	-62.3	148.8	0	0	0	109.2	W913 F914 F923 L1005 M1092 G1093	W913-L925 HydrophobicContact CH2-CD2 3.72Å; W913-L925 HydrophobicContact CZ3-CD2 4.13Å; F914-L925 HydrophobicContact CD2-CD1 4.22Å; F914-L925 HydrophobicContact CD2-CD2 4.19Å; F914-L925 HydrophobicContact CE2-CD1 3.2Å; F914-L925 HydrophobicContact CE2-CD2 3.92Å; F914-L925 HydrophobicContact CE2-CG 4.09Å; F914-L925 HydrophobicContact CZ-CD1 3.43Å; F914-L925 VanDerWaalsContact CZ-CD1 3.43Å; F923-L925 HydrophobicContact CE1-CD2 3.92Å; F923-L925 HydrophobicContact CE1-CG 4.14Å; F923-L925 HydrophobicContact CZ-CD2 4.44Å; L925-L1005 HydrophobicContact CD2-CD2 4.17Å; L925-M1092 HydrophobicContact CB-CB 4.36Å; L925-M1092 HydrophobicContact CD1-CE 4.39Å; L925-M1092 CarbonylContact O-C 3.45Å; L925-M1092 WeakPolarHBondContact O-CB 3.29Å; L925-M1092 VanDerWaalsContact O-O 3.06Å; L925-G1093 VanDerWaalsContact O-CA 3.27Å; L925-G1093 WeakPolarHBondContact O-CA 3.37Å; L925-G1093 PolarHBondContact O-N 2.88Å; L925-G1093 VanDerWaalsContact O-N 3.12Å
926	N	70.6	Confident	68.4	Low	4 Å²	4	51 Å²	51	2%	0.021	25%	0.253	C	S	.	.			trans	-104.4	-20.8	-177.7	56.1	15.2	0	0	0	113.3	Q924 L1004 L1005 F1028 R1091 M1092 C1095	Q924-N926 PolarHBondContact O-N 3.26Å; N926-L1004 PolarHBondContact ND2-O 3.42Å; N926-L1005 WeakPolarHBondContact OD1-CD2 3.46Å; N926-F1028 HydrophobicContact CB-CE2 4.05Å; N926-F1028 HydrophobicContact CB-CZ 3.66Å; N926-R1091 CarbonylContact O-C 3.52Å; N926-R1091 WeakPolarHBondContact O-CA 3.31Å; N926-M1092 WeakPolarHBondContact CA-O 3.35Å; N926-M1092 PolarHBondContact O-N 3.44Å; N926-C1095 HydrophobicContact CB-CB 4.01Å; N926-C1095 WeakPolarHBondContact CB-SG 3.23Å
927	H	78.2	Confident	68.5	Low	2 Å²	2	51.7 Å²	51.7	1%	0.009	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	166.8	175.4	73	-64.4	0	0	0	115.2	Q1001 F1028 D1090	H927-Q1001 PolarHBondContact CE1-O 2.87Å; H927-Q1001 VanDerWaalsContact CE1-O 3.26Å; H927-Q1001 PolarHBondContact NE2-N 3.11Å; H927-Q1001 VanDerWaalsContact NE2-N 3.17Å; H927-F1028 HydrophobicContact CB-CD1 4.04Å; H927-F1028 HydrophobicContact CB-CE1 3.35Å; H927-F1028 HydrophobicContact CB-CZ 4.06Å; H927-F1028 AromaticContact CG-CE1 3.33Å; H927-F1028 AromaticContact ND1-CE1 3.39Å; H927-F1028 WeakPolarHBondContact ND1-CE1 3.08Å; H927-F1028 AromaticContact ND1-CZ 3.79Å; H927-D1090 CarbonylContact C-O 3.31Å; H927-D1090 WeakPolarHBondContact CA-O 3.25Å; H927-D1090 WeakPolarHBondContact CB-O 3.49Å
928	R	82	Confident	68.1	Low	83 Å²	83	55.1 Å²	55.1	31%	0.313	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	154.5	160.4	66.1	177.5	-179	-154.5	-4.1	110.4	D1090 M1092	R928-D1090 HydrophobicContact CG-CB 3.76Å; R928-D1090 IonicContact CZ-OD2 3.9Å; R928-D1090 PolarHBondContact N-O 2.94Å; R928-D1090 IonicContact NE-OD2 2.72Å; R928-D1090 PolarHBondContact NE-OD2 3.24Å; R928-D1090 IonicContact NH2-OD2 3.29Å; R928-D1090 PolarHBondContact NH2-OD2 2.81Å; R928-D1090 PolarHBondContact O-N 2.79Å; R928-M1092 HydrophobicContact CB-SD 4.06Å; R928-M1092 HydrophobicContact CG-SD 3.69Å
929	V	84.9	Confident	67.6	Low	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.3	176.4	-173.7	0	0	0	0	109.7	L931 T998 W999 L1031 L1035 V1088 V1089	V929-L931 HydrophobicContact CG1-CD2 4.15Å; V929-T998 CarbonylContact O-C 3.57Å; V929-T998 WeakPolarHBondContact O-CA 3.49Å; V929-W999 WeakPolarHBondContact CA-O 3.41Å; V929-W999 HydrophobicContact CB-CD2 3.97Å; V929-W999 HydrophobicContact CB-CG 4.31Å; V929-W999 HydrophobicContact CB-CH2 4.48Å; V929-W999 HydrophobicContact CB-CZ2 3.91Å; V929-W999 HydrophobicContact CG1-CD2 4.43Å; V929-W999 HydrophobicContact CG1-CZ2 3.66Å; V929-W999 HydrophobicContact CG2-CD2 4.43Å; V929-W999 HydrophobicContact CG2-CH2 4.16Å; V929-W999 HydrophobicContact CG2-CZ2 4.05Å; V929-W999 HydrophobicContact CG2-CZ3 4.42Å; V929-W999 PolarHBondContact N-O 3.37Å; V929-W999 PolarHBondContact O-N 3.3Å; V929-L1031 HydrophobicContact CG2-CD2 4.4Å; V929-L1035 HydrophobicContact CG1-CD1 3.86Å; V929-L1035 HydrophobicContact CG2-CD1 4.11Å; V929-V1088 CarbonylContact C-O 3.57Å; V929-V1088 WeakPolarHBondContact CA-O 3.36Å; V929-V1089 HydrophobicContact CG1-CG2 4.48Å; V929-V1089 HydrophobicContact CG2-CG1 4.46Å; V929-V1089 HydrophobicContact CG2-CG2 4.17Å
930	R	84.4	Confident	66.8	Low	24 Å²	24	52 Å²	52	9%	0.091	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.7	176.8	-67.4	-178	-76.7	162.4	-3.4	110.2	V997 T998 L1054 L1060 A1087 V1088 D1090	R930-V997 CarbonylContact C-O 3.57Å; R930-V997 WeakPolarHBondContact CA-O 3.33Å; R930-T998 HydrophobicContact CG-CG2 4.08Å; R930-L1054 VanDerWaalsContact NH1-CD2 3.31Å; R930-L1060 HydrophobicContact CB-CD1 3.63Å; R930-A1087 WeakPolarHBondContact O-CA 3.5Å; R930-V1088 PolarHBondContact N-O 3.36Å; R930-V1088 PolarHBondContact O-N 3Å; R930-D1090 IonicContact CZ-OD1 3.11Å; R930-D1090 IonicContact CZ-OD2 2.71Å; R930-D1090 IonicContact NE-OD1 2.81Å; R930-D1090 IonicContact NE-OD2 3.87Å; R930-D1090 PolarHBondContact NE-OD2 2.76Å; R930-D1090 IonicContact NH2-OD1 3.96Å; R930-D1090 PolarHBondContact NH2-OD1 3.06Å; R930-D1090 IonicContact NH2-OD2 3.73Å; R930-D1090 PolarHBondContact NH2-OD2 2.99Å
931	L	87.3	Confident	66.4	Low	2 Å²	2	55.4 Å²	55.4	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	148.6	179.3	-55.1	179.4	0	0	0	110.5	V929 I933 I966 S996 V997 F1072 A1086 A1087	V929-L931 HydrophobicContact CG1-CD2 4.15Å; L931-I933 HydrophobicContact CB-CG1 4.24Å; L931-I933 HydrophobicContact CD1-CD1 4.42Å; L931-I966 HydrophobicContact CD1-CD1 4.23Å; L931-S996 VanDerWaalsContact O-CA 3.32Å; L931-S996 WeakPolarHBondContact O-CA 3.31Å; L931-V997 HydrophobicContact CB-CB 4.3Å; L931-V997 PolarHBondContact N-O 2.86Å; L931-V997 PolarHBondContact O-N 2.88Å; L931-F1072 HydrophobicContact CD1-CE1 4.16Å; L931-F1072 HydrophobicContact CD1-CZ 3.92Å; L931-F1072 HydrophobicContact CD2-CE1 3.93Å; L931-F1072 HydrophobicContact CD2-CZ 4.41Å; L931-A1086 WeakPolarHBondContact CA-O 3.36Å; L931-A1087 HydrophobicContact CD2-CB 3.48Å; L931-A1087 VanDerWaalsContact CD2-CB 3.48Å
932	R	83.4	Confident	66	Low	29 Å²	29	50.3 Å²	50.3	11%	0.109	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.4	165.1	-179.1	172.5	165.3	153.6	-2.3	108.7	L995 E1085 A1086	R932-L995 CarbonylContact C-O 3.54Å; R932-L995 WeakPolarHBondContact CA-O 3.21Å; R932-E1085 WeakPolarHBondContact CD-OE2 3Å; R932-E1085 HydrophobicContact CG-CB 4.31Å; R932-E1085 IonicContact CZ-OE2 2.82Å; R932-E1085 IonicContact NE-OE2 2.82Å; R932-E1085 PolarHBondContact NE-OE2 3.38Å; R932-E1085 IonicContact NH2-OE1 2.82Å; R932-E1085 IonicContact NH2-OE2 3.33Å; R932-E1085 PolarHBondContact NH2-OE2 3.01Å; R932-E1085 PolarHBondContact O-N 2.73Å; R932-A1086 HydrophobicContact CB-CB 4.32Å; R932-A1086 PolarHBondContact N-O 2.91Å
933	I	86.5	Confident	65.7	Low	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134.5	-173.3	-52.1	179.1	0	0	0	109.5	L931 L962 S994 L995 V997 M1076 I1083 V1084	L931-I933 HydrophobicContact CB-CG1 4.24Å; L931-I933 HydrophobicContact CD1-CD1 4.42Å; I933-L962 HydrophobicContact CD1-CD1 3.79Å; I933-S994 CarbonylContact O-C 3.56Å; I933-S994 WeakPolarHBondContact O-CA 3.46Å; I933-L995 PolarHBondContact N-O 2.88Å; I933-L995 PolarHBondContact O-N 3.47Å; I933-V997 HydrophobicContact CD1-CG2 3.92Å; I933-M1076 HydrophobicContact CD1-CE 4.09Å; I933-I1083 WeakPolarHBondContact CA-O 3.13Å; I933-V1084 HydrophobicContact CG1-CG2 4.43Å
934	L	80.7	Confident	65.1	Low	63 Å²	63	54.8 Å²	54.8	33%	0.33	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	106.2	169	-69.8	164.3	0	0	0	108.3	G1082 I1083	L934-G1082 CarbonylContact O-C 3.53Å; L934-G1082 WeakPolarHBondContact O-CA 3.46Å; L934-I1083 PolarHBondContact N-O 2.73Å; L934-I1083 PolarHBondContact O-N 2.78Å
935	P	80.8	Confident	64.3	Low	21 Å²	21	56 Å²	56	14%	0.136	32%	0.316	C	S	.	.			trans	-55.9	149.7	178.9	-26.2	37	0	0	0	112.4	I937 P952 N993 L995	P935-I937 PolarHBondContact O-N 3.11Å; P935-P952 HydrophobicContact CB-CG 4.25Å; P935-P952 HydrophobicContact CG-CB 4.47Å; P935-P952 HydrophobicContact CG-CG 4.13Å; P935-N993 WeakPolarHBondContact CD-O 3.12Å; P935-L995 HydrophobicContact CG-CD1 3.41Å; P935-L995 VanDerWaalsContact CG-CD1 3.41Å; P935-L995 HydrophobicContact CG-CG 4.28Å
936	S	69.8	Low	63.7	Low	34 Å²	34	62.5 Å²	62.5	24%	0.238	35%	0.346	C	S	.	.			trans	-61.3	122.5	173.3	46	0	0	0	0	110.6	I947 E1080	S936-I947 WeakPolarHBondContact O-CD1 3.45Å; S936-E1080 PolarHBondContact OG-O 2.85Å
937	I	61.7	Low	63.1	Low	75 Å²	75	65.5 Å²	65.5	39%	0.385	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	120.7	171.1	-55.4	168.6	0	0	0	105.8	P935 T939 P944	P935-I937 PolarHBondContact O-N 3.11Å; I937-T939 PolarHBondContact O-N 2.77Å; I937-P944 HydrophobicContact CG2-CB 3.67Å
938	Q	44.9	Very low	62	Low	108 Å²	108	66.5 Å²	66.5	51%	0.505	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	105	175.3	-87.3	177.9	8.4	0	0	109	S940 P944 T945 I947	Q938-S940 VanDerWaalsContact C-N 3.25Å; Q938-S940 PolarHBondContact O-N 2.93Å; Q938-P944 WeakPolarHBondContact O-CA 3.25Å; Q938-T945 PolarHBondContact OE1-OG1 3.27Å; Q938-I947 HydrophobicContact CB-CG1 4.35Å; Q938-I947 HydrophobicContact CG-CD1 3.8Å; Q938-I947 HydrophobicContact CG-CG1 3.85Å
939	T	40.2	Very low	60.7	Low	118 Å²	118	66.4 Å²	66.4	72%	0.724	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	64.1	171.1	48.2	0	0	0	0	109.3	I937 T941	I937-T939 PolarHBondContact O-N 2.77Å; T939-T941 PolarHBondContact O-N 3.22Å
940	S	36.4	Very low	59.5	Low	67 Å²	67	67.4 Å²	67.4	47%	0.469	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	133	158.5	78.1	0	0	0	0	106.8	Q938 S942 Q943	Q938-S940 VanDerWaalsContact C-N 3.25Å; Q938-S940 PolarHBondContact O-N 2.93Å; S940-S942 PolarHBondContact O-N 3.12Å; S940-Q943 PolarHBondContact O-N 2.89Å; S940-Q943 VanDerWaalsContact O-N 3.13Å; S940-Q943 PolarHBondContact OG-O 2.93Å
941	T	47.9	Very low	59	Low	160 Å²	160	73.1 Å²	73.1	98%	0.982	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	12.4	-165.1	39.8	0	0	0	0	116.1	T939	T939-T941 PolarHBondContact O-N 3.22Å
942	S	46.7	Very low	58.6	Low	102 Å²	102	74 Å²	74	71%	0.713	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.1	-6.4	172.7	53.6	0	0	0	0	116.6	S940	S940-S942 PolarHBondContact O-N 3.12Å
943	Q	42.3	Very low	58.3	Low	102 Å²	102	74 Å²	74	48%	0.477	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.5	134.2	172.2	-104.7	157.2	22.8	0	0	111.4	S940 T945	S940-Q943 PolarHBondContact O-N 2.89Å; S940-Q943 VanDerWaalsContact O-N 3.13Å; S940-Q943 PolarHBondContact OG-O 2.93Å; Q943-T945 PolarHBondContact O-N 2.69Å
944	P	37.1	Very low	58	Low	85 Å²	85	76.1 Å²	76.1	55%	0.552	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	105.2	171.6	29.3	-30	0	0	0	110.2	I937 Q938	I937-P944 HydrophobicContact CG2-CB 3.67Å; Q938-P944 WeakPolarHBondContact O-CA 3.25Å
945	T	42.2	Very low	58.2	Low	73 Å²	73	73.1 Å²	73.1	45%	0.448	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	117.5	166.7	30.9	0	0	0	0	108.6	Q938 Q943 I947	Q938-T945 PolarHBondContact OE1-OG1 3.27Å; Q943-T945 PolarHBondContact O-N 2.69Å; T945-I947 PolarHBondContact O-N 3.39Å
946	E	50.9	Low	58.6	Low	161 Å²	161	72.2 Å²	72.2	75%	0.752	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.7	118.6	169.5	-76.5	-176.7	167.9	0	0	108.4	W948	E946-W948 PolarHBondContact O-N 2.95Å
947	I	56.1	Low	59.5	Low	67 Å²	67	73.8 Å²	73.8	34%	0.344	42%	0.415	S	S	.	.	S	Bend	trans	-67.3	-22.3	-176.5	-58.2	172	0	0	0	111.4	S936 Q938 T945	S936-I947 WeakPolarHBondContact O-CD1 3.45Å; Q938-I947 HydrophobicContact CB-CG1 4.35Å; Q938-I947 HydrophobicContact CG-CD1 3.8Å; Q938-I947 HydrophobicContact CG-CG1 3.85Å; T945-I947 PolarHBondContact O-N 3.39Å
948	W	55.5	Low	60.7	Low	23 Å²	23	70.2 Å²	70.2	9%	0.087	40%	0.397	C	S	.	.			trans	-108.5	127.8	-172.9	-59.2	94.3	0	0	0	111.1	E946 V950 P952 Y958 K961	E946-W948 PolarHBondContact O-N 2.95Å; W948-V950 WeakPolarHBondContact CB-O 3.44Å; W948-V950 PolarHBondContact O-N 3.42Å; W948-P952 HydrophobicContact CG-CG 4.31Å; W948-Y958 HydrophobicContact CD2-CD2 4.06Å; W948-Y958 AromaticContact CE2-CD2 3.66Å; W948-Y958 HydrophobicContact CE3-CD2 4.44Å; W948-Y958 HydrophobicContact CH2-CD2 4.12Å; W948-Y958 AromaticContact CZ2-CD2 3.71Å; W948-Y958 HydrophobicContact CZ2-CD2 3.71Å; W948-Y958 HydrophobicContact CZ2-CE2 4.3Å; W948-Y958 HydrophobicContact CZ3-CD2 4.47Å; W948-K961 HydrophobicContact CH2-CD 3.66Å; W948-K961 HydrophobicContact CZ3-CD 4.3Å
949	P	55.2	Low	62.9	Low	80 Å²	80	65.2 Å²	65.2	52%	0.519	37%	0.374	S	S	.	.	S	Bend	trans	-68.4	-25.6	-177.9	26.8	-33.9	0	0	0	112.8
950	V	59.7	Low	65.1	Low	21 Å²	21	61.8 Å²	61.8	13%	0.127	35%	0.347	C	S	.	.	S	Bend	trans	-121.9	142.8	176.2	179.9	0	0	0	0	107.2	W948 S954 P1680	W948-V950 WeakPolarHBondContact CB-O 3.44Å; W948-V950 PolarHBondContact O-N 3.42Å; V950-S954 WeakPolarHBondContact CG1-OG 3.46Å; V950-P1680 HydrophobicContact CG2-CB 4.06Å
951	K	73.5	Confident	67.6	Low	144 Å²	144	62 Å²	62	63%	0.626	34%	0.34	S	S	*	.			trans	-49.4	133.7	178.2	-69.6	-177.1	179.4	-178.2	0	109.6	S953 S954 S955	K951-S953 PolarHBondContact O-N 2.85Å; K951-S954 PolarHBondContact O-N 3.48Å; K951-S954 PolarHBondContact O-OG 3.39Å; K951-S955 PolarHBondContact O-N 3.17Å; K951-S955 VanDerWaalsContact O-N 3.12Å
952	P	78.4	Confident	69.7	Low	20 Å²	20	54.4 Å²	54.4	13%	0.13	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-31.8	-174.8	-34.1	37.7	0	0	0	115.4	P935 W948 S954 Y958 L995	P935-P952 HydrophobicContact CB-CG 4.25Å; P935-P952 HydrophobicContact CG-CB 4.47Å; P935-P952 HydrophobicContact CG-CG 4.13Å; W948-P952 HydrophobicContact CG-CG 4.31Å; P952-S954 VanDerWaalsContact C-N 3.29Å; P952-S954 PolarHBondContact O-N 2.54Å; P952-Y958 HydrophobicContact CB-CD1 3.81Å; P952-Y958 HydrophobicContact CB-CD2 3.84Å; P952-Y958 HydrophobicContact CB-CE1 3.93Å; P952-Y958 HydrophobicContact CB-CE2 3.95Å; P952-Y958 HydrophobicContact CB-CG 3.77Å; P952-Y958 HydrophobicContact CG-CD2 4.41Å; P952-Y958 HydrophobicContact CG-CE2 4.46Å; P952-Y958 VanDerWaalsContact O-CD1 3.28Å; P952-Y958 WeakPolarHBondContact O-CD1 3.46Å; P952-L995 HydrophobicContact CB-CD1 3.65Å; P952-L995 HydrophobicContact CB-CD2 4.42Å; P952-L995 HydrophobicContact CG-CD1 4.5Å
953	S	77.5	Confident	71.7	Confident	31 Å²	31	49.6 Å²	49.6	22%	0.217	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-29.5	176.4	59.6	0	0	0	0	114	K951	K951-S953 PolarHBondContact O-N 2.85Å
954	S	79.5	Confident	73.9	Confident	43 Å²	43	47.2 Å²	47.2	30%	0.301	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-15.1	-177.7	36.7	0	0	0	0	114	V950 K951 P952 R959	V950-S954 WeakPolarHBondContact CG1-OG 3.46Å; K951-S954 PolarHBondContact O-N 3.48Å; K951-S954 PolarHBondContact O-OG 3.39Å; P952-S954 VanDerWaalsContact C-N 3.29Å; P952-S954 PolarHBondContact O-N 2.54Å; S954-R959 PolarHBondContact O-NH2 3.15Å
955	S	86.5	Confident	76.4	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.			trans	-75	123.1	-180	170.3	0	0	0	0	111.8	D860 K951 N957 Y958 R959	D860-S955 CarbonylContact O-C 3.57Å; D860-S955 WeakPolarHBondContact O-CA 3.36Å; D860-S955 WeakPolarHBondContact OD2-CA 3.42Å; D860-S955 WeakPolarHBondContact OD2-CB 3.41Å; D860-S955 PolarHBondContact OD2-OG 2.86Å; K951-S955 PolarHBondContact O-N 3.17Å; K951-S955 VanDerWaalsContact O-N 3.12Å; S955-N957 VanDerWaalsContact C-N 3.34Å; S955-N957 PolarHBondContact OG-N 3.17Å; S955-Y958 PolarHBondContact OG-N 2.82Å; S955-R959 WeakPolarHBondContact O-CB 3.4Å; S955-R959 WeakPolarHBondContact O-CG 3.31Å; S955-R959 PolarHBondContact O-N 2.94Å; S955-R959 VanDerWaalsContact O-N 3.12Å; S955-R959 PolarHBondContact O-NE 2.94Å; S955-R959 VanDerWaalsContact O-NE 3.16Å
956	L	89.5	Confident	78.7	Confident	2 Å²	2	40 Å²	40	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-62.6	-41.9	171.1	-180	58.9	0	0	0	111.1	D860 S862 L876 Y958 R959 W960	D860-L956 PolarHBondContact O-N 2.8Å; D860-L956 WeakPolarHBondContact OD1-CB 3.31Å; D860-L956 PolarHBondContact OD1-N 2.85Å; S862-L956 WeakPolarHBondContact O-CB 3.31Å; L876-L956 HydrophobicContact CB-CD1 4.11Å; L956-Y958 PolarHBondContact O-N 2.97Å; L956-R959 PolarHBondContact O-N 2.83Å; L956-W960 WeakPolarHBondContact O-CB 3.27Å; L956-W960 PolarHBondContact O-N 2.8Å
957	N	87.1	Confident	80.5	Confident	67 Å²	67	32.8 Å²	32.8	36%	0.358	17%	0.172	S	C	.	.	H	α-helix	trans	-60.7	-45.4	179	-169.1	8.5	0	0	0	111.7	D860 S955 W960 K961	D860-N957 VanDerWaalsContact OD1-CB 3.29Å; D860-N957 WeakPolarHBondContact OD1-CB 3.36Å; D860-N957 PolarHBondContact OD1-N 3.22Å; S955-N957 VanDerWaalsContact C-N 3.34Å; S955-N957 PolarHBondContact OG-N 3.17Å; N957-W960 PolarHBondContact O-N 3.44Å; N957-K961 WeakPolarHBondContact O-CB 3.47Å; N957-K961 WeakPolarHBondContact O-CG 3.48Å; N957-K961 PolarHBondContact O-N 3.15Å
958	Y	88.8	Confident	81.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.6	-49.1	174.7	-175.1	-89.8	0	0	0	111.4	W948 P952 S955 L956 W960 K961 L962 L995 L1081	W948-Y958 HydrophobicContact CD2-CD2 4.06Å; W948-Y958 AromaticContact CE2-CD2 3.66Å; W948-Y958 HydrophobicContact CE3-CD2 4.44Å; W948-Y958 HydrophobicContact CH2-CD2 4.12Å; W948-Y958 AromaticContact CZ2-CD2 3.71Å; W948-Y958 HydrophobicContact CZ2-CD2 3.71Å; W948-Y958 HydrophobicContact CZ2-CE2 4.3Å; W948-Y958 HydrophobicContact CZ3-CD2 4.47Å; P952-Y958 HydrophobicContact CB-CD1 3.81Å; P952-Y958 HydrophobicContact CB-CD2 3.84Å; P952-Y958 HydrophobicContact CB-CE1 3.93Å; P952-Y958 HydrophobicContact CB-CE2 3.95Å; P952-Y958 HydrophobicContact CB-CG 3.77Å; P952-Y958 HydrophobicContact CG-CD2 4.41Å; P952-Y958 HydrophobicContact CG-CE2 4.46Å; P952-Y958 VanDerWaalsContact O-CD1 3.28Å; P952-Y958 WeakPolarHBondContact O-CD1 3.46Å; S955-Y958 PolarHBondContact OG-N 2.82Å; L956-Y958 PolarHBondContact O-N 2.97Å; Y958-W960 VanDerWaalsContact C-N 3.28Å; Y958-W960 PolarHBondContact O-N 3.14Å; Y958-K961 PolarHBondContact O-N 3.48Å; Y958-L962 HydrophobicContact CE1-CD2 4.28Å; Y958-L962 VanDerWaalsContact O-CB 3.28Å; Y958-L962 WeakPolarHBondContact O-CB 3.24Å; Y958-L962 PolarHBondContact O-N 3.01Å; Y958-L995 HydrophobicContact CE1-CD1 3.72Å; Y958-L995 WeakPolarHBondContact OH-CD1 3.33Å; Y958-L1081 HydrophobicContact CD2-CD2 4.06Å; Y958-L1081 HydrophobicContact CE2-CD2 3.78Å; Y958-L1081 PolarHBondContact OH-O 2.94Å
959	R	89.3	Confident	83.4	Confident	4 Å²	4	36.9 Å²	36.9	2%	0.015	19%	0.188	C	C	.	.	H	α-helix	trans	-59.2	-39.6	178.3	-71.5	-176.6	-68.9	177.7	-1.8	112.5	S862 L876 S954 S955 L956 S963 I987	S862-R959 PolarHBondContact O-NH2 2.76Å; L876-R959 HydrophobicContact CD2-CB 3.73Å; S954-R959 PolarHBondContact O-NH2 3.15Å; S955-R959 WeakPolarHBondContact O-CB 3.4Å; S955-R959 WeakPolarHBondContact O-CG 3.31Å; S955-R959 PolarHBondContact O-N 2.94Å; S955-R959 VanDerWaalsContact O-N 3.12Å; S955-R959 PolarHBondContact O-NE 2.94Å; S955-R959 VanDerWaalsContact O-NE 3.16Å; L956-R959 PolarHBondContact O-N 2.83Å; R959-S963 PolarHBondContact O-N 3.35Å; R959-I987 HydrophobicContact CB-CD1 4.35Å; R959-I987 HydrophobicContact CG-CD1 3.63Å
960	W	88.3	Confident	84.9	Confident	45 Å²	45	33.9 Å²	33.9	17%	0.17	17%	0.167	C	C	.	.	H	α-helix	trans	-66.4	-50.5	176.8	-176.9	-89.9	0	0	0	111.8	R829 F830 K831 I874 L956 N957 Y958 L962 S963 N964	R829-W960 HydrophobicContact CB-CE3 3.97Å; R829-W960 HydrophobicContact CB-CH2 4.32Å; R829-W960 HydrophobicContact CB-CZ3 3.7Å; R829-W960 HydrophobicContact CG-CZ3 4.4Å; F830-W960 WeakPolarHBondContact O-CZ3 3.35Å; K831-W960 HydrophobicContact CB-CH2 4.23Å; I874-W960 HydrophobicContact CB-CE3 4.32Å; I874-W960 HydrophobicContact CB-CH2 4.11Å; I874-W960 HydrophobicContact CB-CZ3 3.88Å; I874-W960 HydrophobicContact CG2-CH2 3.79Å; I874-W960 HydrophobicContact CG2-CZ2 4.18Å; I874-W960 HydrophobicContact CG2-CZ3 4.1Å; L956-W960 WeakPolarHBondContact O-CB 3.27Å; L956-W960 PolarHBondContact O-N 2.8Å; N957-W960 PolarHBondContact O-N 3.44Å; Y958-W960 VanDerWaalsContact C-N 3.28Å; Y958-W960 PolarHBondContact O-N 3.14Å; W960-L962 VanDerWaalsContact C-N 3.31Å; W960-L962 PolarHBondContact O-N 3.43Å; W960-S963 PolarHBondContact O-N 2.95Å; W960-N964 PolarHBondContact NE1-ND2 3.08Å; W960-N964 VanDerWaalsContact NE1-ND2 3.11Å; W960-N964 WeakPolarHBondContact O-CB 3.26Å; W960-N964 PolarHBondContact O-N 3.25Å
961	K	88.6	Confident	86	Confident	73 Å²	73	35.9 Å²	35.9	32%	0.317	18%	0.175	S	C	.	.	H	α-helix	trans	-60.2	-40.2	176.1	-78.8	175.8	169.3	-167.5	0	111.8	W948 N957 Y958 N964 A965 L1081	W948-K961 HydrophobicContact CH2-CD 3.66Å; W948-K961 HydrophobicContact CZ3-CD 4.3Å; N957-K961 WeakPolarHBondContact O-CB 3.47Å; N957-K961 WeakPolarHBondContact O-CG 3.48Å; N957-K961 PolarHBondContact O-N 3.15Å; Y958-K961 PolarHBondContact O-N 3.48Å; K961-N964 PolarHBondContact O-N 2.83Å; K961-A965 WeakPolarHBondContact O-CB 3.05Å; K961-A965 PolarHBondContact O-N 3.42Å; K961-L1081 HydrophobicContact CB-CD2 3.95Å
962	L	90.9	Very high	86	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.6	-50	175.4	177.2	62.9	0	0	0	112	I933 Y958 W960 N964 A965 I966 I984 I987 V997 M1076 L1081	I933-L962 HydrophobicContact CD1-CD1 3.79Å; Y958-L962 HydrophobicContact CE1-CD2 4.28Å; Y958-L962 VanDerWaalsContact O-CB 3.28Å; Y958-L962 WeakPolarHBondContact O-CB 3.24Å; Y958-L962 PolarHBondContact O-N 3.01Å; W960-L962 VanDerWaalsContact C-N 3.31Å; W960-L962 PolarHBondContact O-N 3.43Å; L962-N964 VanDerWaalsContact C-N 3.31Å; L962-N964 PolarHBondContact O-N 3.15Å; L962-A965 PolarHBondContact O-N 3.08Å; L962-I966 HydrophobicContact CD1-CD1 3.96Å; L962-I966 HydrophobicContact CD1-CG1 4.38Å; L962-I966 HydrophobicContact CG-CD1 4.2Å; L962-I966 WeakPolarHBondContact O-CG1 3.3Å; L962-I966 PolarHBondContact O-N 2.96Å; L962-I966 VanDerWaalsContact O-N 3.13Å; L962-I984 HydrophobicContact CD2-CD1 4.34Å; L962-I984 HydrophobicContact CG-CD1 4.31Å; L962-I987 HydrophobicContact CD2-CD1 3.97Å; L962-V997 HydrophobicContact CD2-CG1 3.98Å; L962-V997 HydrophobicContact CD2-CG2 3.8Å; L962-M1076 HydrophobicContact CD1-CE 3.6Å; L962-L1081 HydrophobicContact CB-CD1 4.44Å; L962-L1081 HydrophobicContact CB-CD2 4.29Å; L962-L1081 HydrophobicContact CD1-CD1 4.23Å
963	S	89.6	Confident	85.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58	-44.1	174.7	176.4	0	0	0	0	111.4	R829 R959 W960 D967	R829-S963 PolarHBondContact NH1-O 3.3Å; R829-S963 PolarHBondContact NH1-OG 3.29Å; R959-S963 PolarHBondContact O-N 3.35Å; W960-S963 PolarHBondContact O-N 2.95Å; S963-D967 VanDerWaalsContact O-CB 3.27Å; S963-D967 WeakPolarHBondContact O-CB 3.45Å; S963-D967 PolarHBondContact O-N 3.43Å
964	N	87.8	Confident	85.3	Confident	53 Å²	53	40.9 Å²	40.9	28%	0.283	21%	0.214	S	C	.	.	H	α-helix	trans	-64.4	-42.3	178.7	-74.8	-2.5	0	0	0	112.7	R829 W960 K961 L962 D967 K968	R829-N964 VanDerWaalsContact CD-OD1 3.3Å; R829-N964 WeakPolarHBondContact CD-OD1 3.03Å; R829-N964 PolarHBondContact NE-OD1 3.27Å; R829-N964 VanDerWaalsContact NH1-CA 3.31Å; R829-N964 PolarHBondContact NH1-OD1 3.18Å; W960-N964 PolarHBondContact NE1-ND2 3.08Å; W960-N964 VanDerWaalsContact NE1-ND2 3.11Å; W960-N964 WeakPolarHBondContact O-CB 3.26Å; W960-N964 PolarHBondContact O-N 3.25Å; K961-N964 PolarHBondContact O-N 2.83Å; L962-N964 VanDerWaalsContact C-N 3.31Å; L962-N964 PolarHBondContact O-N 3.15Å; N964-D967 PolarHBondContact O-N 2.83Å; N964-K968 VanDerWaalsContact O-CB 3.23Å; N964-K968 WeakPolarHBondContact O-CB 3.21Å; N964-K968 PolarHBondContact O-N 3.1Å
965	A	89.4	Confident	84.1	Confident	7 Å²	7	43.7 Å²	43.7	6%	0.058	23%	0.233	C	C	.	.	H	α-helix	trans	-65.7	-44	-178.5	0	0	0	0	0	111.5	K961 L962 F969 H1075 M1076 L1081	K961-A965 WeakPolarHBondContact O-CB 3.05Å; K961-A965 PolarHBondContact O-N 3.42Å; L962-A965 PolarHBondContact O-N 3.08Å; A965-F969 WeakPolarHBondContact O-CB 3.19Å; A965-F969 PolarHBondContact O-N 3.48Å; A965-H1075 PolarHBondContact O-NE2 3.04Å; A965-M1076 HydrophobicContact CB-SD 4.02Å; A965-L1081 HydrophobicContact CB-CD1 3.38Å
966	I	90.6	Very high	82.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64	-46.6	176.9	-61.3	169.8	0	0	0	109.9	L931 L962 K968 F969 L970 V982 W999 M1076	L931-I966 HydrophobicContact CD1-CD1 4.23Å; L962-I966 HydrophobicContact CD1-CD1 3.96Å; L962-I966 HydrophobicContact CD1-CG1 4.38Å; L962-I966 HydrophobicContact CG-CD1 4.2Å; L962-I966 WeakPolarHBondContact O-CG1 3.3Å; L962-I966 PolarHBondContact O-N 2.96Å; L962-I966 VanDerWaalsContact O-N 3.13Å; I966-K968 PolarHBondContact O-N 2.94Å; I966-F969 WeakPolarHBondContact O-CB 3.24Å; I966-F969 PolarHBondContact O-N 3.37Å; I966-F969 VanDerWaalsContact O-N 3.16Å; I966-L970 HydrophobicContact CG2-CD1 4.12Å; I966-L970 WeakPolarHBondContact O-CG 3.18Å; I966-L970 PolarHBondContact O-N 2.89Å; I966-V982 HydrophobicContact CB-CG1 4.31Å; I966-V982 HydrophobicContact CB-CG2 4.3Å; I966-V982 HydrophobicContact CG2-CG1 3.99Å; I966-V982 HydrophobicContact CG2-CG2 3.74Å; I966-W999 HydrophobicContact CD1-CD2 4.47Å; I966-W999 HydrophobicContact CD1-CG 4.47Å; I966-W999 HydrophobicContact CG2-CD2 4.22Å; I966-W999 HydrophobicContact CG2-CE3 4.14Å; I966-W999 HydrophobicContact CG2-CH2 3.58Å; I966-W999 HydrophobicContact CG2-CZ2 3.64Å; I966-W999 HydrophobicContact CG2-CZ3 3.84Å; I966-M1076 HydrophobicContact CG1-SD 4.4Å
967	D	88.3	Confident	80.8	Confident	8 Å²	8	55.9 Å²	55.9	4%	0.043	31%	0.313	C	S	.	.	H	α-helix	trans	-64	-42	-178.5	-169.6	53.2	0	0	0	112.3	R829 S963 N964 F969 L970 H971 D981 V982	R829-D967 IonicContact CZ-OD2 3.87Å; R829-D967 IonicContact NH1-OD2 3.7Å; R829-D967 IonicContact NH2-OD2 2.77Å; R829-D967 PolarHBondContact NH2-OD2 3.01Å; S963-D967 VanDerWaalsContact O-CB 3.27Å; S963-D967 WeakPolarHBondContact O-CB 3.45Å; S963-D967 PolarHBondContact O-N 3.43Å; N964-D967 PolarHBondContact O-N 2.83Å; D967-F969 VanDerWaalsContact C-N 3.28Å; D967-F969 PolarHBondContact O-N 3.01Å; D967-L970 PolarHBondContact O-N 3.09Å; D967-H971 PolarHBondContact O-N 2.68Å; D967-H971 IonicContact OD1-ND1 3.46Å; D967-D981 PolarHBondContact OD1-N 2.91Å; D967-V982 HydrophobicContact CB-CB 4.46Å; D967-V982 HydrophobicContact CB-CG2 3.87Å
968	K	85.9	Confident	79.8	Confident	144 Å²	144	54.8 Å²	54.8	63%	0.626	31%	0.31	S	S	*	.	H	α-helix	trans	-64.1	-32.1	174.7	-172.7	178.1	-179.8	-175.3	0	112.7	N964 I966 H971 P972	N964-K968 VanDerWaalsContact O-CB 3.23Å; N964-K968 WeakPolarHBondContact O-CB 3.21Å; N964-K968 PolarHBondContact O-N 3.1Å; I966-K968 PolarHBondContact O-N 2.94Å; K968-H971 CarbonylContact O-C 3.53Å; K968-P972 WeakPolarHBondContact O-CA 3.26Å
969	F	88	Confident	79	Confident	32 Å²	32	62 Å²	62	14%	0.14	35%	0.349	C	S	.	.	H	α-helix	trans	-70.9	-40.8	176	-174.9	-103.7	0	0	0	112	A965 I966 D967 L1034 L1035 H1071 F1072 H1075	A965-F969 WeakPolarHBondContact O-CB 3.19Å; A965-F969 PolarHBondContact O-N 3.48Å; I966-F969 WeakPolarHBondContact O-CB 3.24Å; I966-F969 PolarHBondContact O-N 3.37Å; I966-F969 VanDerWaalsContact O-N 3.16Å; D967-F969 VanDerWaalsContact C-N 3.28Å; D967-F969 PolarHBondContact O-N 3.01Å; F969-L1034 HydrophobicContact CE1-CB 4.08Å; F969-L1034 WeakPolarHBondContact CE1-O 3.32Å; F969-L1035 HydrophobicContact CD1-CD2 4.43Å; F969-L1035 HydrophobicContact CE1-CD2 4.3Å; F969-H1071 HydrophobicContact CE2-CB 4.2Å; F969-H1071 HydrophobicContact CZ-CB 4.31Å; F969-F1072 AromaticContact CD1-CD2 3.49Å; F969-F1072 HydrophobicContact CD1-CD2 3.49Å; F969-F1072 VanDerWaalsContact CD1-CD2 3.49Å; F969-F1072 HydrophobicContact CD1-CE2 4.09Å; F969-F1072 HydrophobicContact CD1-CG 4.42Å; F969-F1072 HydrophobicContact CD2-CD2 4.22Å; F969-F1072 HydrophobicContact CE1-CB 3.83Å; F969-F1072 AromaticContact CE1-CD2 3.55Å; F969-F1072 HydrophobicContact CE1-CD2 3.55Å; F969-F1072 HydrophobicContact CE1-CG 4.05Å; F969-F1072 HydrophobicContact CE2-CB 4.16Å; F969-F1072 HydrophobicContact CE2-CD2 4.29Å; F969-F1072 AromaticContact CG-CD2 3.83Å; F969-F1072 HydrophobicContact CG-CD2 3.83Å; F969-F1072 HydrophobicContact CG-CE2 4.41Å; F969-F1072 HydrophobicContact CZ-CB 3.59Å; F969-F1072 AromaticContact CZ-CD2 3.98Å; F969-F1072 HydrophobicContact CZ-CD2 3.98Å; F969-F1072 HydrophobicContact CZ-CG 4.25Å; F969-H1075 HydrophobicContact CD2-CB 3.84Å; F969-H1075 AromaticContact CD2-CD2 3.83Å; F969-H1075 AromaticContact CD2-CG 3.74Å; F969-H1075 HydrophobicContact CE2-CB 4.22Å
970	L	86.5	Confident	78.3	Confident	17 Å²	17	63.1 Å²	63.1	9%	0.089	36%	0.356	C	S	.	.	H	α-helix	trans	-74.9	-34.8	179.5	-62.1	176	0	0	0	112.4	I966 D967 V982 W999 Q1001 L1031 L1034	I966-L970 HydrophobicContact CG2-CD1 4.12Å; I966-L970 WeakPolarHBondContact O-CG 3.18Å; I966-L970 PolarHBondContact O-N 2.89Å; D967-L970 PolarHBondContact O-N 3.09Å; L970-V982 HydrophobicContact CD1-CG2 3.8Å; L970-W999 HydrophobicContact CD1-CH2 3.74Å; L970-W999 HydrophobicContact CD1-CZ3 3.71Å; L970-W999 HydrophobicContact CD2-CH2 4.48Å; L970-Q1001 HydrophobicContact CD1-CG 4.41Å; L970-L1031 HydrophobicContact CD2-CD1 3.61Å; L970-L1034 HydrophobicContact CD2-CD1 4.24Å
971	H	81.7	Confident	78	Confident	63 Å²	63	61.6 Å²	61.6	29%	0.292	35%	0.352	S	S	.	.			trans	-128.7	72	-178.8	-56	105.5	0	0	0	112	D967 K968 N973 C974 D981	D967-H971 PolarHBondContact O-N 2.68Å; D967-H971 IonicContact OD1-ND1 3.46Å; K968-H971 CarbonylContact O-C 3.53Å; H971-N973 PolarHBondContact O-N 2.74Å; H971-C974 HydrophobicContact CB-CB 3.82Å; H971-C974 VanDerWaalsContact O-CB 3.25Å; H971-C974 WeakPolarHBondContact O-CB 3.42Å; H971-C974 PolarHBondContact O-N 3.46Å; H971-C974 VanDerWaalsContact O-N 3.12Å; H971-D981 VanDerWaalsContact CE1-CB 3.46Å; H971-D981 WeakPolarHBondContact CE1-CB 3.45Å; H971-D981 IonicContact CE1-OD2 3.32Å; H971-D981 PolarHBondContact CE1-OD2 2.93Å; H971-D981 IonicContact NE2-OD2 3.6Å
972	P	74.5	Confident	78	Confident	97 Å²	97	58.1 Å²	58.1	63%	0.63	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.3	-178.1	25.3	-34.6	0	0	0	113.3	K968 C974	K968-P972 WeakPolarHBondContact O-CA 3.26Å; P972-C974 VanDerWaalsContact C-N 3.31Å
973	N	73.6	Confident	77.7	Confident	152 Å²	152	58.3 Å²	58.3	81%	0.813	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-0.9	-179.2	-63.2	-17.2	0	0	0	113.5	H971 S975	H971-N973 PolarHBondContact O-N 2.74Å; N973-S975 PolarHBondContact O-N 2.78Å
974	C	67	Low	77.6	Confident	52 Å²	52	58.3 Å²	58.3	35%	0.351	34%	0.338	S	S	.	.			trans	-75.3	95.9	179.3	-150.6	0	0	0	0	109.7	H971 P972 C978	H971-C974 HydrophobicContact CB-CB 3.82Å; H971-C974 VanDerWaalsContact O-CB 3.25Å; H971-C974 WeakPolarHBondContact O-CB 3.42Å; H971-C974 PolarHBondContact O-N 3.46Å; H971-C974 VanDerWaalsContact O-N 3.12Å; P972-C974 VanDerWaalsContact C-N 3.31Å; C974-C978 HydrophobicContact CB-CB 4.32Å; C974-C978 WeakPolarHBondContact CB-SG 3.23Å; C974-C978 WeakPolarHBondContact SG-CB 3.29Å; C974-C978 CovalentContact SG-SG 2.04Å; C974-C978 PolarHBondContact SG-SG 2.9Å
975	S	54.9	Low	77.1	Confident	101 Å²	101	58.6 Å²	58.6	71%	0.706	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-74.9	128.2	172	-62.5	0	0	0	0	109	N973	N973-S975 PolarHBondContact O-N 2.78Å
976	P	53.8	Low	76.8	Confident	120 Å²	120	62.9 Å²	62.9	78%	0.779	35%	0.354	S	S	*	.	S	Bend	trans	-61.6	145.1	179.3	22.1	-30.4	0	0	0	111.5
977	P	53.1	Low	76.5	Confident	138 Å²	138	63.6 Å²	63.6	90%	0.896	36%	0.358	S	S	*	.	S	Bend	cis	-89.9	118.2	9	33.2	-30.3	0	0	0	112.2
978	C	65.9	Low	76.1	Confident	44 Å²	44	65.7 Å²	65.7	30%	0.297	37%	0.371	S	S	.	.			trans	-121.7	146.8	169.8	63.7	0	0	0	0	112	C974	C974-C978 HydrophobicContact CB-CB 4.32Å; C974-C978 WeakPolarHBondContact CB-SG 3.23Å; C974-C978 WeakPolarHBondContact SG-CB 3.29Å; C974-C978 CovalentContact SG-SG 2.04Å; C974-C978 PolarHBondContact SG-SG 2.9Å
979	N	71.6	Confident	75.7	Confident	153 Å²	153	62.1 Å²	62.1	82%	0.818	36%	0.356	S	S	*	.			trans	-67.2	137.6	178.7	-73.8	-12.6	0	0	0	109.2	D981	N979-D981 PolarHBondContact O-N 2.77Å
980	P	75.2	Confident	74.7	Confident	27 Å²	27	62.3 Å²	62.3	18%	0.175	36%	0.358	C	S	.	.			trans	-62.4	129.9	178.7	26.5	-33.6	0	0	0	110.1	R829 V982 L1002	R829-P980 HydrophobicContact CG-CB 3.77Å; R829-P980 HydrophobicContact CG-CG 3.79Å; P980-V982 VanDerWaalsContact C-N 3.32Å; P980-L1002 WeakPolarHBondContact O-CD1 2.88Å
981	D	82	Confident	73.6	Confident	13 Å²	13	66.5 Å²	66.5	7%	0.07	38%	0.38	C	S	.	.			trans	-94	6.5	173.6	-162.5	36.4	0	0	0	112.7	D967 H971 N979 Q1001 L1002 S1003	D967-D981 PolarHBondContact OD1-N 2.91Å; H971-D981 VanDerWaalsContact CE1-CB 3.46Å; H971-D981 WeakPolarHBondContact CE1-CB 3.45Å; H971-D981 IonicContact CE1-OD2 3.32Å; H971-D981 PolarHBondContact CE1-OD2 2.93Å; H971-D981 IonicContact NE2-OD2 3.6Å; N979-D981 PolarHBondContact O-N 2.77Å; D981-Q1001 CarbonylContact O-C 3.56Å; D981-Q1001 WeakPolarHBondContact O-CA 3.49Å; D981-Q1001 WeakPolarHBondContact OD2-CG 3.38Å; D981-Q1001 PolarHBondContact OD2-NE2 2.6Å; D981-L1002 PolarHBondContact O-N 2.78Å; D981-S1003 WeakPolarHBondContact OD1-CA 3.34Å; D981-S1003 WeakPolarHBondContact OD1-CB 2.96Å; D981-S1003 PolarHBondContact OD1-N 2.75Å; D981-S1003 PolarHBondContact OD1-OG 3.4Å; D981-S1003 WeakPolarHBondContact OD2-CB 3.25Å; D981-S1003 PolarHBondContact OD2-OG 3.3Å
982	V	87	Confident	72.4	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.5	-175.8	176.2	0	0	0	0	109.9	I966 D967 L970 P980 I984 W999	I966-V982 HydrophobicContact CB-CG1 4.31Å; I966-V982 HydrophobicContact CB-CG2 4.3Å; I966-V982 HydrophobicContact CG2-CG1 3.99Å; I966-V982 HydrophobicContact CG2-CG2 3.74Å; D967-V982 HydrophobicContact CB-CB 4.46Å; D967-V982 HydrophobicContact CB-CG2 3.87Å; L970-V982 HydrophobicContact CD1-CG2 3.8Å; P980-V982 VanDerWaalsContact C-N 3.32Å; V982-I984 HydrophobicContact CG1-CG1 4.23Å; V982-W999 HydrophobicContact CG1-CD2 4.27Å; V982-W999 HydrophobicContact CG1-CE3 3.77Å; V982-W999 HydrophobicContact CG1-CZ3 4.39Å; V982-W999 HydrophobicContact CG2-CE3 4.49Å; V982-W999 HydrophobicContact CG2-CZ3 4.32Å
983	G	84.6	Confident	72.3	Confident	3 Å²	3	69.3 Å²	69.3	3%	0.031	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	111.9	171	0	0	0	0	0	111.6	G827 W999 A1000	G827-G983 CarbonylContact O-C 3.59Å; G827-G983 WeakPolarHBondContact O-CA 3.41Å; G983-W999 CarbonylContact O-C 3.52Å; G983-W999 WeakPolarHBondContact O-CA 3.46Å; G983-W999 VanDerWaalsContact O-CB 3.31Å; G983-W999 WeakPolarHBondContact O-CB 3.13Å; G983-A1000 PolarHBondContact N-O 2.87Å; G983-A1000 PolarHBondContact O-N 2.89Å
984	I	87.8	Confident	72.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	113.2	176.3	-60	-178.1	0	0	0	109.3	G827 L876 L878 L962 V982 I987 V997 W999	G827-I984 WeakPolarHBondContact CA-O 3.37Å; G827-I984 PolarHBondContact O-N 3.14Å; L876-I984 HydrophobicContact CD2-CD1 4.24Å; L878-I984 HydrophobicContact CD2-CG2 4.23Å; L962-I984 HydrophobicContact CD2-CD1 4.34Å; L962-I984 HydrophobicContact CG-CD1 4.31Å; V982-I984 HydrophobicContact CG1-CG1 4.23Å; I984-I987 HydrophobicContact CG2-CD1 3.86Å; I984-I987 HydrophobicContact CG2-CG1 3.75Å; I984-V997 HydrophobicContact CG2-CG1 4.26Å; I984-W999 HydrophobicContact CG1-CB 4.2Å
985	W	76.9	Confident	73.2	Confident	60 Å²	60	59.8 Å²	59.8	23%	0.227	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-52.5	-179.7	-165.7	-21.7	0	0	0	111.6	N879 W913 F914 T998	N879-W985 PolarHBondContact ND2-NE1 3.23Å; W913-W985 HydrophobicContact CZ2-CE3 4.39Å; F914-W985 AromaticContact CD2-CH2 3.78Å; F914-W985 HydrophobicContact CD2-CH2 3.78Å; F914-W985 HydrophobicContact CD2-CZ2 4.16Å; F914-W985 HydrophobicContact CD2-CZ3 4.41Å; F914-W985 AromaticContact CE2-CH2 3.56Å; F914-W985 HydrophobicContact CE2-CH2 3.56Å; F914-W985 HydrophobicContact CE2-CZ2 4.24Å; F914-W985 HydrophobicContact CE2-CZ3 4.27Å; W985-T998 HydrophobicContact CB-CG2 4.43Å; W985-T998 WeakPolarHBondContact CB-O 3.42Å; W985-T998 PolarHBondContact N-O 2.93Å
986	Q	83.1	Confident	74.6	Confident	96 Å²	96	55.6 Å²	55.6	45%	0.449	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	140.3	-170.7	-175.4	173.7	7.8	0	0	111.1	T988 V997 T998	Q986-T988 HydrophobicContact CG-CG2 3.93Å; Q986-V997 WeakPolarHBondContact O-CA 3.21Å; Q986-T998 PolarHBondContact N-O 2.89Å; Q986-T998 PolarHBondContact O-N 2.9Å
987	I	85.8	Confident	76.2	Confident	15 Å²	15	50 Å²	50	8%	0.077	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	120.3	169.1	-62.4	170	0	0	0	106.6	R959 L962 I984 L995 S996 V997	R959-I987 HydrophobicContact CB-CD1 4.35Å; R959-I987 HydrophobicContact CG-CD1 3.63Å; L962-I987 HydrophobicContact CD2-CD1 3.97Å; I984-I987 HydrophobicContact CG2-CD1 3.86Å; I984-I987 HydrophobicContact CG2-CG1 3.75Å; I987-L995 HydrophobicContact CG2-CD2 3.81Å; I987-S996 WeakPolarHBondContact CA-O 3.14Å; I987-V997 HydrophobicContact CG1-CG1 4.16Å; I987-V997 HydrophobicContact CG1-CG2 4.28Å; I987-V997 HydrophobicContact CG2-CG2 4.5Å
988	T	80.1	Confident	77.8	Confident	53 Å²	53	44.7 Å²	44.7	33%	0.325	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136	177.4	37.5	0	0	0	0	110.2	Q986 Q990 S996	Q986-T988 HydrophobicContact CG-CG2 3.93Å; T988-Q990 PolarHBondContact O-N 3.3Å; T988-S996 PolarHBondContact N-O 2.83Å; T988-S996 PolarHBondContact O-N 2.96Å; T988-S996 PolarHBondContact O-OG 2.81Å; T988-S996 PolarHBondContact OG1-OG 2.97Å
989	Q	77.8	Confident	78.9	Confident	68 Å²	68	42.7 Å²	42.7	32%	0.318	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	121	171.4	-170.1	72.9	21.4	0	0	108.7	N991 V992 S994	Q989-N991 WeakPolarHBondContact CG-O 3.22Å; Q989-V992 PolarHBondContact NE2-O 2.95Å; Q989-V992 VanDerWaalsContact NE2-O 3.14Å; Q989-S994 CarbonylContact C-O 3.55Å; Q989-S994 VanDerWaalsContact CD-O 3.28Å; Q989-S994 PolarHBondContact NE2-O 3.35Å
990	Q	65.7	Low	79.5	Confident	37 Å²	37	35.6 Å²	35.6	17%	0.173	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.8	171.5	-70	-169.7	-20.1	0	0	108.6	T988 S994 S996	T988-Q990 PolarHBondContact O-N 3.3Å; Q990-S994 CarbonylContact C-O 3.56Å; Q990-S994 PolarHBondContact N-O 2.03Å; Q990-S994 CarbonylContact O-C 3.51Å; Q990-S994 WeakPolarHBondContact O-CA 3.49Å; Q990-S994 WeakPolarHBondContact O-CB 3.44Å; Q990-S994 PolarHBondContact O-N 2.65Å; Q990-S994 PolarHBondContact O-OG 2.92Å; Q990-S996 VanDerWaalsContact CD-CB 3.43Å; Q990-S996 PolarHBondContact NE2-OG 2.81Å
991	N	62.6	Low	80.1	Confident	104 Å²	104	35.6 Å²	35.6	56%	0.556	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	-173.7	-172.5	-53.1	-33.7	0	0	0	113.1	Q989 N993 Q1059	Q989-N991 WeakPolarHBondContact CG-O 3.22Å; N991-N993 VanDerWaalsContact C-N 3.26Å; N991-N993 PolarHBondContact O-N 2.85Å; N991-Q1059 PolarHBondContact ND2-NE2 3.11Å; N991-Q1059 VanDerWaalsContact ND2-NE2 3.12Å
992	V	58.5	Low	80	Confident	131 Å²	131	35.9 Å²	35.9	79%	0.794	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-31.8	-178.1	-166.2	0	0	0	0	111.2	Q989	Q989-V992 PolarHBondContact NE2-O 2.95Å; Q989-V992 VanDerWaalsContact NE2-O 3.14Å
993	N	70.5	Confident	79.7	Confident	89 Å²	89	38.5 Å²	38.5	48%	0.476	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.5	5	-165.3	-64.4	6.6	0	0	0	116.3	P935 N991	P935-N993 WeakPolarHBondContact CD-O 3.12Å; N991-N993 VanDerWaalsContact C-N 3.26Å; N991-N993 PolarHBondContact O-N 2.85Å
994	S	76.3	Confident	79.4	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.021	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	152	180	72	0	0	0	0	113.1	I933 Q989 Q990	I933-S994 CarbonylContact O-C 3.56Å; I933-S994 WeakPolarHBondContact O-CA 3.46Å; Q989-S994 CarbonylContact C-O 3.55Å; Q989-S994 VanDerWaalsContact CD-O 3.28Å; Q989-S994 PolarHBondContact NE2-O 3.35Å; Q990-S994 CarbonylContact C-O 3.56Å; Q990-S994 PolarHBondContact N-O 2.03Å; Q990-S994 CarbonylContact O-C 3.51Å; Q990-S994 WeakPolarHBondContact O-CA 3.49Å; Q990-S994 WeakPolarHBondContact O-CB 3.44Å; Q990-S994 PolarHBondContact O-N 2.65Å; Q990-S994 PolarHBondContact O-OG 2.92Å
995	L	84.4	Confident	78.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.5	176.2	-71.9	150.5	0	0	0	109.1	R932 I933 P935 P952 Y958 I987	R932-L995 CarbonylContact C-O 3.54Å; R932-L995 WeakPolarHBondContact CA-O 3.21Å; I933-L995 PolarHBondContact N-O 2.88Å; I933-L995 PolarHBondContact O-N 3.47Å; P935-L995 HydrophobicContact CG-CD1 3.41Å; P935-L995 VanDerWaalsContact CG-CD1 3.41Å; P935-L995 HydrophobicContact CG-CG 4.28Å; P952-L995 HydrophobicContact CB-CD1 3.65Å; P952-L995 HydrophobicContact CB-CD2 4.42Å; P952-L995 HydrophobicContact CG-CD1 4.5Å; Y958-L995 HydrophobicContact CE1-CD1 3.72Å; Y958-L995 WeakPolarHBondContact OH-CD1 3.33Å; I987-L995 HydrophobicContact CG2-CD2 3.81Å
996	S	83.2	Confident	78.2	Confident	14 Å²	14	41.9 Å²	41.9	10%	0.098	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125	164.9	61.4	0	0	0	0	110.1	L931 I987 T988 Q990	L931-S996 VanDerWaalsContact O-CA 3.32Å; L931-S996 WeakPolarHBondContact O-CA 3.31Å; I987-S996 WeakPolarHBondContact CA-O 3.14Å; T988-S996 PolarHBondContact N-O 2.83Å; T988-S996 PolarHBondContact O-N 2.96Å; T988-S996 PolarHBondContact O-OG 2.81Å; T988-S996 PolarHBondContact OG1-OG 2.97Å; Q990-S996 VanDerWaalsContact CD-CB 3.43Å; Q990-S996 PolarHBondContact NE2-OG 2.81Å
997	V	88.5	Confident	77.3	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.4	-178.3	-177.7	0	0	0	0	108.6	R930 L931 I933 L962 I984 Q986 I987	R930-V997 CarbonylContact C-O 3.57Å; R930-V997 WeakPolarHBondContact CA-O 3.33Å; L931-V997 HydrophobicContact CB-CB 4.3Å; L931-V997 PolarHBondContact N-O 2.86Å; L931-V997 PolarHBondContact O-N 2.88Å; I933-V997 HydrophobicContact CD1-CG2 3.92Å; L962-V997 HydrophobicContact CD2-CG1 3.98Å; L962-V997 HydrophobicContact CD2-CG2 3.8Å; I984-V997 HydrophobicContact CG2-CG1 4.26Å; Q986-V997 WeakPolarHBondContact O-CA 3.21Å; I987-V997 HydrophobicContact CG1-CG1 4.16Å; I987-V997 HydrophobicContact CG1-CG2 4.28Å; I987-V997 HydrophobicContact CG2-CG2 4.5Å
998	T	85.4	Confident	75.8	Confident	27 Å²	27	42.9 Å²	42.9	17%	0.166	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.7	173.5	-55.5	0	0	0	0	109.3	V929 R930 W985 Q986	V929-T998 CarbonylContact O-C 3.57Å; V929-T998 WeakPolarHBondContact O-CA 3.49Å; R930-T998 HydrophobicContact CG-CG2 4.08Å; W985-T998 HydrophobicContact CB-CG2 4.43Å; W985-T998 WeakPolarHBondContact CB-O 3.42Å; W985-T998 PolarHBondContact N-O 2.93Å; Q986-T998 PolarHBondContact N-O 2.89Å; Q986-T998 PolarHBondContact O-N 2.9Å
999	W	89.7	Confident	74.3	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.008	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	170.3	-176.4	66.6	-84.3	0	0	0	111.7	V929 I966 L970 V982 G983 I984 Q1001 L1031 L1035	V929-W999 WeakPolarHBondContact CA-O 3.41Å; V929-W999 HydrophobicContact CB-CD2 3.97Å; V929-W999 HydrophobicContact CB-CG 4.31Å; V929-W999 HydrophobicContact CB-CH2 4.48Å; V929-W999 HydrophobicContact CB-CZ2 3.91Å; V929-W999 HydrophobicContact CG1-CD2 4.43Å; V929-W999 HydrophobicContact CG1-CZ2 3.66Å; V929-W999 HydrophobicContact CG2-CD2 4.43Å; V929-W999 HydrophobicContact CG2-CH2 4.16Å; V929-W999 HydrophobicContact CG2-CZ2 4.05Å; V929-W999 HydrophobicContact CG2-CZ3 4.42Å; V929-W999 PolarHBondContact N-O 3.37Å; V929-W999 PolarHBondContact O-N 3.3Å; I966-W999 HydrophobicContact CD1-CD2 4.47Å; I966-W999 HydrophobicContact CD1-CG 4.47Å; I966-W999 HydrophobicContact CG2-CD2 4.22Å; I966-W999 HydrophobicContact CG2-CE3 4.14Å; I966-W999 HydrophobicContact CG2-CH2 3.58Å; I966-W999 HydrophobicContact CG2-CZ2 3.64Å; I966-W999 HydrophobicContact CG2-CZ3 3.84Å; L970-W999 HydrophobicContact CD1-CH2 3.74Å; L970-W999 HydrophobicContact CD1-CZ3 3.71Å; L970-W999 HydrophobicContact CD2-CH2 4.48Å; V982-W999 HydrophobicContact CG1-CD2 4.27Å; V982-W999 HydrophobicContact CG1-CE3 3.77Å; V982-W999 HydrophobicContact CG1-CZ3 4.39Å; V982-W999 HydrophobicContact CG2-CE3 4.49Å; V982-W999 HydrophobicContact CG2-CZ3 4.32Å; G983-W999 CarbonylContact O-C 3.52Å; G983-W999 WeakPolarHBondContact O-CA 3.46Å; G983-W999 VanDerWaalsContact O-CB 3.31Å; G983-W999 WeakPolarHBondContact O-CB 3.13Å; I984-W999 HydrophobicContact CG1-CB 4.2Å; W999-Q1001 HydrophobicContact CZ3-CB 4.39Å; W999-L1031 HydrophobicContact CH2-CD1 4.39Å; W999-L1035 HydrophobicContact CH2-CD1 3.92Å; W999-L1035 HydrophobicContact CH2-CD2 4.44Å; W999-L1035 HydrophobicContact CZ2-CD1 3.74Å; W999-L1035 HydrophobicContact CZ2-CD2 4.12Å
1000	A	85.3	Confident	72.4	Confident	5 Å²	5	48.5 Å²	48.5	4%	0.041	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	155.7	174.2	0	0	0	0	0	111.3	G983 L1005	G983-A1000 PolarHBondContact N-O 2.87Å; G983-A1000 PolarHBondContact O-N 2.89Å; A1000-L1005 HydrophobicContact CB-CD1 3.57Å; A1000-L1005 HydrophobicContact CB-CG 4.3Å
1001	Q	87	Confident	71.1	Confident	27 Å²	27	51.4 Å²	51.4	13%	0.126	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.6	174.4	-172.8	177.9	-3.5	0	0	109.9	H927 L970 D981 W999 L1004 L1005 L1031	H927-Q1001 PolarHBondContact CE1-O 2.87Å; H927-Q1001 VanDerWaalsContact CE1-O 3.26Å; H927-Q1001 PolarHBondContact NE2-N 3.11Å; H927-Q1001 VanDerWaalsContact NE2-N 3.17Å; L970-Q1001 HydrophobicContact CD1-CG 4.41Å; D981-Q1001 CarbonylContact O-C 3.56Å; D981-Q1001 WeakPolarHBondContact O-CA 3.49Å; D981-Q1001 WeakPolarHBondContact OD2-CG 3.38Å; D981-Q1001 PolarHBondContact OD2-NE2 2.6Å; W999-Q1001 HydrophobicContact CZ3-CB 4.39Å; Q1001-L1004 HydrophobicContact CB-CB 4.15Å; Q1001-L1004 HydrophobicContact CG-CB 4.22Å; Q1001-L1004 PolarHBondContact O-N 3.19Å; Q1001-L1005 WeakPolarHBondContact O-CG 3.45Å; Q1001-L1005 PolarHBondContact O-N 3.01Å; Q1001-L1031 HydrophobicContact CB-CD2 4.39Å
1002	L	80.3	Confident	69.9	Low	19 Å²	19	55 Å²	55	10%	0.099	30%	0.298	C	S	.	.	H	α-helix	trans	-72	-42.5	-168.1	-57.8	166.6	0	0	0	112.7	L828 P980 D981 L1004 L1005 Q1006	L828-L1002 HydrophobicContact CD1-CD1 4.24Å; L828-L1002 HydrophobicContact CD2-CD1 3.23Å; L828-L1002 HydrophobicContact CD2-CD2 3.9Å; L828-L1002 HydrophobicContact CD2-CG 4.12Å; L828-L1002 HydrophobicContact CG-CD1 4.4Å; P980-L1002 WeakPolarHBondContact O-CD1 2.88Å; D981-L1002 PolarHBondContact O-N 2.78Å; L1002-L1004 PolarHBondContact O-N 2.75Å; L1002-L1005 HydrophobicContact CD2-CD1 4.35Å; L1002-L1005 WeakPolarHBondContact O-CB 3.49Å; L1002-L1005 PolarHBondContact O-N 2.91Å; L1002-L1005 VanDerWaalsContact O-N 3.09Å; L1002-Q1006 WeakPolarHBondContact O-CG 3.39Å; L1002-Q1006 PolarHBondContact O-N 3.33Å
1003	S	79.5	Confident	68.8	Low	54 Å²	54	55.4 Å²	55.4	38%	0.378	30%	0.301	S	S	.	.	H	α-helix	trans	-60.7	-39.7	177.3	-64.6	0	0	0	0	110.5	D981 Q1006 E1007	D981-S1003 WeakPolarHBondContact OD1-CA 3.34Å; D981-S1003 WeakPolarHBondContact OD1-CB 2.96Å; D981-S1003 PolarHBondContact OD1-N 2.75Å; D981-S1003 PolarHBondContact OD1-OG 3.4Å; D981-S1003 WeakPolarHBondContact OD2-CB 3.25Å; D981-S1003 PolarHBondContact OD2-OG 3.3Å; S1003-Q1006 PolarHBondContact O-N 2.98Å; S1003-E1007 PolarHBondContact O-N 2.86Å
1004	L	78.9	Confident	67.4	Low	5 Å²	5	54.2 Å²	54.2	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-71.5	-32.4	176.9	-169.7	57.8	0	0	0	112	N926 Q1001 L1002 P1024 K1027 F1028 L1031	N926-L1004 PolarHBondContact ND2-O 3.42Å; Q1001-L1004 HydrophobicContact CB-CB 4.15Å; Q1001-L1004 HydrophobicContact CG-CB 4.22Å; Q1001-L1004 PolarHBondContact O-N 3.19Å; L1002-L1004 PolarHBondContact O-N 2.75Å; L1004-P1024 HydrophobicContact CD1-CB 4.42Å; L1004-P1024 HydrophobicContact CD1-CG 3.9Å; L1004-K1027 HydrophobicContact CD1-CB 3.44Å; L1004-K1027 VanDerWaalsContact CD1-CB 3.44Å; L1004-K1027 HydrophobicContact CD1-CD 4.26Å; L1004-K1027 HydrophobicContact CD1-CG 4.49Å; L1004-F1028 HydrophobicContact CD1-CE1 4.31Å; L1004-F1028 HydrophobicContact CD1-CE2 4.45Å; L1004-F1028 HydrophobicContact CD1-CZ 4.13Å; L1004-F1028 HydrophobicContact CD2-CD1 3.6Å; L1004-F1028 HydrophobicContact CD2-CE1 3.27Å; L1004-F1028 HydrophobicContact CD2-CG 4.35Å; L1004-F1028 HydrophobicContact CD2-CZ 3.91Å; L1004-F1028 HydrophobicContact CG-CD1 4.31Å; L1004-F1028 HydrophobicContact CG-CE1 3.61Å; L1004-F1028 HydrophobicContact CG-CE2 4.49Å; L1004-F1028 HydrophobicContact CG-CZ 3.71Å; L1004-L1031 HydrophobicContact CD2-CB 4.3Å; L1004-L1031 HydrophobicContact CD2-CD2 3.71Å
1005	L	73.5	Confident	65.7	Low	0 Å²	0	61.4 Å²	61.4	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-65.4	-35.8	172.6	-78.6	163.4	0	0	0	112.8	W913 F923 L925 N926 A1000 Q1001 L1002	W913-L1005 HydrophobicContact CH2-CD1 3.56Å; W913-L1005 HydrophobicContact CH2-CD2 4.43Å; W913-L1005 HydrophobicContact CZ3-CD1 3.63Å; F923-L1005 HydrophobicContact CE2-CB 4.41Å; F923-L1005 WeakPolarHBondContact CE2-O 3.24Å; F923-L1005 HydrophobicContact CZ-CB 4.24Å; F923-L1005 HydrophobicContact CZ-CD2 4.32Å; L925-L1005 HydrophobicContact CD2-CD2 4.17Å; N926-L1005 WeakPolarHBondContact OD1-CD2 3.46Å; A1000-L1005 HydrophobicContact CB-CD1 3.57Å; A1000-L1005 HydrophobicContact CB-CG 4.3Å; Q1001-L1005 WeakPolarHBondContact O-CG 3.45Å; Q1001-L1005 PolarHBondContact O-N 3.01Å; L1002-L1005 HydrophobicContact CD2-CD1 4.35Å; L1002-L1005 WeakPolarHBondContact O-CB 3.49Å; L1002-L1005 PolarHBondContact O-N 2.91Å; L1002-L1005 VanDerWaalsContact O-N 3.09Å
1006	Q	65.3	Low	63.5	Low	130 Å²	130	66.9 Å²	66.9	61%	0.607	39%	0.385	S	S	*	.	H	α-helix	trans	-78.8	-19.5	-179.1	-70.8	177.7	3	0	0	113.6	M917 L1002 S1003 Q1008	M917-Q1006 HydrophobicContact CE-CG 3.92Å; L1002-Q1006 WeakPolarHBondContact O-CG 3.39Å; L1002-Q1006 PolarHBondContact O-N 3.33Å; S1003-Q1006 PolarHBondContact O-N 2.98Å; Q1006-Q1008 VanDerWaalsContact C-N 3.29Å; Q1006-Q1008 PolarHBondContact O-N 3.01Å
1007	E	64.8	Low	61.4	Low	72 Å²	72	73.5 Å²	73.5	34%	0.336	42%	0.419	S	S	.	.			trans	-73.7	82.6	176.5	-79.5	-172.6	-152.3	0	0	112.1	S1003 P1024 K1027	S1003-E1007 PolarHBondContact O-N 2.86Å; E1007-P1024 HydrophobicContact CB-CG 4.13Å; E1007-K1027 IonicContact OE1-NZ 2.68Å; E1007-K1027 PolarHBondContact OE1-NZ 2.95Å; E1007-K1027 WeakPolarHBondContact OE2-CD 2.87Å; E1007-K1027 WeakPolarHBondContact OE2-CE 3.26Å; E1007-K1027 IonicContact OE2-NZ 3.76Å; E1007-K1027 PolarHBondContact OE2-NZ 2.9Å
1008	Q	54.4	Low	59.1	Low	59 Å²	59	76.1 Å²	76.1	28%	0.276	45%	0.446	S	S	.	.			trans	-90.9	125.7	158.9	-60.4	-160.5	-28.8	0	0	108.1	S922 Q1006 K1010	S922-Q1008 VanDerWaalsContact C-OE1 3.29Å; S922-Q1008 PolarHBondContact O-NE2 2.69Å; S922-Q1008 PolarHBondContact O-OE1 3.35Å; Q1006-Q1008 VanDerWaalsContact C-N 3.29Å; Q1006-Q1008 PolarHBondContact O-N 3.01Å; Q1008-K1010 PolarHBondContact O-N 2.8Å
1009	G	48.1	Very low	56.9	Low	39 Å²	39	82.2 Å²	82.2	40%	0.402	48%	0.477	S	S	.	.			trans	-42.3	116.8	-172.5	0	0	0	0	0	111.6	S1011 N1022	G1009-S1011 PolarHBondContact O-N 2.98Å; G1009-N1022 PolarHBondContact N-O 3.18Å
1010	K	38.9	Very low	54.8	Low	201 Å²	201	86.2 Å²	86.2	87%	0.874	50%	0.502	S	S	*	.			trans	-44.5	110.4	171.8	-75.3	-179.6	177.5	178.6	0	107.2	Q1008 Q1012	Q1008-K1010 PolarHBondContact O-N 2.8Å; K1010-Q1012 PolarHBondContact O-N 2.83Å
1011	S	37.1	Very low	53.1	Low	97 Å²	97	89 Å²	89	68%	0.678	52%	0.52	S	S	*	.			trans	-50.7	108.6	165.3	164.2	0	0	0	0	105.7	G1009 T1013	G1009-S1011 PolarHBondContact O-N 2.98Å; S1011-T1013 VanDerWaalsContact C-N 3.31Å; S1011-T1013 PolarHBondContact O-N 3.25Å
1012	Q	37.5	Very low	52	Low	180 Å²	180	93.5 Å²	93.5	84%	0.841	55%	0.545	S	S	*	.			trans	-61	105.9	171.1	-77.4	-178.4	-11.1	0	0	105.4	K1010 G1014	K1010-Q1012 PolarHBondContact O-N 2.83Å; Q1012-G1014 PolarHBondContact O-N 2.9Å
1013	T	37	Very low	51.3	Low	140 Å²	140	93.1 Å²	93.1	86%	0.859	54%	0.543	S	S	*	.	S	Bend	trans	-57.3	106.7	177.2	43.8	0	0	0	0	108.1	S1011	S1011-T1013 VanDerWaalsContact C-N 3.31Å; S1011-T1013 PolarHBondContact O-N 3.25Å
1014	G	39.4	Very low	50.9	Low	64 Å²	64	91.8 Å²	91.8	66%	0.66	53%	0.533	S	S	*	.	S	Bend	trans	112.3	68.1	174.1	0	0	0	0	0	113.3	Q1012	Q1012-G1014 PolarHBondContact O-N 2.9Å
1015	I	41.3	Very low	50.4	Low	154 Å²	154	93.6 Å²	93.6	79%	0.79	54%	0.54	S	S	*	.				-171.3	116.2	127.1	-84.5	142	0	0	0	105.9	D1017	I1015-D1017 PolarHBondContact O-N 2.83Å
1016	S	38.9	Very low	50.2	Low	115 Å²	115	101 Å²	101	80%	0.804	57%	0.574	S	S	*	*			trans	-73.9	87.2	178	54.8	0	0	0	0	109.6
1017	D	37.7	Very low	50.7	Low	153 Å²	153	99.6 Å²	99.6	82%	0.818	57%	0.566	S	S	*	*	S	Bend	trans	-158.5	111.4	159.4	-89.6	-35.1	0	0	0	110.8	I1015	I1015-D1017 PolarHBondContact O-N 2.83Å
1018	G	40.7	Very low	51.1	Low	55 Å²	55	96.2 Å²	96.2	57%	0.567	55%	0.551	S	S	*	*			trans	72	82.1	161.9	0	0	0	0	0	117.6	T1020	G1018-T1020 VanDerWaalsContact C-N 3.34Å; G1018-T1020 PolarHBondContact O-N 3.16Å
1019	N	40.5	Very low	51.8	Low	156 Å²	156	94 Å²	94	83%	0.834	54%	0.541	S	S	*	.			trans	-53	83.7	167.7	-74.2	-10	0	0	0	113.1
1020	T	45.2	Very low	53.2	Low	86 Å²	86	97.9 Å²	97.9	53%	0.528	55%	0.548	S	S	.	.			trans	-98.7	110.4	163	37.5	0	0	0	0	107.5	G1018 N1022	G1018-T1020 VanDerWaalsContact C-N 3.34Å; G1018-T1020 PolarHBondContact O-N 3.16Å; T1020-N1022 PolarHBondContact O-N 3.39Å; T1020-N1022 VanDerWaalsContact O-N 3.07Å
1021	P	50.1	Low	55.2	Low	64 Å²	64	88.4 Å²	88.4	42%	0.416	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-59.6	116.3	177.8	21.9	-30.4	0	0	0	108.8	C1023	P1021-C1023 PolarHBondContact O-N 2.82Å
1022	N	62.2	Low	57	Low	120 Å²	120	83.8 Å²	83.8	64%	0.642	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-80.9	116.7	-176.1	-153.1	19.6	0	0	0	108.6	G1009 T1020	G1009-N1022 PolarHBondContact N-O 3.18Å; T1020-N1022 PolarHBondContact O-N 3.39Å; T1020-N1022 VanDerWaalsContact O-N 3.07Å
1023	C	65.7	Low	58.5	Low	11 Å²	11	79.3 Å²	79.3	7%	0.074	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-73.3	133.6	179.2	-177.4	0	0	0	0	110.7	P1021 W1025 F1028 C1095	P1021-C1023 PolarHBondContact O-N 2.82Å; C1023-W1025 HydrophobicContact CB-CD2 4.22Å; C1023-W1025 HydrophobicContact CB-CG 4.44Å; C1023-W1025 HydrophobicContact CB-CZ2 4.05Å; C1023-W1025 VanDerWaalsContact O-CD1 3.25Å; C1023-W1025 PolarHBondContact O-N 3.01Å; C1023-F1028 VanDerWaalsContact SG-CE2 3.57Å; C1023-C1095 HydrophobicContact CB-CB 4.07Å; C1023-C1095 WeakPolarHBondContact CB-SG 3.44Å; C1023-C1095 VanDerWaalsContact SG-CA 3.57Å; C1023-C1095 WeakPolarHBondContact SG-CB 3.41Å; C1023-C1095 CovalentContact SG-SG 2.02Å; C1023-C1095 PolarHBondContact SG-SG 2.96Å
1024	P	72.8	Confident	60.6	Low	26 Å²	26	75.1 Å²	75.1	17%	0.169	43%	0.429	C	S	.	.			trans	-76.2	68.1	176.8	32	-36.6	0	0	0	111.8	L1004 E1007 E1026 K1027 F1028	L1004-P1024 HydrophobicContact CD1-CB 4.42Å; L1004-P1024 HydrophobicContact CD1-CG 3.9Å; E1007-P1024 HydrophobicContact CB-CG 4.13Å; P1024-E1026 VanDerWaalsContact C-N 3.32Å; P1024-E1026 PolarHBondContact O-N 2.67Å; P1024-K1027 HydrophobicContact CB-CB 4.48Å; P1024-K1027 PolarHBondContact O-N 2.55Å; P1024-K1027 VanDerWaalsContact O-N 3.12Å; P1024-F1028 HydrophobicContact CG-CD2 4.33Å; P1024-F1028 HydrophobicContact CG-CE2 3.79Å; P1024-F1028 HydrophobicContact CG-CZ 4.5Å; P1024-F1028 WeakPolarHBondContact O-CD2 3.23Å; P1024-F1028 PolarHBondContact O-N 3.17Å
1025	W	67.6	Low	62.6	Low	43 Å²	43	72 Å²	72	16%	0.163	40%	0.397	C	S	.	.	H	α-helix	trans	-54.8	-41.8	-174.7	-67.8	110.1	0	0	0	113.9	C1023 K1027 F1028 D1029 C1095 H1098	C1023-W1025 HydrophobicContact CB-CD2 4.22Å; C1023-W1025 HydrophobicContact CB-CG 4.44Å; C1023-W1025 HydrophobicContact CB-CZ2 4.05Å; C1023-W1025 VanDerWaalsContact O-CD1 3.25Å; C1023-W1025 PolarHBondContact O-N 3.01Å; W1025-K1027 VanDerWaalsContact C-N 3.27Å; W1025-K1027 PolarHBondContact O-N 3.23Å; W1025-F1028 PolarHBondContact O-N 3.41Å; W1025-D1029 WeakPolarHBondContact O-CB 3.36Å; W1025-D1029 VanDerWaalsContact O-CG 3.22Å; W1025-D1029 PolarHBondContact O-N 3.22Å; W1025-C1095 WeakPolarHBondContact CH2-O 3.43Å; W1025-H1098 AromaticContact CD2-CD2 3.99Å; W1025-H1098 AromaticContact CE2-CD2 3.71Å; W1025-H1098 HydrophobicContact CH2-CB 4.37Å; W1025-H1098 HydrophobicContact CZ2-CB 4.28Å; W1025-H1098 AromaticContact CZ2-CD2 3.83Å
1026	E	68.9	Low	63.9	Low	155 Å²	155	65 Å²	65	72%	0.724	36%	0.361	S	S	*	.	H	α-helix	trans	-59	-39.2	179.5	-68.8	-177.2	170.7	0	0	112.5	P1024 D1029 H1030	P1024-E1026 VanDerWaalsContact C-N 3.32Å; P1024-E1026 PolarHBondContact O-N 2.67Å; E1026-D1029 PolarHBondContact O-N 3Å; E1026-H1030 WeakPolarHBondContact O-CB 3.4Å; E1026-H1030 PolarHBondContact O-N 3.1Å
1027	K	76.5	Confident	64.8	Low	101 Å²	101	61.3 Å²	61.3	44%	0.439	33%	0.33	S	S	.	.	H	α-helix	trans	-76	-33.6	179.2	-68.6	178.1	177.7	173.7	0	112.3	L1004 E1007 P1024 W1025 H1030 L1031	L1004-K1027 HydrophobicContact CD1-CB 3.44Å; L1004-K1027 VanDerWaalsContact CD1-CB 3.44Å; L1004-K1027 HydrophobicContact CD1-CD 4.26Å; L1004-K1027 HydrophobicContact CD1-CG 4.49Å; E1007-K1027 IonicContact OE1-NZ 2.68Å; E1007-K1027 PolarHBondContact OE1-NZ 2.95Å; E1007-K1027 WeakPolarHBondContact OE2-CD 2.87Å; E1007-K1027 WeakPolarHBondContact OE2-CE 3.26Å; E1007-K1027 IonicContact OE2-NZ 3.76Å; E1007-K1027 PolarHBondContact OE2-NZ 2.9Å; P1024-K1027 HydrophobicContact CB-CB 4.48Å; P1024-K1027 PolarHBondContact O-N 2.55Å; P1024-K1027 VanDerWaalsContact O-N 3.12Å; W1025-K1027 VanDerWaalsContact C-N 3.27Å; W1025-K1027 PolarHBondContact O-N 3.23Å; K1027-H1030 PolarHBondContact O-N 3.33Å; K1027-L1031 WeakPolarHBondContact O-CB 3.47Å; K1027-L1031 PolarHBondContact O-N 3.21Å
1028	F	73.6	Confident	65.4	Low	1 Å²	1	54.5 Å²	54.5	0%	0.004	30%	0.296	C	S	.	.	H	α-helix	trans	-61.9	-45	169.6	-80.5	-56.3	0	0	0	112.6	N926 H927 L1004 C1023 P1024 W1025 H1030 L1031 Q1032 C1095	N926-F1028 HydrophobicContact CB-CE2 4.05Å; N926-F1028 HydrophobicContact CB-CZ 3.66Å; H927-F1028 HydrophobicContact CB-CD1 4.04Å; H927-F1028 HydrophobicContact CB-CE1 3.35Å; H927-F1028 HydrophobicContact CB-CZ 4.06Å; H927-F1028 AromaticContact CG-CE1 3.33Å; H927-F1028 AromaticContact ND1-CE1 3.39Å; H927-F1028 WeakPolarHBondContact ND1-CE1 3.08Å; H927-F1028 AromaticContact ND1-CZ 3.79Å; L1004-F1028 HydrophobicContact CD1-CE1 4.31Å; L1004-F1028 HydrophobicContact CD1-CE2 4.45Å; L1004-F1028 HydrophobicContact CD1-CZ 4.13Å; L1004-F1028 HydrophobicContact CD2-CD1 3.6Å; L1004-F1028 HydrophobicContact CD2-CE1 3.27Å; L1004-F1028 HydrophobicContact CD2-CG 4.35Å; L1004-F1028 HydrophobicContact CD2-CZ 3.91Å; L1004-F1028 HydrophobicContact CG-CD1 4.31Å; L1004-F1028 HydrophobicContact CG-CE1 3.61Å; L1004-F1028 HydrophobicContact CG-CE2 4.49Å; L1004-F1028 HydrophobicContact CG-CZ 3.71Å; C1023-F1028 VanDerWaalsContact SG-CE2 3.57Å; P1024-F1028 HydrophobicContact CG-CD2 4.33Å; P1024-F1028 HydrophobicContact CG-CE2 3.79Å; P1024-F1028 HydrophobicContact CG-CZ 4.5Å; P1024-F1028 WeakPolarHBondContact O-CD2 3.23Å; P1024-F1028 PolarHBondContact O-N 3.17Å; W1025-F1028 PolarHBondContact O-N 3.41Å; F1028-H1030 VanDerWaalsContact C-N 3.33Å; F1028-L1031 PolarHBondContact O-N 2.83Å; F1028-Q1032 VanDerWaalsContact O-CB 3.28Å; F1028-Q1032 WeakPolarHBondContact O-CB 3.3Å; F1028-Q1032 PolarHBondContact O-N 3.48Å; F1028-C1095 HydrophobicContact CE2-CB 4.27Å; F1028-C1095 VanDerWaalsContact CE2-SG 3.52Å
1029	D	68.5	Low	65.6	Low	13 Å²	13	52.7 Å²	52.7	7%	0.07	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-39.9	179.2	-71.4	-25.4	0	0	0	110.7	W1025 E1026 Q1032 N1033 T1040 R1091 R1164	W1025-D1029 WeakPolarHBondContact O-CB 3.36Å; W1025-D1029 VanDerWaalsContact O-CG 3.22Å; W1025-D1029 PolarHBondContact O-N 3.22Å; E1026-D1029 PolarHBondContact O-N 3Å; D1029-Q1032 PolarHBondContact O-N 2.93Å; D1029-N1033 WeakPolarHBondContact O-CB 3.5Å; D1029-N1033 PolarHBondContact O-N 3.43Å; D1029-N1033 PolarHBondContact O-ND2 3.18Å; D1029-T1040 HydrophobicContact CB-CG2 3.61Å; D1029-T1040 WeakPolarHBondContact OD1-CB 3.48Å; D1029-T1040 WeakPolarHBondContact OD1-CG2 3.43Å; D1029-R1091 IonicContact OD1-CZ 2.7Å; D1029-R1091 IonicContact OD1-NH1 3.52Å; D1029-R1091 IonicContact OD1-NH2 2.73Å; D1029-R1091 PolarHBondContact OD1-NH2 2.9Å; D1029-R1164 IonicContact OD2-CZ 3.37Å; D1029-R1164 VanDerWaalsContact OD2-CZ 3.29Å; D1029-R1164 IonicContact OD2-NH1 3.81Å; D1029-R1164 PolarHBondContact OD2-NH1 3.09Å; D1029-R1164 IonicContact OD2-NH2 3.53Å; D1029-R1164 PolarHBondContact OD2-NH2 3.2Å
1030	H	76.4	Confident	65.8	Low	121 Å²	121	46 Å²	46	56%	0.56	24%	0.238	S	C	*	.	H	α-helix	trans	-60.6	-51.3	171.8	-177	-89	0	0	0	112.2	E1026 K1027 F1028 Q1032 N1033 L1034	E1026-H1030 WeakPolarHBondContact O-CB 3.4Å; E1026-H1030 PolarHBondContact O-N 3.1Å; K1027-H1030 PolarHBondContact O-N 3.33Å; F1028-H1030 VanDerWaalsContact C-N 3.33Å; H1030-Q1032 VanDerWaalsContact C-N 3.29Å; H1030-Q1032 PolarHBondContact O-N 3.25Å; H1030-N1033 PolarHBondContact O-N 2.83Å; H1030-L1034 VanDerWaalsContact CE1-CD1 3.42Å; H1030-L1034 WeakPolarHBondContact CE1-CD1 3.24Å; H1030-L1034 WeakPolarHBondContact O-CG 3.15Å; H1030-L1034 PolarHBondContact O-N 3Å
1031	L	81.8	Confident	65.6	Low	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-57.7	-43.3	177	177.5	62.3	0	0	0	111.5	V929 L970 W999 Q1001 L1004 K1027 F1028 L1034 L1035	V929-L1031 HydrophobicContact CG2-CD2 4.4Å; L970-L1031 HydrophobicContact CD2-CD1 3.61Å; W999-L1031 HydrophobicContact CH2-CD1 4.39Å; Q1001-L1031 HydrophobicContact CB-CD2 4.39Å; L1004-L1031 HydrophobicContact CD2-CB 4.3Å; L1004-L1031 HydrophobicContact CD2-CD2 3.71Å; K1027-L1031 WeakPolarHBondContact O-CB 3.47Å; K1027-L1031 PolarHBondContact O-N 3.21Å; F1028-L1031 PolarHBondContact O-N 2.83Å; L1031-L1034 PolarHBondContact O-N 2.83Å; L1031-L1035 HydrophobicContact CD1-CD1 3.74Å; L1031-L1035 HydrophobicContact CD1-CG 4.21Å; L1031-L1035 HydrophobicContact CG-CD1 4.05Å; L1031-L1035 WeakPolarHBondContact O-CG 3.46Å; L1031-L1035 PolarHBondContact O-N 2.79Å; L1031-L1035 VanDerWaalsContact O-N 3.17Å
1032	Q	74	Confident	65.1	Low	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.4	-44.9	178.5	-169	-173.6	-47	0	0	111.8	F1028 D1029 H1030 L1034 L1035 I1036 T1040 S1043 V1089	F1028-Q1032 VanDerWaalsContact O-CB 3.28Å; F1028-Q1032 WeakPolarHBondContact O-CB 3.3Å; F1028-Q1032 PolarHBondContact O-N 3.48Å; D1029-Q1032 PolarHBondContact O-N 2.93Å; H1030-Q1032 VanDerWaalsContact C-N 3.29Å; H1030-Q1032 PolarHBondContact O-N 3.25Å; Q1032-L1034 VanDerWaalsContact C-N 3.27Å; Q1032-L1034 PolarHBondContact O-N 3.23Å; Q1032-L1035 PolarHBondContact O-N 2.97Å; Q1032-I1036 HydrophobicContact CG-CB 4.43Å; Q1032-I1036 HydrophobicContact CG-CD1 4.06Å; Q1032-I1036 HydrophobicContact CG-CG1 4.44Å; Q1032-I1036 WeakPolarHBondContact O-CB 3.24Å; Q1032-I1036 PolarHBondContact O-N 2.96Å; Q1032-T1040 HydrophobicContact CB-CG2 4.35Å; Q1032-S1043 PolarHBondContact NE2-OG 2.85Å; Q1032-S1043 PolarHBondContact OE1-OG 2.81Å; Q1032-V1089 HydrophobicContact CB-CG2 4.45Å; Q1032-V1089 HydrophobicContact CG-CG2 4.37Å
1033	N	70.5	Confident	63.9	Low	86 Å²	86	37.8 Å²	37.8	46%	0.46	19%	0.19	S	C	.	.	H	α-helix	trans	-65.5	-30.6	178.5	-70	-20.5	0	0	0	112.6	D1029 H1030 T1040	D1029-N1033 WeakPolarHBondContact O-CB 3.5Å; D1029-N1033 PolarHBondContact O-N 3.43Å; D1029-N1033 PolarHBondContact O-ND2 3.18Å; H1030-N1033 PolarHBondContact O-N 2.83Å; N1033-T1040 WeakPolarHBondContact OD1-CG2 3.21Å
1034	L	80.4	Confident	62.5	Low	52 Å²	52	39.1 Å²	39.1	27%	0.272	20%	0.201	S	C	.	.	H	α-helix	trans	-67.2	-41.2	173.1	-75.9	179.7	0	0	0	111.8	F969 L970 H1030 L1031 Q1032 S1069	F969-L1034 HydrophobicContact CE1-CB 4.08Å; F969-L1034 WeakPolarHBondContact CE1-O 3.32Å; L970-L1034 HydrophobicContact CD2-CD1 4.24Å; H1030-L1034 VanDerWaalsContact CE1-CD1 3.42Å; H1030-L1034 WeakPolarHBondContact CE1-CD1 3.24Å; H1030-L1034 WeakPolarHBondContact O-CG 3.15Å; H1030-L1034 PolarHBondContact O-N 3Å; L1031-L1034 PolarHBondContact O-N 2.83Å; Q1032-L1034 VanDerWaalsContact C-N 3.27Å; Q1032-L1034 PolarHBondContact O-N 3.23Å; L1034-S1069 WeakPolarHBondContact O-CB 2.96Å; L1034-S1069 PolarHBondContact O-OG 3.4Å
1035	L	80.6	Confident	60.9	Low	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-92.8	-32	-170.7	-64.9	176.1	0	0	0	114.2	V929 F969 W999 L1031 Q1032 P1068 S1069 F1072 V1089	V929-L1035 HydrophobicContact CG1-CD1 3.86Å; V929-L1035 HydrophobicContact CG2-CD1 4.11Å; F969-L1035 HydrophobicContact CD1-CD2 4.43Å; F969-L1035 HydrophobicContact CE1-CD2 4.3Å; W999-L1035 HydrophobicContact CH2-CD1 3.92Å; W999-L1035 HydrophobicContact CH2-CD2 4.44Å; W999-L1035 HydrophobicContact CZ2-CD1 3.74Å; W999-L1035 HydrophobicContact CZ2-CD2 4.12Å; L1031-L1035 HydrophobicContact CD1-CD1 3.74Å; L1031-L1035 HydrophobicContact CD1-CG 4.21Å; L1031-L1035 HydrophobicContact CG-CD1 4.05Å; L1031-L1035 WeakPolarHBondContact O-CG 3.46Å; L1031-L1035 PolarHBondContact O-N 2.79Å; L1031-L1035 VanDerWaalsContact O-N 3.17Å; Q1032-L1035 PolarHBondContact O-N 2.97Å; L1035-P1068 CarbonylContact O-C 3.57Å; L1035-P1068 WeakPolarHBondContact O-CA 3.28Å; L1035-S1069 PolarHBondContact O-N 2.8Å; L1035-F1072 HydrophobicContact CD2-CD1 4.15Å; L1035-F1072 HydrophobicContact CD2-CD2 3.91Å; L1035-F1072 HydrophobicContact CD2-CE1 4.11Å; L1035-F1072 HydrophobicContact CD2-CE2 3.86Å; L1035-F1072 HydrophobicContact CD2-CG 4.06Å; L1035-F1072 HydrophobicContact CD2-CZ 3.96Å; L1035-V1089 HydrophobicContact CD1-CG2 4.06Å
1036	I	70.3	Confident	59.5	Low	5 Å²	5	39.2 Å²	39.2	3%	0.026	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-124.3	141.8	-169.4	-51.5	-177.3	0	0	0	109.1	Q1032 A1038 W1065 A1067 A1087 V1089	Q1032-I1036 HydrophobicContact CG-CB 4.43Å; Q1032-I1036 HydrophobicContact CG-CD1 4.06Å; Q1032-I1036 HydrophobicContact CG-CG1 4.44Å; Q1032-I1036 WeakPolarHBondContact O-CB 3.24Å; Q1032-I1036 PolarHBondContact O-N 2.96Å; I1036-A1038 HydrophobicContact CG2-CB 4.2Å; I1036-W1065 VanDerWaalsContact CG2-O 3.25Å; I1036-W1065 WeakPolarHBondContact CG2-O 3.48Å; I1036-A1067 WeakPolarHBondContact CA-O 3.31Å; I1036-A1067 VanDerWaalsContact CG2-O 3.3Å; I1036-A1067 WeakPolarHBondContact CG2-O 3.35Å; I1036-A1087 WeakPolarHBondContact CD1-O 3.49Å; I1036-A1087 HydrophobicContact CG1-CB 4.29Å; I1036-V1089 HydrophobicContact CD1-CB 4.44Å; I1036-V1089 HydrophobicContact CD1-CG2 3.99Å
1037	F	56.3	Low	57.9	Low	38 Å²	38	32.9 Å²	32.9	17%	0.167	17%	0.172	C	C	.	.	S	Bend	trans	-71.2	-33.4	177.6	-175.9	-85.9	0	0	0	113.6	A1067 S1169 H1246	F1037-A1067 HydrophobicContact CB-CB 4.48Å; F1037-A1067 PolarHBondContact N-O 3.34Å; F1037-S1169 VanDerWaalsContact O-CB 3.32Å; F1037-S1169 WeakPolarHBondContact O-CB 2.96Å; F1037-S1169 PolarHBondContact O-OG 3.02Å; F1037-H1246 HydrophobicContact CD1-CB 3.23Å; F1037-H1246 HydrophobicContact CE1-CB 3.19Å; F1037-H1246 WeakPolarHBondContact CE1-O 3.41Å; F1037-H1246 HydrophobicContact CG-CB 4.09Å; F1037-H1246 HydrophobicContact CZ-CB 4Å
1038	A	51.9	Low	55.9	Low	11 Å²	11	33.2 Å²	33.2	9%	0.091	18%	0.178	C	C	.	.	S	Bend	trans	-74.4	143	-172.2	0	0	0	0	0	113.6	I1036 W1065	I1036-A1038 HydrophobicContact CG2-CB 4.2Å; A1038-W1065 HydrophobicContact CB-CB 4.29Å
1039	P	45	Very low	54	Low	16 Å²	16	34.9 Å²	34.9	10%	0.104	20%	0.195	C	C	.	.			trans	-65.7	146.6	-179.5	-2.2	10.8	0	0	0	113.5	L1041 V1042 S1169 H1170	P1039-L1041 PolarHBondContact O-N 3.33Å; P1039-V1042 PolarHBondContact O-N 3.29Å; P1039-S1169 WeakPolarHBondContact CD-O 3.44Å; P1039-S1169 WeakPolarHBondContact CD-OG 3.45Å; P1039-S1169 WeakPolarHBondContact CG-O 3.05Å; P1039-H1170 WeakPolarHBondContact CB-CE1 3.25Å; P1039-H1170 WeakPolarHBondContact CB-ND1 3.48Å; P1039-H1170 HydrophobicContact CG-CB 4.29Å; P1039-H1170 VanDerWaalsContact CG-ND1 3.34Å; P1039-H1170 WeakPolarHBondContact CG-ND1 3.33Å
1040	T	44	Very low	52.2	Low	15 Å²	15	38.8 Å²	38.8	9%	0.092	22%	0.216	C	C	.	.	H	α-helix	trans	-52.5	-25.5	-177.7	45.2	0	0	0	0	115.4	D1029 Q1032 N1033 V1042 S1043 A1044	D1029-T1040 HydrophobicContact CB-CG2 3.61Å; D1029-T1040 WeakPolarHBondContact OD1-CB 3.48Å; D1029-T1040 WeakPolarHBondContact OD1-CG2 3.43Å; Q1032-T1040 HydrophobicContact CB-CG2 4.35Å; N1033-T1040 WeakPolarHBondContact OD1-CG2 3.21Å; T1040-V1042 VanDerWaalsContact C-N 3.31Å; T1040-V1042 PolarHBondContact O-N 2.99Å; T1040-S1043 PolarHBondContact O-N 3.25Å; T1040-S1043 VanDerWaalsContact O-N 3.15Å; T1040-A1044 PolarHBondContact O-N 3.32Å
1041	L	40.4	Very low	50.2	Low	56 Å²	56	36 Å²	36	29%	0.293	21%	0.207	S	C	.	.	H	α-helix	trans	-61.8	-34	179.9	-136.6	85.6	0	0	0	113.7	P1039 A1044 H1195	P1039-L1041 PolarHBondContact O-N 3.33Å; L1041-A1044 PolarHBondContact O-N 2.62Å; L1041-H1195 WeakPolarHBondContact CD2-CE1 3.23Å; L1041-H1195 VanDerWaalsContact CD2-ND1 3.33Å; L1041-H1195 WeakPolarHBondContact CD2-ND1 3.33Å
1042	V	39.5	Very low	48.4	Very low	29 Å²	29	39.2 Å²	39.2	18%	0.176	23%	0.227	C	C	.	.	H	α-helix	trans	-72.7	-33.3	178	-177.3	0	0	0	0	110.6	P1039 T1040 A1044 Q1045 W1065	P1039-V1042 PolarHBondContact O-N 3.29Å; T1040-V1042 VanDerWaalsContact C-N 3.31Å; T1040-V1042 PolarHBondContact O-N 2.99Å; V1042-A1044 VanDerWaalsContact C-N 3.33Å; V1042-A1044 PolarHBondContact O-N 3.2Å; V1042-Q1045 PolarHBondContact O-N 2.78Å; V1042-W1065 HydrophobicContact CG1-CB 4.11Å
1043	S	36.7	Very low	47	Very low	14 Å²	14	39.2 Å²	39.2	10%	0.098	23%	0.227	C	C	.	.	H	α-helix	trans	-72.5	-25.2	177	-63.3	0	0	0	0	113.3	Q1032 T1040 Q1045 K1046	Q1032-S1043 PolarHBondContact NE2-OG 2.85Å; Q1032-S1043 PolarHBondContact OE1-OG 2.81Å; T1040-S1043 PolarHBondContact O-N 3.25Å; T1040-S1043 VanDerWaalsContact O-N 3.15Å; S1043-Q1045 VanDerWaalsContact C-N 3.26Å; S1043-Q1045 PolarHBondContact O-N 2.89Å; S1043-K1046 WeakPolarHBondContact O-CB 3.4Å; S1043-K1046 PolarHBondContact O-N 2.82Å
1044	A	37.9	Very low	45.6	Very low	38 Å²	38	38.1 Å²	38.1	31%	0.314	22%	0.22	S	C	.	.	H	α-helix	trans	-65.3	-28.2	173.1	0	0	0	0	0	112.7	T1040 L1041 V1042 N1047	T1040-A1044 PolarHBondContact O-N 3.32Å; L1041-A1044 PolarHBondContact O-N 2.62Å; V1042-A1044 VanDerWaalsContact C-N 3.33Å; V1042-A1044 PolarHBondContact O-N 3.2Å; A1044-N1047 WeakPolarHBondContact O-CB 3.28Å; A1044-N1047 PolarHBondContact O-N 3.4Å
1045	Q	39.2	Very low	44	Very low	33 Å²	33	37 Å²	37	15%	0.154	22%	0.219	C	C	.	.	H	α-helix	trans	-77.8	-21.1	175.3	-71	-179.6	-5.3	0	0	113	V1042 S1043 N1047 L1048 S1189	V1042-Q1045 PolarHBondContact O-N 2.78Å; S1043-Q1045 VanDerWaalsContact C-N 3.26Å; S1043-Q1045 PolarHBondContact O-N 2.89Å; Q1045-N1047 PolarHBondContact O-N 3.2Å; Q1045-L1048 WeakPolarHBondContact O-CB 3.47Å; Q1045-L1048 PolarHBondContact O-N 3.17Å; Q1045-S1189 PolarHBondContact OE1-O 3.26Å
1046	K	37.6	Very low	42	Very low	39 Å²	39	45.8 Å²	45.8	17%	0.17	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-33.5	171.4	-150.9	-174.6	-172.3	-174.4	0	112.3	S1043 L1048 G1049 V1051 D1090	S1043-K1046 WeakPolarHBondContact O-CB 3.4Å; S1043-K1046 PolarHBondContact O-N 2.82Å; K1046-L1048 PolarHBondContact O-N 2.95Å; K1046-G1049 PolarHBondContact O-N 3.33Å; K1046-V1051 WeakPolarHBondContact CE-O 3.47Å; K1046-V1051 WeakPolarHBondContact CG-O 3.42Å; K1046-D1090 IonicContact NZ-OD1 2.93Å; K1046-D1090 PolarHBondContact NZ-OD1 2.76Å
1047	N	35.2	Very low	40.8	Very low	21 Å²	21	50.2 Å²	50.2	11%	0.112	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-11.4	176.3	-86.3	8.7	0	0	0	114	A1044 Q1045 G1049 R1091 C1095 A1096	A1044-N1047 WeakPolarHBondContact O-CB 3.28Å; A1044-N1047 PolarHBondContact O-N 3.4Å; Q1045-N1047 PolarHBondContact O-N 3.2Å; N1047-G1049 VanDerWaalsContact C-N 3.34Å; N1047-R1091 WeakPolarHBondContact ND2-CD 3.38Å; N1047-R1091 WeakPolarHBondContact OD1-CB 3.38Å; N1047-C1095 PolarHBondContact ND2-O 3.21Å; N1047-A1096 WeakPolarHBondContact CA-O 3.3Å; N1047-A1096 WeakPolarHBondContact CB-O 3.11Å; N1047-A1096 VanDerWaalsContact CG-C 3.44Å; N1047-A1096 PolarHBondContact ND2-O 3.45Å; N1047-A1096 VanDerWaalsContact O-O 3.11Å; N1047-A1096 PolarHBondContact OD1-O 2.6Å
1048	L	35	Very low	40.5	Very low	108 Å²	108	50 Å²	50	57%	0.565	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	0.7	168.2	-71.7	157.1	0	0	0	112.6	Q1045 K1046 L1050	Q1045-L1048 WeakPolarHBondContact O-CB 3.47Å; Q1045-L1048 PolarHBondContact O-N 3.17Å; K1046-L1048 PolarHBondContact O-N 2.95Å; L1048-L1050 HydrophobicContact CB-CD1 3.64Å
1049	G	32.4	Very low	40.4	Very low	36 Å²	36	51.1 Å²	51.1	37%	0.371	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	19.9	173.2	0	0	0	0	0	115.6	K1046 N1047	K1046-G1049 PolarHBondContact O-N 3.33Å; N1047-G1049 VanDerWaalsContact C-N 3.34Å
1050	L	30.4	Very low	40.8	Very low	96 Å²	96	51 Å²	51	50%	0.503	30%	0.3	S	S	.	.			trans	-94.4	-17.5	-171.8	-69.9	135.8	0	0	0	115.5	L1048 Q1191	L1048-L1050 HydrophobicContact CB-CD1 3.64Å; L1050-Q1191 HydrophobicContact CD1-CG 3.98Å
1051	V	35.1	Very low	41.4	Very low	61 Å²	61	55.1 Å²	55.1	37%	0.37	32%	0.315	S	S	.	.			trans	-140.2	100	-177.3	-174.3	0	0	0	0	109.3	K1046 W1065	K1046-V1051 WeakPolarHBondContact CE-O 3.47Å; K1046-V1051 WeakPolarHBondContact CG-O 3.42Å; V1051-W1065 HydrophobicContact CG1-CZ2 3.79Å
1052	T	43.5	Very low	42.1	Very low	69 Å²	69	56.6 Å²	56.6	42%	0.423	32%	0.322	S	S	.	.			trans	-74.2	128.6	166.6	55.5	0	0	0	0	107.4	G346 L1054	G346-T1052 VanDerWaalsContact O-CG2 3.27Å; G346-T1052 WeakPolarHBondContact O-CG2 3.4Å; T1052-L1054 PolarHBondContact O-N 3.41Å
1053	G	45.5	Very low	42.7	Very low	0 Å²	0	55.9 Å²	55.9	0%	0	32%	0.319	C	S	.	.	S	Bend	trans	-75.4	24.3	-179.3	0	0	0	0	0	114.6	L1060 Y1061	G1053-L1060 WeakPolarHBondContact O-CA 3.49Å; G1053-Y1061 PolarHBondContact O-N 3.14Å
1054	L	40.5	Very low	43.3	Very low	63 Å²	63	57.8 Å²	57.8	33%	0.33	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-121.8	132.5	-170.6	-73.6	158.3	0	0	0	109.6	R930 T1052 G1058 Q1059	R930-L1054 VanDerWaalsContact NH1-CD2 3.31Å; T1052-L1054 PolarHBondContact O-N 3.41Å; L1054-G1058 VanDerWaalsContact CD2-C 3.48Å; L1054-G1058 WeakPolarHBondContact CD2-O 3.27Å; L1054-Q1059 CarbonylContact C-O 3.57Å; L1054-Q1059 VanDerWaalsContact CA-O 3.24Å; L1054-Q1059 WeakPolarHBondContact CA-O 3.49Å
1055	A	46.7	Very low	43.9	Very low	30 Å²	30	57.6 Å²	57.6	25%	0.248	32%	0.322	C	S	.	.			trans	-72.5	169.9	163.7	0	0	0	0	0	110.7	D1057 G1058 Q1059 Y1061	A1055-D1057 VanDerWaalsContact CB-OD1 3.31Å; A1055-D1057 WeakPolarHBondContact CB-OD1 3.29Å; A1055-D1057 PolarHBondContact O-N 3.3Å; A1055-G1058 PolarHBondContact O-N 3.04Å; A1055-Q1059 PolarHBondContact N-O 3.48Å; A1055-Y1061 HydrophobicContact CB-CD2 4.22Å
1056	N	40.1	Very low	45.1	Very low	183 Å²	183	56.1 Å²	56.1	98%	0.979	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-22.5	-177.5	-66	-10.7	0	0	0	113.9
1057	D	44.9	Very low	46.3	Very low	99 Å²	99	54.6 Å²	54.6	53%	0.529	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	3.5	178.8	62.8	-4.5	0	0	0	113.6	A1055 Q1059	A1055-D1057 VanDerWaalsContact CB-OD1 3.31Å; A1055-D1057 WeakPolarHBondContact CB-OD1 3.29Å; A1055-D1057 PolarHBondContact O-N 3.3Å; D1057-Q1059 VanDerWaalsContact C-N 3.3Å; D1057-Q1059 VanDerWaalsContact CG-CG 3.47Å; D1057-Q1059 WeakPolarHBondContact OD1-CB 3.33Å; D1057-Q1059 WeakPolarHBondContact OD1-CG 3.14Å; D1057-Q1059 PolarHBondContact OD1-N 3.05Å; D1057-Q1059 WeakPolarHBondContact OD2-CG 3.34Å; D1057-Q1059 PolarHBondContact OD2-NE2 3.09Å; D1057-Q1059 PolarHBondContact OD2-OE1 3.41Å
1058	G	48.7	Very low	48.2	Very low	34 Å²	34	53.8 Å²	53.8	35%	0.351	31%	0.306	S	S	.	.	S	Bend	trans	78.3	9	-175.1	0	0	0	0	0	114.4	L1054 A1055	L1054-G1058 VanDerWaalsContact CD2-C 3.48Å; L1054-G1058 WeakPolarHBondContact CD2-O 3.27Å; A1055-G1058 PolarHBondContact O-N 3.04Å
1059	Q	51	Low	50.1	Low	34 Å²	34	49.1 Å²	49.1	16%	0.159	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-77	149.5	172.8	-67.4	-179.8	18.1	0	0	111.2	N991 L1054 A1055 D1057 Y1061	N991-Q1059 PolarHBondContact ND2-NE2 3.11Å; N991-Q1059 VanDerWaalsContact ND2-NE2 3.12Å; L1054-Q1059 CarbonylContact C-O 3.57Å; L1054-Q1059 VanDerWaalsContact CA-O 3.24Å; L1054-Q1059 WeakPolarHBondContact CA-O 3.49Å; A1055-Q1059 PolarHBondContact N-O 3.48Å; D1057-Q1059 VanDerWaalsContact C-N 3.3Å; D1057-Q1059 VanDerWaalsContact CG-CG 3.47Å; D1057-Q1059 WeakPolarHBondContact OD1-CB 3.33Å; D1057-Q1059 WeakPolarHBondContact OD1-CG 3.14Å; D1057-Q1059 PolarHBondContact OD1-N 3.05Å; D1057-Q1059 WeakPolarHBondContact OD2-CG 3.34Å; D1057-Q1059 PolarHBondContact OD2-NE2 3.09Å; D1057-Q1059 PolarHBondContact OD2-OE1 3.41Å; Q1059-Y1061 PolarHBondContact O-N 2.8Å
1060	L	53.6	Low	52.1	Low	13 Å²	13	50.2 Å²	50.2	7%	0.068	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-62.4	125.5	170.8	-118.3	79.8	0	0	0	109.8	R930 G1053 L1062 A1086 V1088	R930-L1060 HydrophobicContact CB-CD1 3.63Å; G1053-L1060 WeakPolarHBondContact O-CA 3.49Å; L1060-L1062 PolarHBondContact O-N 3.13Å; L1060-A1086 HydrophobicContact CB-CB 4.29Å; L1060-A1086 HydrophobicContact CD2-CB 3.72Å; L1060-V1088 HydrophobicContact CD2-CB 3.87Å; L1060-V1088 HydrophobicContact CD2-CG2 3.37Å; L1060-V1088 HydrophobicContact CG-CB 4.46Å; L1060-V1088 HydrophobicContact CG-CG2 3.93Å
1061	Y	55.5	Low	54.3	Low	102 Å²	102	53 Å²	53	40%	0.4	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-68.7	125.5	177.5	-157	-84	0	0	0	109.7	G1053 A1055 Q1059 S1063 S1066 F1626	G1053-Y1061 PolarHBondContact O-N 3.14Å; A1055-Y1061 HydrophobicContact CB-CD2 4.22Å; Q1059-Y1061 PolarHBondContact O-N 2.8Å; Y1061-S1063 PolarHBondContact O-N 2.81Å; Y1061-S1066 PolarHBondContact O-OG 3.22Å; Y1061-F1626 HydrophobicContact CE2-CE1 4.39Å; Y1061-F1626 WeakPolarHBondContact OH-CE1 3.42Å
1062	L	55.7	Low	56.8	Low	86 Å²	86	50.1 Å²	50.1	45%	0.45	27%	0.272	S	S	.	.			trans	-75.5	104.6	176.2	-59.7	176.7	0	0	0	108.4	L1060 E1085 A1086	L1060-L1062 PolarHBondContact O-N 3.13Å; L1062-E1085 WeakPolarHBondContact CD1-OE1 3.44Å; L1062-E1085 HydrophobicContact CD2-CG 3.73Å; L1062-A1086 HydrophobicContact CD2-CB 3.97Å
1063	S	51.3	Low	58.5	Low	15 Å²	15	50.5 Å²	50.5	11%	0.105	27%	0.266	C	S	.	.			trans	-141.9	162.9	-175.4	64.7	0	0	0	0	110.2	Y1061 W1065 S1066 A1067	Y1061-S1063 PolarHBondContact O-N 2.81Å; S1063-W1065 PolarHBondContact O-N 2.99Å; S1063-W1065 VanDerWaalsContact O-N 3.11Å; S1063-W1065 WeakPolarHBondContact OG-CH2 3.32Å; S1063-W1065 WeakPolarHBondContact OG-CZ2 3.29Å; S1063-W1065 PolarHBondContact OG-NE1 3.29Å; S1063-S1066 PolarHBondContact N-OG 3.29Å; S1063-S1066 PolarHBondContact O-N 3.43Å; S1063-S1066 PolarHBondContact O-OG 3.13Å; S1063-S1066 PolarHBondContact OG-N 2.9Å; S1063-S1066 PolarHBondContact OG-OG 2.79Å; S1063-S1066 VanDerWaalsContact OG-OG 3.14Å; S1063-A1067 PolarHBondContact O-N 3.15Å
1064	P	49	Very low	60.1	Low	53 Å²	53	53.1 Å²	53.1	34%	0.344	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.5	177.1	-24.1	33.7	0	0	0	113.7	Y1285	P1064-Y1285 HydrophobicContact CB-CE2 4.43Å; P1064-Y1285 HydrophobicContact CG-CE2 4.1Å
1065	W	51.7	Low	62.2	Low	35 Å²	35	51.9 Å²	51.9	13%	0.133	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-11	179.4	55.1	-101.1	0	0	0	114.1	I1036 A1038 V1042 V1051 S1063 V1088	I1036-W1065 VanDerWaalsContact CG2-O 3.25Å; I1036-W1065 WeakPolarHBondContact CG2-O 3.48Å; A1038-W1065 HydrophobicContact CB-CB 4.29Å; V1042-W1065 HydrophobicContact CG1-CB 4.11Å; V1051-W1065 HydrophobicContact CG1-CZ2 3.79Å; S1063-W1065 PolarHBondContact O-N 2.99Å; S1063-W1065 VanDerWaalsContact O-N 3.11Å; S1063-W1065 WeakPolarHBondContact OG-CH2 3.32Å; S1063-W1065 WeakPolarHBondContact OG-CZ2 3.29Å; S1063-W1065 PolarHBondContact OG-NE1 3.29Å; W1065-V1088 HydrophobicContact CE3-CG2 4.46Å; W1065-V1088 HydrophobicContact CZ3-CG2 3.8Å
1066	S	63.9	Low	64.2	Low	1 Å²	1	50.5 Å²	50.5	1%	0.007	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	1.8	170.8	66.2	0	0	0	0	113.1	Y1061 S1063 A1086 A1087	Y1061-S1066 PolarHBondContact O-OG 3.22Å; S1063-S1066 PolarHBondContact N-OG 3.29Å; S1063-S1066 PolarHBondContact O-N 3.43Å; S1063-S1066 PolarHBondContact O-OG 3.13Å; S1063-S1066 PolarHBondContact OG-N 2.9Å; S1063-S1066 PolarHBondContact OG-OG 2.79Å; S1063-S1066 VanDerWaalsContact OG-OG 3.14Å; S1066-A1086 CarbonylContact O-C 3.49Å; S1066-A1086 WeakPolarHBondContact O-CA 3.45Å; S1066-A1087 CarbonylContact C-O 3.49Å; S1066-A1087 WeakPolarHBondContact CA-O 3.44Å; S1066-A1087 PolarHBondContact O-N 2.89Å; S1066-A1087 VanDerWaalsContact O-O 3.09Å
1067	A	61.8	Low	66.3	Low	7 Å²	7	46.9 Å²	46.9	6%	0.058	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-65.4	122.6	179.9	0	0	0	0	0	111.2	I1036 F1037 S1063 H1246	I1036-A1067 WeakPolarHBondContact CA-O 3.31Å; I1036-A1067 VanDerWaalsContact CG2-O 3.3Å; I1036-A1067 WeakPolarHBondContact CG2-O 3.35Å; F1037-A1067 HydrophobicContact CB-CB 4.48Å; F1037-A1067 PolarHBondContact N-O 3.34Å; S1063-A1067 PolarHBondContact O-N 3.15Å; A1067-H1246 VanDerWaalsContact CB-NE2 3.27Å; A1067-H1246 WeakPolarHBondContact CB-NE2 3.45Å
1068	P	75.3	Confident	68.1	Low	5 Å²	5	46.6 Å²	46.6	3%	0.032	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-67.6	149.7	179.7	28	-32	0	0	0	110.6	L1035 F1072 V1084 A1087	L1035-P1068 CarbonylContact O-C 3.57Å; L1035-P1068 WeakPolarHBondContact O-CA 3.28Å; P1068-F1072 HydrophobicContact CB-CD1 4.37Å; P1068-V1084 HydrophobicContact CB-CB 4.35Å; P1068-V1084 HydrophobicContact CB-CG1 3.9Å; P1068-V1084 HydrophobicContact CG-CB 4.3Å; P1068-V1084 HydrophobicContact CG-CG1 4.05Å; P1068-V1084 WeakPolarHBondContact CG-O 2.99Å; P1068-A1087 HydrophobicContact CB-CB 4.14Å
1069	S	75.3	Confident	69.8	Low	10 Å²	10	46.9 Å²	46.9	7%	0.07	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62.5	146.8	175.1	81.9	0	0	0	0	110.5	L1034 L1035 H1071 F1072 R1073	L1034-S1069 WeakPolarHBondContact O-CB 2.96Å; L1034-S1069 PolarHBondContact O-OG 3.4Å; L1035-S1069 PolarHBondContact O-N 2.8Å; S1069-H1071 VanDerWaalsContact C-N 3.26Å; S1069-H1071 PolarHBondContact O-N 2.87Å; S1069-F1072 PolarHBondContact O-N 2.73Å; S1069-F1072 WeakPolarHBondContact OG-CB 3.28Å; S1069-F1072 PolarHBondContact OG-N 2.94Å; S1069-R1073 WeakPolarHBondContact O-CB 3.24Å; S1069-R1073 PolarHBondContact O-N 3.41Å
1070	N	74.5	Confident	71.3	Confident	59 Å²	59	51.1 Å²	51.1	32%	0.316	27%	0.268	S	S	.	.	H	α-helix	trans	-60.1	-38.6	179.6	-70.8	-22.5	0	0	0	111.7	R1073 A1074	N1070-R1073 PolarHBondContact OD1-NH2 2.91Å; N1070-A1074 VanDerWaalsContact O-CB 3.26Å; N1070-A1074 WeakPolarHBondContact O-CB 3.47Å; N1070-A1074 PolarHBondContact O-N 3.07Å
1071	H	76.7	Confident	72.8	Confident	154 Å²	154	50.6 Å²	50.6	71%	0.713	27%	0.265	S	S	*	.	H	α-helix	trans	-63.7	-45.3	176.4	-69.4	-69.2	0	0	0	111.9	F969 S1069 H1075	F969-H1071 HydrophobicContact CE2-CB 4.2Å; F969-H1071 HydrophobicContact CZ-CB 4.31Å; S1069-H1071 VanDerWaalsContact C-N 3.26Å; S1069-H1071 PolarHBondContact O-N 2.87Å; H1071-H1075 VanDerWaalsContact O-CB 3.27Å; H1071-H1075 WeakPolarHBondContact O-CB 3.27Å; H1071-H1075 PolarHBondContact O-N 3.34Å
1072	F	86.8	Confident	74.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-44.6	178.8	-176.7	-121.9	0	0	0	111.6	L931 F969 L1035 P1068 S1069 H1075 M1076 V1084	L931-F1072 HydrophobicContact CD1-CE1 4.16Å; L931-F1072 HydrophobicContact CD1-CZ 3.92Å; L931-F1072 HydrophobicContact CD2-CE1 3.93Å; L931-F1072 HydrophobicContact CD2-CZ 4.41Å; F969-F1072 AromaticContact CD1-CD2 3.49Å; F969-F1072 HydrophobicContact CD1-CD2 3.49Å; F969-F1072 VanDerWaalsContact CD1-CD2 3.49Å; F969-F1072 HydrophobicContact CD1-CE2 4.09Å; F969-F1072 HydrophobicContact CD1-CG 4.42Å; F969-F1072 HydrophobicContact CD2-CD2 4.22Å; F969-F1072 HydrophobicContact CE1-CB 3.83Å; F969-F1072 AromaticContact CE1-CD2 3.55Å; F969-F1072 HydrophobicContact CE1-CD2 3.55Å; F969-F1072 HydrophobicContact CE1-CG 4.05Å; F969-F1072 HydrophobicContact CE2-CB 4.16Å; F969-F1072 HydrophobicContact CE2-CD2 4.29Å; F969-F1072 AromaticContact CG-CD2 3.83Å; F969-F1072 HydrophobicContact CG-CD2 3.83Å; F969-F1072 HydrophobicContact CG-CE2 4.41Å; F969-F1072 HydrophobicContact CZ-CB 3.59Å; F969-F1072 AromaticContact CZ-CD2 3.98Å; F969-F1072 HydrophobicContact CZ-CD2 3.98Å; F969-F1072 HydrophobicContact CZ-CG 4.25Å; L1035-F1072 HydrophobicContact CD2-CD1 4.15Å; L1035-F1072 HydrophobicContact CD2-CD2 3.91Å; L1035-F1072 HydrophobicContact CD2-CE1 4.11Å; L1035-F1072 HydrophobicContact CD2-CE2 3.86Å; L1035-F1072 HydrophobicContact CD2-CG 4.06Å; L1035-F1072 HydrophobicContact CD2-CZ 3.96Å; P1068-F1072 HydrophobicContact CB-CD1 4.37Å; S1069-F1072 PolarHBondContact O-N 2.73Å; S1069-F1072 WeakPolarHBondContact OG-CB 3.28Å; S1069-F1072 PolarHBondContact OG-N 2.94Å; F1072-H1075 PolarHBondContact O-N 3.41Å; F1072-M1076 HydrophobicContact CD2-CG 4.18Å; F1072-M1076 HydrophobicContact CE1-CG 4.37Å; F1072-M1076 HydrophobicContact CE2-CG 3.84Å; F1072-M1076 HydrophobicContact CE2-SD 4Å; F1072-M1076 HydrophobicContact CZ-CG 3.93Å; F1072-M1076 HydrophobicContact CZ-SD 4.15Å; F1072-M1076 VanDerWaalsContact O-CG 3.26Å; F1072-M1076 WeakPolarHBondContact O-CG 3.33Å; F1072-M1076 PolarHBondContact O-N 3.32Å; F1072-V1084 HydrophobicContact CD1-CG2 4.45Å; F1072-V1084 HydrophobicContact CE1-CG1 4.18Å; F1072-V1084 HydrophobicContact CE1-CG2 4.02Å
1073	R	80.3	Confident	75.4	Confident	77 Å²	77	45.5 Å²	45.5	29%	0.291	25%	0.245	S	C	.	.	H	α-helix	trans	-60.6	-49.3	177.8	-173.5	172.6	65.1	-133.2	-5.9	111.7	S1069 N1070 H1075 M1076 E1077 I1083	S1069-R1073 WeakPolarHBondContact O-CB 3.24Å; S1069-R1073 PolarHBondContact O-N 3.41Å; N1070-R1073 PolarHBondContact OD1-NH2 2.91Å; R1073-H1075 VanDerWaalsContact C-N 3.34Å; R1073-H1075 PolarHBondContact O-N 3.41Å; R1073-M1076 PolarHBondContact O-N 3.1Å; R1073-E1077 WeakPolarHBondContact O-CB 3.45Å; R1073-E1077 PolarHBondContact O-N 3.27Å; R1073-I1083 HydrophobicContact CG-CG2 4.32Å
1074	A	78.1	Confident	77	Confident	55 Å²	55	44.9 Å²	44.9	46%	0.455	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-39.2	178.7	0	0	0	0	0	112.3	N1070 E1077 S1078	N1070-A1074 VanDerWaalsContact O-CB 3.26Å; N1070-A1074 WeakPolarHBondContact O-CB 3.47Å; N1070-A1074 PolarHBondContact O-N 3.07Å; A1074-E1077 PolarHBondContact O-N 3.3Å; A1074-S1078 VanDerWaalsContact O-CB 3.31Å; A1074-S1078 WeakPolarHBondContact O-CB 3.48Å; A1074-S1078 PolarHBondContact O-N 2.84Å; A1074-S1078 PolarHBondContact O-OG 2.91Å
1075	H	86.2	Confident	78.3	Confident	38 Å²	38	45.3 Å²	45.3	18%	0.176	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-44.9	176.6	177.2	80	0	0	0	112.3	A965 F969 H1071 F1072 R1073 S1078 S1079	A965-H1075 PolarHBondContact O-NE2 3.04Å; F969-H1075 HydrophobicContact CD2-CB 3.84Å; F969-H1075 AromaticContact CD2-CD2 3.83Å; F969-H1075 AromaticContact CD2-CG 3.74Å; F969-H1075 HydrophobicContact CE2-CB 4.22Å; H1071-H1075 VanDerWaalsContact O-CB 3.27Å; H1071-H1075 WeakPolarHBondContact O-CB 3.27Å; H1071-H1075 PolarHBondContact O-N 3.34Å; F1072-H1075 PolarHBondContact O-N 3.41Å; R1073-H1075 VanDerWaalsContact C-N 3.34Å; R1073-H1075 PolarHBondContact O-N 3.41Å; H1075-S1078 PolarHBondContact O-N 3.2Å; H1075-S1078 PolarHBondContact O-OG 3.22Å; H1075-S1079 WeakPolarHBondContact O-CB 3.41Å; H1075-S1079 PolarHBondContact O-N 3.14Å; H1075-S1079 VanDerWaalsContact O-N 3.1Å; H1075-S1079 PolarHBondContact O-OG 2.88Å
1076	M	88	Confident	79.3	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-66.1	-40.6	178.4	-68.4	-67	-62.9	0	0	112.4	I933 L962 A965 I966 F1072 R1073 S1079 L1081 V1084	I933-M1076 HydrophobicContact CD1-CE 4.09Å; L962-M1076 HydrophobicContact CD1-CE 3.6Å; A965-M1076 HydrophobicContact CB-SD 4.02Å; I966-M1076 HydrophobicContact CG1-SD 4.4Å; F1072-M1076 HydrophobicContact CD2-CG 4.18Å; F1072-M1076 HydrophobicContact CE1-CG 4.37Å; F1072-M1076 HydrophobicContact CE2-CG 3.84Å; F1072-M1076 HydrophobicContact CE2-SD 4Å; F1072-M1076 HydrophobicContact CZ-CG 3.93Å; F1072-M1076 HydrophobicContact CZ-SD 4.15Å; F1072-M1076 VanDerWaalsContact O-CG 3.26Å; F1072-M1076 WeakPolarHBondContact O-CG 3.33Å; F1072-M1076 PolarHBondContact O-N 3.32Å; R1073-M1076 PolarHBondContact O-N 3.1Å; M1076-S1079 PolarHBondContact O-N 3.49Å; M1076-L1081 HydrophobicContact CE-CB 4.16Å; M1076-L1081 HydrophobicContact CE-CD1 3.75Å; M1076-L1081 PolarHBondContact O-N 3.31Å; M1076-L1081 HydrophobicContact SD-CD1 4.28Å; M1076-V1084 HydrophobicContact CB-CG2 3.81Å; M1076-V1084 HydrophobicContact CE-CG2 4.4Å; M1076-V1084 HydrophobicContact CG-CG2 3.74Å
1077	E	83.5	Confident	80.1	Confident	108 Å²	108	43.6 Å²	43.6	51%	0.505	23%	0.231	S	C	.	.	H	α-helix	trans	-65.5	-44.9	176.3	-172.5	173.4	-171.5	0	0	111.5	R1073 A1074 S1079 E1080 G1082	R1073-E1077 WeakPolarHBondContact O-CB 3.45Å; R1073-E1077 PolarHBondContact O-N 3.27Å; A1074-E1077 PolarHBondContact O-N 3.3Å; E1077-S1079 PolarHBondContact O-N 2.84Å; E1077-E1080 PolarHBondContact O-N 3.22Å; E1077-G1082 WeakPolarHBondContact CA-O 3.24Å; E1077-G1082 PolarHBondContact N-O 3.44Å
1078	S	83.3	Confident	80.7	Confident	92 Å²	92	43.4 Å²	43.4	64%	0.643	23%	0.23	S	C	*	.	H	α-helix	trans	-65	-18.4	175.5	72.8	0	0	0	0	113.9	A1074 H1075 E1080	A1074-S1078 VanDerWaalsContact O-CB 3.31Å; A1074-S1078 WeakPolarHBondContact O-CB 3.48Å; A1074-S1078 PolarHBondContact O-N 2.84Å; A1074-S1078 PolarHBondContact O-OG 2.91Å; H1075-S1078 PolarHBondContact O-N 3.2Å; H1075-S1078 PolarHBondContact O-OG 3.22Å; S1078-E1080 VanDerWaalsContact C-N 3.29Å
1079	S	83.7	Confident	80.7	Confident	40 Å²	40	43.4 Å²	43.4	28%	0.28	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	8.4	175.8	-58.7	0	0	0	0	113.1	H1075 M1076 E1077 L1081	H1075-S1079 WeakPolarHBondContact O-CB 3.41Å; H1075-S1079 PolarHBondContact O-N 3.14Å; H1075-S1079 VanDerWaalsContact O-N 3.1Å; H1075-S1079 PolarHBondContact O-OG 2.88Å; M1076-S1079 PolarHBondContact O-N 3.49Å; E1077-S1079 PolarHBondContact O-N 2.84Å; S1079-L1081 PolarHBondContact O-N 3.32Å
1080	E	83.8	Confident	80.5	Confident	124 Å²	124	43.5 Å²	43.5	58%	0.579	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.6	17.4	-179	-55.3	177	167.1	0	0	114.7	S936 E1077 S1078	S936-E1080 PolarHBondContact OG-O 2.85Å; E1077-E1080 PolarHBondContact O-N 3.22Å; S1078-E1080 VanDerWaalsContact C-N 3.29Å
1081	L	84.5	Confident	80.2	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.218	C	C	.	.	S	Bend	trans	-87.7	-7.6	-180	-68.7	167.9	0	0	0	113.3	Y958 K961 L962 A965 M1076 S1079	Y958-L1081 HydrophobicContact CD2-CD2 4.06Å; Y958-L1081 HydrophobicContact CE2-CD2 3.78Å; Y958-L1081 PolarHBondContact OH-O 2.94Å; K961-L1081 HydrophobicContact CB-CD2 3.95Å; L962-L1081 HydrophobicContact CB-CD1 4.44Å; L962-L1081 HydrophobicContact CB-CD2 4.29Å; L962-L1081 HydrophobicContact CD1-CD1 4.23Å; A965-L1081 HydrophobicContact CB-CD1 3.38Å; M1076-L1081 HydrophobicContact CE-CB 4.16Å; M1076-L1081 HydrophobicContact CE-CD1 3.75Å; M1076-L1081 PolarHBondContact O-N 3.31Å; M1076-L1081 HydrophobicContact SD-CD1 4.28Å; S1079-L1081 PolarHBondContact O-N 3.32Å
1082	G	84.5	Confident	79.5	Confident	4 Å²	4	35.6 Å²	35.6	4%	0.041	19%	0.19	C	C	.	.			trans	97.5	-165.8	-176.8	0	0	0	0	0	113.7	L934 E1077	L934-G1082 CarbonylContact O-C 3.53Å; L934-G1082 WeakPolarHBondContact O-CA 3.46Å; E1077-G1082 WeakPolarHBondContact CA-O 3.24Å; E1077-G1082 PolarHBondContact N-O 3.44Å
1083	I	81.6	Confident	78.5	Confident	77 Å²	77	37.2 Å²	37.2	40%	0.395	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.8	-171.2	-56.4	171.6	0	0	0	109.7	I933 L934 R1073 E1085	I933-I1083 WeakPolarHBondContact CA-O 3.13Å; L934-I1083 PolarHBondContact N-O 2.73Å; L934-I1083 PolarHBondContact O-N 2.78Å; R1073-I1083 HydrophobicContact CG-CG2 4.32Å; I1083-E1085 PolarHBondContact O-N 3.14Å
1084	V	83.6	Confident	77.6	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	117.1	169.8	-174.7	0	0	0	0	108.5	I933 P1068 F1072 M1076	I933-V1084 HydrophobicContact CG1-CG2 4.43Å; P1068-V1084 HydrophobicContact CB-CB 4.35Å; P1068-V1084 HydrophobicContact CB-CG1 3.9Å; P1068-V1084 HydrophobicContact CG-CB 4.3Å; P1068-V1084 HydrophobicContact CG-CG1 4.05Å; P1068-V1084 WeakPolarHBondContact CG-O 2.99Å; F1072-V1084 HydrophobicContact CD1-CG2 4.45Å; F1072-V1084 HydrophobicContact CE1-CG1 4.18Å; F1072-V1084 HydrophobicContact CE1-CG2 4.02Å; M1076-V1084 HydrophobicContact CB-CG2 3.81Å; M1076-V1084 HydrophobicContact CE-CG2 4.4Å; M1076-V1084 HydrophobicContact CG-CG2 3.74Å
1085	E	77.1	Confident	76.9	Confident	62 Å²	62	32.9 Å²	32.9	29%	0.29	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-37.7	-179.9	-161.5	-177	178.6	0	0	111.1	R932 L1062 I1083	R932-E1085 WeakPolarHBondContact CD-OE2 3Å; R932-E1085 HydrophobicContact CG-CB 4.31Å; R932-E1085 IonicContact CZ-OE2 2.82Å; R932-E1085 IonicContact NE-OE2 2.82Å; R932-E1085 PolarHBondContact NE-OE2 3.38Å; R932-E1085 IonicContact NH2-OE1 2.82Å; R932-E1085 IonicContact NH2-OE2 3.33Å; R932-E1085 PolarHBondContact NH2-OE2 3.01Å; R932-E1085 PolarHBondContact O-N 2.73Å; L1062-E1085 WeakPolarHBondContact CD1-OE1 3.44Å; L1062-E1085 HydrophobicContact CD2-CG 3.73Å; I1083-E1085 PolarHBondContact O-N 3.14Å
1086	A	73	Confident	75.5	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	146.2	178.5	0	0	0	0	0	112.3	L931 R932 L1060 L1062 S1066	L931-A1086 WeakPolarHBondContact CA-O 3.36Å; R932-A1086 HydrophobicContact CB-CB 4.32Å; R932-A1086 PolarHBondContact N-O 2.91Å; L1060-A1086 HydrophobicContact CB-CB 4.29Å; L1060-A1086 HydrophobicContact CD2-CB 3.72Å; L1062-A1086 HydrophobicContact CD2-CB 3.97Å; S1066-A1086 CarbonylContact O-C 3.49Å; S1066-A1086 WeakPolarHBondContact O-CA 3.45Å
1087	A	80.5	Confident	73.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133.3	175	0	0	0	0	0	110.4	R930 L931 I1036 S1066 P1068	R930-A1087 WeakPolarHBondContact O-CA 3.5Å; L931-A1087 HydrophobicContact CD2-CB 3.48Å; L931-A1087 VanDerWaalsContact CD2-CB 3.48Å; I1036-A1087 WeakPolarHBondContact CD1-O 3.49Å; I1036-A1087 HydrophobicContact CG1-CB 4.29Å; S1066-A1087 CarbonylContact C-O 3.49Å; S1066-A1087 WeakPolarHBondContact CA-O 3.44Å; S1066-A1087 PolarHBondContact O-N 2.89Å; S1066-A1087 VanDerWaalsContact O-O 3.09Å; P1068-A1087 HydrophobicContact CB-CB 4.14Å
1088	V	73.8	Confident	71.9	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	128.4	-177.7	172.9	0	0	0	0	110.2	V929 R930 L1060 W1065	V929-V1088 CarbonylContact C-O 3.57Å; V929-V1088 WeakPolarHBondContact CA-O 3.36Å; R930-V1088 PolarHBondContact N-O 3.36Å; R930-V1088 PolarHBondContact O-N 3Å; L1060-V1088 HydrophobicContact CD2-CB 3.87Å; L1060-V1088 HydrophobicContact CD2-CG2 3.37Å; L1060-V1088 HydrophobicContact CG-CB 4.46Å; L1060-V1088 HydrophobicContact CG-CG2 3.93Å; W1065-V1088 HydrophobicContact CE3-CG2 4.46Å; W1065-V1088 HydrophobicContact CZ3-CG2 3.8Å
1089	V	76.3	Confident	70	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.03	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.6	171.5	-174.9	0	0	0	0	108.3	V929 Q1032 L1035 I1036	V929-V1089 HydrophobicContact CG1-CG2 4.48Å; V929-V1089 HydrophobicContact CG2-CG1 4.46Å; V929-V1089 HydrophobicContact CG2-CG2 4.17Å; Q1032-V1089 HydrophobicContact CB-CG2 4.45Å; Q1032-V1089 HydrophobicContact CG-CG2 4.37Å; L1035-V1089 HydrophobicContact CD1-CG2 4.06Å; I1036-V1089 HydrophobicContact CD1-CB 4.44Å; I1036-V1089 HydrophobicContact CD1-CG2 3.99Å
1090	D	70.3	Confident	67.8	Low	13 Å²	13	45.7 Å²	45.7	7%	0.07	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132	171.2	-58.9	-41.6	0	0	0	109.5	H927 R928 R930 K1046	H927-D1090 CarbonylContact C-O 3.31Å; H927-D1090 WeakPolarHBondContact CA-O 3.25Å; H927-D1090 WeakPolarHBondContact CB-O 3.49Å; R928-D1090 HydrophobicContact CG-CB 3.76Å; R928-D1090 IonicContact CZ-OD2 3.9Å; R928-D1090 PolarHBondContact N-O 2.94Å; R928-D1090 IonicContact NE-OD2 2.72Å; R928-D1090 PolarHBondContact NE-OD2 3.24Å; R928-D1090 IonicContact NH2-OD2 3.29Å; R928-D1090 PolarHBondContact NH2-OD2 2.81Å; R928-D1090 PolarHBondContact O-N 2.79Å; R930-D1090 IonicContact CZ-OD1 3.11Å; R930-D1090 IonicContact CZ-OD2 2.71Å; R930-D1090 IonicContact NE-OD1 2.81Å; R930-D1090 IonicContact NE-OD2 3.87Å; R930-D1090 PolarHBondContact NE-OD2 2.76Å; R930-D1090 IonicContact NH2-OD1 3.96Å; R930-D1090 PolarHBondContact NH2-OD1 3.06Å; R930-D1090 IonicContact NH2-OD2 3.73Å; R930-D1090 PolarHBondContact NH2-OD2 2.99Å; K1046-D1090 IonicContact NZ-OD1 2.93Å; K1046-D1090 PolarHBondContact NZ-OD1 2.76Å
1091	R	67.9	Low	65.3	Low	21 Å²	21	48.2 Å²	48.2	8%	0.079	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	137.8	172.5	-51.2	174.5	-176.8	-170	-7.2	108.3	N926 D1029 N1047 C1095	N926-R1091 CarbonylContact O-C 3.52Å; N926-R1091 WeakPolarHBondContact O-CA 3.31Å; D1029-R1091 IonicContact OD1-CZ 2.7Å; D1029-R1091 IonicContact OD1-NH1 3.52Å; D1029-R1091 IonicContact OD1-NH2 2.73Å; D1029-R1091 PolarHBondContact OD1-NH2 2.9Å; N1047-R1091 WeakPolarHBondContact ND2-CD 3.38Å; N1047-R1091 WeakPolarHBondContact OD1-CB 3.38Å; R1091-C1095 WeakPolarHBondContact CB-O 3.46Å
1092	M	63.4	Low	62.8	Low	25 Å²	25	57.2 Å²	57.2	12%	0.123	29%	0.288	C	S	.	.			trans	-130.3	167.1	-170.7	-63.6	-178.4	67	0	0	110.8	L925 N926 R928 C1095 A1096	L925-M1092 HydrophobicContact CB-CB 4.36Å; L925-M1092 HydrophobicContact CD1-CE 4.39Å; L925-M1092 CarbonylContact O-C 3.45Å; L925-M1092 WeakPolarHBondContact O-CB 3.29Å; L925-M1092 VanDerWaalsContact O-O 3.06Å; N926-M1092 WeakPolarHBondContact CA-O 3.35Å; N926-M1092 PolarHBondContact O-N 3.44Å; R928-M1092 HydrophobicContact CB-SD 4.06Å; R928-M1092 HydrophobicContact CG-SD 3.69Å; M1092-C1095 CarbonylContact O-C 3.54Å; M1092-C1095 WeakPolarHBondContact O-CB 3.36Å; M1092-C1095 PolarHBondContact O-N 3.48Å; M1092-C1095 VanDerWaalsContact O-N 3.11Å; M1092-A1096 PolarHBondContact O-N 2.85Å
1093	G	64.9	Low	60.2	Low	35 Å²	35	65.9 Å²	65.9	36%	0.361	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	57.7	-135.8	174	0	0	0	0	0	114	L925 C1095 A1096	L925-G1093 VanDerWaalsContact O-CA 3.27Å; L925-G1093 WeakPolarHBondContact O-CA 3.37Å; L925-G1093 PolarHBondContact O-N 2.88Å; L925-G1093 VanDerWaalsContact O-N 3.12Å; G1093-C1095 PolarHBondContact O-N 3.37Å; G1093-A1096 WeakPolarHBondContact O-CB 3.31Å; G1093-A1096 PolarHBondContact O-N 3.48Å
1094	S	61.3	Low	57.7	Low	40 Å²	40	66 Å²	66	28%	0.28	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-62.7	-22	177.4	46.3	0	0	0	0	113.8	Q924 A1096	Q924-S1094 VanDerWaalsContact OE1-CB 3.31Å; Q924-S1094 PolarHBondContact OE1-OG 3.01Å; S1094-A1096 VanDerWaalsContact C-N 3.33Å
1095	C	63.9	Low	55.1	Low	1 Å²	1	75.5 Å²	75.5	1%	0.007	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-85.3	-3.1	174.4	-67.8	0	0	0	0	113.6	N926 C1023 W1025 F1028 N1047 R1091 M1092 G1093 R1097	N926-C1095 HydrophobicContact CB-CB 4.01Å; N926-C1095 WeakPolarHBondContact CB-SG 3.23Å; C1023-C1095 HydrophobicContact CB-CB 4.07Å; C1023-C1095 WeakPolarHBondContact CB-SG 3.44Å; C1023-C1095 VanDerWaalsContact SG-CA 3.57Å; C1023-C1095 WeakPolarHBondContact SG-CB 3.41Å; C1023-C1095 CovalentContact SG-SG 2.02Å; C1023-C1095 PolarHBondContact SG-SG 2.96Å; W1025-C1095 WeakPolarHBondContact CH2-O 3.43Å; F1028-C1095 HydrophobicContact CE2-CB 4.27Å; F1028-C1095 VanDerWaalsContact CE2-SG 3.52Å; N1047-C1095 PolarHBondContact ND2-O 3.21Å; R1091-C1095 WeakPolarHBondContact CB-O 3.46Å; M1092-C1095 CarbonylContact O-C 3.54Å; M1092-C1095 WeakPolarHBondContact O-CB 3.36Å; M1092-C1095 PolarHBondContact O-N 3.48Å; M1092-C1095 VanDerWaalsContact O-N 3.11Å; G1093-C1095 PolarHBondContact O-N 3.37Å; C1095-R1097 PolarHBondContact O-N 2.96Å
1096	A	57.1	Low	52.7	Low	31 Å²	31	81 Å²	81	26%	0.256	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-72.7	-11.5	178.6	0	0	0	0	0	113.3	N1047 M1092 G1093 S1094	N1047-A1096 WeakPolarHBondContact CA-O 3.3Å; N1047-A1096 WeakPolarHBondContact CB-O 3.11Å; N1047-A1096 VanDerWaalsContact CG-C 3.44Å; N1047-A1096 PolarHBondContact ND2-O 3.45Å; N1047-A1096 VanDerWaalsContact O-O 3.11Å; N1047-A1096 PolarHBondContact OD1-O 2.6Å; M1092-A1096 PolarHBondContact O-N 2.85Å; G1093-A1096 WeakPolarHBondContact O-CB 3.31Å; G1093-A1096 PolarHBondContact O-N 3.48Å; S1094-A1096 VanDerWaalsContact C-N 3.33Å
1097	R	48.8	Very low	50.6	Low	181 Å²	181	88.4 Å²	88.4	68%	0.683	46%	0.456	S	S	*	.	S	Bend	trans	-140.9	134.7	175.3	-72.2	-173.7	179.9	131.6	0.7	111.3	C1095 T1099	C1095-R1097 PolarHBondContact O-N 2.96Å; R1097-T1099 PolarHBondContact O-N 3.3Å
1098	H	46.3	Very low	48	Very low	108 Å²	108	95.5 Å²	95.5	50%	0.5	50%	0.499	S	S	.	.			trans	-76.5	101.3	171.5	-157.3	-89.7	0	0	0	108.2	W1025 N1100	W1025-H1098 AromaticContact CD2-CD2 3.99Å; W1025-H1098 AromaticContact CE2-CD2 3.71Å; W1025-H1098 HydrophobicContact CH2-CB 4.37Å; W1025-H1098 HydrophobicContact CZ2-CB 4.28Å; W1025-H1098 AromaticContact CZ2-CD2 3.83Å; H1098-N1100 VanDerWaalsContact C-N 3.34Å; H1098-N1100 PolarHBondContact ND1-OD1 2.8Å; H1098-N1100 PolarHBondContact O-N 2.02Å
1099	T	42.8	Very low	45.7	Very low	111 Å²	111	98.8 Å²	98.8	68%	0.681	53%	0.534	S	S	*	.			trans	-73	91.6	171.7	44	0	0	0	0	108.2	R1097 K1101	R1097-T1099 PolarHBondContact O-N 3.3Å; T1099-K1101 VanDerWaalsContact C-N 3.33Å; T1099-K1101 PolarHBondContact O-N 3.06Å
1100	N	38.5	Very low	43.3	Very low	116 Å²	116	108.4 Å²	108.4	62%	0.62	58%	0.576	S	S	*	*			trans	-60.5	96.9	167.7	-76.9	-9.9	0	0	0	108.4	H1098 F1102	H1098-N1100 VanDerWaalsContact C-N 3.34Å; H1098-N1100 PolarHBondContact ND1-OD1 2.8Å; H1098-N1100 PolarHBondContact O-N 2.02Å; N1100-F1102 PolarHBondContact O-N 2.85Å
1101	K	31.2	Very low	41.2	Very low	176 Å²	176	113.5 Å²	113.5	77%	0.765	61%	0.612	S	S	*	*			trans	-66.9	66.4	166.8	-84.4	-174.2	172.7	179.1	0	109.9	T1099	T1099-K1101 VanDerWaalsContact C-N 3.33Å; T1099-K1101 PolarHBondContact O-N 3.06Å
1102	F	32.1	Very low	39.2	Very low	190 Å²	190	121.8 Å²	121.8	83%	0.833	65%	0.654	S	S	*	*			trans	-115.2	3.8	173.4	-91.3	-71	0	0	0	114.4	N1100	N1100-F1102 PolarHBondContact O-N 2.85Å
1103	E	30.7	Very low	37.6	Very low	187 Å²	187	128.1 Å²	128.1	87%	0.874	68%	0.683	S	S	*	*	S	Bend	trans	-129.9	113	172.7	-77	-180	152	0	0	110.2
1104	G	28.1	Very low	36.1	Very low	78 Å²	78	133.8 Å²	133.8	80%	0.804	71%	0.705	S	S	*	*			trans	132.2	22.5	157.5	0	0	0	0	0	120.2
1105	Q	28.1	Very low	34.7	Very low	202 Å²	202	142.7 Å²	142.7	94%	0.944	73%	0.733	S	S	*	*			trans	-98.2	77.8	164.1	-84.8	-174.3	-12.4	0	0	110.9
1106	E	27.4	Very low	33.1	Very low	178 Å²	178	152 Å²	152	83%	0.832	77%	0.774	S	S	*	*			trans	-79.2	114.9	157.3	-79.7	-174.3	158.9	0	0	109.3
1107	L	28.3	Very low	31.9	Very low	155 Å²	155	152.5 Å²	152.5	81%	0.812	78%	0.775	S	S	*	*			trans	44.6	94.1	137.4	-67.1	145.6	0	0	0	117.8
1108	T	26.1	Very low	31.3	Very low	149 Å²	149	146.3 Å²	146.3	91%	0.914	76%	0.759	S	S	*	*				-159.9	128.9	125.2	39.3	0	0	0	0	109.3
1109	G	26.9	Very low	30.8	Very low	73 Å²	73	146.1 Å²	146.1	75%	0.753	76%	0.758	S	S	*	*			trans	-75.8	147.1	-159	0	0	0	0	0	116.5
1110	K	24.9	Very low	30.6	Very low	207 Å²	207	145.9 Å²	145.9	90%	0.9	76%	0.76	S	S	*	*				175.4	112.2	115.8	-94.2	173.4	-178.4	-179.2	0	109.7
1111	S	27	Very low	30.3	Very low	119 Å²	119	144.4 Å²	144.4	83%	0.832	76%	0.759	S	S	*	*			trans	37.2	87.5	147.8	175.5	0	0	0	0	118.6
1112	M	25.3	Very low	30.5	Very low	195 Å²	195	141.9 Å²	141.9	96%	0.961	75%	0.753	S	S	*	*			trans	-140.6	41.5	153.3	-104	-98.9	177.1	0	0	109.5	N1114	M1112-N1114 PolarHBondContact O-N 2.99Å
1113	Q	30.5	Very low	30.7	Very low	158 Å²	158	140 Å²	140	74%	0.738	75%	0.752	S	S	*	*			trans	-95.3	27.9	-167.4	-143.5	177.9	7.8	0	0	114.5	S1117	Q1113-S1117 PolarHBondContact O-OG 2.91Å
1114	N	32.9	Very low	31.1	Very low	154 Å²	154	138.6 Å²	138.6	82%	0.824	75%	0.75	S	S	*	*	S	Bend	trans	-123.2	22.1	-172.1	-95.7	6	0	0	0	117.3	M1112	M1112-N1114 PolarHBondContact O-N 2.99Å
1115	R	31	Very low	32	Very low	227 Å²	227	140.2 Å²	140.2	86%	0.857	74%	0.741	S	S	*	*	S	Bend	trans	-133.9	-3.9	167.7	-79.5	-164.4	-160.8	174.8	7.2	119
1116	F	32	Very low	33.1	Very low	198 Å²	198	136.7 Å²	136.7	87%	0.868	73%	0.733	S	S	*	*	S	Bend	trans	-139.2	13.2	175.7	-69.6	-76.1	0	0	0	114.2
1117	S	31.6	Very low	34.4	Very low	40 Å²	40	131.7 Å²	131.7	28%	0.28	71%	0.711	S	S	.	*			trans	-85.7	-1.3	179.8	39.8	0	0	0	0	114.2	Q1113 F1119 S1120	Q1113-S1117 PolarHBondContact O-OG 2.91Å; S1117-F1119 VanDerWaalsContact C-N 3.28Å; S1117-F1119 PolarHBondContact O-N 2.72Å; S1117-S1120 PolarHBondContact O-N 3.31Å
1118	S	35.4	Very low	36.1	Very low	51 Å²	51	126.1 Å²	126.1	36%	0.357	68%	0.681	S	S	.	*	G	3₁₀ helix	trans	-63.5	-33	178.7	56.5	0	0	0	0	112.2	S1120 N1206	S1118-S1120 PolarHBondContact O-N 2.95Å; S1118-N1206 VanDerWaalsContact O-CG 3.26Å; S1118-N1206 PolarHBondContact O-ND2 2.77Å; S1118-N1206 PolarHBondContact O-OD1 2.8Å
1119	F	36.5	Very low	38.3	Very low	105 Å²	105	123.9 Å²	123.9	46%	0.461	66%	0.663	S	S	.	*	G	3₁₀ helix	trans	-81.2	-2.7	-177.6	-71.2	-75.1	0	0	0	116.1	S1117 P1203	S1117-F1119 VanDerWaalsContact C-N 3.28Å; S1117-F1119 PolarHBondContact O-N 2.72Å; F1119-P1203 WeakPolarHBondContact CZ-O 3.25Å
1120	S	38	Very low	40.4	Very low	105 Å²	105	121.9 Å²	121.9	73%	0.734	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-118	5	-176.1	70.2	0	0	0	0	115.9	S1117 S1118	S1117-S1120 PolarHBondContact O-N 3.31Å; S1118-S1120 PolarHBondContact O-N 2.95Å
1121	S	33	Very low	42.7	Very low	86 Å²	86	113.8 Å²	113.8	60%	0.601	60%	0.602	S	S	*	*			trans	-117.5	71.3	174.2	73.8	0	0	0	0	111.4
1122	L	34.7	Very low	45.1	Very low	123 Å²	123	108.5 Å²	108.5	64%	0.644	57%	0.565	S	S	*	*			trans	-131.9	106	152.4	-155.1	73.3	0	0	0	106.7	N1124 D1125	L1122-N1124 PolarHBondContact O-N 2.61Å; L1122-D1125 HydrophobicContact CD2-CB 4.18Å; L1122-D1125 WeakPolarHBondContact CD2-OD2 3.17Å
1123	D	35.6	Very low	47.4	Very low	150 Å²	150	101.1 Å²	101.1	80%	0.802	53%	0.527	S	S	*	.			trans	-52.8	125.6	171.9	-84.7	-47.4	0	0	0	110	D1125	D1123-D1125 VanDerWaalsContact C-N 3.25Å; D1123-D1125 PolarHBondContact O-N 3.04Å
1124	N	40	Very low	49.3	Very low	157 Å²	157	94.8 Å²	94.8	84%	0.84	50%	0.5	S	S	*	.	S	Bend	trans	52.9	9.7	155.2	-73	-19.7	0	0	0	121.2	L1122 V1126	L1122-N1124 PolarHBondContact O-N 2.61Å; N1124-V1126 PolarHBondContact O-N 3.22Å
1125	D	45.9	Very low	51.2	Low	113 Å²	113	87.6 Å²	87.6	60%	0.604	46%	0.462	S	S	*	.			trans	-68.6	123.2	169.4	-82.9	-18.4	0	0	0	110.4	L1122 D1123 I1127	L1122-D1125 HydrophobicContact CD2-CB 4.18Å; L1122-D1125 WeakPolarHBondContact CD2-OD2 3.17Å; D1123-D1125 VanDerWaalsContact C-N 3.25Å; D1123-D1125 PolarHBondContact O-N 3.04Å; D1125-I1127 PolarHBondContact O-N 2.76Å
1126	V	51.2	Low	53.4	Low	128 Å²	128	77.6 Å²	77.6	78%	0.776	43%	0.425	S	S	*	.			trans	-56.3	95.8	-172.5	-179.6	0	0	0	0	110.3	N1124 M1128	N1124-V1126 PolarHBondContact O-N 3.22Å; V1126-M1128 PolarHBondContact O-N 3.07Å
1127	I	55.4	Low	55.8	Low	72 Å²	72	68.3 Å²	68.3	37%	0.369	39%	0.385	S	S	.	.			trans	-61.9	113.3	171	-58.8	174.6	0	0	0	107.4	D1125 N1129	D1125-I1127 PolarHBondContact O-N 2.76Å; I1127-N1129 PolarHBondContact O-N 3.39Å; I1127-N1129 PolarHBondContact O-OD1 2.72Å
1128	M	63.4	Low	58.1	Low	38 Å²	38	67.1 Å²	67.1	19%	0.187	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	117.8	178.7	-75.6	176.7	-87.2	0	0	109.6	V1126 F1130 I1142 V1209 F1211 S1212	V1126-M1128 PolarHBondContact O-N 3.07Å; M1128-F1130 HydrophobicContact CB-CE1 4.4Å; M1128-F1130 HydrophobicContact CB-CE2 3.86Å; M1128-F1130 HydrophobicContact CB-CZ 3.66Å; M1128-F1130 HydrophobicContact CG-CZ 4.36Å; M1128-F1130 HydrophobicContact SD-CZ 4.27Å; M1128-I1142 HydrophobicContact CE-CG2 3.42Å; M1128-I1142 VanDerWaalsContact CE-CG2 3.42Å; M1128-I1142 HydrophobicContact SD-CG2 4.05Å; M1128-V1209 HydrophobicContact CE-CG1 3.53Å; M1128-F1211 HydrophobicContact CB-CB 4.11Å; M1128-F1211 CarbonylContact O-C 3.46Å; M1128-F1211 VanDerWaalsContact O-CA 3.27Å; M1128-F1211 WeakPolarHBondContact O-CA 3.33Å; M1128-F1211 WeakPolarHBondContact O-CB 3.26Å; M1128-S1212 PolarHBondContact O-N 2.85Å
1129	N	72.9	Confident	60.3	Low	102 Å²	102	66 Å²	66	55%	0.545	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131	-179.5	-63.8	-20.7	0	0	0	110.2	I1127 S1212	I1127-N1129 PolarHBondContact O-N 3.39Å; I1127-N1129 PolarHBondContact O-OD1 2.72Å; N1129-S1212 CarbonylContact C-O 3.42Å; N1129-S1212 WeakPolarHBondContact CA-O 3.43Å; N1129-S1212 VanDerWaalsContact CG-OG 3.28Å; N1129-S1212 PolarHBondContact OD1-OG 3.32Å
1130	F	70.6	Confident	62.3	Low	31 Å²	31	64.6 Å²	64.6	14%	0.136	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146.5	-179.1	-51.7	-63.2	0	0	0	110.7	M1128 F1211 S1212 I1213 Y1214	M1128-F1130 HydrophobicContact CB-CE1 4.4Å; M1128-F1130 HydrophobicContact CB-CE2 3.86Å; M1128-F1130 HydrophobicContact CB-CZ 3.66Å; M1128-F1130 HydrophobicContact CG-CZ 4.36Å; M1128-F1130 HydrophobicContact SD-CZ 4.27Å; F1130-F1211 HydrophobicContact CD2-CD2 4.31Å; F1130-F1211 HydrophobicContact CE2-CB 4.07Å; F1130-F1211 HydrophobicContact CE2-CD2 4.31Å; F1130-F1211 HydrophobicContact CE2-CG 4.42Å; F1130-S1212 PolarHBondContact N-O 2.93Å; F1130-I1213 HydrophobicContact CB-CG1 4.41Å; F1130-I1213 HydrophobicContact CD2-CG1 4.38Å; F1130-I1213 CarbonylContact O-C 3.51Å; F1130-I1213 VanDerWaalsContact O-CA 3.28Å; F1130-I1213 WeakPolarHBondContact O-CA 3.27Å; F1130-Y1214 PolarHBondContact O-N 2.76Å
1131	T	73.3	Confident	64.1	Low	38 Å²	38	63.1 Å²	63.1	23%	0.233	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.9	171.3	56.3	0	0	0	0	109.3	Y1214	T1131-Y1214 CarbonylContact C-O 3.6Å; T1131-Y1214 VanDerWaalsContact CA-O 3.29Å; T1131-Y1214 WeakPolarHBondContact CA-O 3.28Å; T1131-Y1214 HydrophobicContact CG2-CD1 4.06Å
1132	V	77.6	Confident	66	Low	8 Å²	8	59 Å²	59	5%	0.048	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	149.2	175.7	-60.8	0	0	0	0	109.3	F1138 W1171 I1185 I1213 Y1214 V1215 A1216	V1132-F1138 HydrophobicContact CB-CD1 4.03Å; V1132-F1138 HydrophobicContact CB-CE1 4.34Å; V1132-F1138 HydrophobicContact CG1-CB 4.24Å; V1132-F1138 HydrophobicContact CG1-CD1 3.6Å; V1132-F1138 HydrophobicContact CG1-CD2 4.15Å; V1132-F1138 HydrophobicContact CG1-CE1 3.96Å; V1132-F1138 HydrophobicContact CG1-CE2 4.47Å; V1132-F1138 HydrophobicContact CG1-CG 3.71Å; V1132-F1138 HydrophobicContact CG1-CZ 4.39Å; V1132-F1138 HydrophobicContact CG2-CE1 4.47Å; V1132-W1171 HydrophobicContact CG2-CZ3 4.42Å; V1132-I1185 HydrophobicContact CG2-CD1 3.49Å; V1132-I1185 VanDerWaalsContact CG2-CD1 3.49Å; V1132-I1213 HydrophobicContact CB-CG2 4.2Å; V1132-I1213 HydrophobicContact CG1-CG2 3.85Å; V1132-I1213 HydrophobicContact CG2-CG2 3.32Å; V1132-Y1214 PolarHBondContact N-O 2.88Å; V1132-V1215 HydrophobicContact CG2-CB 4.38Å; V1132-V1215 HydrophobicContact CG2-CG2 3.88Å; V1132-V1215 WeakPolarHBondContact O-CA 3.14Å; V1132-A1216 PolarHBondContact O-N 2.96Å
1133	F	74.1	Confident	67.3	Low	39 Å²	39	58.8 Å²	58.8	17%	0.171	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	150	-177.3	-63.1	-78.8	0	0	0	111	G1135 E1136 A1216 N1219	F1133-G1135 PolarHBondContact O-N 3.01Å; F1133-E1136 HydrophobicContact CB-CG 4.33Å; F1133-E1136 PolarHBondContact O-N 2.68Å; F1133-A1216 HydrophobicContact CD1-CB 3.46Å; F1133-A1216 VanDerWaalsContact CD1-CB 3.46Å; F1133-A1216 HydrophobicContact CE1-CB 3.5Å; F1133-A1216 VanDerWaalsContact CE1-CB 3.5Å; F1133-A1216 HydrophobicContact CG-CB 4.46Å; F1133-N1219 HydrophobicContact CB-CB 3.91Å; F1133-N1219 VanDerWaalsContact CD1-CA 3.44Å; F1133-N1219 HydrophobicContact CD1-CB 3.82Å; F1133-N1219 HydrophobicContact CD2-CB 4.04Å; F1133-N1219 HydrophobicContact CE1-CB 4.34Å; F1133-N1219 HydrophobicContact CG-CB 3.65Å
1134	T	69.9	Low	68.7	Low	26 Å²	26	55.1 Å²	55.1	16%	0.16	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	132.5	176.7	57	0	0	0	0	111	E1136 I1185 A1216 G1217 S1218	T1134-E1136 VanDerWaalsContact C-N 3.31Å; T1134-I1185 CarbonylContact C-O 3.53Å; T1134-I1185 HydrophobicContact CG2-CG2 4.19Å; T1134-A1216 PolarHBondContact N-O 2.76Å; T1134-G1217 PolarHBondContact N-O 2.72Å; T1134-G1217 VanDerWaalsContact N-O 3.1Å; T1134-G1217 PolarHBondContact OG1-O 2.94Å; T1134-S1218 PolarHBondContact OG1-N 2.9Å
1135	G	72.3	Confident	69.6	Low	3 Å²	3	50.3 Å²	50.3	3%	0.031	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.2	-20.4	-178.8	0	0	0	0	0	113.5	F1133 I1184 I1185 I1279 L1280	F1133-G1135 PolarHBondContact O-N 3.01Å; G1135-I1184 WeakPolarHBondContact O-CD1 3.39Å; G1135-I1185 PolarHBondContact N-O 2.7Å; G1135-I1279 CarbonylContact O-C 3.54Å; G1135-I1279 WeakPolarHBondContact O-CA 3.49Å; G1135-L1280 WeakPolarHBondContact CA-O 3.39Å; G1135-L1280 PolarHBondContact O-N 2.76Å
1136	E	78.7	Confident	70.6	Confident	17 Å²	17	51.5 Å²	51.5	8%	0.079	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	125.2	-179.2	-65.9	-172.9	-170.6	0	0	110.8	F1133 T1134 N1219 I1279 K1297	F1133-E1136 HydrophobicContact CB-CG 4.33Å; F1133-E1136 PolarHBondContact O-N 2.68Å; T1134-E1136 VanDerWaalsContact C-N 3.31Å; E1136-N1219 WeakPolarHBondContact OE1-CB 3.23Å; E1136-N1219 PolarHBondContact OE1-ND2 3.2Å; E1136-I1279 HydrophobicContact CG-CG1 3.91Å; E1136-K1297 IonicContact OE1-NZ 2.66Å; E1136-K1297 IonicContact OE2-NZ 3.38Å; E1136-K1297 PolarHBondContact OE2-NZ 3.35Å
1137	G	80.7	Confident	71.3	Confident	3 Å²	3	48 Å²	48	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	134.4	167.6	0	0	0	0	0	110.3	G1183 M1276	G1137-G1183 WeakPolarHBondContact CA-O 3.31Å; G1137-M1276 WeakPolarHBondContact O-CB 3.37Å; G1137-M1276 WeakPolarHBondContact O-CG 3.43Å
1138	F	80.8	Confident	71.7	Confident	14 Å²	14	45.2 Å²	45.2	6%	0.061	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.6	176.6	66.8	-88.1	0	0	0	110.6	V1132 W1171 I1172 I1181 F1182 G1183 I1213 W1252	V1132-F1138 HydrophobicContact CB-CD1 4.03Å; V1132-F1138 HydrophobicContact CB-CE1 4.34Å; V1132-F1138 HydrophobicContact CG1-CB 4.24Å; V1132-F1138 HydrophobicContact CG1-CD1 3.6Å; V1132-F1138 HydrophobicContact CG1-CD2 4.15Å; V1132-F1138 HydrophobicContact CG1-CE1 3.96Å; V1132-F1138 HydrophobicContact CG1-CE2 4.47Å; V1132-F1138 HydrophobicContact CG1-CG 3.71Å; V1132-F1138 HydrophobicContact CG1-CZ 4.39Å; V1132-F1138 HydrophobicContact CG2-CE1 4.47Å; F1138-W1171 AromaticContact CE1-CE3 3.86Å; F1138-W1171 HydrophobicContact CE1-CE3 3.86Å; F1138-W1171 AromaticContact CE1-CZ3 3.65Å; F1138-W1171 HydrophobicContact CE1-CZ3 3.65Å; F1138-W1171 AromaticContact CZ-CE3 3.9Å; F1138-W1171 HydrophobicContact CZ-CE3 3.9Å; F1138-W1171 AromaticContact CZ-CZ3 3.5Å; F1138-W1171 HydrophobicContact CZ-CZ3 3.5Å; F1138-W1171 VanDerWaalsContact CZ-CZ3 3.5Å; F1138-I1172 HydrophobicContact CE2-CD1 4.22Å; F1138-I1172 HydrophobicContact CE2-CG1 4.42Å; F1138-I1172 HydrophobicContact CZ-CB 4.38Å; F1138-I1172 HydrophobicContact CZ-CD1 4.09Å; F1138-I1172 HydrophobicContact CZ-CG1 4.14Å; F1138-I1181 HydrophobicContact CE2-CD1 4.44Å; F1138-F1182 CarbonylContact O-C 3.56Å; F1138-F1182 VanDerWaalsContact O-CA 3.24Å; F1138-F1182 WeakPolarHBondContact O-CA 3.42Å; F1138-G1183 VanDerWaalsContact CD1-O 3.25Å; F1138-G1183 WeakPolarHBondContact CD1-O 3.33Å; F1138-G1183 WeakPolarHBondContact CE1-O 3.47Å; F1138-G1183 PolarHBondContact N-O 3.5Å; F1138-G1183 PolarHBondContact O-N 3.32Å; F1138-I1213 HydrophobicContact CE2-CD1 4.26Å; F1138-I1213 HydrophobicContact CZ-CD1 4.29Å; F1138-W1252 WeakPolarHBondContact O-CH2 3.09Å
1139	R	81.4	Confident	71.8	Confident	27 Å²	27	46.9 Å²	46.9	10%	0.102	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	126.4	171	-175.4	173.9	-178	-111.3	6	108.3	E1175 T1180 I1181 F1182 W1252 N1274	R1139-E1175 IonicContact CZ-OE1 3.54Å; R1139-E1175 IonicContact CZ-OE2 3.57Å; R1139-E1175 IonicContact NE-OE1 2.8Å; R1139-E1175 IonicContact NE-OE2 2.67Å; R1139-E1175 PolarHBondContact NE-OE2 3.24Å; R1139-E1175 VanDerWaalsContact NH2-CD 3.3Å; R1139-E1175 IonicContact NH2-OE1 3.53Å; R1139-E1175 PolarHBondContact NH2-OE1 3.29Å; R1139-E1175 VanDerWaalsContact NH2-OE1 3.13Å; R1139-E1175 IonicContact NH2-OE2 3.1Å; R1139-E1175 PolarHBondContact NH2-OE2 2.99Å; R1139-T1180 HydrophobicContact CG-CG2 3.59Å; R1139-I1181 CarbonylContact C-O 2.98Å; R1139-I1181 WeakPolarHBondContact CA-O 3.44Å; R1139-F1182 HydrophobicContact CG-CB 4.41Å; R1139-W1252 HydrophobicContact CB-CH2 3.91Å; R1139-W1252 HydrophobicContact CB-CZ2 4.02Å; R1139-W1252 HydrophobicContact CG-CZ2 4.39Å; R1139-N1274 PolarHBondContact N-O 3.39Å; R1139-N1274 CarbonylContact O-C 3.57Å; R1139-N1274 WeakPolarHBondContact O-CA 3.16Å; R1139-N1274 WeakPolarHBondContact O-CB 3.36Å; R1139-N1274 PolarHBondContact O-OD1 3.17Å
1140	R	78.2	Confident	71.5	Confident	76 Å²	76	47.5 Å²	47.5	29%	0.287	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	127.7	-178.2	-67	-170.6	-179.4	-166.7	1.2	110.7	I1181	R1140-I1181 HydrophobicContact CB-CG1 4.16Å; R1140-I1181 PolarHBondContact N-O 3.44Å; R1140-I1181 VanDerWaalsContact O-CG1 3.23Å; R1140-I1181 WeakPolarHBondContact O-CG1 3.47Å; R1140-I1181 PolarHBondContact O-N 3.08Å
1141	K	76.9	Confident	71.3	Confident	74 Å²	74	46.7 Å²	46.7	32%	0.322	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	129.6	167.9	-155.7	-165.6	-157.9	-164.4	0	109.4	D1145 M1270	K1141-D1145 WeakPolarHBondContact CE-OD2 3.47Å; K1141-D1145 IonicContact NZ-OD2 3.71Å; K1141-D1145 PolarHBondContact NZ-OD2 3.13Å; K1141-M1270 HydrophobicContact CB-CE 4.14Å; K1141-M1270 HydrophobicContact CD-CE 3.56Å; K1141-M1270 HydrophobicContact CG-CE 4.07Å
1142	I	72.6	Confident	70.9	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.267	C	S	.	.			trans	-85.9	120.9	175.5	-64	175	0	0	0	107.4	M1128 N1144 S1179 I1181 I1199 V1209 F1211	M1128-I1142 HydrophobicContact CE-CG2 3.42Å; M1128-I1142 VanDerWaalsContact CE-CG2 3.42Å; M1128-I1142 HydrophobicContact SD-CG2 4.05Å; I1142-N1144 VanDerWaalsContact C-N 3.27Å; I1142-N1144 PolarHBondContact O-N 2.87Å; I1142-S1179 PolarHBondContact N-O 2.88Å; I1142-I1181 HydrophobicContact CD1-CB 4.42Å; I1142-I1181 HydrophobicContact CD1-CD1 4.17Å; I1142-I1181 HydrophobicContact CD1-CG1 4.08Å; I1142-I1181 HydrophobicContact CD1-CG2 3.54Å; I1142-I1181 HydrophobicContact CG1-CD1 4.41Å; I1142-I1181 HydrophobicContact CG1-CG1 4.16Å; I1142-I1181 HydrophobicContact CG1-CG2 4.4Å; I1142-I1199 HydrophobicContact CD1-CD1 3.29Å; I1142-V1209 HydrophobicContact CG2-CG1 3.61Å; I1142-F1211 HydrophobicContact CD1-CD1 3.73Å; I1142-F1211 HydrophobicContact CD1-CE1 3.66Å; I1142-F1211 HydrophobicContact CD1-CG 4.38Å; I1142-F1211 HydrophobicContact CD1-CZ 4.27Å
1143	V	62.3	Low	70.2	Confident	118 Å²	118	56.4 Å²	56.4	72%	0.715	30%	0.298	S	S	*	.	S	Bend	trans	-71.4	-14.7	-162.2	177.9	0	0	0	0	114	D1145	V1143-D1145 PolarHBondContact O-N 2.83Å
1144	N	63.6	Low	69.8	Low	73 Å²	73	58.6 Å²	58.6	39%	0.39	32%	0.318	S	S	.	.			trans	-81.9	57.3	-179.7	-93.1	2.5	0	0	0	113.4	I1142 D1146 I1147 L1148 V1209	I1142-N1144 VanDerWaalsContact C-N 3.27Å; I1142-N1144 PolarHBondContact O-N 2.87Å; N1144-D1146 PolarHBondContact O-N 2.8Å; N1144-I1147 HydrophobicContact CB-CD1 4.33Å; N1144-I1147 PolarHBondContact O-N 2.88Å; N1144-L1148 PolarHBondContact O-N 2.85Å; N1144-V1209 HydrophobicContact CB-CG2 4.11Å
1145	D	58.8	Low	69.8	Low	56 Å²	56	61.4 Å²	61.4	30%	0.299	33%	0.333	S	S	.	.	H	α-helix	trans	-59.9	-28.3	173.9	-88.8	-27.6	0	0	0	111.6	K1141 V1143 I1147 L1148 A1149 S1179	K1141-D1145 WeakPolarHBondContact CE-OD2 3.47Å; K1141-D1145 IonicContact NZ-OD2 3.71Å; K1141-D1145 PolarHBondContact NZ-OD2 3.13Å; V1143-D1145 PolarHBondContact O-N 2.83Å; D1145-I1147 PolarHBondContact O-N 2.9Å; D1145-L1148 PolarHBondContact O-N 2.83Å; D1145-A1149 WeakPolarHBondContact O-CB 3.31Å; D1145-A1149 PolarHBondContact O-N 2.79Å; D1145-S1179 VanDerWaalsContact OD1-CB 3.23Å; D1145-S1179 WeakPolarHBondContact OD1-CB 3.34Å; D1145-S1179 PolarHBondContact OD1-OG 2.9Å
1146	D	67.2	Low	70.2	Confident	138 Å²	138	61.3 Å²	61.3	74%	0.738	33%	0.331	S	S	*	.	H	α-helix	trans	-62.5	-41.3	-179.1	-65	-17.7	0	0	0	112.7	N1144	N1144-D1146 PolarHBondContact O-N 2.8Å
1147	I	66.2	Low	70.4	Confident	55 Å²	55	63.2 Å²	63.2	28%	0.282	34%	0.34	S	S	.	.	H	α-helix	trans	-70.4	-45.1	177.8	-59.2	177.5	0	0	0	109.4	N1144 D1145 A1149 T1150 V1209	N1144-I1147 HydrophobicContact CB-CD1 4.33Å; N1144-I1147 PolarHBondContact O-N 2.88Å; D1145-I1147 PolarHBondContact O-N 2.9Å; I1147-A1149 VanDerWaalsContact C-N 3.31Å; I1147-A1149 PolarHBondContact O-N 3.16Å; I1147-T1150 PolarHBondContact O-N 3.44Å; I1147-T1150 PolarHBondContact O-OG1 2.85Å; I1147-V1209 HydrophobicContact CB-CG2 4.32Å; I1147-V1209 HydrophobicContact CG2-CG2 4.33Å
1148	L	63.6	Low	70.5	Confident	14 Å²	14	63.3 Å²	63.3	7%	0.073	34%	0.34	C	S	.	.	H	α-helix	trans	-65.8	-31.1	179.3	-82.5	152	0	0	0	113	N1144 D1145 T1150 M1151 V1156 I1199 V1209	N1144-L1148 PolarHBondContact O-N 2.85Å; D1145-L1148 PolarHBondContact O-N 2.83Å; L1148-T1150 PolarHBondContact O-N 3.3Å; L1148-M1151 PolarHBondContact O-N 3.4Å; L1148-M1151 VanDerWaalsContact O-N 3.13Å; L1148-V1156 HydrophobicContact CD2-CG1 3.87Å; L1148-I1199 HydrophobicContact CD2-CG2 3.85Å; L1148-V1209 HydrophobicContact CD1-CG2 4.23Å; L1148-V1209 HydrophobicContact CG-CG2 4.32Å
1149	A	65.3	Low	70.5	Confident	73 Å²	73	63.8 Å²	63.8	60%	0.603	34%	0.341	S	S	*	.	H	α-helix	trans	-66.3	-24.9	178.5	0	0	0	0	0	112.9	D1145 I1147 M1151	D1145-A1149 WeakPolarHBondContact O-CB 3.31Å; D1145-A1149 PolarHBondContact O-N 2.79Å; I1147-A1149 VanDerWaalsContact C-N 3.31Å; I1147-A1149 PolarHBondContact O-N 3.16Å; A1149-M1151 VanDerWaalsContact C-N 3.3Å
1150	T	67	Low	70.5	Confident	115 Å²	115	63.7 Å²	63.7	71%	0.706	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-12.2	174.5	65.1	0	0	0	0	113.7	I1147 L1148	I1147-T1150 PolarHBondContact O-N 3.44Å; I1147-T1150 PolarHBondContact O-OG1 2.85Å; L1148-T1150 PolarHBondContact O-N 3.3Å
1151	M	66.9	Low	70	Confident	13 Å²	13	66.3 Å²	66.3	6%	0.064	36%	0.361	C	S	.	.	S	Bend	trans	-98.9	146.4	-174.6	-52.1	-180	88.8	0	0	111	L1148 A1149 R1153 V1156 T1200 D1201 V1207	L1148-M1151 PolarHBondContact O-N 3.4Å; L1148-M1151 VanDerWaalsContact O-N 3.13Å; A1149-M1151 VanDerWaalsContact C-N 3.3Å; M1151-R1153 PolarHBondContact O-N 3.42Å; M1151-V1156 HydrophobicContact CB-CG2 3.95Å; M1151-T1200 WeakPolarHBondContact CE-OG1 3.34Å; M1151-D1201 HydrophobicContact CE-CB 4.02Å; M1151-D1201 VanDerWaalsContact CE-N 3.26Å; M1151-D1201 WeakPolarHBondContact CE-OD1 3.3Å; M1151-V1207 VanDerWaalsContact CE-O 3.3Å; M1151-V1207 WeakPolarHBondContact CE-O 3.23Å
1152	S	64	Low	69.5	Low	64 Å²	64	65.5 Å²	65.5	45%	0.448	37%	0.374	S	S	.	.			trans	-69.4	109.2	177.1	-178	0	0	0	0	110.5	S1154 N1155	S1152-S1154 PolarHBondContact O-N 2.67Å; S1152-S1154 PolarHBondContact OG-OG 3.43Å; S1152-N1155 PolarHBondContact O-N 3.42Å
1153	R	64.6	Low	69.3	Low	187 Å²	187	66.9 Å²	66.9	71%	0.706	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-27.2	-175.9	-73.9	-176.6	178.1	152.4	0.2	114.6	M1151 N1155	M1151-R1153 PolarHBondContact O-N 3.42Å; R1153-N1155 VanDerWaalsContact C-N 3.28Å; R1153-N1155 PolarHBondContact O-N 2.9Å
1154	S	64.8	Low	69.6	Low	84 Å²	84	65.6 Å²	65.6	59%	0.587	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.3	179	63	0	0	0	0	113.1	S1152	S1152-S1154 PolarHBondContact O-N 2.67Å; S1152-S1154 PolarHBondContact OG-OG 3.43Å
1155	N	70.4	Confident	70.2	Confident	86 Å²	86	67.3 Å²	67.3	46%	0.46	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-3.7	-170.1	-62.4	-2.5	0	0	0	112.9	S1152 R1153 H1157 D1201	S1152-N1155 PolarHBondContact O-N 3.42Å; R1153-N1155 VanDerWaalsContact C-N 3.28Å; R1153-N1155 PolarHBondContact O-N 2.9Å; N1155-H1157 PolarHBondContact O-CD2 2.97Å; N1155-H1157 PolarHBondContact O-N 2.91Å; N1155-D1201 HydrophobicContact CB-CB 4.05Å; N1155-D1201 WeakPolarHBondContact O-CA 3.45Å
1156	V	79.8	Confident	70.8	Confident	1 Å²	1	65.5 Å²	65.5	1%	0.006	37%	0.367	C	S	.	.			trans	-72	122.4	179.1	179.5	0	0	0	0	110.6	L1148 M1151 K1178 I1199 D1201	L1148-V1156 HydrophobicContact CD2-CG1 3.87Å; M1151-V1156 HydrophobicContact CB-CG2 3.95Å; V1156-K1178 HydrophobicContact CB-CB 4.37Å; V1156-K1178 HydrophobicContact CG1-CB 4.28Å; V1156-K1178 PolarHBondContact O-NZ 3.25Å; V1156-I1199 HydrophobicContact CG1-CG2 3.34Å; V1156-D1201 HydrophobicContact CG2-CB 4.19Å
1157	H	82.5	Confident	70.8	Confident	57 Å²	57	60.9 Å²	60.9	26%	0.264	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	161.4	179	-64.4	-66.6	0	0	0	112	N1155 Y1159 Q1165 I1199 T1200	N1155-H1157 PolarHBondContact O-CD2 2.97Å; N1155-H1157 PolarHBondContact O-N 2.91Å; H1157-Y1159 HydrophobicContact CB-CD2 4.47Å; H1157-Y1159 HydrophobicContact CB-CE2 3.73Å; H1157-Y1159 WeakPolarHBondContact O-CD2 3.46Å; H1157-Q1165 HydrophobicContact CB-CG 4.03Å; H1157-Q1165 PolarHBondContact CE1-NE2 3.38Å; H1157-Q1165 PolarHBondContact ND1-NE2 3.11Å; H1157-I1199 WeakPolarHBondContact O-CA 3.39Å; H1157-T1200 PolarHBondContact N-O 3.2Å; H1157-T1200 PolarHBondContact O-N 3.13Å; H1157-T1200 VanDerWaalsContact O-N 3.17Å
1158	L	84.6	Confident	70.7	Confident	5 Å²	5	62 Å²	62	3%	0.026	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	132.3	175.1	-174.2	66.1	0	0	0	108.3	Q1165 V1166 I1172 L1174 F1197 I1199 F1211	L1158-Q1165 CarbonylContact O-C 3.53Å; L1158-Q1165 WeakPolarHBondContact O-CA 3.34Å; L1158-V1166 HydrophobicContact CB-CB 4.04Å; L1158-V1166 HydrophobicContact CB-CG2 4.27Å; L1158-V1166 HydrophobicContact CD2-CB 3.9Å; L1158-V1166 HydrophobicContact CD2-CG1 3.94Å; L1158-V1166 HydrophobicContact CD2-CG2 3.94Å; L1158-V1166 HydrophobicContact CG-CB 3.96Å; L1158-V1166 HydrophobicContact CG-CG2 3.76Å; L1158-V1166 PolarHBondContact O-N 2.9Å; L1158-I1172 HydrophobicContact CD2-CD1 4.42Å; L1158-I1172 HydrophobicContact CD2-CG1 4.05Å; L1158-I1172 HydrophobicContact CD2-CG2 4.06Å; L1158-L1174 HydrophobicContact CB-CD1 3.53Å; L1158-L1174 HydrophobicContact CB-CG 3.99Å; L1158-L1174 VanDerWaalsContact N-CD1 3.31Å; L1158-F1197 HydrophobicContact CD1-CB 3.9Å; L1158-F1197 HydrophobicContact CD1-CD1 4.46Å; L1158-F1197 HydrophobicContact CD1-CG 4.43Å; L1158-F1197 HydrophobicContact CD2-CD1 4.41Å; L1158-F1197 HydrophobicContact CG-CD1 4.34Å; L1158-I1199 HydrophobicContact CD1-CD1 4.36Å; L1158-I1199 HydrophobicContact CD1-CG1 3.59Å; L1158-F1211 HydrophobicContact CD1-CE1 3.85Å; L1158-F1211 HydrophobicContact CD1-CZ 3.72Å
1159	Y	80.3	Confident	70.3	Confident	23 Å²	23	62.3 Å²	62.3	9%	0.09	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	145.6	177	-64.2	-92.1	0	0	0	110.3	H1157 G1163 R1164 Q1165 F1197 H1198 T1200 P1203	H1157-Y1159 HydrophobicContact CB-CD2 4.47Å; H1157-Y1159 HydrophobicContact CB-CE2 3.73Å; H1157-Y1159 WeakPolarHBondContact O-CD2 3.46Å; Y1159-G1163 VanDerWaalsContact CD1-O 3.31Å; Y1159-G1163 WeakPolarHBondContact CD1-O 3.39Å; Y1159-R1164 CarbonylContact C-O 3.44Å; Y1159-R1164 VanDerWaalsContact CA-O 3.25Å; Y1159-R1164 WeakPolarHBondContact CA-O 3.32Å; Y1159-Q1165 HydrophobicContact CD1-CB 4.03Å; Y1159-Q1165 HydrophobicContact CE1-CB 3.72Å; Y1159-Q1165 HydrophobicContact CE1-CG 4.33Å; Y1159-F1197 CarbonylContact O-C 3.6Å; Y1159-F1197 VanDerWaalsContact O-CA 3.31Å; Y1159-F1197 WeakPolarHBondContact O-CA 3.27Å; Y1159-H1198 PolarHBondContact N-O 2.79Å; Y1159-H1198 PolarHBondContact O-N 2.73Å; Y1159-T1200 HydrophobicContact CD2-CG2 3.71Å; Y1159-T1200 HydrophobicContact CE2-CG2 3.87Å; Y1159-P1203 HydrophobicContact CD1-CB 4.06Å; Y1159-P1203 HydrophobicContact CD1-CG 4.37Å; Y1159-P1203 HydrophobicContact CE1-CB 4.01Å; Y1159-P1203 HydrophobicContact CE1-CG 3.83Å; Y1159-P1203 HydrophobicContact CG-CB 4.38Å
1160	D	80	Confident	70.5	Confident	26 Å²	26	59.5 Å²	59.5	14%	0.139	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	175.3	169.1	72.4	9.5	0	0	0	111.5	G1162 G1163 R1164	D1160-G1162 PolarHBondContact O-N 3.14Å; D1160-G1162 VanDerWaalsContact O-N 3.12Å; D1160-G1162 WeakPolarHBondContact OD1-CA 3.29Å; D1160-G1162 PolarHBondContact OD1-N 2.67Å; D1160-G1163 PolarHBondContact O-N 3.37Å; D1160-G1163 PolarHBondContact OD1-N 3.44Å; D1160-G1163 VanDerWaalsContact OD1-N 3.14Å; D1160-R1164 PolarHBondContact N-O 3.39Å; D1160-R1164 PolarHBondContact OD1-N 2.76Å
1161	I	68.6	Low	71	Confident	131 Å²	131	54.8 Å²	54.8	67%	0.672	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.5	176.1	-168.8	156.6	0	0	0	113.8	G1163 K1196	I1161-G1163 VanDerWaalsContact C-N 3.28Å; I1161-K1196 HydrophobicContact CB-CB 4.25Å; I1161-K1196 HydrophobicContact CD1-CB 3.92Å; I1161-K1196 HydrophobicContact CD1-CD 3.74Å; I1161-K1196 HydrophobicContact CD1-CG 4.39Å; I1161-K1196 PolarHBondContact N-O 3.18Å
1162	G	67.4	Low	71.8	Confident	57 Å²	57	54.2 Å²	54.2	59%	0.588	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	0.8	174.2	0	0	0	0	0	113.6	D1160 R1164	D1160-G1162 PolarHBondContact O-N 3.14Å; D1160-G1162 VanDerWaalsContact O-N 3.12Å; D1160-G1162 WeakPolarHBondContact OD1-CA 3.29Å; D1160-G1162 PolarHBondContact OD1-N 2.67Å; G1162-R1164 VanDerWaalsContact C-N 3.28Å; G1162-R1164 PolarHBondContact O-N 3.3Å
1163	G	67.4	Low	72.8	Confident	29 Å²	29	51.8 Å²	51.8	30%	0.299	29%	0.294	S	S	.	.	S	Bend	trans	75.4	14.8	-175.5	0	0	0	0	0	113.4	Y1159 D1160 I1161	Y1159-G1163 VanDerWaalsContact CD1-O 3.31Å; Y1159-G1163 WeakPolarHBondContact CD1-O 3.39Å; D1160-G1163 PolarHBondContact O-N 3.37Å; D1160-G1163 PolarHBondContact OD1-N 3.44Å; D1160-G1163 VanDerWaalsContact OD1-N 3.14Å; I1161-G1163 VanDerWaalsContact C-N 3.28Å
1164	R	68	Low	73.7	Confident	91 Å²	91	44.4 Å²	44.4	34%	0.343	27%	0.269	S	S	.	.			trans	-92.9	133.7	179.4	-64.4	179.7	176.8	171.2	-1.5	110.7	D1029 Y1159 D1160 G1162 V1166	D1029-R1164 IonicContact OD2-CZ 3.37Å; D1029-R1164 VanDerWaalsContact OD2-CZ 3.29Å; D1029-R1164 IonicContact OD2-NH1 3.81Å; D1029-R1164 PolarHBondContact OD2-NH1 3.09Å; D1029-R1164 IonicContact OD2-NH2 3.53Å; D1029-R1164 PolarHBondContact OD2-NH2 3.2Å; Y1159-R1164 CarbonylContact C-O 3.44Å; Y1159-R1164 VanDerWaalsContact CA-O 3.25Å; Y1159-R1164 WeakPolarHBondContact CA-O 3.32Å; D1160-R1164 PolarHBondContact N-O 3.39Å; D1160-R1164 PolarHBondContact OD1-N 2.76Å; G1162-R1164 VanDerWaalsContact C-N 3.28Å; G1162-R1164 PolarHBondContact O-N 3.3Å; R1164-V1166 PolarHBondContact O-N 3.27Å
1165	Q	76	Confident	74.6	Confident	108 Å²	108	43.2 Å²	43.2	51%	0.505	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-63.8	127	178.8	-172	176.8	-6.1	0	0	110.4	H1157 L1158 Y1159 G1167	H1157-Q1165 HydrophobicContact CB-CG 4.03Å; H1157-Q1165 PolarHBondContact CE1-NE2 3.38Å; H1157-Q1165 PolarHBondContact ND1-NE2 3.11Å; L1158-Q1165 CarbonylContact O-C 3.53Å; L1158-Q1165 WeakPolarHBondContact O-CA 3.34Å; Y1159-Q1165 HydrophobicContact CD1-CB 4.03Å; Y1159-Q1165 HydrophobicContact CE1-CB 3.72Å; Y1159-Q1165 HydrophobicContact CE1-CG 4.33Å; Q1165-G1167 PolarHBondContact O-N 3.18Å; Q1165-G1167 VanDerWaalsContact O-N 3.14Å
1166	V	72.7	Confident	75	Confident	19 Å²	19	49 Å²	49	12%	0.115	28%	0.275	C	S	.	.			trans	-72.2	106.9	179.2	179	0	0	0	0	108.8	L1158 R1164 H1170 I1172 F1197	L1158-V1166 HydrophobicContact CB-CB 4.04Å; L1158-V1166 HydrophobicContact CB-CG2 4.27Å; L1158-V1166 HydrophobicContact CD2-CB 3.9Å; L1158-V1166 HydrophobicContact CD2-CG1 3.94Å; L1158-V1166 HydrophobicContact CD2-CG2 3.94Å; L1158-V1166 HydrophobicContact CG-CB 3.96Å; L1158-V1166 HydrophobicContact CG-CG2 3.76Å; L1158-V1166 PolarHBondContact O-N 2.9Å; R1164-V1166 PolarHBondContact O-N 3.27Å; V1166-H1170 HydrophobicContact CG1-CB 3.39Å; V1166-I1172 HydrophobicContact CG1-CG2 4.2Å; V1166-I1172 WeakPolarHBondContact CG1-O 3.42Å; V1166-F1197 HydrophobicContact CG2-CD1 4.05Å; V1166-F1197 HydrophobicContact CG2-CE1 4.05Å
1167	G	66.7	Low	74.8	Confident	40 Å²	40	51.8 Å²	51.8	41%	0.412	29%	0.29	S	S	.	.			trans	-72.7	169.6	179.4	0	0	0	0	0	114.1	Q1165 S1169 H1170	Q1165-G1167 PolarHBondContact O-N 3.18Å; Q1165-G1167 VanDerWaalsContact O-N 3.14Å; G1167-S1169 PolarHBondContact O-N 2.03Å; G1167-S1169 VanDerWaalsContact O-N 3.09Å; G1167-H1170 PolarHBondContact O-N 3.1Å
1168	S	63.6	Low	74.6	Confident	78 Å²	78	51.3 Å²	51.3	55%	0.545	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-14.6	-175.6	58.7	0	0	0	0	115.2	L1248	S1168-L1248 VanDerWaalsContact O-CB 3.32Å; S1168-L1248 WeakPolarHBondContact O-CB 3.5Å; S1168-L1248 PolarHBondContact O-N 3.02Å
1169	S	55.5	Low	74.2	Confident	22 Å²	22	51.5 Å²	51.5	15%	0.154	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-5.6	178.7	62.7	0	0	0	0	114.1	F1037 P1039 G1167	F1037-S1169 VanDerWaalsContact O-CB 3.32Å; F1037-S1169 WeakPolarHBondContact O-CB 2.96Å; F1037-S1169 PolarHBondContact O-OG 3.02Å; P1039-S1169 WeakPolarHBondContact CD-O 3.44Å; P1039-S1169 WeakPolarHBondContact CD-OG 3.45Å; P1039-S1169 WeakPolarHBondContact CG-O 3.05Å; G1167-S1169 PolarHBondContact O-N 2.03Å; G1167-S1169 VanDerWaalsContact O-N 3.09Å
1170	H	69.6	Low	74.3	Confident	13 Å²	13	50.5 Å²	50.5	6%	0.06	29%	0.285	C	S	.	.	S	Bend	trans	-65.8	164.8	177.4	-109.5	79.3	0	0	0	112.4	P1039 V1166 G1167 I1172 L1248 R1251	P1039-H1170 WeakPolarHBondContact CB-CE1 3.25Å; P1039-H1170 WeakPolarHBondContact CB-ND1 3.48Å; P1039-H1170 HydrophobicContact CG-CB 4.29Å; P1039-H1170 VanDerWaalsContact CG-ND1 3.34Å; P1039-H1170 WeakPolarHBondContact CG-ND1 3.33Å; V1166-H1170 HydrophobicContact CG1-CB 3.39Å; G1167-H1170 PolarHBondContact O-N 3.1Å; H1170-I1172 PolarHBondContact O-N 3.08Å; H1170-L1248 VanDerWaalsContact O-CB 3.28Å; H1170-L1248 WeakPolarHBondContact O-CB 3.22Å; H1170-R1251 PolarHBondContact O-NH2 3.24Å
1171	W	78	Confident	74.6	Confident	16 Å²	16	49.3 Å²	49.3	6%	0.061	28%	0.278	C	S	.	.	S	Bend	trans	-77.8	-8	172.9	59	-94.9	0	0	0	112.8	V1132 F1138 G1183 I1184 I1185 H1195 F1197 I1213 V1215 L1248	V1132-W1171 HydrophobicContact CG2-CZ3 4.42Å; F1138-W1171 AromaticContact CE1-CE3 3.86Å; F1138-W1171 HydrophobicContact CE1-CE3 3.86Å; F1138-W1171 AromaticContact CE1-CZ3 3.65Å; F1138-W1171 HydrophobicContact CE1-CZ3 3.65Å; F1138-W1171 AromaticContact CZ-CE3 3.9Å; F1138-W1171 HydrophobicContact CZ-CE3 3.9Å; F1138-W1171 AromaticContact CZ-CZ3 3.5Å; F1138-W1171 HydrophobicContact CZ-CZ3 3.5Å; F1138-W1171 VanDerWaalsContact CZ-CZ3 3.5Å; W1171-G1183 CarbonylContact O-C 3.57Å; W1171-G1183 WeakPolarHBondContact O-CA 3.27Å; W1171-I1184 VanDerWaalsContact CB-O 3.29Å; W1171-I1184 WeakPolarHBondContact CB-O 3.13Å; W1171-I1184 PolarHBondContact O-N 3.49Å; W1171-I1185 HydrophobicContact CB-CG1 4.05Å; W1171-I1185 HydrophobicContact CD2-CD1 3.87Å; W1171-I1185 HydrophobicContact CD2-CG1 3.58Å; W1171-I1185 HydrophobicContact CE3-CD1 3.47Å; W1171-I1185 VanDerWaalsContact CE3-CD1 3.47Å; W1171-I1185 HydrophobicContact CE3-CG1 3.27Å; W1171-I1185 HydrophobicContact CG-CG1 3.94Å; W1171-I1185 HydrophobicContact CH2-CD1 3.99Å; W1171-I1185 HydrophobicContact CZ2-CD1 4.36Å; W1171-I1185 HydrophobicContact CZ3-CD1 3.53Å; W1171-I1185 HydrophobicContact CZ3-CG1 3.89Å; W1171-H1195 HydrophobicContact CZ2-CB 4.23Å; W1171-H1195 AromaticContact CZ2-CD2 3.99Å; W1171-H1195 AromaticContact CZ2-CG 3.98Å; W1171-F1197 HydrophobicContact CH2-CE2 4.01Å; W1171-F1197 HydrophobicContact CH2-CZ 4.28Å; W1171-F1197 AromaticContact CZ2-CE2 3.98Å; W1171-F1197 HydrophobicContact CZ2-CE2 3.98Å; W1171-F1197 AromaticContact CZ2-CZ 3.85Å; W1171-F1197 HydrophobicContact CZ2-CZ 3.85Å; W1171-I1213 HydrophobicContact CH2-CB 4.1Å; W1171-I1213 HydrophobicContact CH2-CD1 4Å; W1171-I1213 HydrophobicContact CH2-CG2 3.76Å; W1171-I1213 HydrophobicContact CZ3-CD1 4.18Å; W1171-I1213 HydrophobicContact CZ3-CG2 4.22Å; W1171-V1215 HydrophobicContact CH2-CG2 3.92Å; W1171-V1215 HydrophobicContact CZ2-CG2 4.01Å; W1171-L1248 WeakPolarHBondContact O-CD1 3.47Å
1172	I	83.8	Confident	75.4	Confident	1 Å²	1	44 Å²	44	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	145.4	-179.8	-173.8	167.3	0	0	0	110.9	F1138 L1158 V1166 H1170 I1181 F1182 F1197 F1211 I1213	F1138-I1172 HydrophobicContact CE2-CD1 4.22Å; F1138-I1172 HydrophobicContact CE2-CG1 4.42Å; F1138-I1172 HydrophobicContact CZ-CB 4.38Å; F1138-I1172 HydrophobicContact CZ-CD1 4.09Å; F1138-I1172 HydrophobicContact CZ-CG1 4.14Å; L1158-I1172 HydrophobicContact CD2-CD1 4.42Å; L1158-I1172 HydrophobicContact CD2-CG1 4.05Å; L1158-I1172 HydrophobicContact CD2-CG2 4.06Å; V1166-I1172 HydrophobicContact CG1-CG2 4.2Å; V1166-I1172 WeakPolarHBondContact CG1-O 3.42Å; H1170-I1172 PolarHBondContact O-N 3.08Å; I1172-I1181 HydrophobicContact CD1-CD1 4.46Å; I1172-F1182 CarbonylContact C-O 3.46Å; I1172-F1182 WeakPolarHBondContact CA-O 3.46Å; I1172-F1197 HydrophobicContact CD1-CD2 4.29Å; I1172-F1197 HydrophobicContact CD1-CE2 4.16Å; I1172-F1197 HydrophobicContact CG2-CE1 3.78Å; I1172-F1197 HydrophobicContact CG2-CE2 4.24Å; I1172-F1197 HydrophobicContact CG2-CZ 3.61Å; I1172-F1211 HydrophobicContact CD1-CE2 4.05Å; I1172-F1211 HydrophobicContact CD1-CZ 4.23Å; I1172-I1213 HydrophobicContact CD1-CD1 3.26Å
1173	G	85.3	Confident	76.2	Confident	13 Å²	13	41.2 Å²	41.2	13%	0.134	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	175.3	178.6	0	0	0	0	0	112.4	I1181 F1182	G1173-I1181 WeakPolarHBondContact O-CA 3.45Å; G1173-F1182 PolarHBondContact N-O 3.4Å; G1173-F1182 PolarHBondContact O-N 2.78Å
1174	L	83.1	Confident	76.8	Confident	33 Å²	33	39.9 Å²	39.9	17%	0.173	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	133.8	175.2	-83.4	164.1	0	0	0	109.8	L1158 I1181 F1182 I1199	L1158-L1174 HydrophobicContact CB-CD1 3.53Å; L1158-L1174 HydrophobicContact CB-CG 3.99Å; L1158-L1174 VanDerWaalsContact N-CD1 3.31Å; L1174-I1181 HydrophobicContact CD2-CG2 3.92Å; L1174-F1182 VanDerWaalsContact C-CE1 3.44Å; L1174-F1182 WeakPolarHBondContact O-CE1 3.26Å; L1174-I1199 HydrophobicContact CD1-CG1 4.24Å; L1174-I1199 HydrophobicContact CD1-CG2 4.2Å; L1174-I1199 HydrophobicContact CD2-CD1 3.79Å; L1174-I1199 HydrophobicContact CD2-CG1 4.17Å
1175	E	83.7	Confident	77.1	Confident	58 Å²	58	35.6 Å²	35.6	27%	0.271	19%	0.192	S	C	.	.			trans	-73.8	173.4	175.7	-160.2	169.9	175.8	0	0	111.3	R1139 D1177 K1178 T1180 F1182	R1139-E1175 IonicContact CZ-OE1 3.54Å; R1139-E1175 IonicContact CZ-OE2 3.57Å; R1139-E1175 IonicContact NE-OE1 2.8Å; R1139-E1175 IonicContact NE-OE2 2.67Å; R1139-E1175 PolarHBondContact NE-OE2 3.24Å; R1139-E1175 VanDerWaalsContact NH2-CD 3.3Å; R1139-E1175 IonicContact NH2-OE1 3.53Å; R1139-E1175 PolarHBondContact NH2-OE1 3.29Å; R1139-E1175 VanDerWaalsContact NH2-OE1 3.13Å; R1139-E1175 IonicContact NH2-OE2 3.1Å; R1139-E1175 PolarHBondContact NH2-OE2 2.99Å; E1175-D1177 PolarHBondContact O-N 2.97Å; E1175-K1178 PolarHBondContact O-N 3.25Å; E1175-T1180 PolarHBondContact N-O 2.98Å; E1175-T1180 WeakPolarHBondContact OE2-CG2 3.47Å; E1175-F1182 HydrophobicContact CB-CD1 4.04Å; E1175-F1182 HydrophobicContact CB-CE1 4.17Å
1176	K	77.7	Confident	76.6	Confident	208 Å²	208	31.2 Å²	31.2	90%	0.904	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.5	-177.9	-67.8	-177.9	-179.4	175.8	0	113.4	K1178	K1176-K1178 PolarHBondContact O-N 3.4Å
1177	D	75.8	Confident	75.7	Confident	60 Å²	60	32.4 Å²	32.4	32%	0.321	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-12.9	176	66.5	-3.5	0	0	0	113.4	E1175 S1179 T1180	E1175-D1177 PolarHBondContact O-N 2.97Å; D1177-S1179 PolarHBondContact O-N 3.05Å; D1177-S1179 VanDerWaalsContact O-N 3.11Å; D1177-S1179 PolarHBondContact OD1-N 3.49Å; D1177-T1180 WeakPolarHBondContact OD1-CB 3.08Å; D1177-T1180 PolarHBondContact OD1-N 3.37Å; D1177-T1180 VanDerWaalsContact OD2-CB 3.3Å; D1177-T1180 WeakPolarHBondContact OD2-CB 2.7Å; D1177-T1180 PolarHBondContact OD2-OG1 3.27Å
1178	K	79.3	Confident	74.9	Confident	47 Å²	47	36.4 Å²	36.4	20%	0.204	20%	0.199	C	C	.	.	S	Bend	trans	61.5	6.2	-178.2	-55.2	-64.8	-168.2	158.1	0	115.3	V1156 E1175 K1176	V1156-K1178 HydrophobicContact CB-CB 4.37Å; V1156-K1178 HydrophobicContact CG1-CB 4.28Å; V1156-K1178 PolarHBondContact O-NZ 3.25Å; E1175-K1178 PolarHBondContact O-N 3.25Å; K1176-K1178 PolarHBondContact O-N 3.4Å
1179	S	76.5	Confident	74	Confident	9 Å²	9	34.2 Å²	34.2	6%	0.063	18%	0.184	C	C	.	.	S	Bend	trans	-118.8	-14	176.1	60.1	0	0	0	0	113.5	I1142 D1145 D1177	I1142-S1179 PolarHBondContact N-O 2.88Å; D1145-S1179 VanDerWaalsContact OD1-CB 3.23Å; D1145-S1179 WeakPolarHBondContact OD1-CB 3.34Å; D1145-S1179 PolarHBondContact OD1-OG 2.9Å; D1177-S1179 PolarHBondContact O-N 3.05Å; D1177-S1179 VanDerWaalsContact O-N 3.11Å; D1177-S1179 PolarHBondContact OD1-N 3.49Å
1180	T	82.4	Confident	73.6	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.2	174.6	-57.2	0	0	0	0	110.9	R1139 E1175 D1177	R1139-T1180 HydrophobicContact CG-CG2 3.59Å; E1175-T1180 PolarHBondContact N-O 2.98Å; E1175-T1180 WeakPolarHBondContact OE2-CG2 3.47Å; D1177-T1180 WeakPolarHBondContact OD1-CB 3.08Å; D1177-T1180 PolarHBondContact OD1-N 3.37Å; D1177-T1180 VanDerWaalsContact OD2-CB 3.3Å; D1177-T1180 WeakPolarHBondContact OD2-CB 2.7Å; D1177-T1180 PolarHBondContact OD2-OG1 3.27Å
1181	I	85.6	Confident	72.6	Confident	1 Å²	1	37 Å²	37	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	143.4	169.5	55.9	165.3	0	0	0	110	F1138 R1139 R1140 I1142 I1172 G1173 L1174 I1199 F1211 I1213	F1138-I1181 HydrophobicContact CE2-CD1 4.44Å; R1139-I1181 CarbonylContact C-O 2.98Å; R1139-I1181 WeakPolarHBondContact CA-O 3.44Å; R1140-I1181 HydrophobicContact CB-CG1 4.16Å; R1140-I1181 PolarHBondContact N-O 3.44Å; R1140-I1181 VanDerWaalsContact O-CG1 3.23Å; R1140-I1181 WeakPolarHBondContact O-CG1 3.47Å; R1140-I1181 PolarHBondContact O-N 3.08Å; I1142-I1181 HydrophobicContact CD1-CB 4.42Å; I1142-I1181 HydrophobicContact CD1-CD1 4.17Å; I1142-I1181 HydrophobicContact CD1-CG1 4.08Å; I1142-I1181 HydrophobicContact CD1-CG2 3.54Å; I1142-I1181 HydrophobicContact CG1-CD1 4.41Å; I1142-I1181 HydrophobicContact CG1-CG1 4.16Å; I1142-I1181 HydrophobicContact CG1-CG2 4.4Å; I1172-I1181 HydrophobicContact CD1-CD1 4.46Å; G1173-I1181 WeakPolarHBondContact O-CA 3.45Å; L1174-I1181 HydrophobicContact CD2-CG2 3.92Å; I1181-I1199 HydrophobicContact CG2-CD1 4.13Å; I1181-F1211 HydrophobicContact CD1-CD2 4.32Å; I1181-F1211 HydrophobicContact CD1-CE2 3.81Å; I1181-F1211 HydrophobicContact CD1-CZ 4.08Å; I1181-F1211 HydrophobicContact CG2-CE1 4.29Å; I1181-F1211 HydrophobicContact CG2-CZ 3.9Å; I1181-I1213 HydrophobicContact CD1-CD1 4.34Å
1182	F	85.8	Confident	71.5	Confident	19 Å²	19	39.8 Å²	39.8	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	155.3	174.6	69.2	-87.3	0	0	0	110.7	F1138 R1139 I1172 G1173 L1174 E1175 L1248 W1252	F1138-F1182 CarbonylContact O-C 3.56Å; F1138-F1182 VanDerWaalsContact O-CA 3.24Å; F1138-F1182 WeakPolarHBondContact O-CA 3.42Å; R1139-F1182 HydrophobicContact CG-CB 4.41Å; I1172-F1182 CarbonylContact C-O 3.46Å; I1172-F1182 WeakPolarHBondContact CA-O 3.46Å; G1173-F1182 PolarHBondContact N-O 3.4Å; G1173-F1182 PolarHBondContact O-N 2.78Å; L1174-F1182 VanDerWaalsContact C-CE1 3.44Å; L1174-F1182 WeakPolarHBondContact O-CE1 3.26Å; E1175-F1182 HydrophobicContact CB-CD1 4.04Å; E1175-F1182 HydrophobicContact CB-CE1 4.17Å; F1182-L1248 HydrophobicContact CD2-CD2 4.17Å; F1182-L1248 HydrophobicContact CD2-CG 4.35Å; F1182-L1248 HydrophobicContact CE2-CD2 3.76Å; F1182-L1248 HydrophobicContact CE2-CG 3.81Å; F1182-L1248 HydrophobicContact CZ-CD2 4.33Å; F1182-W1252 HydrophobicContact CB-CD2 4.19Å; F1182-W1252 HydrophobicContact CB-CE3 4.3Å; F1182-W1252 HydrophobicContact CB-CH2 3.88Å; F1182-W1252 HydrophobicContact CB-CZ2 3.74Å; F1182-W1252 HydrophobicContact CB-CZ3 4.14Å; F1182-W1252 HydrophobicContact CD2-CB 4.03Å; F1182-W1252 AromaticContact CD2-CD1 3.8Å; F1182-W1252 AromaticContact CD2-CD2 3.29Å; F1182-W1252 HydrophobicContact CD2-CD2 3.29Å; F1182-W1252 AromaticContact CD2-CE2 3.67Å; F1182-W1252 AromaticContact CD2-CE3 3.7Å; F1182-W1252 HydrophobicContact CD2-CE3 3.7Å; F1182-W1252 AromaticContact CD2-CG 3.42Å; F1182-W1252 HydrophobicContact CD2-CG 3.42Å; F1182-W1252 VanDerWaalsContact CD2-CG 3.42Å; F1182-W1252 HydrophobicContact CD2-CZ2 4.38Å; F1182-W1252 HydrophobicContact CD2-CZ3 4.37Å; F1182-W1252 AromaticContact CD2-NE1 3.92Å; F1182-W1252 HydrophobicContact CE2-CB 3.77Å; F1182-W1252 AromaticContact CE2-CD1 3.81Å; F1182-W1252 AromaticContact CE2-CD2 3.95Å; F1182-W1252 HydrophobicContact CE2-CD2 3.95Å; F1182-W1252 AromaticContact CE2-CG 3.52Å; F1182-W1252 HydrophobicContact CE2-CG 3.52Å; F1182-W1252 HydrophobicContact CG-CD2 4.07Å; F1182-W1252 AromaticContact CG-CE2 3.98Å; F1182-W1252 HydrophobicContact CG-CE3 4.46Å; F1182-W1252 HydrophobicContact CG-CG 4.42Å; F1182-W1252 HydrophobicContact CG-CZ2 4.36Å
1183	G	84.3	Confident	70.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175	162.3	180	0	0	0	0	0	115	G1137 F1138 W1171 W1252	G1137-G1183 WeakPolarHBondContact CA-O 3.31Å; F1138-G1183 VanDerWaalsContact CD1-O 3.25Å; F1138-G1183 WeakPolarHBondContact CD1-O 3.33Å; F1138-G1183 WeakPolarHBondContact CE1-O 3.47Å; F1138-G1183 PolarHBondContact N-O 3.5Å; F1138-G1183 PolarHBondContact O-N 3.32Å; W1171-G1183 CarbonylContact O-C 3.57Å; W1171-G1183 WeakPolarHBondContact O-CA 3.27Å; G1183-W1252 WeakPolarHBondContact O-CZ3 3.41Å
1184	I	80.4	Confident	69.5	Low	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	131.9	168	-172	158.7	0	0	0	111.5	G1135 W1171 L1248 R1251 I1255 L1280	G1135-I1184 WeakPolarHBondContact O-CD1 3.39Å; W1171-I1184 VanDerWaalsContact CB-O 3.29Å; W1171-I1184 WeakPolarHBondContact CB-O 3.13Å; W1171-I1184 PolarHBondContact O-N 3.49Å; I1184-L1248 HydrophobicContact CG2-CD1 4.23Å; I1184-R1251 HydrophobicContact CG2-CB 4.27Å; I1184-I1255 HydrophobicContact CB-CD1 3.96Å; I1184-I1255 HydrophobicContact CD1-CD1 3.27Å; I1184-I1255 HydrophobicContact CD1-CG1 4.24Å; I1184-I1255 HydrophobicContact CG1-CD1 4.16Å; I1184-I1255 HydrophobicContact CG2-CD1 3.68Å; I1184-L1280 HydrophobicContact CD1-CB 3.44Å; I1184-L1280 VanDerWaalsContact CD1-CB 3.44Å; I1184-L1280 HydrophobicContact CD1-CD2 3.86Å; I1184-L1280 HydrophobicContact CD1-CG 4.3Å
1185	I	72.6	Confident	69.1	Low	1 Å²	1	44.3 Å²	44.3	1%	0.005	25%	0.246	C	C	.	.			trans	-109.1	119.8	-178.7	-55.1	176.4	0	0	0	108.6	V1132 T1134 G1135 W1171 V1190 V1215	V1132-I1185 HydrophobicContact CG2-CD1 3.49Å; V1132-I1185 VanDerWaalsContact CG2-CD1 3.49Å; T1134-I1185 CarbonylContact C-O 3.53Å; T1134-I1185 HydrophobicContact CG2-CG2 4.19Å; G1135-I1185 PolarHBondContact N-O 2.7Å; W1171-I1185 HydrophobicContact CB-CG1 4.05Å; W1171-I1185 HydrophobicContact CD2-CD1 3.87Å; W1171-I1185 HydrophobicContact CD2-CG1 3.58Å; W1171-I1185 HydrophobicContact CE3-CD1 3.47Å; W1171-I1185 VanDerWaalsContact CE3-CD1 3.47Å; W1171-I1185 HydrophobicContact CE3-CG1 3.27Å; W1171-I1185 HydrophobicContact CG-CG1 3.94Å; W1171-I1185 HydrophobicContact CH2-CD1 3.99Å; W1171-I1185 HydrophobicContact CZ2-CD1 4.36Å; W1171-I1185 HydrophobicContact CZ3-CD1 3.53Å; W1171-I1185 HydrophobicContact CZ3-CG1 3.89Å; I1185-V1190 HydrophobicContact CG2-CB 3.91Å; I1185-V1190 HydrophobicContact CG2-CG2 3.7Å; I1185-V1215 HydrophobicContact CD1-CB 4.04Å; I1185-V1215 HydrophobicContact CD1-CG1 3.52Å; I1185-V1215 HydrophobicContact CD1-CG2 3.36Å; I1185-V1215 HydrophobicContact CG2-CG1 4.15Å
1186	I	66.3	Low	68.8	Low	17 Å²	17	46.9 Å²	46.9	9%	0.087	26%	0.256	C	S	.	.			trans	-94.4	136.7	177.7	-57	172.7	0	0	0	108.8	N1188 S1189 L1280 L1283	I1186-N1188 PolarHBondContact O-N 2.94Å; I1186-S1189 VanDerWaalsContact O-CB 3.32Å; I1186-S1189 WeakPolarHBondContact O-CB 3.34Å; I1186-S1189 PolarHBondContact O-N 3.47Å; I1186-S1189 PolarHBondContact O-OG 3.42Å; I1186-L1280 HydrophobicContact CD1-CD2 3.71Å; I1186-L1280 HydrophobicContact CG1-CD2 3.98Å; I1186-L1283 HydrophobicContact CD1-CB 4.39Å
1187	G	53.8	Low	69.2	Low	43 Å²	43	37.3 Å²	37.3	44%	0.443	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-23	-166.7	0	0	0	0	0	116.4	S1189	G1187-S1189 PolarHBondContact O-N 3.49Å
1188	N	49.1	Very low	69.4	Low	124 Å²	124	35 Å²	35	66%	0.663	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-4.7	177.6	-59.6	-1.8	0	0	0	113.3	I1186	I1186-N1188 PolarHBondContact O-N 2.94Å
1189	S	46.2	Very low	69.7	Low	32 Å²	32	32.7 Å²	32.7	22%	0.224	19%	0.192	C	C	.	.	S	Bend	trans	-111.8	-20.5	-163.1	-22.7	0	0	0	0	115.3	Q1045 I1186 G1187	Q1045-S1189 PolarHBondContact OE1-O 3.26Å; I1186-S1189 VanDerWaalsContact O-CB 3.32Å; I1186-S1189 WeakPolarHBondContact O-CB 3.34Å; I1186-S1189 PolarHBondContact O-N 3.47Å; I1186-S1189 PolarHBondContact O-OG 3.42Å; G1187-S1189 PolarHBondContact O-N 3.49Å
1190	V	45.3	Very low	69.9	Low	14 Å²	14	32.3 Å²	32.3	9%	0.085	19%	0.189	C	C	.	.			trans	-148.8	113.9	-170.1	-169.3	0	0	0	0	112.2	I1185 V1215	I1185-V1190 HydrophobicContact CG2-CB 3.91Å; I1185-V1190 HydrophobicContact CG2-CG2 3.7Å; V1190-V1215 HydrophobicContact CB-CG1 4.21Å; V1190-V1215 HydrophobicContact CG1-CB 4.12Å; V1190-V1215 HydrophobicContact CG1-CG1 3.83Å; V1190-V1215 HydrophobicContact CG1-CG2 4.31Å
1191	Q	49.2	Very low	69.7	Low	80 Å²	80	34.7 Å²	34.7	37%	0.374	20%	0.202	S	C	.	.			trans	-61.1	152.9	160.5	-73.5	-160.2	-45.4	0	0	111.6	L1050 S1193	L1050-Q1191 HydrophobicContact CD1-CG 3.98Å; Q1191-S1193 PolarHBondContact O-N 3.27Å; Q1191-S1193 PolarHBondContact O-OG 2.86Å
1192	P	55.2	Low	69.1	Low	74 Å²	74	37 Å²	37	48%	0.481	21%	0.214	S	C	.	.	S	Bend	trans	-60.3	109.9	-178.6	-20.8	31	0	0	0	112.8	V1215	P1192-V1215 CarbonylContact C-O 3.49Å; P1192-V1215 WeakPolarHBondContact CA-O 3.46Å; P1192-V1215 WeakPolarHBondContact CB-O 3.16Å
1193	S	59.4	Low	68.3	Low	36 Å²	36	37.9 Å²	37.9	25%	0.252	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	154.5	-177.3	54.8	0	0	0	0	113.6	Q1191 H1195 V1215	Q1191-S1193 PolarHBondContact O-N 3.27Å; Q1191-S1193 PolarHBondContact O-OG 2.86Å; S1193-H1195 PolarHBondContact O-CD2 3.01Å; S1193-H1195 PolarHBondContact OG-NE2 2.99Å; S1193-V1215 PolarHBondContact N-O 3.41Å; S1193-V1215 VanDerWaalsContact N-O 3.1Å; S1193-V1215 PolarHBondContact O-N 2.83Å
1194	S	68.9	Low	67.5	Low	83 Å²	83	46 Å²	46	58%	0.58	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	123.5	173.9	-58.4	0	0	0	0	111.3	I1213 Y1214	S1194-I1213 CarbonylContact C-O 3.55Å; S1194-I1213 WeakPolarHBondContact CA-O 3.33Å; S1194-Y1214 WeakPolarHBondContact OG-CD2 3.45Å
1195	H	74.4	Confident	66.8	Low	24 Å²	24	51.9 Å²	51.9	11%	0.111	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.5	175.5	-61.9	-88.6	0	0	0	109.6	L1041 W1171 S1193 F1197 S1212 I1213	L1041-H1195 WeakPolarHBondContact CD2-CE1 3.23Å; L1041-H1195 VanDerWaalsContact CD2-ND1 3.33Å; L1041-H1195 WeakPolarHBondContact CD2-ND1 3.33Å; W1171-H1195 HydrophobicContact CZ2-CB 4.23Å; W1171-H1195 AromaticContact CZ2-CD2 3.99Å; W1171-H1195 AromaticContact CZ2-CG 3.98Å; S1193-H1195 PolarHBondContact O-CD2 3.01Å; S1193-H1195 PolarHBondContact OG-NE2 2.99Å; H1195-F1197 HydrophobicContact CB-CD2 4.34Å; H1195-F1197 HydrophobicContact CB-CE2 3.51Å; H1195-F1197 HydrophobicContact CB-CZ 3.86Å; H1195-S1212 CarbonylContact O-C 3.58Å; H1195-S1212 VanDerWaalsContact O-CA 3.24Å; H1195-S1212 WeakPolarHBondContact O-CA 3.45Å; H1195-I1213 PolarHBondContact N-O 2.87Å; H1195-I1213 PolarHBondContact O-N 2.83Å
1196	K	77.3	Confident	66.2	Low	111 Å²	111	54.8 Å²	54.8	48%	0.483	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	137.1	174.6	-75.1	176.9	172.9	-173.4	0	109.4	I1161 F1211	I1161-K1196 HydrophobicContact CB-CB 4.25Å; I1161-K1196 HydrophobicContact CD1-CB 3.92Å; I1161-K1196 HydrophobicContact CD1-CD 3.74Å; I1161-K1196 HydrophobicContact CD1-CG 4.39Å; I1161-K1196 PolarHBondContact N-O 3.18Å; K1196-F1211 WeakPolarHBondContact CA-O 3.34Å
1197	F	85.2	Confident	66.2	Low	7 Å²	7	57.8 Å²	57.8	3%	0.031	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	155.2	-179.5	-63.7	-79.9	0	0	0	110.7	L1158 Y1159 V1166 W1171 I1172 H1195 Q1210 F1211 I1213	L1158-F1197 HydrophobicContact CD1-CB 3.9Å; L1158-F1197 HydrophobicContact CD1-CD1 4.46Å; L1158-F1197 HydrophobicContact CD1-CG 4.43Å; L1158-F1197 HydrophobicContact CD2-CD1 4.41Å; L1158-F1197 HydrophobicContact CG-CD1 4.34Å; Y1159-F1197 CarbonylContact O-C 3.6Å; Y1159-F1197 VanDerWaalsContact O-CA 3.31Å; Y1159-F1197 WeakPolarHBondContact O-CA 3.27Å; V1166-F1197 HydrophobicContact CG2-CD1 4.05Å; V1166-F1197 HydrophobicContact CG2-CE1 4.05Å; W1171-F1197 HydrophobicContact CH2-CE2 4.01Å; W1171-F1197 HydrophobicContact CH2-CZ 4.28Å; W1171-F1197 AromaticContact CZ2-CE2 3.98Å; W1171-F1197 HydrophobicContact CZ2-CE2 3.98Å; W1171-F1197 AromaticContact CZ2-CZ 3.85Å; W1171-F1197 HydrophobicContact CZ2-CZ 3.85Å; I1172-F1197 HydrophobicContact CD1-CD2 4.29Å; I1172-F1197 HydrophobicContact CD1-CE2 4.16Å; I1172-F1197 HydrophobicContact CG2-CE1 3.78Å; I1172-F1197 HydrophobicContact CG2-CE2 4.24Å; I1172-F1197 HydrophobicContact CG2-CZ 3.61Å; H1195-F1197 HydrophobicContact CB-CD2 4.34Å; H1195-F1197 HydrophobicContact CB-CE2 3.51Å; H1195-F1197 HydrophobicContact CB-CZ 3.86Å; F1197-Q1210 WeakPolarHBondContact O-CA 3.43Å; F1197-F1211 HydrophobicContact CB-CD1 4.35Å; F1197-F1211 HydrophobicContact CB-CD2 4.27Å; F1197-F1211 HydrophobicContact CB-CE1 3.79Å; F1197-F1211 HydrophobicContact CB-CE2 3.7Å; F1197-F1211 HydrophobicContact CB-CZ 3.45Å; F1197-F1211 VanDerWaalsContact CB-CZ 3.45Å; F1197-F1211 HydrophobicContact CD2-CD2 4.39Å; F1197-F1211 AromaticContact CD2-CE2 3.7Å; F1197-F1211 HydrophobicContact CD2-CE2 3.7Å; F1197-F1211 HydrophobicContact CD2-CZ 4.18Å; F1197-F1211 HydrophobicContact CG-CE2 4.04Å; F1197-F1211 HydrophobicContact CG-CZ 4.06Å; F1197-F1211 PolarHBondContact N-O 3.35Å; F1197-F1211 PolarHBondContact O-N 2.81Å; F1197-I1213 HydrophobicContact CD2-CD1 4.26Å; F1197-I1213 HydrophobicContact CE2-CD1 4.18Å
1198	H	80.5	Confident	67.1	Low	11 Å²	11	56.6 Å²	56.6	5%	0.051	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.1	-179.7	-173	-160.1	0	0	0	109.5	Y1159 G1208 Q1210	Y1159-H1198 PolarHBondContact N-O 2.79Å; Y1159-H1198 PolarHBondContact O-N 2.73Å; H1198-G1208 WeakPolarHBondContact NE2-CA 3.42Å; H1198-Q1210 HydrophobicContact CB-CG 4.3Å
1199	I	84.6	Confident	68.5	Low	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.4	172.6	-62	161.3	0	0	0	107.8	I1142 L1148 V1156 H1157 L1158 L1174 I1181 G1208 V1209 F1211	I1142-I1199 HydrophobicContact CD1-CD1 3.29Å; L1148-I1199 HydrophobicContact CD2-CG2 3.85Å; V1156-I1199 HydrophobicContact CG1-CG2 3.34Å; H1157-I1199 WeakPolarHBondContact O-CA 3.39Å; L1158-I1199 HydrophobicContact CD1-CD1 4.36Å; L1158-I1199 HydrophobicContact CD1-CG1 3.59Å; L1174-I1199 HydrophobicContact CD1-CG1 4.24Å; L1174-I1199 HydrophobicContact CD1-CG2 4.2Å; L1174-I1199 HydrophobicContact CD2-CD1 3.79Å; L1174-I1199 HydrophobicContact CD2-CG1 4.17Å; I1181-I1199 HydrophobicContact CG2-CD1 4.13Å; I1199-G1208 CarbonylContact O-C 3.52Å; I1199-G1208 VanDerWaalsContact O-CA 3.23Å; I1199-G1208 WeakPolarHBondContact O-CA 3.32Å; I1199-V1209 PolarHBondContact N-O 2.87Å; I1199-V1209 PolarHBondContact O-N 3.28Å; I1199-F1211 HydrophobicContact CD1-CD1 4.24Å; I1199-F1211 HydrophobicContact CD1-CE1 3.57Å; I1199-F1211 HydrophobicContact CD1-CZ 4.49Å; I1199-F1211 HydrophobicContact CG1-CE1 3.84Å
1200	T	81.4	Confident	70	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	161.6	-179.5	-178.3	0	0	0	0	110.9	M1151 H1157 Y1159 N1202 V1207	M1151-T1200 WeakPolarHBondContact CE-OG1 3.34Å; H1157-T1200 PolarHBondContact N-O 3.2Å; H1157-T1200 PolarHBondContact O-N 3.13Å; H1157-T1200 VanDerWaalsContact O-N 3.17Å; Y1159-T1200 HydrophobicContact CD2-CG2 3.71Å; Y1159-T1200 HydrophobicContact CE2-CG2 3.87Å; T1200-N1202 PolarHBondContact OG1-N 2.64Å; T1200-N1202 PolarHBondContact OG1-O 2.72Å; T1200-V1207 PolarHBondContact OG1-O 2.89Å
1201	D	78.5	Confident	71.8	Confident	52 Å²	52	52.5 Å²	52.5	28%	0.278	28%	0.28	S	S	.	.	S	Bend	trans	-87.9	-15.7	170.2	69.7	-11.3	0	0	0	112.6	M1151 N1155 V1156	M1151-D1201 HydrophobicContact CE-CB 4.02Å; M1151-D1201 VanDerWaalsContact CE-N 3.26Å; M1151-D1201 WeakPolarHBondContact CE-OD1 3.3Å; N1155-D1201 HydrophobicContact CB-CB 4.05Å; N1155-D1201 WeakPolarHBondContact O-CA 3.45Å; V1156-D1201 HydrophobicContact CG2-CB 4.19Å
1202	N	73.9	Confident	73.1	Confident	49 Å²	49	49.3 Å²	49.3	26%	0.262	27%	0.266	S	S	.	.			trans	-148.2	110.2	177.9	-175.4	-12.1	0	0	0	110.4	T1200 E1204 K1205	T1200-N1202 PolarHBondContact OG1-N 2.64Å; T1200-N1202 PolarHBondContact OG1-O 2.72Å; N1202-E1204 PolarHBondContact O-N 2.68Å; N1202-E1204 VanDerWaalsContact O-N 3.11Å; N1202-E1204 WeakPolarHBondContact OD1-CB 3.34Å; N1202-E1204 PolarHBondContact OD1-N 2.98Å; N1202-K1205 HydrophobicContact CB-CB 4.31Å; N1202-K1205 HydrophobicContact CB-CD 4.37Å; N1202-K1205 HydrophobicContact CB-CG 4.32Å; N1202-K1205 PolarHBondContact O-N 3.45Å
1203	P	68	Low	74.4	Confident	37 Å²	37	45.8 Å²	45.8	24%	0.24	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-18.2	-178.7	27.6	-34.7	0	0	0	113.8	F1119 Y1159	F1119-P1203 WeakPolarHBondContact CZ-O 3.25Å; Y1159-P1203 HydrophobicContact CD1-CB 4.06Å; Y1159-P1203 HydrophobicContact CD1-CG 4.37Å; Y1159-P1203 HydrophobicContact CE1-CB 4.01Å; Y1159-P1203 HydrophobicContact CE1-CG 3.83Å; Y1159-P1203 HydrophobicContact CG-CB 4.38Å
1204	E	67.8	Low	75.1	Confident	170 Å²	170	49 Å²	49	79%	0.794	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-22.4	176.6	-59.4	-174.3	168	0	0	112.9	N1202	N1202-E1204 PolarHBondContact O-N 2.68Å; N1202-E1204 VanDerWaalsContact O-N 3.11Å; N1202-E1204 WeakPolarHBondContact OD1-CB 3.34Å; N1202-E1204 PolarHBondContact OD1-N 2.98Å
1205	K	64.7	Low	75.3	Confident	124 Å²	124	45.1 Å²	45.1	54%	0.539	22%	0.224	S	C	.	.	S	Bend	trans	-89.7	129.2	175.2	-71.4	-176.8	178.6	179.7	0	108.9	N1202 V1207	N1202-K1205 HydrophobicContact CB-CB 4.31Å; N1202-K1205 HydrophobicContact CB-CD 4.37Å; N1202-K1205 HydrophobicContact CB-CG 4.32Å; N1202-K1205 PolarHBondContact O-N 3.45Å; K1205-V1207 PolarHBondContact O-N 3.4Å
1206	N	59.8	Low	74.8	Confident	63 Å²	63	44.6 Å²	44.6	34%	0.337	22%	0.224	S	C	.	.	S	Bend	trans	-67.5	15	173.2	-78.8	-8.1	0	0	0	114.3	S1118	S1118-N1206 VanDerWaalsContact O-CG 3.26Å; S1118-N1206 PolarHBondContact O-ND2 2.77Å; S1118-N1206 PolarHBondContact O-OD1 2.8Å
1207	V	66.6	Low	74.3	Confident	79 Å²	79	40.6 Å²	40.6	48%	0.479	21%	0.214	S	C	.	.			trans	-98.8	112.8	179.9	-175.4	0	0	0	0	107.2	M1151 T1200 K1205	M1151-V1207 VanDerWaalsContact CE-O 3.3Å; M1151-V1207 WeakPolarHBondContact CE-O 3.23Å; T1200-V1207 PolarHBondContact OG1-O 2.89Å; K1205-V1207 PolarHBondContact O-N 3.4Å
1208	G	73.5	Confident	73.4	Confident	18 Å²	18	44.9 Å²	44.9	19%	0.186	25%	0.245	C	C	.	.	S	Bend	trans	167	179.3	-179.8	0	0	0	0	0	111.6	H1198 I1199	H1198-G1208 WeakPolarHBondContact NE2-CA 3.42Å; I1199-G1208 CarbonylContact O-C 3.52Å; I1199-G1208 VanDerWaalsContact O-CA 3.23Å; I1199-G1208 WeakPolarHBondContact O-CA 3.32Å
1209	V	77.7	Confident	72.8	Confident	6 Å²	6	44.7 Å²	44.7	4%	0.036	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	117.6	-177.3	-174.6	0	0	0	0	109.7	M1128 I1142 N1144 I1147 L1148 I1199	M1128-V1209 HydrophobicContact CE-CG1 3.53Å; I1142-V1209 HydrophobicContact CG2-CG1 3.61Å; N1144-V1209 HydrophobicContact CB-CG2 4.11Å; I1147-V1209 HydrophobicContact CB-CG2 4.32Å; I1147-V1209 HydrophobicContact CG2-CG2 4.33Å; L1148-V1209 HydrophobicContact CD1-CG2 4.23Å; L1148-V1209 HydrophobicContact CG-CG2 4.32Å; I1199-V1209 PolarHBondContact N-O 2.87Å; I1199-V1209 PolarHBondContact O-N 3.28Å
1210	Q	77.9	Confident	71.8	Confident	77 Å²	77	49.5 Å²	49.5	36%	0.36	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136.9	176.3	-65.6	-175	5.5	0	0	111.3	F1197 H1198	F1197-Q1210 WeakPolarHBondContact O-CA 3.43Å; H1198-Q1210 HydrophobicContact CB-CG 4.3Å
1211	F	82.6	Confident	70.8	Confident	1 Å²	1	53.4 Å²	53.4	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	160	175.2	65	-88.3	0	0	0	110.9	M1128 F1130 I1142 L1158 I1172 I1181 K1196 F1197 I1199 I1213	M1128-F1211 HydrophobicContact CB-CB 4.11Å; M1128-F1211 CarbonylContact O-C 3.46Å; M1128-F1211 VanDerWaalsContact O-CA 3.27Å; M1128-F1211 WeakPolarHBondContact O-CA 3.33Å; M1128-F1211 WeakPolarHBondContact O-CB 3.26Å; F1130-F1211 HydrophobicContact CD2-CD2 4.31Å; F1130-F1211 HydrophobicContact CE2-CB 4.07Å; F1130-F1211 HydrophobicContact CE2-CD2 4.31Å; F1130-F1211 HydrophobicContact CE2-CG 4.42Å; I1142-F1211 HydrophobicContact CD1-CD1 3.73Å; I1142-F1211 HydrophobicContact CD1-CE1 3.66Å; I1142-F1211 HydrophobicContact CD1-CG 4.38Å; I1142-F1211 HydrophobicContact CD1-CZ 4.27Å; L1158-F1211 HydrophobicContact CD1-CE1 3.85Å; L1158-F1211 HydrophobicContact CD1-CZ 3.72Å; I1172-F1211 HydrophobicContact CD1-CE2 4.05Å; I1172-F1211 HydrophobicContact CD1-CZ 4.23Å; I1181-F1211 HydrophobicContact CD1-CD2 4.32Å; I1181-F1211 HydrophobicContact CD1-CE2 3.81Å; I1181-F1211 HydrophobicContact CD1-CZ 4.08Å; I1181-F1211 HydrophobicContact CG2-CE1 4.29Å; I1181-F1211 HydrophobicContact CG2-CZ 3.9Å; K1196-F1211 WeakPolarHBondContact CA-O 3.34Å; F1197-F1211 HydrophobicContact CB-CD1 4.35Å; F1197-F1211 HydrophobicContact CB-CD2 4.27Å; F1197-F1211 HydrophobicContact CB-CE1 3.79Å; F1197-F1211 HydrophobicContact CB-CE2 3.7Å; F1197-F1211 HydrophobicContact CB-CZ 3.45Å; F1197-F1211 VanDerWaalsContact CB-CZ 3.45Å; F1197-F1211 HydrophobicContact CD2-CD2 4.39Å; F1197-F1211 AromaticContact CD2-CE2 3.7Å; F1197-F1211 HydrophobicContact CD2-CE2 3.7Å; F1197-F1211 HydrophobicContact CD2-CZ 4.18Å; F1197-F1211 HydrophobicContact CG-CE2 4.04Å; F1197-F1211 HydrophobicContact CG-CZ 4.06Å; F1197-F1211 PolarHBondContact N-O 3.35Å; F1197-F1211 PolarHBondContact O-N 2.81Å; I1199-F1211 HydrophobicContact CD1-CD1 4.24Å; I1199-F1211 HydrophobicContact CD1-CE1 3.57Å; I1199-F1211 HydrophobicContact CD1-CZ 4.49Å; I1199-F1211 HydrophobicContact CG1-CE1 3.84Å; F1211-I1213 HydrophobicContact CD2-CD1 4.19Å; F1211-I1213 HydrophobicContact CD2-CG1 4Å; F1211-I1213 HydrophobicContact CE2-CD1 3.67Å; F1211-I1213 HydrophobicContact CE2-CG1 3.98Å
1212	S	78.2	Confident	70.3	Confident	13 Å²	13	51.9 Å²	51.9	9%	0.091	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.1	175	87.6	0	0	0	0	112	M1128 N1129 F1130 H1195	M1128-S1212 PolarHBondContact O-N 2.85Å; N1129-S1212 CarbonylContact C-O 3.42Å; N1129-S1212 WeakPolarHBondContact CA-O 3.43Å; N1129-S1212 VanDerWaalsContact CG-OG 3.28Å; N1129-S1212 PolarHBondContact OD1-OG 3.32Å; F1130-S1212 PolarHBondContact N-O 2.93Å; H1195-S1212 CarbonylContact O-C 3.58Å; H1195-S1212 VanDerWaalsContact O-CA 3.24Å; H1195-S1212 WeakPolarHBondContact O-CA 3.45Å
1213	I	81.3	Confident	69.8	Low	1 Å²	1	51.2 Å²	51.2	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	114.8	178.1	-62.8	174.5	0	0	0	108.6	F1130 V1132 F1138 W1171 I1172 I1181 S1194 H1195 F1197 F1211 V1215	F1130-I1213 HydrophobicContact CB-CG1 4.41Å; F1130-I1213 HydrophobicContact CD2-CG1 4.38Å; F1130-I1213 CarbonylContact O-C 3.51Å; F1130-I1213 VanDerWaalsContact O-CA 3.28Å; F1130-I1213 WeakPolarHBondContact O-CA 3.27Å; V1132-I1213 HydrophobicContact CB-CG2 4.2Å; V1132-I1213 HydrophobicContact CG1-CG2 3.85Å; V1132-I1213 HydrophobicContact CG2-CG2 3.32Å; F1138-I1213 HydrophobicContact CE2-CD1 4.26Å; F1138-I1213 HydrophobicContact CZ-CD1 4.29Å; W1171-I1213 HydrophobicContact CH2-CB 4.1Å; W1171-I1213 HydrophobicContact CH2-CD1 4Å; W1171-I1213 HydrophobicContact CH2-CG2 3.76Å; W1171-I1213 HydrophobicContact CZ3-CD1 4.18Å; W1171-I1213 HydrophobicContact CZ3-CG2 4.22Å; I1172-I1213 HydrophobicContact CD1-CD1 3.26Å; I1181-I1213 HydrophobicContact CD1-CD1 4.34Å; S1194-I1213 CarbonylContact C-O 3.55Å; S1194-I1213 WeakPolarHBondContact CA-O 3.33Å; H1195-I1213 PolarHBondContact N-O 2.87Å; H1195-I1213 PolarHBondContact O-N 2.83Å; F1197-I1213 HydrophobicContact CD2-CD1 4.26Å; F1197-I1213 HydrophobicContact CE2-CD1 4.18Å; F1211-I1213 HydrophobicContact CD2-CD1 4.19Å; F1211-I1213 HydrophobicContact CD2-CG1 4Å; F1211-I1213 HydrophobicContact CE2-CD1 3.67Å; F1211-I1213 HydrophobicContact CE2-CG1 3.98Å; I1213-V1215 HydrophobicContact CG2-CG2 4.32Å
1214	Y	74.9	Confident	69.6	Low	104 Å²	104	57.6 Å²	57.6	41%	0.408	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	112.3	165.8	-177.7	-109.5	0	0	0	109.5	F1130 T1131 V1132 S1194 A1216	F1130-Y1214 PolarHBondContact O-N 2.76Å; T1131-Y1214 CarbonylContact C-O 3.6Å; T1131-Y1214 VanDerWaalsContact CA-O 3.29Å; T1131-Y1214 WeakPolarHBondContact CA-O 3.28Å; T1131-Y1214 HydrophobicContact CG2-CD1 4.06Å; V1132-Y1214 PolarHBondContact N-O 2.88Å; S1194-Y1214 WeakPolarHBondContact OG-CD2 3.45Å; Y1214-A1216 HydrophobicContact CD1-CB 4.27Å; Y1214-A1216 HydrophobicContact CE1-CB 3.97Å; Y1214-A1216 PolarHBondContact O-N 2.9Å
1215	V	72.9	Confident	69.5	Low	0 Å²	0	55 Å²	55	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	110.2	171.3	-178.7	0	0	0	0	106.7	V1132 W1171 I1185 V1190 P1192 S1193 I1213	V1132-V1215 HydrophobicContact CG2-CB 4.38Å; V1132-V1215 HydrophobicContact CG2-CG2 3.88Å; V1132-V1215 WeakPolarHBondContact O-CA 3.14Å; W1171-V1215 HydrophobicContact CH2-CG2 3.92Å; W1171-V1215 HydrophobicContact CZ2-CG2 4.01Å; I1185-V1215 HydrophobicContact CD1-CB 4.04Å; I1185-V1215 HydrophobicContact CD1-CG1 3.52Å; I1185-V1215 HydrophobicContact CD1-CG2 3.36Å; I1185-V1215 HydrophobicContact CG2-CG1 4.15Å; V1190-V1215 HydrophobicContact CB-CG1 4.21Å; V1190-V1215 HydrophobicContact CG1-CB 4.12Å; V1190-V1215 HydrophobicContact CG1-CG1 3.83Å; V1190-V1215 HydrophobicContact CG1-CG2 4.31Å; P1192-V1215 CarbonylContact C-O 3.49Å; P1192-V1215 WeakPolarHBondContact CA-O 3.46Å; P1192-V1215 WeakPolarHBondContact CB-O 3.16Å; S1193-V1215 PolarHBondContact N-O 3.41Å; S1193-V1215 VanDerWaalsContact N-O 3.1Å; S1193-V1215 PolarHBondContact O-N 2.83Å; I1213-V1215 HydrophobicContact CG2-CG2 4.32Å
1216	A	64.3	Low	70.1	Confident	14 Å²	14	51.7 Å²	51.7	12%	0.116	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	159.5	166.9	0	0	0	0	0	109.1	V1132 F1133 T1134 Y1214	V1132-A1216 PolarHBondContact O-N 2.96Å; F1133-A1216 HydrophobicContact CD1-CB 3.46Å; F1133-A1216 VanDerWaalsContact CD1-CB 3.46Å; F1133-A1216 HydrophobicContact CE1-CB 3.5Å; F1133-A1216 VanDerWaalsContact CE1-CB 3.5Å; F1133-A1216 HydrophobicContact CG-CB 4.46Å; T1134-A1216 PolarHBondContact N-O 2.76Å; Y1214-A1216 HydrophobicContact CD1-CB 4.27Å; Y1214-A1216 HydrophobicContact CE1-CB 3.97Å; Y1214-A1216 PolarHBondContact O-N 2.9Å
1217	G	66	Low	71	Confident	26 Å²	26	49 Å²	49	27%	0.268	28%	0.277	S	S	.	.	S	Bend	trans	-67	-139.3	174.1	0	0	0	0	0	112.3	T1134 N1219	T1134-G1217 PolarHBondContact N-O 2.72Å; T1134-G1217 VanDerWaalsContact N-O 3.1Å; T1134-G1217 PolarHBondContact OG1-O 2.94Å; G1217-N1219 PolarHBondContact O-N 3.06Å
1218	S	65.7	Low	71.8	Confident	98 Å²	98	45.2 Å²	45.2	69%	0.685	25%	0.254	S	S	*	.	S	Bend	trans	-58.9	138.9	171.4	50.1	0	0	0	0	110.5	T1134 P1220	T1134-S1218 PolarHBondContact OG1-N 2.9Å; S1218-P1220 WeakPolarHBondContact O-CD 3.13Å; S1218-P1220 VanDerWaalsContact O-N 3.14Å
1219	N	69.1	Low	72.4	Confident	6 Å²	6	46 Å²	46	3%	0.032	25%	0.251	C	S	.	.			trans	-61.1	116.4	176.3	-177.6	-14.1	0	0	0	108.9	F1133 E1136 G1217 Q1221 L1222	F1133-N1219 HydrophobicContact CB-CB 3.91Å; F1133-N1219 VanDerWaalsContact CD1-CA 3.44Å; F1133-N1219 HydrophobicContact CD1-CB 3.82Å; F1133-N1219 HydrophobicContact CD2-CB 4.04Å; F1133-N1219 HydrophobicContact CE1-CB 4.34Å; F1133-N1219 HydrophobicContact CG-CB 3.65Å; E1136-N1219 WeakPolarHBondContact OE1-CB 3.23Å; E1136-N1219 PolarHBondContact OE1-ND2 3.2Å; G1217-N1219 PolarHBondContact O-N 3.06Å; N1219-Q1221 PolarHBondContact O-N 2.9Å; N1219-Q1221 PolarHBondContact OD1-N 2.82Å; N1219-L1222 HydrophobicContact CB-CD1 3.8Å; N1219-L1222 HydrophobicContact CB-CG 3.96Å; N1219-L1222 WeakPolarHBondContact O-CB 3.29Å; N1219-L1222 PolarHBondContact O-N 3.08Å
1220	P	63.4	Low	72.7	Confident	102 Å²	102	45.7 Å²	45.7	66%	0.662	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-9.1	-172.2	27.6	-35.7	0	0	0	113.7	S1218	S1218-P1220 WeakPolarHBondContact O-CD 3.13Å; S1218-P1220 VanDerWaalsContact O-N 3.14Å
1221	Q	59.9	Low	73	Confident	81 Å²	81	42.7 Å²	42.7	38%	0.379	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-17.6	175.3	-65.7	167.5	-36.3	0	0	113.1	N1219 I1331	N1219-Q1221 PolarHBondContact O-N 2.9Å; N1219-Q1221 PolarHBondContact OD1-N 2.82Å; Q1221-I1331 VanDerWaalsContact NE2-CD1 3.34Å
1222	L	68	Low	73.1	Confident	21 Å²	21	42.7 Å²	42.7	11%	0.11	24%	0.236	C	C	.	.	S	Bend	trans	-72.4	140.6	171.7	-66.6	172.7	0	0	0	108.9	N1219 I1224 F1226 I1279 K1297 L1300 I1301	N1219-L1222 HydrophobicContact CB-CD1 3.8Å; N1219-L1222 HydrophobicContact CB-CG 3.96Å; N1219-L1222 WeakPolarHBondContact O-CB 3.29Å; N1219-L1222 PolarHBondContact O-N 3.08Å; L1222-I1224 PolarHBondContact O-N 2.93Å; L1222-F1226 HydrophobicContact CB-CE1 4.39Å; L1222-I1279 HydrophobicContact CD1-CD1 3.46Å; L1222-I1279 VanDerWaalsContact CD1-CD1 3.46Å; L1222-I1279 HydrophobicContact CD1-CG1 4.31Å; L1222-I1279 HydrophobicContact CD2-CD1 3.79Å; L1222-I1279 HydrophobicContact CG-CD1 4.29Å; L1222-K1297 HydrophobicContact CD2-CG 4.32Å; L1222-L1300 HydrophobicContact CD2-CB 4.06Å; L1222-L1300 HydrophobicContact CD2-CD1 4.24Å; L1222-I1301 HydrophobicContact CD2-CD1 4.32Å; L1222-I1301 HydrophobicContact CD2-CG1 4.01Å
1223	P	63.7	Low	73.2	Confident	34 Å²	34	44.8 Å²	44.8	22%	0.221	25%	0.245	C	C	.	.			trans	-61.9	140.6	175.2	28.8	-35.2	0	0	0	109.5	N1225 L1300	P1223-N1225 WeakPolarHBondContact CB-O 3.49Å; P1223-N1225 PolarHBondContact O-N 2.78Å; P1223-L1300 WeakPolarHBondContact CD-O 3.49Å; P1223-L1300 HydrophobicContact CG-CB 4.43Å; P1223-L1300 WeakPolarHBondContact CG-O 3.45Å
1224	I	63.3	Low	73.1	Confident	171 Å²	171	45 Å²	45	88%	0.877	25%	0.246	S	C	*	.	S	Bend	trans	-57.5	-35.5	177.4	-60.4	169.5	0	0	0	110.3	L1222	L1222-I1224 PolarHBondContact O-N 2.93Å
1225	N	65.3	Low	72.9	Confident	117 Å²	117	41.4 Å²	41.4	63%	0.626	24%	0.236	S	C	*	.	S	Bend	trans	-104.6	113.2	174.2	-61.3	-17.7	0	0	0	108.5	P1223	P1223-N1225 WeakPolarHBondContact CB-O 3.49Å; P1223-N1225 PolarHBondContact O-N 2.78Å
1226	F	77.2	Confident	72.4	Confident	53 Å²	53	43.5 Å²	43.5	23%	0.232	25%	0.253	C	S	.	.			trans	-63.8	148	173.2	-60.9	-32.1	0	0	0	111	L1222 L1281 L1300 L1435 G1436	L1222-F1226 HydrophobicContact CB-CE1 4.39Å; F1226-L1281 HydrophobicContact CD2-CD1 3.85Å; F1226-L1281 HydrophobicContact CD2-CD2 4.15Å; F1226-L1281 HydrophobicContact CE2-CD1 3.81Å; F1226-L1281 HydrophobicContact CE2-CD2 3.27Å; F1226-L1281 HydrophobicContact CE2-CG 4.19Å; F1226-L1281 HydrophobicContact CZ-CD2 3.83Å; F1226-L1300 HydrophobicContact CB-CD2 3.53Å; F1226-L1300 HydrophobicContact CD1-CD1 3.93Å; F1226-L1300 HydrophobicContact CD1-CD2 3.65Å; F1226-L1300 HydrophobicContact CD1-CG 4.4Å; F1226-L1300 HydrophobicContact CE1-CD1 4.17Å; F1226-L1300 HydrophobicContact CG-CD1 4.43Å; F1226-L1300 HydrophobicContact CG-CD2 3.82Å; F1226-L1435 CarbonylContact O-C 3.5Å; F1226-L1435 VanDerWaalsContact O-C 3.31Å; F1226-L1435 WeakPolarHBondContact O-CB 3.17Å; F1226-G1436 PolarHBondContact O-N 3.04Å
1227	N	79	Confident	72.2	Confident	7 Å²	7	45.4 Å²	45.4	4%	0.037	26%	0.261	C	S	.	.	S	Bend	trans	-86.7	-16.4	176.8	62.8	1.9	0	0	0	112.6	I1299 L1300 P1389 L1435	N1227-I1299 PolarHBondContact ND2-O 3.08Å; N1227-L1300 WeakPolarHBondContact OD1-CD2 3.46Å; N1227-P1389 VanDerWaalsContact ND2-CG 3.25Å; N1227-P1389 WeakPolarHBondContact ND2-CG 3.34Å; N1227-L1435 CarbonylContact C-O 3.57Å; N1227-L1435 VanDerWaalsContact CA-O 3.29Å; N1227-L1435 WeakPolarHBondContact CA-O 3.14Å; N1227-L1435 PolarHBondContact O-N 3.31Å
1228	H	84.5	Confident	71.8	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	163.2	172.8	70.9	-68.9	0	0	0	111.2	Q1296 I1393 E1433	H1228-Q1296 PolarHBondContact NE2-N 2.83Å; H1228-I1393 HydrophobicContact CB-CD1 4.4Å; H1228-E1433 CarbonylContact C-O 3.46Å; H1228-E1433 WeakPolarHBondContact CA-O 3.12Å
1229	R	85.6	Confident	71	Confident	33 Å²	33	53.1 Å²	53.1	13%	0.125	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	155.4	161.9	67.8	-177.7	175.8	-150.6	-2.7	110.5	L1281 I1293 W1294 E1433 L1435 D1628	R1229-L1281 HydrophobicContact CB-CD1 4.08Å; R1229-I1293 HydrophobicContact CB-CG2 4.13Å; R1229-I1293 HydrophobicContact CG-CG2 4.26Å; R1229-W1294 CarbonylContact C-O 3.54Å; R1229-E1433 HydrophobicContact CG-CB 3.98Å; R1229-E1433 IonicContact CZ-OE2 3.48Å; R1229-E1433 PolarHBondContact N-O 3.26Å; R1229-E1433 IonicContact NE-OE2 2.72Å; R1229-E1433 PolarHBondContact NE-OE2 2.91Å; R1229-E1433 IonicContact NH2-OE2 3.61Å; R1229-E1433 PolarHBondContact NH2-OE2 3.46Å; R1229-E1433 PolarHBondContact O-N 2.9Å; R1229-L1435 HydrophobicContact CB-CD1 4.07Å; R1229-L1435 HydrophobicContact CG-CD1 3.66Å; R1229-L1435 HydrophobicContact CG-CG 4.41Å; R1229-D1628 IonicContact CZ-OD2 3.19Å; R1229-D1628 IonicContact NH1-OD1 3.18Å; R1229-D1628 IonicContact NH1-OD2 3.05Å; R1229-D1628 PolarHBondContact NH1-OD2 2.7Å; R1229-D1628 IonicContact NH2-OD2 3.75Å
1230	V	84.5	Confident	70	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.8	-179.1	-173.6	0	0	0	0	109	M1232 I1293 W1294 L1396 L1400 I1430 Q1431 I1432	V1230-M1232 HydrophobicContact CG1-CE 3.85Å; V1230-M1232 HydrophobicContact CG1-CG 4.43Å; V1230-I1293 CarbonylContact O-C 3.48Å; V1230-I1293 VanDerWaalsContact O-CA 3.25Å; V1230-I1293 WeakPolarHBondContact O-CA 3.47Å; V1230-W1294 HydrophobicContact CB-CD2 4.14Å; V1230-W1294 HydrophobicContact CB-CG 4.42Å; V1230-W1294 HydrophobicContact CB-CZ2 3.95Å; V1230-W1294 HydrophobicContact CG1-CZ2 3.92Å; V1230-W1294 HydrophobicContact CG2-CD2 4.44Å; V1230-W1294 HydrophobicContact CG2-CH2 4.16Å; V1230-W1294 HydrophobicContact CG2-CZ2 3.93Å; V1230-W1294 PolarHBondContact N-O 2.77Å; V1230-W1294 PolarHBondContact O-N 3.15Å; V1230-L1396 HydrophobicContact CG2-CD2 4.44Å; V1230-L1400 HydrophobicContact CG1-CD1 4.19Å; V1230-L1400 HydrophobicContact CG2-CD1 4.19Å; V1230-I1430 HydrophobicContact CG1-CD1 4.12Å; V1230-I1430 HydrophobicContact CG1-CG1 3.97Å; V1230-Q1431 CarbonylContact C-O 3.55Å; V1230-Q1431 WeakPolarHBondContact CA-O 3Å; V1230-I1432 HydrophobicContact CG1-CG1 4.06Å; V1230-I1432 HydrophobicContact CG2-CG1 4.04Å; V1230-I1432 HydrophobicContact CG2-CG2 4.46Å
1231	V	83.8	Confident	69.3	Low	15 Å²	15	62.4 Å²	62.4	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.7	178.6	-174.2	0	0	0	0	108.9	V1292 I1293 I1430 Q1431	V1231-V1292 CarbonylContact C-O 3.54Å; V1231-V1292 WeakPolarHBondContact CA-O 3.39Å; V1231-I1293 HydrophobicContact CG1-CG1 4.25Å; V1231-I1293 HydrophobicContact CG2-CD1 4.26Å; V1231-I1293 HydrophobicContact CG2-CG1 4.09Å; V1231-I1293 HydrophobicContact CG2-CG2 4.26Å; V1231-I1430 CarbonylContact O-C 3.55Å; V1231-I1430 VanDerWaalsContact O-CA 3.31Å; V1231-I1430 WeakPolarHBondContact O-CA 3.07Å; V1231-Q1431 HydrophobicContact CB-CB 4.44Å; V1231-Q1431 PolarHBondContact N-O 3.49Å; V1231-Q1431 PolarHBondContact O-N 3.04Å
1232	M	84.9	Confident	68.6	Low	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	141.3	179	-68.6	172.9	-177.5	0	0	110.8	V1230 F1234 L1258 S1291 V1292 W1294 F1415 L1427 E1429 I1430	V1230-M1232 HydrophobicContact CG1-CE 3.85Å; V1230-M1232 HydrophobicContact CG1-CG 4.43Å; M1232-F1234 HydrophobicContact CB-CD2 4.38Å; M1232-F1234 HydrophobicContact CB-CE2 3.68Å; M1232-F1234 HydrophobicContact CB-CZ 4.35Å; M1232-F1234 HydrophobicContact SD-CE2 4.39Å; M1232-F1234 HydrophobicContact SD-CZ 4.3Å; M1232-L1258 HydrophobicContact CE-CD2 3.81Å; M1232-L1258 HydrophobicContact SD-CD2 4.17Å; M1232-S1291 CarbonylContact O-C 3.56Å; M1232-S1291 VanDerWaalsContact O-CA 3.23Å; M1232-S1291 WeakPolarHBondContact O-CA 3.33Å; M1232-V1292 HydrophobicContact CB-CB 4.42Å; M1232-V1292 PolarHBondContact N-O 3.07Å; M1232-V1292 PolarHBondContact O-N 3.43Å; M1232-W1294 HydrophobicContact CE-CZ2 3.71Å; M1232-F1415 HydrophobicContact CE-CE1 3.65Å; M1232-F1415 HydrophobicContact CE-CZ 3.51Å; M1232-F1415 HydrophobicContact SD-CE1 4.38Å; M1232-F1415 HydrophobicContact SD-CZ 4.29Å; M1232-L1427 HydrophobicContact CB-CD1 3.78Å; M1232-L1427 HydrophobicContact CG-CD1 4.05Å; M1232-L1427 HydrophobicContact SD-CD1 4.49Å; M1232-E1429 CarbonylContact C-O 3.55Å; M1232-E1429 WeakPolarHBondContact CA-O 3.44Å; M1232-I1430 HydrophobicContact CE-CD1 3.45Å; M1232-I1430 VanDerWaalsContact CE-CD1 3.45Å; M1232-I1430 HydrophobicContact CE-CG1 4.12Å; M1232-I1430 HydrophobicContact CG-CB 4.3Å; M1232-I1430 HydrophobicContact CG-CD1 4.2Å; M1232-I1430 HydrophobicContact CG-CG1 3.86Å
1233	H	80.3	Confident	67.6	Low	58 Å²	58	63.6 Å²	63.6	27%	0.269	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.5	175.1	-63.4	96.1	0	0	0	110.8	S1291 D1428 E1429	H1233-S1291 VanDerWaalsContact CD2-CB 3.43Å; H1233-S1291 WeakPolarHBondContact CD2-CB 3.32Å; H1233-D1428 PolarHBondContact O-N 3.37Å; H1233-E1429 HydrophobicContact CB-CB 4.2Å; H1233-E1429 PolarHBondContact N-O 3.33Å; H1233-E1429 IonicContact ND1-OE2 2.67Å; H1233-E1429 PolarHBondContact O-N 3.25Å
1234	F	79.2	Confident	67	Low	5 Å²	5	62.9 Å²	62.9	2%	0.022	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.9	-176.9	-66.4	-96.7	0	0	0	111.3	M1232 L1254 G1289 F1290 V1292 L1419 V1424 Q1426 L1427	M1232-F1234 HydrophobicContact CB-CD2 4.38Å; M1232-F1234 HydrophobicContact CB-CE2 3.68Å; M1232-F1234 HydrophobicContact CB-CZ 4.35Å; M1232-F1234 HydrophobicContact SD-CE2 4.39Å; M1232-F1234 HydrophobicContact SD-CZ 4.3Å; F1234-L1254 HydrophobicContact CE2-CD1 4.25Å; F1234-L1254 HydrophobicContact CZ-CD1 3.85Å; F1234-G1289 CarbonylContact O-C 3.55Å; F1234-G1289 WeakPolarHBondContact O-CA 3.48Å; F1234-F1290 HydrophobicContact CB-CD1 3.67Å; F1234-F1290 HydrophobicContact CB-CD2 4.32Å; F1234-F1290 HydrophobicContact CB-CE1 3.24Å; F1234-F1290 HydrophobicContact CB-CE2 3.97Å; F1234-F1290 HydrophobicContact CB-CG 4.18Å; F1234-F1290 HydrophobicContact CB-CZ 3.4Å; F1234-F1290 VanDerWaalsContact CB-CZ 3.4Å; F1234-F1290 HydrophobicContact CD1-CE1 4.27Å; F1234-F1290 HydrophobicContact CD1-CE2 4.4Å; F1234-F1290 AromaticContact CD1-CZ 3.73Å; F1234-F1290 HydrophobicContact CD1-CZ 3.73Å; F1234-F1290 AromaticContact CD2-CD2 3.85Å; F1234-F1290 HydrophobicContact CD2-CD2 3.85Å; F1234-F1290 HydrophobicContact CD2-CE1 4.13Å; F1234-F1290 AromaticContact CD2-CE2 3.22Å; F1234-F1290 HydrophobicContact CD2-CE2 3.22Å; F1234-F1290 AromaticContact CD2-CZ 3.38Å; F1234-F1290 HydrophobicContact CD2-CZ 3.38Å; F1234-F1290 HydrophobicContact CE1-CZ 4.3Å; F1234-F1290 AromaticContact CE2-CE2 3.7Å; F1234-F1290 HydrophobicContact CE2-CE2 3.7Å; F1234-F1290 AromaticContact CE2-CZ 3.99Å; F1234-F1290 HydrophobicContact CE2-CZ 3.99Å; F1234-F1290 HydrophobicContact CG-CD1 4.38Å; F1234-F1290 HydrophobicContact CG-CD2 4.35Å; F1234-F1290 AromaticContact CG-CE1 3.66Å; F1234-F1290 HydrophobicContact CG-CE1 3.66Å; F1234-F1290 AromaticContact CG-CE2 3.63Å; F1234-F1290 HydrophobicContact CG-CE2 3.63Å; F1234-F1290 AromaticContact CG-CZ 3.22Å; F1234-F1290 HydrophobicContact CG-CZ 3.22Å; F1234-F1290 HydrophobicContact CZ-CE2 4.46Å; F1234-F1290 HydrophobicContact CZ-CZ 4.41Å; F1234-F1290 PolarHBondContact N-O 3.32Å; F1234-F1290 PolarHBondContact O-N 3.48Å; F1234-V1292 HydrophobicContact CD2-CG2 4.19Å; F1234-V1292 HydrophobicContact CE2-CG2 3.87Å; F1234-L1419 HydrophobicContact CE1-CD1 4.07Å; F1234-L1419 HydrophobicContact CZ-CD1 4.19Å; F1234-V1424 HydrophobicContact CD1-CG1 4.28Å; F1234-V1424 HydrophobicContact CE1-CG1 3.64Å; F1234-V1424 HydrophobicContact CZ-CG1 4.01Å; F1234-Q1426 VanDerWaalsContact CA-O 3.3Å; F1234-Q1426 WeakPolarHBondContact CA-O 3.36Å; F1234-L1427 HydrophobicContact CD1-CB 4.2Å; F1234-L1427 HydrophobicContact CD1-CD1 4.19Å; F1234-L1427 HydrophobicContact CD2-CD1 4.29Å; F1234-L1427 HydrophobicContact CE1-CB 4Å; F1234-L1427 HydrophobicContact CE1-CD1 3.82Å; F1234-L1427 HydrophobicContact CE2-CD1 3.93Å; F1234-L1427 HydrophobicContact CG-CD1 4.42Å; F1234-L1427 HydrophobicContact CZ-CD1 3.68Å
1235	S	71	Confident	66.4	Low	28 Å²	28	54.8 Å²	54.8	20%	0.196	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	149.7	170.9	46	0	0	0	0	111.9	D1237 Q1426 D1428	S1235-D1237 PolarHBondContact O-N 3.37Å; S1235-Q1426 PolarHBondContact N-O 3.35Å; S1235-D1428 WeakPolarHBondContact CB-OD2 3.35Å; S1235-D1428 PolarHBondContact N-OD2 3.17Å; S1235-D1428 PolarHBondContact OG-OD1 3.3Å; S1235-D1428 PolarHBondContact OG-OD2 3.21Å
1236	A	61.9	Low	65.7	Low	44 Å²	44	50.5 Å²	50.5	36%	0.364	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-69.6	122.6	174.8	0	0	0	0	0	111	S1288	A1236-S1288 PolarHBondContact N-O 2.87Å; A1236-S1288 VanDerWaalsContact N-O 3.14Å
1237	D	60.8	Low	65	Low	55 Å²	55	48.4 Å²	48.4	29%	0.294	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-75.5	126.8	172.9	-167.5	-28.6	0	0	0	109.7	S1235 S1239 R1240	S1235-D1237 PolarHBondContact O-N 3.37Å; D1237-S1239 VanDerWaalsContact CG-OG 3.26Å; D1237-S1239 PolarHBondContact O-N 2.77Å; D1237-S1239 VanDerWaalsContact O-N 3.16Å; D1237-S1239 PolarHBondContact OD1-N 3.15Å; D1237-S1239 VanDerWaalsContact OD1-N 3.07Å; D1237-S1239 PolarHBondContact OD1-OG 2.85Å; D1237-S1239 PolarHBondContact OD2-OG 3.46Å; D1237-R1240 CarbonylContact O-C 3.56Å; D1237-R1240 PolarHBondContact O-N 3.07Å; D1237-R1240 VanDerWaalsContact O-O 3.1Å
1238	H	56.3	Low	64.7	Low	195 Å²	195	48.3 Å²	48.3	90%	0.903	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-23	-177.7	-65.5	75.5	0	0	0	112.8
1239	S	48.6	Very low	64.1	Low	91 Å²	91	52.3 Å²	52.3	64%	0.636	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-21.1	-174.4	65.6	0	0	0	0	114.5	D1237	D1237-S1239 VanDerWaalsContact CG-OG 3.26Å; D1237-S1239 PolarHBondContact O-N 2.77Å; D1237-S1239 VanDerWaalsContact O-N 3.16Å; D1237-S1239 PolarHBondContact OD1-N 3.15Å; D1237-S1239 VanDerWaalsContact OD1-N 3.07Å; D1237-S1239 PolarHBondContact OD1-OG 2.85Å; D1237-S1239 PolarHBondContact OD2-OG 3.46Å
1240	R	49.5	Very low	63.5	Low	188 Å²	188	52 Å²	52	71%	0.709	28%	0.283	S	S	*	.	S	Bend	trans	-138.7	102.3	172.2	-74.9	-173.6	179.7	179.8	2.7	108.1	D1237 W1242	D1237-R1240 CarbonylContact O-C 3.56Å; D1237-R1240 PolarHBondContact O-N 3.07Å; D1237-R1240 VanDerWaalsContact O-O 3.1Å; R1240-W1242 PolarHBondContact O-N 3.34Å
1241	P	47.7	Very low	63.1	Low	115 Å²	115	53.1 Å²	53.1	75%	0.747	29%	0.287	S	S	*	.			trans	-57.9	108.7	175.2	23.4	-31.1	0	0	0	107.4	T1243	P1241-T1243 PolarHBondContact O-N 3.26Å; P1241-T1243 VanDerWaalsContact O-N 3.17Å
1242	W	44.9	Very low	63.1	Low	56 Å²	56	53.5 Å²	53.5	21%	0.212	29%	0.287	C	S	.	.			trans	-51.2	124.9	176.1	-130	64	0	0	0	106.7	R1240 G1244 Y1285 F1290 V1424	R1240-W1242 PolarHBondContact O-N 3.34Å; W1242-G1244 PolarHBondContact O-N 3.08Å; W1242-Y1285 HydrophobicContact CZ3-CD1 4.27Å; W1242-Y1285 AromaticContact CZ3-CE1 3.96Å; W1242-Y1285 HydrophobicContact CZ3-CE1 3.96Å; W1242-F1290 HydrophobicContact CD2-CD1 4Å; W1242-F1290 AromaticContact CD2-CE1 3.73Å; W1242-F1290 HydrophobicContact CD2-CE1 3.73Å; W1242-F1290 AromaticContact CE2-CE1 3.42Å; W1242-F1290 VanDerWaalsContact CE2-CE1 3.42Å; W1242-F1290 AromaticContact CE2-CZ 3.91Å; W1242-F1290 AromaticContact CE3-CD1 3.48Å; W1242-F1290 HydrophobicContact CE3-CD1 3.48Å; W1242-F1290 VanDerWaalsContact CE3-CD1 3.48Å; W1242-F1290 AromaticContact CE3-CE1 3.65Å; W1242-F1290 HydrophobicContact CE3-CE1 3.65Å; W1242-F1290 HydrophobicContact CE3-CG 4.22Å; W1242-F1290 HydrophobicContact CE3-CZ 4.5Å; W1242-F1290 AromaticContact CH2-CD1 3.45Å; W1242-F1290 HydrophobicContact CH2-CD1 3.45Å; W1242-F1290 VanDerWaalsContact CH2-CD1 3.45Å; W1242-F1290 AromaticContact CH2-CD2 3.77Å; W1242-F1290 HydrophobicContact CH2-CD2 3.77Å; W1242-F1290 AromaticContact CH2-CE1 3.1Å; W1242-F1290 HydrophobicContact CH2-CE1 3.1Å; W1242-F1290 AromaticContact CH2-CE2 3.45Å; W1242-F1290 HydrophobicContact CH2-CE2 3.45Å; W1242-F1290 VanDerWaalsContact CH2-CE2 3.45Å; W1242-F1290 AromaticContact CH2-CG 3.78Å; W1242-F1290 HydrophobicContact CH2-CG 3.78Å; W1242-F1290 AromaticContact CH2-CZ 3.1Å; W1242-F1290 HydrophobicContact CH2-CZ 3.1Å; W1242-F1290 AromaticContact CZ2-CD1 3.94Å; W1242-F1290 HydrophobicContact CZ2-CD1 3.94Å; W1242-F1290 AromaticContact CZ2-CE1 3.15Å; W1242-F1290 HydrophobicContact CZ2-CE1 3.15Å; W1242-F1290 AromaticContact CZ2-CE2 3.97Å; W1242-F1290 HydrophobicContact CZ2-CE2 3.97Å; W1242-F1290 AromaticContact CZ2-CZ 3.17Å; W1242-F1290 HydrophobicContact CZ2-CZ 3.17Å; W1242-F1290 HydrophobicContact CZ3-CB 4.21Å; W1242-F1290 AromaticContact CZ3-CD1 3.13Å; W1242-F1290 HydrophobicContact CZ3-CD1 3.13Å; W1242-F1290 AromaticContact CZ3-CD2 3.94Å; W1242-F1290 HydrophobicContact CZ3-CD2 3.94Å; W1242-F1290 AromaticContact CZ3-CE1 3.31Å; W1242-F1290 HydrophobicContact CZ3-CE1 3.31Å; W1242-F1290 HydrophobicContact CZ3-CE2 4.07Å; W1242-F1290 AromaticContact CZ3-CG 3.48Å; W1242-F1290 HydrophobicContact CZ3-CG 3.48Å; W1242-F1290 VanDerWaalsContact CZ3-CG 3.48Å; W1242-F1290 AromaticContact CZ3-CZ 3.79Å; W1242-F1290 HydrophobicContact CZ3-CZ 3.79Å; W1242-V1424 WeakPolarHBondContact CZ2-O 3.23Å; W1242-V1424 PolarHBondContact NE1-O 2.85Å
1243	T	48.6	Very low	63	Low	71 Å²	71	56.6 Å²	56.6	44%	0.436	30%	0.303	S	S	.	.			trans	-69.8	26.5	-172.9	33.5	0	0	0	0	113.8	P1241 G1245 D1250	P1241-T1243 PolarHBondContact O-N 3.26Å; P1241-T1243 VanDerWaalsContact O-N 3.17Å; T1243-G1245 VanDerWaalsContact C-N 3.31Å; T1243-D1250 PolarHBondContact OG1-OD2 2.88Å
1244	G	49.6	Very low	63.2	Low	19 Å²	19	53.9 Å²	53.9	20%	0.196	29%	0.29	C	S	.	.			trans	81.6	4.8	-175.3	0	0	0	0	0	113.4	W1242 H1246 Y1285	W1242-G1244 PolarHBondContact O-N 3.08Å; G1244-H1246 PolarHBondContact O-CD2 3.44Å; G1244-H1246 PolarHBondContact O-N 3.15Å; G1244-H1246 PolarHBondContact O-NE2 3.49Å; G1244-Y1285 WeakPolarHBondContact O-CD1 3.42Å; G1244-Y1285 WeakPolarHBondContact O-CE1 3.43Å
1245	G	50.2	Low	63.4	Low	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	58	-5.8	179.3	0	0	0	0	0	116.8	T1243 S1247 R1251 Y1285	T1243-G1245 VanDerWaalsContact C-N 3.31Å; G1245-S1247 PolarHBondContact O-N 3.27Å; G1245-R1251 WeakPolarHBondContact O-CG 3.22Å; G1245-Y1285 VanDerWaalsContact C-CE1 3.45Å; G1245-Y1285 VanDerWaalsContact C-CZ 3.46Å; G1245-Y1285 VanDerWaalsContact CA-CE1 3.46Å; G1245-Y1285 PolarHBondContact O-OH 2.82Å
1246	H	52.3	Low	64	Low	27 Å²	27	53.5 Å²	53.5	13%	0.125	29%	0.289	C	S	.	.			trans	-65.6	-18.3	177.9	-60.4	-67.5	0	0	0	112.6	F1037 A1067 G1244 Y1285	F1037-H1246 HydrophobicContact CD1-CB 3.23Å; F1037-H1246 HydrophobicContact CE1-CB 3.19Å; F1037-H1246 WeakPolarHBondContact CE1-O 3.41Å; F1037-H1246 HydrophobicContact CG-CB 4.09Å; F1037-H1246 HydrophobicContact CZ-CB 4Å; A1067-H1246 VanDerWaalsContact CB-NE2 3.27Å; A1067-H1246 WeakPolarHBondContact CB-NE2 3.45Å; G1244-H1246 PolarHBondContact O-CD2 3.44Å; G1244-H1246 PolarHBondContact O-N 3.15Å; G1244-H1246 PolarHBondContact O-NE2 3.49Å; H1246-Y1285 AromaticContact CE1-CD2 3.13Å; H1246-Y1285 WeakPolarHBondContact CE1-CD2 3.34Å; H1246-Y1285 AromaticContact CE1-CE2 3.4Å; H1246-Y1285 VanDerWaalsContact CE1-CE2 3.4Å; H1246-Y1285 WeakPolarHBondContact CE1-CE2 3.47Å; H1246-Y1285 AromaticContact CE1-CG 3.75Å; H1246-Y1285 AromaticContact ND1-CD2 3.51Å; H1246-Y1285 AromaticContact ND1-CE2 3.21Å; H1246-Y1285 WeakPolarHBondContact ND1-CE2 3.39Å; H1246-Y1285 AromaticContact ND1-CZ 3.81Å; H1246-Y1285 AromaticContact NE2-CD2 3.95Å
1247	S	62.6	Low	65.2	Low	10 Å²	10	51.5 Å²	51.5	7%	0.07	27%	0.272	C	S	.	.	S	Bend	trans	-67.3	144.6	177.9	86.7	0	0	0	0	110.6	G1245 V1249 D1250 R1251	G1245-S1247 PolarHBondContact O-N 3.27Å; S1247-V1249 PolarHBondContact O-N 3.25Å; S1247-V1249 PolarHBondContact OG-N 3.2Å; S1247-D1250 PolarHBondContact O-N 3.13Å; S1247-D1250 WeakPolarHBondContact OG-CB 3.4Å; S1247-D1250 PolarHBondContact OG-N 3.07Å; S1247-D1250 PolarHBondContact OG-OD1 3.18Å; S1247-D1250 PolarHBondContact OG-OD2 3.45Å; S1247-R1251 PolarHBondContact O-N 3.41Å
1248	L	72.6	Confident	66.5	Low	4 Å²	4	49 Å²	49	2%	0.021	26%	0.258	C	S	.	.	H	α-helix	trans	-56.7	-37	171.3	-174.4	57.5	0	0	0	111.1	S1168 H1170 W1171 F1182 I1184 R1251 W1252	S1168-L1248 VanDerWaalsContact O-CB 3.32Å; S1168-L1248 WeakPolarHBondContact O-CB 3.5Å; S1168-L1248 PolarHBondContact O-N 3.02Å; H1170-L1248 VanDerWaalsContact O-CB 3.28Å; H1170-L1248 WeakPolarHBondContact O-CB 3.22Å; W1171-L1248 WeakPolarHBondContact O-CD1 3.47Å; F1182-L1248 HydrophobicContact CD2-CD2 4.17Å; F1182-L1248 HydrophobicContact CD2-CG 4.35Å; F1182-L1248 HydrophobicContact CE2-CD2 3.76Å; F1182-L1248 HydrophobicContact CE2-CG 3.81Å; F1182-L1248 HydrophobicContact CZ-CD2 4.33Å; I1184-L1248 HydrophobicContact CG2-CD1 4.23Å; L1248-R1251 PolarHBondContact O-N 2.8Å; L1248-W1252 WeakPolarHBondContact O-CA 3.34Å; L1248-W1252 WeakPolarHBondContact O-CB 3.44Å; L1248-W1252 PolarHBondContact O-N 3.34Å
1249	V	72.1	Confident	67.9	Low	84 Å²	84	39.8 Å²	39.8	51%	0.509	22%	0.216	S	C	.	.	H	α-helix	trans	-61.9	-45.4	-178.2	-179.6	0	0	0	0	110.3	S1247 W1252 L1253	S1247-V1249 PolarHBondContact O-N 3.25Å; S1247-V1249 PolarHBondContact OG-N 3.2Å; V1249-W1252 PolarHBondContact O-N 2.98Å; V1249-L1253 VanDerWaalsContact O-CB 3.22Å; V1249-L1253 WeakPolarHBondContact O-CB 3.46Å; V1249-L1253 PolarHBondContact O-N 3.33Å
1250	D	72.4	Confident	69.6	Low	26 Å²	26	36.9 Å²	36.9	14%	0.139	19%	0.193	C	C	.	.	H	α-helix	trans	-67.7	-45.2	179.8	-59	-32.2	0	0	0	111.1	T1243 S1247 W1252 L1253 L1254	T1243-D1250 PolarHBondContact OG1-OD2 2.88Å; S1247-D1250 PolarHBondContact O-N 3.13Å; S1247-D1250 WeakPolarHBondContact OG-CB 3.4Å; S1247-D1250 PolarHBondContact OG-N 3.07Å; S1247-D1250 PolarHBondContact OG-OD1 3.18Å; S1247-D1250 PolarHBondContact OG-OD2 3.45Å; D1250-W1252 VanDerWaalsContact C-N 3.34Å; D1250-W1252 PolarHBondContact O-N 3.31Å; D1250-L1253 PolarHBondContact O-N 3.09Å; D1250-L1254 PolarHBondContact O-N 2.73Å; D1250-L1254 VanDerWaalsContact O-N 3.14Å
1251	R	76.6	Confident	71.4	Confident	24 Å²	24	30 Å²	30	9%	0.091	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-44.4	175.5	-69.8	-176	-76.8	156.4	-1.9	111.6	H1170 I1184 G1245 S1247 L1248 L1254 I1255 L1283	H1170-R1251 PolarHBondContact O-NH2 3.24Å; I1184-R1251 HydrophobicContact CG2-CB 4.27Å; G1245-R1251 WeakPolarHBondContact O-CG 3.22Å; S1247-R1251 PolarHBondContact O-N 3.41Å; L1248-R1251 PolarHBondContact O-N 2.8Å; R1251-L1254 PolarHBondContact O-N 2.87Å; R1251-I1255 WeakPolarHBondContact O-CD1 3.24Å; R1251-I1255 VanDerWaalsContact O-CG1 3.26Å; R1251-I1255 WeakPolarHBondContact O-CG1 3.42Å; R1251-I1255 PolarHBondContact O-N 3.34Å; R1251-I1255 VanDerWaalsContact O-N 3.08Å; R1251-L1283 HydrophobicContact CG-CD1 4.21Å
1252	W	83	Confident	73.2	Confident	24 Å²	24	24.7 Å²	24.7	9%	0.091	13%	0.133	C	C	.	.	H	α-helix	trans	-67.3	-38.5	178.9	-172	-99.8	0	0	0	111.8	F1138 R1139 F1182 G1183 L1248 V1249 D1250 L1254 I1255 S1256 M1276	F1138-W1252 WeakPolarHBondContact O-CH2 3.09Å; R1139-W1252 HydrophobicContact CB-CH2 3.91Å; R1139-W1252 HydrophobicContact CB-CZ2 4.02Å; R1139-W1252 HydrophobicContact CG-CZ2 4.39Å; F1182-W1252 HydrophobicContact CB-CD2 4.19Å; F1182-W1252 HydrophobicContact CB-CE3 4.3Å; F1182-W1252 HydrophobicContact CB-CH2 3.88Å; F1182-W1252 HydrophobicContact CB-CZ2 3.74Å; F1182-W1252 HydrophobicContact CB-CZ3 4.14Å; F1182-W1252 HydrophobicContact CD2-CB 4.03Å; F1182-W1252 AromaticContact CD2-CD1 3.8Å; F1182-W1252 AromaticContact CD2-CD2 3.29Å; F1182-W1252 HydrophobicContact CD2-CD2 3.29Å; F1182-W1252 AromaticContact CD2-CE2 3.67Å; F1182-W1252 AromaticContact CD2-CE3 3.7Å; F1182-W1252 HydrophobicContact CD2-CE3 3.7Å; F1182-W1252 AromaticContact CD2-CG 3.42Å; F1182-W1252 HydrophobicContact CD2-CG 3.42Å; F1182-W1252 VanDerWaalsContact CD2-CG 3.42Å; F1182-W1252 HydrophobicContact CD2-CZ2 4.38Å; F1182-W1252 HydrophobicContact CD2-CZ3 4.37Å; F1182-W1252 AromaticContact CD2-NE1 3.92Å; F1182-W1252 HydrophobicContact CE2-CB 3.77Å; F1182-W1252 AromaticContact CE2-CD1 3.81Å; F1182-W1252 AromaticContact CE2-CD2 3.95Å; F1182-W1252 HydrophobicContact CE2-CD2 3.95Å; F1182-W1252 AromaticContact CE2-CG 3.52Å; F1182-W1252 HydrophobicContact CE2-CG 3.52Å; F1182-W1252 HydrophobicContact CG-CD2 4.07Å; F1182-W1252 AromaticContact CG-CE2 3.98Å; F1182-W1252 HydrophobicContact CG-CE3 4.46Å; F1182-W1252 HydrophobicContact CG-CG 4.42Å; F1182-W1252 HydrophobicContact CG-CZ2 4.36Å; G1183-W1252 WeakPolarHBondContact O-CZ3 3.41Å; L1248-W1252 WeakPolarHBondContact O-CA 3.34Å; L1248-W1252 WeakPolarHBondContact O-CB 3.44Å; L1248-W1252 PolarHBondContact O-N 3.34Å; V1249-W1252 PolarHBondContact O-N 2.98Å; D1250-W1252 VanDerWaalsContact C-N 3.34Å; D1250-W1252 PolarHBondContact O-N 3.31Å; W1252-L1254 VanDerWaalsContact C-N 3.32Å; W1252-L1254 PolarHBondContact O-N 3.18Å; W1252-I1255 PolarHBondContact O-N 3.23Å; W1252-S1256 WeakPolarHBondContact O-CB 3.46Å; W1252-S1256 PolarHBondContact O-N 3.15Å; W1252-M1276 HydrophobicContact CH2-CG 4.27Å
1253	L	82.3	Confident	75	Confident	64 Å²	64	23.6 Å²	23.6	34%	0.335	13%	0.129	S	C	.	.	H	α-helix	trans	-58.2	-46.4	175.6	-174.8	68.3	0	0	0	110.7	V1249 D1250 A1257 V1424	V1249-L1253 VanDerWaalsContact O-CB 3.22Å; V1249-L1253 WeakPolarHBondContact O-CB 3.46Å; V1249-L1253 PolarHBondContact O-N 3.33Å; D1250-L1253 PolarHBondContact O-N 3.09Å; L1253-A1257 WeakPolarHBondContact O-CB 3.37Å; L1253-A1257 PolarHBondContact O-N 3.45Å; L1253-V1424 HydrophobicContact CD2-CG2 4.48Å; L1253-V1424 HydrophobicContact CG-CG2 4.15Å
1254	L	84.6	Confident	76.4	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-59.7	-52.4	174.8	171.9	69.6	0	0	0	111.8	F1234 D1250 R1251 W1252 A1257 L1258 L1283 F1290 V1292 V1424	F1234-L1254 HydrophobicContact CE2-CD1 4.25Å; F1234-L1254 HydrophobicContact CZ-CD1 3.85Å; D1250-L1254 PolarHBondContact O-N 2.73Å; D1250-L1254 VanDerWaalsContact O-N 3.14Å; R1251-L1254 PolarHBondContact O-N 2.87Å; W1252-L1254 VanDerWaalsContact C-N 3.32Å; W1252-L1254 PolarHBondContact O-N 3.18Å; L1254-A1257 PolarHBondContact O-N 2.94Å; L1254-L1258 HydrophobicContact CD1-CD1 4.17Å; L1254-L1258 HydrophobicContact CD1-CG 4.35Å; L1254-L1258 HydrophobicContact CG-CD1 4.19Å; L1254-L1258 VanDerWaalsContact O-CG 3.26Å; L1254-L1258 WeakPolarHBondContact O-CG 3.14Å; L1254-L1258 PolarHBondContact O-N 3.38Å; L1254-L1283 HydrophobicContact CD2-CD1 4.03Å; L1254-F1290 HydrophobicContact CD2-CE2 4.48Å; L1254-V1292 HydrophobicContact CD2-CB 4.33Å; L1254-V1292 HydrophobicContact CD2-CG1 3.8Å; L1254-V1292 HydrophobicContact CD2-CG2 3.56Å; L1254-V1424 HydrophobicContact CB-CG1 4.23Å; L1254-V1424 HydrophobicContact CD1-CG1 3.59Å; L1254-V1424 HydrophobicContact CG-CG1 4.49Å
1255	I	84.4	Confident	77.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.4	-40.9	-175.8	-61.2	151.2	0	0	0	111.4	I1184 R1251 W1252 L1258 D1259 M1276 I1278 L1280	I1184-I1255 HydrophobicContact CB-CD1 3.96Å; I1184-I1255 HydrophobicContact CD1-CD1 3.27Å; I1184-I1255 HydrophobicContact CD1-CG1 4.24Å; I1184-I1255 HydrophobicContact CG1-CD1 4.16Å; I1184-I1255 HydrophobicContact CG2-CD1 3.68Å; R1251-I1255 WeakPolarHBondContact O-CD1 3.24Å; R1251-I1255 VanDerWaalsContact O-CG1 3.26Å; R1251-I1255 WeakPolarHBondContact O-CG1 3.42Å; R1251-I1255 PolarHBondContact O-N 3.34Å; R1251-I1255 VanDerWaalsContact O-N 3.08Å; W1252-I1255 PolarHBondContact O-N 3.23Å; I1255-L1258 PolarHBondContact O-N 3.34Å; I1255-D1259 WeakPolarHBondContact O-CB 3.21Å; I1255-D1259 PolarHBondContact O-N 3.25Å; I1255-M1276 HydrophobicContact CG2-CE 3.81Å; I1255-I1278 HydrophobicContact CG2-CB 4.28Å; I1255-I1278 HydrophobicContact CG2-CG2 4.31Å; I1255-L1280 HydrophobicContact CD1-CD2 4.32Å
1256	S	84	Confident	78.7	Confident	26 Å²	26	29.2 Å²	29.2	18%	0.182	15%	0.152	C	C	.	.	H	α-helix	trans	-62.9	-44.8	175.5	-169.6	0	0	0	0	110.6	W1252 L1258 D1259 D1260	W1252-S1256 WeakPolarHBondContact O-CB 3.46Å; W1252-S1256 PolarHBondContact O-N 3.15Å; S1256-L1258 VanDerWaalsContact C-N 3.34Å; S1256-L1258 PolarHBondContact O-N 3.07Å; S1256-D1259 PolarHBondContact O-N 3.34Å; S1256-D1260 VanDerWaalsContact O-CB 3.27Å; S1256-D1260 WeakPolarHBondContact O-CB 3.4Å; S1256-D1260 PolarHBondContact O-N 3.47Å; S1256-D1260 PolarHBondContact OG-OD2 3.34Å
1257	A	86.1	Confident	79.2	Confident	2 Å²	2	33.6 Å²	33.6	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-42.8	177.4	0	0	0	0	0	111.6	L1253 L1254 Y1261 H1418 L1419 T1422 V1424	L1253-A1257 WeakPolarHBondContact O-CB 3.37Å; L1253-A1257 PolarHBondContact O-N 3.45Å; L1254-A1257 PolarHBondContact O-N 2.94Å; A1257-Y1261 WeakPolarHBondContact O-CB 3.47Å; A1257-Y1261 PolarHBondContact O-N 3.07Å; A1257-Y1261 VanDerWaalsContact O-N 3.11Å; A1257-H1418 PolarHBondContact O-CD2 3.25Å; A1257-H1418 PolarHBondContact O-NE2 3.48Å; A1257-L1419 HydrophobicContact CB-CD2 4.06Å; A1257-T1422 HydrophobicContact CB-CG2 3.97Å; A1257-V1424 HydrophobicContact CB-CG2 3.94Å
1258	L	88.2	Confident	79.4	Confident	1 Å²	1	37 Å²	37	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-46	175.4	-69.4	171.6	0	0	0	111.5	M1232 L1254 I1255 S1256 Y1261 L1262 I1278 W1294 F1415	M1232-L1258 HydrophobicContact CE-CD2 3.81Å; M1232-L1258 HydrophobicContact SD-CD2 4.17Å; L1254-L1258 HydrophobicContact CD1-CD1 4.17Å; L1254-L1258 HydrophobicContact CD1-CG 4.35Å; L1254-L1258 HydrophobicContact CG-CD1 4.19Å; L1254-L1258 VanDerWaalsContact O-CG 3.26Å; L1254-L1258 WeakPolarHBondContact O-CG 3.14Å; L1254-L1258 PolarHBondContact O-N 3.38Å; I1255-L1258 PolarHBondContact O-N 3.34Å; S1256-L1258 VanDerWaalsContact C-N 3.34Å; S1256-L1258 PolarHBondContact O-N 3.07Å; L1258-Y1261 PolarHBondContact O-N 3.04Å; L1258-L1262 WeakPolarHBondContact O-CB 3.38Å; L1258-L1262 VanDerWaalsContact O-CG 3.24Å; L1258-L1262 WeakPolarHBondContact O-CG 3.48Å; L1258-L1262 PolarHBondContact O-N 3.34Å; L1258-I1278 HydrophobicContact CB-CD1 3.18Å; L1258-I1278 HydrophobicContact CD1-CD1 4.3Å; L1258-I1278 HydrophobicContact CG-CD1 4.35Å; L1258-W1294 HydrophobicContact CD1-CD2 4.3Å; L1258-W1294 HydrophobicContact CD1-CG 4.33Å; L1258-W1294 HydrophobicContact CD2-CZ2 4.2Å; L1258-F1415 HydrophobicContact CD2-CE2 3.74Å; L1258-F1415 HydrophobicContact CD2-CZ 3.45Å; L1258-F1415 VanDerWaalsContact CD2-CZ 3.45Å
1259	D	85.7	Confident	79.1	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.011	22%	0.22	C	C	.	.	H	α-helix	trans	-70.9	-40.6	-176.4	-168.2	68.4	0	0	0	112.2	I1255 S1256 Y1261 L1262 R1263 M1276 D1277 I1278	I1255-D1259 WeakPolarHBondContact O-CB 3.21Å; I1255-D1259 PolarHBondContact O-N 3.25Å; S1256-D1259 PolarHBondContact O-N 3.34Å; D1259-Y1261 VanDerWaalsContact C-N 3.25Å; D1259-Y1261 PolarHBondContact O-N 2.92Å; D1259-L1262 CarbonylContact O-C 3.53Å; D1259-L1262 PolarHBondContact O-N 3.05Å; D1259-L1262 VanDerWaalsContact O-N 3.16Å; D1259-R1263 PolarHBondContact O-N 2.99Å; D1259-R1263 IonicContact OD1-CZ 3.07Å; D1259-R1263 IonicContact OD1-NE 2.69Å; D1259-R1263 PolarHBondContact OD1-NE 3.09Å; D1259-R1263 IonicContact OD1-NH2 3.87Å; D1259-R1263 PolarHBondContact OD1-NH2 3.44Å; D1259-R1263 IonicContact OD2-CZ 3.42Å; D1259-R1263 IonicContact OD2-NE 2.84Å; D1259-R1263 IonicContact OD2-NH2 2.75Å; D1259-R1263 PolarHBondContact OD2-NH2 3.28Å; D1259-M1276 HydrophobicContact CB-CE 3.24Å; D1259-M1276 HydrophobicContact CB-SD 4.1Å; D1259-M1276 VanDerWaalsContact OD2-SD 3.39Å; D1259-D1277 PolarHBondContact OD1-N 3.44Å; D1259-I1278 HydrophobicContact CB-CD1 3.82Å; D1259-I1278 HydrophobicContact CB-CG1 4.38Å; D1259-I1278 VanDerWaalsContact N-CD1 3.26Å
1260	D	84.6	Confident	78.5	Confident	30 Å²	30	38.6 Å²	38.6	16%	0.16	22%	0.217	C	C	.	.	H	α-helix	trans	-59.7	-39.4	174.6	-72.3	-33.9	0	0	0	110.4	S1256 R1273	S1256-D1260 VanDerWaalsContact O-CB 3.27Å; S1256-D1260 WeakPolarHBondContact O-CB 3.4Å; S1256-D1260 PolarHBondContact O-N 3.47Å; S1256-D1260 PolarHBondContact OG-OD2 3.34Å; D1260-R1273 IonicContact OD1-CZ 3.6Å; D1260-R1273 IonicContact OD1-NE 2.7Å; D1260-R1273 IonicContact OD1-NH2 2.84Å; D1260-R1273 PolarHBondContact OD1-NH2 2.77Å; D1260-R1273 IonicContact OD2-NH2 3.96Å; D1260-R1273 PolarHBondContact OD2-NH2 2.97Å
1261	Y	87.2	Confident	78	Confident	43 Å²	43	42.9 Å²	42.9	17%	0.169	24%	0.238	C	C	.	.	H	α-helix	trans	-70.2	-39.9	175.1	-174.5	-97.9	0	0	0	112.4	A1257 L1258 D1259 R1399 L1400 S1412 D1414 F1415 H1418	A1257-Y1261 WeakPolarHBondContact O-CB 3.47Å; A1257-Y1261 PolarHBondContact O-N 3.07Å; A1257-Y1261 VanDerWaalsContact O-N 3.11Å; L1258-Y1261 PolarHBondContact O-N 3.04Å; D1259-Y1261 VanDerWaalsContact C-N 3.25Å; D1259-Y1261 PolarHBondContact O-N 2.92Å; Y1261-R1399 WeakPolarHBondContact CE1-O 3.48Å; Y1261-R1399 PolarHBondContact O-NH2 3.45Å; Y1261-R1399 PolarHBondContact OH-O 2.84Å; Y1261-L1400 HydrophobicContact CD1-CD2 4.48Å; Y1261-L1400 HydrophobicContact CE1-CD2 4.37Å; Y1261-S1412 PolarHBondContact OH-OG 2.77Å; Y1261-D1414 HydrophobicContact CE2-CB 4.45Å; Y1261-F1415 AromaticContact CD1-CD2 3.48Å; Y1261-F1415 HydrophobicContact CD1-CD2 3.48Å; Y1261-F1415 VanDerWaalsContact CD1-CD2 3.48Å; Y1261-F1415 AromaticContact CD1-CE2 3.99Å; Y1261-F1415 HydrophobicContact CD1-CE2 3.99Å; Y1261-F1415 HydrophobicContact CD1-CG 4.47Å; Y1261-F1415 HydrophobicContact CD2-CD2 4.08Å; Y1261-F1415 HydrophobicContact CE1-CB 4.05Å; Y1261-F1415 AromaticContact CE1-CD2 3.58Å; Y1261-F1415 HydrophobicContact CE1-CD2 3.58Å; Y1261-F1415 HydrophobicContact CE1-CE2 4.43Å; Y1261-F1415 HydrophobicContact CE1-CG 4.15Å; Y1261-F1415 HydrophobicContact CE2-CB 4.08Å; Y1261-F1415 HydrophobicContact CE2-CD2 4.17Å; Y1261-F1415 AromaticContact CG-CD2 3.74Å; Y1261-F1415 HydrophobicContact CG-CD2 3.74Å; Y1261-F1415 HydrophobicContact CG-CE2 4.27Å; Y1261-F1415 AromaticContact CZ-CD2 3.94Å; Y1261-H1418 HydrophobicContact CD2-CB 4.14Å
1262	L	85.7	Confident	77.5	Confident	4 Å²	4	43 Å²	43	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-78.9	-25.6	-177.5	-68.8	173.6	0	0	0	113.4	L1258 D1259 I1278 W1294 L1396 R1399 L1400	L1258-L1262 WeakPolarHBondContact O-CB 3.38Å; L1258-L1262 VanDerWaalsContact O-CG 3.24Å; L1258-L1262 WeakPolarHBondContact O-CG 3.48Å; L1258-L1262 PolarHBondContact O-N 3.34Å; D1259-L1262 CarbonylContact O-C 3.53Å; D1259-L1262 PolarHBondContact O-N 3.05Å; D1259-L1262 VanDerWaalsContact O-N 3.16Å; L1262-I1278 HydrophobicContact CD1-CD1 4.13Å; L1262-I1278 HydrophobicContact CD1-CG1 4.31Å; L1262-W1294 HydrophobicContact CD1-CH2 3.49Å; L1262-W1294 VanDerWaalsContact CD1-CH2 3.49Å; L1262-W1294 HydrophobicContact CD1-CZ3 3.71Å; L1262-L1396 HydrophobicContact CD2-CD1 3.73Å; L1262-R1399 PolarHBondContact O-NH1 2.99Å; L1262-R1399 PolarHBondContact O-NH2 3.29Å; L1262-L1400 HydrophobicContact CD2-CD2 4.24Å
1263	R	83.3	Confident	76.8	Confident	33 Å²	33	45.1 Å²	45.1	13%	0.125	25%	0.25	C	S	.	.			trans	-135.7	66.2	-178.7	-62	-174.5	-61.1	161.4	9.9	111.3	D1259 H1265 C1266 D1275 M1276	D1259-R1263 PolarHBondContact O-N 2.99Å; D1259-R1263 IonicContact OD1-CZ 3.07Å; D1259-R1263 IonicContact OD1-NE 2.69Å; D1259-R1263 PolarHBondContact OD1-NE 3.09Å; D1259-R1263 IonicContact OD1-NH2 3.87Å; D1259-R1263 PolarHBondContact OD1-NH2 3.44Å; D1259-R1263 IonicContact OD2-CZ 3.42Å; D1259-R1263 IonicContact OD2-NE 2.84Å; D1259-R1263 IonicContact OD2-NH2 2.75Å; D1259-R1263 PolarHBondContact OD2-NH2 3.28Å; R1263-H1265 PolarHBondContact O-N 3.44Å; R1263-H1265 VanDerWaalsContact O-N 3.13Å; R1263-C1266 HydrophobicContact CB-CB 4.25Å; R1263-C1266 WeakPolarHBondContact O-CB 3.33Å; R1263-C1266 PolarHBondContact O-N 3.5Å; R1263-D1275 VanDerWaalsContact CZ-O 3.29Å; R1263-D1275 PolarHBondContact NH1-O 3.39Å; R1263-D1275 PolarHBondContact NH2-O 3.44Å; R1263-M1276 VanDerWaalsContact NH2-CA 3.33Å
1264	P	76.7	Confident	76.2	Confident	72 Å²	72	44.2 Å²	44.2	47%	0.468	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-60.8	-29.3	-176.6	24	-34.3	0	0	0	113.1	C1266 M1267	P1264-C1266 PolarHBondContact O-N 3.13Å; P1264-C1266 VanDerWaalsContact O-N 3.13Å; P1264-M1267 WeakPolarHBondContact O-CB 3.37Å; P1264-M1267 WeakPolarHBondContact O-CG 3.1Å; P1264-M1267 PolarHBondContact O-N 2.92Å; P1264-M1267 VanDerWaalsContact O-N 3.13Å
1265	H	75.5	Confident	75.5	Confident	134 Å²	134	47.4 Å²	47.4	62%	0.62	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-61.6	-19.2	174.7	61	-88	0	0	0	113.4	R1263	R1263-H1265 PolarHBondContact O-N 3.44Å; R1263-H1265 VanDerWaalsContact O-N 3.13Å
1266	C	73.4	Confident	75.1	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.02	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-85	-8.8	178.8	-63.6	0	0	0	0	113.9	R1263 P1264 G1268 S1269 C1272	R1263-C1266 HydrophobicContact CB-CB 4.25Å; R1263-C1266 WeakPolarHBondContact O-CB 3.33Å; R1263-C1266 PolarHBondContact O-N 3.5Å; P1264-C1266 PolarHBondContact O-N 3.13Å; P1264-C1266 VanDerWaalsContact O-N 3.13Å; C1266-G1268 PolarHBondContact O-N 2.81Å; C1266-G1268 VanDerWaalsContact O-N 3.14Å; C1266-S1269 PolarHBondContact O-N 3.43Å; C1266-S1269 VanDerWaalsContact O-N 3.16Å; C1266-C1272 HydrophobicContact CB-CB 3.55Å; C1266-C1272 WeakPolarHBondContact CB-SG 3.4Å; C1266-C1272 WeakPolarHBondContact SG-CB 3.42Å; C1266-C1272 CovalentContact SG-SG 2.01Å; C1266-C1272 PolarHBondContact SG-SG 3.47Å
1267	M	63.2	Low	74.9	Confident	119 Å²	119	47.1 Å²	47.1	59%	0.586	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-58.6	-28.7	178.1	-71.2	176.3	66.4	0	0	113	P1264	P1264-M1267 WeakPolarHBondContact O-CB 3.37Å; P1264-M1267 WeakPolarHBondContact O-CG 3.1Å; P1264-M1267 PolarHBondContact O-N 2.92Å; P1264-M1267 VanDerWaalsContact O-N 3.13Å
1268	G	65	Low	74.9	Confident	80 Å²	80	47.1 Å²	47.1	83%	0.825	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-96.8	-13.8	177.7	0	0	0	0	0	115.8	C1266	C1266-G1268 PolarHBondContact O-N 2.81Å; C1266-G1268 VanDerWaalsContact O-N 3.14Å
1269	S	66.5	Low	74.6	Confident	35 Å²	35	47.2 Å²	47.2	25%	0.245	26%	0.26	C	S	.	.			trans	-108.1	105.6	-174.9	179.1	0	0	0	0	111.2	C1266 I1271 C1272 R1273	C1266-S1269 PolarHBondContact O-N 3.43Å; C1266-S1269 VanDerWaalsContact O-N 3.16Å; S1269-I1271 PolarHBondContact O-N 2.89Å; S1269-C1272 PolarHBondContact O-N 3.44Å; S1269-C1272 VanDerWaalsContact O-N 3.11Å; S1269-C1272 PolarHBondContact OG-N 2.83Å; S1269-R1273 PolarHBondContact O-N 2.91Å; S1269-R1273 VanDerWaalsContact O-N 3.1Å
1270	M	60.3	Low	74.4	Confident	88 Å²	88	47.3 Å²	47.3	43%	0.433	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-35.3	176.2	-167.2	99	154.1	0	0	112.2	K1141 N1274	K1141-M1270 HydrophobicContact CB-CE 4.14Å; K1141-M1270 HydrophobicContact CD-CE 3.56Å; K1141-M1270 HydrophobicContact CG-CE 4.07Å; M1270-N1274 VanDerWaalsContact O-CG 3.25Å; M1270-N1274 PolarHBondContact O-ND2 2.8Å; M1270-N1274 PolarHBondContact O-OD1 3.08Å
1271	I	62.6	Low	74	Confident	115 Å²	115	48 Å²	48	59%	0.59	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-43.4	179.9	-60.2	166.5	0	0	0	110.3	S1269 R1273 N1274 Q1321	S1269-I1271 PolarHBondContact O-N 2.89Å; I1271-R1273 VanDerWaalsContact C-N 3.35Å; I1271-R1273 PolarHBondContact O-N 3.24Å; I1271-N1274 PolarHBondContact O-N 3.38Å; I1271-Q1321 HydrophobicContact CG2-CG 4.4Å; I1271-Q1321 VanDerWaalsContact CG2-NE2 3.33Å
1272	C	64.5	Low	73.2	Confident	27 Å²	27	47.7 Å²	47.7	18%	0.182	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-64.5	-40.8	177.6	-175.5	0	0	0	0	111.8	C1266 S1269 N1274 D1275	C1266-C1272 HydrophobicContact CB-CB 3.55Å; C1266-C1272 WeakPolarHBondContact CB-SG 3.4Å; C1266-C1272 WeakPolarHBondContact SG-CB 3.42Å; C1266-C1272 CovalentContact SG-SG 2.01Å; C1266-C1272 PolarHBondContact SG-SG 3.47Å; S1269-C1272 PolarHBondContact O-N 3.44Å; S1269-C1272 VanDerWaalsContact O-N 3.11Å; S1269-C1272 PolarHBondContact OG-N 2.83Å; C1272-N1274 PolarHBondContact O-N 3.49Å; C1272-N1274 VanDerWaalsContact O-N 3.08Å; C1272-D1275 PolarHBondContact O-N 3.33Å
1273	R	68.8	Low	72.4	Confident	69 Å²	69	47.9 Å²	47.9	26%	0.26	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-68.7	-7	-176.4	-137.9	171.9	-172.7	171.8	0.5	114.8	D1260 S1269 I1271	D1260-R1273 IonicContact OD1-CZ 3.6Å; D1260-R1273 IonicContact OD1-NE 2.7Å; D1260-R1273 IonicContact OD1-NH2 2.84Å; D1260-R1273 PolarHBondContact OD1-NH2 2.77Å; D1260-R1273 IonicContact OD2-NH2 3.96Å; D1260-R1273 PolarHBondContact OD2-NH2 2.97Å; S1269-R1273 PolarHBondContact O-N 2.91Å; S1269-R1273 VanDerWaalsContact O-N 3.1Å; I1271-R1273 VanDerWaalsContact C-N 3.35Å; I1271-R1273 PolarHBondContact O-N 3.24Å
1274	N	69	Low	71.5	Confident	45 Å²	45	50.6 Å²	50.6	24%	0.241	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-86.4	-23.3	179.5	-72.9	-21	0	0	0	113.5	R1139 M1270 I1271 C1272	R1139-N1274 PolarHBondContact N-O 3.39Å; R1139-N1274 CarbonylContact O-C 3.57Å; R1139-N1274 WeakPolarHBondContact O-CA 3.16Å; R1139-N1274 WeakPolarHBondContact O-CB 3.36Å; R1139-N1274 PolarHBondContact O-OD1 3.17Å; M1270-N1274 VanDerWaalsContact O-CG 3.25Å; M1270-N1274 PolarHBondContact O-ND2 2.8Å; M1270-N1274 PolarHBondContact O-OD1 3.08Å; I1271-N1274 PolarHBondContact O-N 3.38Å; C1272-N1274 PolarHBondContact O-N 3.49Å; C1272-N1274 VanDerWaalsContact O-N 3.08Å
1275	D	69.9	Low	70.9	Confident	67 Å²	67	49.5 Å²	49.5	36%	0.358	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	100.3	177.4	-163.1	1.6	0	0	0	108.9	R1263 C1272 K1297	R1263-D1275 VanDerWaalsContact CZ-O 3.29Å; R1263-D1275 PolarHBondContact NH1-O 3.39Å; R1263-D1275 PolarHBondContact NH2-O 3.44Å; C1272-D1275 PolarHBondContact O-N 3.33Å; D1275-K1297 IonicContact OD1-NZ 3.4Å; D1275-K1297 PolarHBondContact OD1-NZ 3.05Å
1276	M	77.2	Confident	70	Confident	5 Å²	5	49.4 Å²	49.4	3%	0.025	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	137.8	-177	-59.8	-68	-78.9	0	0	110	G1137 W1252 I1255 D1259 R1263 I1278	G1137-M1276 WeakPolarHBondContact O-CB 3.37Å; G1137-M1276 WeakPolarHBondContact O-CG 3.43Å; W1252-M1276 HydrophobicContact CH2-CG 4.27Å; I1255-M1276 HydrophobicContact CG2-CE 3.81Å; D1259-M1276 HydrophobicContact CB-CE 3.24Å; D1259-M1276 HydrophobicContact CB-SD 4.1Å; D1259-M1276 VanDerWaalsContact OD2-SD 3.39Å; R1263-M1276 VanDerWaalsContact NH2-CA 3.33Å; M1276-I1278 PolarHBondContact O-N 3.42Å
1277	D	80.3	Confident	68.9	Low	16 Å²	16	54.9 Å²	54.9	9%	0.086	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	17.5	-178.8	-162.9	30.5	0	0	0	112.8	D1259 Q1296 K1297 S1298	D1259-D1277 PolarHBondContact OD1-N 3.44Å; D1277-Q1296 CarbonylContact O-C 3.46Å; D1277-Q1296 WeakPolarHBondContact O-CA 3.44Å; D1277-Q1296 WeakPolarHBondContact O-CG 3.47Å; D1277-Q1296 VanDerWaalsContact OD2-CG 3.25Å; D1277-Q1296 WeakPolarHBondContact OD2-CG 3.33Å; D1277-Q1296 PolarHBondContact OD2-NE2 3.08Å; D1277-K1297 PolarHBondContact O-N 2.92Å; D1277-K1297 WeakPolarHBondContact OD1-CB 3.15Å; D1277-S1298 VanDerWaalsContact CG-OG 3.31Å; D1277-S1298 VanDerWaalsContact OD1-CB 3.24Å; D1277-S1298 WeakPolarHBondContact OD1-CB 3.11Å; D1277-S1298 PolarHBondContact OD1-N 3.47Å; D1277-S1298 PolarHBondContact OD1-OG 3.46Å; D1277-S1298 WeakPolarHBondContact OD2-CB 3.41Å; D1277-S1298 PolarHBondContact OD2-OG 3.34Å
1278	I	85.5	Confident	68.6	Low	1 Å²	1	53.4 Å²	53.4	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	128.8	-172.5	-59.5	-175.7	0	0	0	110.1	I1255 L1258 D1259 L1262 M1276 W1294	I1255-I1278 HydrophobicContact CG2-CB 4.28Å; I1255-I1278 HydrophobicContact CG2-CG2 4.31Å; L1258-I1278 HydrophobicContact CB-CD1 3.18Å; L1258-I1278 HydrophobicContact CD1-CD1 4.3Å; L1258-I1278 HydrophobicContact CG-CD1 4.35Å; D1259-I1278 HydrophobicContact CB-CD1 3.82Å; D1259-I1278 HydrophobicContact CB-CG1 4.38Å; D1259-I1278 VanDerWaalsContact N-CD1 3.26Å; L1262-I1278 HydrophobicContact CD1-CD1 4.13Å; L1262-I1278 HydrophobicContact CD1-CG1 4.31Å; M1276-I1278 PolarHBondContact O-N 3.42Å; I1278-W1294 HydrophobicContact CG2-CB 4.31Å; I1278-W1294 HydrophobicContact CG2-CD2 4.36Å; I1278-W1294 HydrophobicContact CG2-CE3 3.91Å
1279	I	82.2	Confident	68.7	Low	4 Å²	4	50.2 Å²	50.2	2%	0.021	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	111.5	170.6	-66.8	151.7	0	0	0	108.3	G1135 E1136 L1222 L1281 W1294 A1295 K1297 L1300	G1135-I1279 CarbonylContact O-C 3.54Å; G1135-I1279 WeakPolarHBondContact O-CA 3.49Å; E1136-I1279 HydrophobicContact CG-CG1 3.91Å; L1222-I1279 HydrophobicContact CD1-CD1 3.46Å; L1222-I1279 VanDerWaalsContact CD1-CD1 3.46Å; L1222-I1279 HydrophobicContact CD1-CG1 4.31Å; L1222-I1279 HydrophobicContact CD2-CD1 3.79Å; L1222-I1279 HydrophobicContact CG-CD1 4.29Å; I1279-L1281 HydrophobicContact CG2-CD2 3.68Å; I1279-W1294 CarbonylContact O-C 3.44Å; I1279-W1294 WeakPolarHBondContact O-CA 3.37Å; I1279-W1294 WeakPolarHBondContact O-CB 3.48Å; I1279-A1295 PolarHBondContact N-O 3.01Å; I1279-A1295 PolarHBondContact O-N 3.03Å; I1279-K1297 HydrophobicContact CD1-CB 3.59Å; I1279-K1297 HydrophobicContact CD1-CD 4.44Å; I1279-K1297 HydrophobicContact CD1-CG 3.89Å; I1279-K1297 HydrophobicContact CG1-CB 4.06Å; I1279-K1297 HydrophobicContact CG1-CG 4.48Å; I1279-L1300 HydrophobicContact CD1-CD1 3.59Å
1280	L	80.8	Confident	68.9	Low	4 Å²	4	49 Å²	49	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	118.4	172.1	-173.6	66.9	0	0	0	109.6	G1135 I1184 I1186 I1255 L1283 V1292 W1294	G1135-L1280 WeakPolarHBondContact CA-O 3.39Å; G1135-L1280 PolarHBondContact O-N 2.76Å; I1184-L1280 HydrophobicContact CD1-CB 3.44Å; I1184-L1280 VanDerWaalsContact CD1-CB 3.44Å; I1184-L1280 HydrophobicContact CD1-CD2 3.86Å; I1184-L1280 HydrophobicContact CD1-CG 4.3Å; I1186-L1280 HydrophobicContact CD1-CD2 3.71Å; I1186-L1280 HydrophobicContact CG1-CD2 3.98Å; I1255-L1280 HydrophobicContact CD1-CD2 4.32Å; L1280-L1283 HydrophobicContact CD2-CB 4.44Å; L1280-L1283 HydrophobicContact CD2-CD1 4.24Å; L1280-V1292 HydrophobicContact CD1-CG1 3.49Å; L1280-V1292 VanDerWaalsContact CD1-CG1 3.49Å; L1280-W1294 HydrophobicContact CD1-CB 4.33Å
1281	L	76.1	Confident	69.6	Low	43 Å²	43	45.8 Å²	45.8	23%	0.225	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-52.5	-178.2	-59.6	-178.9	0	0	0	111.2	F1226 R1229 I1279 I1293 A1295	F1226-L1281 HydrophobicContact CD2-CD1 3.85Å; F1226-L1281 HydrophobicContact CD2-CD2 4.15Å; F1226-L1281 HydrophobicContact CE2-CD1 3.81Å; F1226-L1281 HydrophobicContact CE2-CD2 3.27Å; F1226-L1281 HydrophobicContact CE2-CG 4.19Å; F1226-L1281 HydrophobicContact CZ-CD2 3.83Å; R1229-L1281 HydrophobicContact CB-CD1 4.08Å; I1279-L1281 HydrophobicContact CG2-CD2 3.68Å; L1281-I1293 WeakPolarHBondContact CA-O 3.24Å; L1281-I1293 HydrophobicContact CB-CB 4.38Å; L1281-I1293 HydrophobicContact CB-CG2 4.25Å; L1281-I1293 WeakPolarHBondContact CB-O 3.25Å; L1281-I1293 HydrophobicContact CD1-CG2 4.12Å; L1281-I1293 PolarHBondContact N-O 3.48Å; L1281-A1295 HydrophobicContact CD1-CB 4.39Å
1282	T	70.2	Confident	70.5	Confident	37 Å²	37	40.3 Å²	40.3	23%	0.227	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	152.6	-180	61.9	0	0	0	0	111.3	I1293	T1282-I1293 PolarHBondContact N-O 3.27Å; T1282-I1293 VanDerWaalsContact N-O 3.12Å; T1282-I1293 PolarHBondContact O-N 2.79Å; T1282-I1293 VanDerWaalsContact OG1-CB 3.25Å; T1282-I1293 WeakPolarHBondContact OG1-CB 3.2Å; T1282-I1293 VanDerWaalsContact OG1-CD1 3.31Å; T1282-I1293 WeakPolarHBondContact OG1-CD1 3.38Å; T1282-I1293 WeakPolarHBondContact OG1-CG1 3.48Å
1283	L	68.8	Low	71.3	Confident	9 Å²	9	40.1 Å²	40.1	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	114.5	172.9	-163.4	162.8	0	0	0	109	I1186 R1251 L1254 L1280 Y1285 F1290 S1291 V1292	I1186-L1283 HydrophobicContact CD1-CB 4.39Å; R1251-L1283 HydrophobicContact CG-CD1 4.21Å; L1254-L1283 HydrophobicContact CD2-CD1 4.03Å; L1280-L1283 HydrophobicContact CD2-CB 4.44Å; L1280-L1283 HydrophobicContact CD2-CD1 4.24Å; L1283-Y1285 HydrophobicContact CD2-CD1 3.9Å; L1283-Y1285 HydrophobicContact CD2-CD2 4.19Å; L1283-Y1285 HydrophobicContact CD2-CE1 3.18Å; L1283-Y1285 HydrophobicContact CD2-CE2 3.57Å; L1283-Y1285 HydrophobicContact CD2-CG 4.37Å; L1283-Y1285 WeakPolarHBondContact CD2-OH 3.33Å; L1283-F1290 HydrophobicContact CD2-CD2 4.5Å; L1283-S1291 CarbonylContact C-O 3.53Å; L1283-S1291 WeakPolarHBondContact CA-O 3Å; L1283-V1292 HydrophobicContact CD1-CG2 4.2Å; L1283-V1292 HydrophobicContact CG-CG2 4.07Å
1284	N	65.7	Low	72.2	Confident	89 Å²	89	36.9 Å²	36.9	48%	0.476	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134	-172.7	-73.7	-22.9	0	0	0	110.7	F1290 S1291	N1284-F1290 CarbonylContact O-C 3.52Å; N1284-F1290 WeakPolarHBondContact O-CA 3.45Å; N1284-F1290 WeakPolarHBondContact O-CB 3.23Å; N1284-S1291 PolarHBondContact N-O 3.44Å; N1284-S1291 PolarHBondContact O-N 3.31Å
1285	Y	63.4	Low	73	Confident	49 Å²	49	34.7 Å²	34.7	19%	0.192	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	142.5	-176.1	-53.8	-82.1	0	0	0	111.3	P1064 W1242 G1244 G1245 H1246 L1283 F1290	P1064-Y1285 HydrophobicContact CB-CE2 4.43Å; P1064-Y1285 HydrophobicContact CG-CE2 4.1Å; W1242-Y1285 HydrophobicContact CZ3-CD1 4.27Å; W1242-Y1285 AromaticContact CZ3-CE1 3.96Å; W1242-Y1285 HydrophobicContact CZ3-CE1 3.96Å; G1244-Y1285 WeakPolarHBondContact O-CD1 3.42Å; G1244-Y1285 WeakPolarHBondContact O-CE1 3.43Å; G1245-Y1285 VanDerWaalsContact C-CE1 3.45Å; G1245-Y1285 VanDerWaalsContact C-CZ 3.46Å; G1245-Y1285 VanDerWaalsContact CA-CE1 3.46Å; G1245-Y1285 PolarHBondContact O-OH 2.82Å; H1246-Y1285 AromaticContact CE1-CD2 3.13Å; H1246-Y1285 WeakPolarHBondContact CE1-CD2 3.34Å; H1246-Y1285 AromaticContact CE1-CE2 3.4Å; H1246-Y1285 VanDerWaalsContact CE1-CE2 3.4Å; H1246-Y1285 WeakPolarHBondContact CE1-CE2 3.47Å; H1246-Y1285 AromaticContact CE1-CG 3.75Å; H1246-Y1285 AromaticContact ND1-CD2 3.51Å; H1246-Y1285 AromaticContact ND1-CE2 3.21Å; H1246-Y1285 WeakPolarHBondContact ND1-CE2 3.39Å; H1246-Y1285 AromaticContact ND1-CZ 3.81Å; H1246-Y1285 AromaticContact NE2-CD2 3.95Å; L1283-Y1285 HydrophobicContact CD2-CD1 3.9Å; L1283-Y1285 HydrophobicContact CD2-CD2 4.19Å; L1283-Y1285 HydrophobicContact CD2-CE1 3.18Å; L1283-Y1285 HydrophobicContact CD2-CE2 3.57Å; L1283-Y1285 HydrophobicContact CD2-CG 4.37Å; L1283-Y1285 WeakPolarHBondContact CD2-OH 3.33Å; Y1285-F1290 HydrophobicContact CD1-CB 3.92Å
1286	Q	56.8	Low	73.8	Confident	132 Å²	132	32.3 Å²	32.3	62%	0.617	19%	0.193	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.5	161	174.4	-64.3	-178.4	-17.4	0	0	109.4	S1288 G1289	Q1286-S1288 PolarHBondContact O-N 2.84Å; Q1286-S1288 VanDerWaalsContact O-N 3.15Å; Q1286-G1289 CarbonylContact C-O 3.58Å; Q1286-G1289 WeakPolarHBondContact CA-O 3.41Å; Q1286-G1289 PolarHBondContact N-O 3.44Å; Q1286-G1289 PolarHBondContact O-N 3.08Å
1287	A	49.2	Very low	74	Confident	119 Å²	119	32.6 Å²	32.6	98%	0.983	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.4	-176.9	0	0	0	0	0	113.7
1288	S	58.5	Low	74	Confident	88 Å²	88	33.5 Å²	33.5	62%	0.615	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-0.7	-178.6	54.9	0	0	0	0	114.8	A1236 Q1286	A1236-S1288 PolarHBondContact N-O 2.87Å; A1236-S1288 VanDerWaalsContact N-O 3.14Å; Q1286-S1288 PolarHBondContact O-N 2.84Å; Q1286-S1288 VanDerWaalsContact O-N 3.15Å
1289	G	65.7	Low	73.8	Confident	13 Å²	13	33.7 Å²	33.7	13%	0.134	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.3	-167.9	-170.1	0	0	0	0	0	114.5	F1234 Q1286	F1234-G1289 CarbonylContact O-C 3.55Å; F1234-G1289 WeakPolarHBondContact O-CA 3.48Å; Q1286-G1289 CarbonylContact C-O 3.58Å; Q1286-G1289 WeakPolarHBondContact CA-O 3.41Å; Q1286-G1289 PolarHBondContact N-O 3.44Å; Q1286-G1289 PolarHBondContact O-N 3.08Å
1290	F	70.5	Confident	73.4	Confident	9 Å²	9	33.8 Å²	33.8	4%	0.039	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	155.9	176.3	66	-80.6	0	0	0	111.9	F1234 W1242 L1254 L1283 N1284 Y1285 V1292 V1424	F1234-F1290 HydrophobicContact CB-CD1 3.67Å; F1234-F1290 HydrophobicContact CB-CD2 4.32Å; F1234-F1290 HydrophobicContact CB-CE1 3.24Å; F1234-F1290 HydrophobicContact CB-CE2 3.97Å; F1234-F1290 HydrophobicContact CB-CG 4.18Å; F1234-F1290 HydrophobicContact CB-CZ 3.4Å; F1234-F1290 VanDerWaalsContact CB-CZ 3.4Å; F1234-F1290 HydrophobicContact CD1-CE1 4.27Å; F1234-F1290 HydrophobicContact CD1-CE2 4.4Å; F1234-F1290 AromaticContact CD1-CZ 3.73Å; F1234-F1290 HydrophobicContact CD1-CZ 3.73Å; F1234-F1290 AromaticContact CD2-CD2 3.85Å; F1234-F1290 HydrophobicContact CD2-CD2 3.85Å; F1234-F1290 HydrophobicContact CD2-CE1 4.13Å; F1234-F1290 AromaticContact CD2-CE2 3.22Å; F1234-F1290 HydrophobicContact CD2-CE2 3.22Å; F1234-F1290 AromaticContact CD2-CZ 3.38Å; F1234-F1290 HydrophobicContact CD2-CZ 3.38Å; F1234-F1290 HydrophobicContact CE1-CZ 4.3Å; F1234-F1290 AromaticContact CE2-CE2 3.7Å; F1234-F1290 HydrophobicContact CE2-CE2 3.7Å; F1234-F1290 AromaticContact CE2-CZ 3.99Å; F1234-F1290 HydrophobicContact CE2-CZ 3.99Å; F1234-F1290 HydrophobicContact CG-CD1 4.38Å; F1234-F1290 HydrophobicContact CG-CD2 4.35Å; F1234-F1290 AromaticContact CG-CE1 3.66Å; F1234-F1290 HydrophobicContact CG-CE1 3.66Å; F1234-F1290 AromaticContact CG-CE2 3.63Å; F1234-F1290 HydrophobicContact CG-CE2 3.63Å; F1234-F1290 AromaticContact CG-CZ 3.22Å; F1234-F1290 HydrophobicContact CG-CZ 3.22Å; F1234-F1290 HydrophobicContact CZ-CE2 4.46Å; F1234-F1290 HydrophobicContact CZ-CZ 4.41Å; F1234-F1290 PolarHBondContact N-O 3.32Å; F1234-F1290 PolarHBondContact O-N 3.48Å; W1242-F1290 HydrophobicContact CD2-CD1 4Å; W1242-F1290 AromaticContact CD2-CE1 3.73Å; W1242-F1290 HydrophobicContact CD2-CE1 3.73Å; W1242-F1290 AromaticContact CE2-CE1 3.42Å; W1242-F1290 VanDerWaalsContact CE2-CE1 3.42Å; W1242-F1290 AromaticContact CE2-CZ 3.91Å; W1242-F1290 AromaticContact CE3-CD1 3.48Å; W1242-F1290 HydrophobicContact CE3-CD1 3.48Å; W1242-F1290 VanDerWaalsContact CE3-CD1 3.48Å; W1242-F1290 AromaticContact CE3-CE1 3.65Å; W1242-F1290 HydrophobicContact CE3-CE1 3.65Å; W1242-F1290 HydrophobicContact CE3-CG 4.22Å; W1242-F1290 HydrophobicContact CE3-CZ 4.5Å; W1242-F1290 AromaticContact CH2-CD1 3.45Å; W1242-F1290 HydrophobicContact CH2-CD1 3.45Å; W1242-F1290 VanDerWaalsContact CH2-CD1 3.45Å; W1242-F1290 AromaticContact CH2-CD2 3.77Å; W1242-F1290 HydrophobicContact CH2-CD2 3.77Å; W1242-F1290 AromaticContact CH2-CE1 3.1Å; W1242-F1290 HydrophobicContact CH2-CE1 3.1Å; W1242-F1290 AromaticContact CH2-CE2 3.45Å; W1242-F1290 HydrophobicContact CH2-CE2 3.45Å; W1242-F1290 VanDerWaalsContact CH2-CE2 3.45Å; W1242-F1290 AromaticContact CH2-CG 3.78Å; W1242-F1290 HydrophobicContact CH2-CG 3.78Å; W1242-F1290 AromaticContact CH2-CZ 3.1Å; W1242-F1290 HydrophobicContact CH2-CZ 3.1Å; W1242-F1290 AromaticContact CZ2-CD1 3.94Å; W1242-F1290 HydrophobicContact CZ2-CD1 3.94Å; W1242-F1290 AromaticContact CZ2-CE1 3.15Å; W1242-F1290 HydrophobicContact CZ2-CE1 3.15Å; W1242-F1290 AromaticContact CZ2-CE2 3.97Å; W1242-F1290 HydrophobicContact CZ2-CE2 3.97Å; W1242-F1290 AromaticContact CZ2-CZ 3.17Å; W1242-F1290 HydrophobicContact CZ2-CZ 3.17Å; W1242-F1290 HydrophobicContact CZ3-CB 4.21Å; W1242-F1290 AromaticContact CZ3-CD1 3.13Å; W1242-F1290 HydrophobicContact CZ3-CD1 3.13Å; W1242-F1290 AromaticContact CZ3-CD2 3.94Å; W1242-F1290 HydrophobicContact CZ3-CD2 3.94Å; W1242-F1290 AromaticContact CZ3-CE1 3.31Å; W1242-F1290 HydrophobicContact CZ3-CE1 3.31Å; W1242-F1290 HydrophobicContact CZ3-CE2 4.07Å; W1242-F1290 AromaticContact CZ3-CG 3.48Å; W1242-F1290 HydrophobicContact CZ3-CG 3.48Å; W1242-F1290 VanDerWaalsContact CZ3-CG 3.48Å; W1242-F1290 AromaticContact CZ3-CZ 3.79Å; W1242-F1290 HydrophobicContact CZ3-CZ 3.79Å; L1254-F1290 HydrophobicContact CD2-CE2 4.48Å; L1283-F1290 HydrophobicContact CD2-CD2 4.5Å; N1284-F1290 CarbonylContact O-C 3.52Å; N1284-F1290 WeakPolarHBondContact O-CA 3.45Å; N1284-F1290 WeakPolarHBondContact O-CB 3.23Å; Y1285-F1290 HydrophobicContact CD1-CB 3.92Å; F1290-V1292 HydrophobicContact CD2-CG2 3.61Å; F1290-V1292 HydrophobicContact CE2-CG2 3.55Å; F1290-V1424 HydrophobicContact CZ-CG1 4.36Å
1291	S	76.9	Confident	72.9	Confident	20 Å²	20	36.3 Å²	36.3	14%	0.14	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143.3	175.1	65.6	0	0	0	0	111.9	M1232 H1233 L1283 N1284	M1232-S1291 CarbonylContact O-C 3.56Å; M1232-S1291 VanDerWaalsContact O-CA 3.23Å; M1232-S1291 WeakPolarHBondContact O-CA 3.33Å; H1233-S1291 VanDerWaalsContact CD2-CB 3.43Å; H1233-S1291 WeakPolarHBondContact CD2-CB 3.32Å; L1283-S1291 CarbonylContact C-O 3.53Å; L1283-S1291 WeakPolarHBondContact CA-O 3Å; N1284-S1291 PolarHBondContact N-O 3.44Å; N1284-S1291 PolarHBondContact O-N 3.31Å
1292	V	80.5	Confident	72.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	135.4	-173.1	-175.7	0	0	0	0	108.5	V1231 M1232 F1234 L1254 L1280 L1283 F1290	V1231-V1292 CarbonylContact C-O 3.54Å; V1231-V1292 WeakPolarHBondContact CA-O 3.39Å; M1232-V1292 HydrophobicContact CB-CB 4.42Å; M1232-V1292 PolarHBondContact N-O 3.07Å; M1232-V1292 PolarHBondContact O-N 3.43Å; F1234-V1292 HydrophobicContact CD2-CG2 4.19Å; F1234-V1292 HydrophobicContact CE2-CG2 3.87Å; L1254-V1292 HydrophobicContact CD2-CB 4.33Å; L1254-V1292 HydrophobicContact CD2-CG1 3.8Å; L1254-V1292 HydrophobicContact CD2-CG2 3.56Å; L1280-V1292 HydrophobicContact CD1-CG1 3.49Å; L1280-V1292 VanDerWaalsContact CD1-CG1 3.49Å; L1283-V1292 HydrophobicContact CD1-CG2 4.2Å; L1283-V1292 HydrophobicContact CG-CG2 4.07Å; F1290-V1292 HydrophobicContact CD2-CG2 3.61Å; F1290-V1292 HydrophobicContact CE2-CG2 3.55Å
1293	I	81.1	Confident	71.7	Confident	24 Å²	24	39.7 Å²	39.7	12%	0.123	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.4	168.7	-49.4	-176.8	0	0	0	108.9	R1229 V1230 V1231 L1281 T1282	R1229-I1293 HydrophobicContact CB-CG2 4.13Å; R1229-I1293 HydrophobicContact CG-CG2 4.26Å; V1230-I1293 CarbonylContact O-C 3.48Å; V1230-I1293 VanDerWaalsContact O-CA 3.25Å; V1230-I1293 WeakPolarHBondContact O-CA 3.47Å; V1231-I1293 HydrophobicContact CG1-CG1 4.25Å; V1231-I1293 HydrophobicContact CG2-CD1 4.26Å; V1231-I1293 HydrophobicContact CG2-CG1 4.09Å; V1231-I1293 HydrophobicContact CG2-CG2 4.26Å; L1281-I1293 WeakPolarHBondContact CA-O 3.24Å; L1281-I1293 HydrophobicContact CB-CB 4.38Å; L1281-I1293 HydrophobicContact CB-CG2 4.25Å; L1281-I1293 WeakPolarHBondContact CB-O 3.25Å; L1281-I1293 HydrophobicContact CD1-CG2 4.12Å; L1281-I1293 PolarHBondContact N-O 3.48Å; T1282-I1293 PolarHBondContact N-O 3.27Å; T1282-I1293 VanDerWaalsContact N-O 3.12Å; T1282-I1293 PolarHBondContact O-N 2.79Å; T1282-I1293 VanDerWaalsContact OG1-CB 3.25Å; T1282-I1293 WeakPolarHBondContact OG1-CB 3.2Å; T1282-I1293 VanDerWaalsContact OG1-CD1 3.31Å; T1282-I1293 WeakPolarHBondContact OG1-CD1 3.38Å; T1282-I1293 WeakPolarHBondContact OG1-CG1 3.48Å
1294	W	88.3	Confident	70.7	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	169	-179.7	66.7	-84.5	0	0	0	112.1	R1229 V1230 M1232 L1258 L1262 I1278 I1279 L1280 Q1296 L1396 L1400	R1229-W1294 CarbonylContact C-O 3.54Å; V1230-W1294 HydrophobicContact CB-CD2 4.14Å; V1230-W1294 HydrophobicContact CB-CG 4.42Å; V1230-W1294 HydrophobicContact CB-CZ2 3.95Å; V1230-W1294 HydrophobicContact CG1-CZ2 3.92Å; V1230-W1294 HydrophobicContact CG2-CD2 4.44Å; V1230-W1294 HydrophobicContact CG2-CH2 4.16Å; V1230-W1294 HydrophobicContact CG2-CZ2 3.93Å; V1230-W1294 PolarHBondContact N-O 2.77Å; V1230-W1294 PolarHBondContact O-N 3.15Å; M1232-W1294 HydrophobicContact CE-CZ2 3.71Å; L1258-W1294 HydrophobicContact CD1-CD2 4.3Å; L1258-W1294 HydrophobicContact CD1-CG 4.33Å; L1258-W1294 HydrophobicContact CD2-CZ2 4.2Å; L1262-W1294 HydrophobicContact CD1-CH2 3.49Å; L1262-W1294 VanDerWaalsContact CD1-CH2 3.49Å; L1262-W1294 HydrophobicContact CD1-CZ3 3.71Å; I1278-W1294 HydrophobicContact CG2-CB 4.31Å; I1278-W1294 HydrophobicContact CG2-CD2 4.36Å; I1278-W1294 HydrophobicContact CG2-CE3 3.91Å; I1279-W1294 CarbonylContact O-C 3.44Å; I1279-W1294 WeakPolarHBondContact O-CA 3.37Å; I1279-W1294 WeakPolarHBondContact O-CB 3.48Å; L1280-W1294 HydrophobicContact CD1-CB 4.33Å; W1294-Q1296 HydrophobicContact CZ3-CB 4.23Å; W1294-L1396 HydrophobicContact CH2-CD1 4.31Å; W1294-L1400 HydrophobicContact CH2-CD1 3.79Å; W1294-L1400 HydrophobicContact CZ2-CD1 3.63Å; W1294-L1400 HydrophobicContact CZ2-CD2 4.32Å
1295	A	86.1	Confident	69.4	Low	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	153.4	174.9	0	0	0	0	0	111	I1279 L1281 L1300	I1279-A1295 PolarHBondContact N-O 3.01Å; I1279-A1295 PolarHBondContact O-N 3.03Å; L1281-A1295 HydrophobicContact CD1-CB 4.39Å; A1295-L1300 HydrophobicContact CB-CD1 3.84Å
1296	Q	86.5	Confident	68.3	Low	17 Å²	17	48 Å²	48	8%	0.079	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	120.9	178	-168	176.6	-3.9	0	0	110.9	H1228 D1277 W1294 S1298 I1299 L1300 L1396	H1228-Q1296 PolarHBondContact NE2-N 2.83Å; D1277-Q1296 CarbonylContact O-C 3.46Å; D1277-Q1296 WeakPolarHBondContact O-CA 3.44Å; D1277-Q1296 WeakPolarHBondContact O-CG 3.47Å; D1277-Q1296 VanDerWaalsContact OD2-CG 3.25Å; D1277-Q1296 WeakPolarHBondContact OD2-CG 3.33Å; D1277-Q1296 PolarHBondContact OD2-NE2 3.08Å; W1294-Q1296 HydrophobicContact CZ3-CB 4.23Å; Q1296-S1298 PolarHBondContact NE2-OG 3.13Å; Q1296-S1298 PolarHBondContact O-N 2.91Å; Q1296-I1299 HydrophobicContact CB-CB 4.46Å; Q1296-I1299 HydrophobicContact CB-CD1 4.18Å; Q1296-I1299 HydrophobicContact CB-CG1 4.3Å; Q1296-I1299 HydrophobicContact CG-CD1 4.38Å; Q1296-I1299 HydrophobicContact CG-CG1 4.3Å; Q1296-I1299 PolarHBondContact O-N 3.47Å; Q1296-L1300 WeakPolarHBondContact O-CG 3.43Å; Q1296-L1300 PolarHBondContact O-N 3.01Å; Q1296-L1396 HydrophobicContact CB-CD2 4.28Å
1297	K	80.4	Confident	67.2	Low	10 Å²	10	49 Å²	49	4%	0.043	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-45.2	-172.1	178.8	174.3	172.4	-175.2	0	112.9	E1136 L1222 D1275 D1277 I1279 I1299 L1300 I1301	E1136-K1297 IonicContact OE1-NZ 2.66Å; E1136-K1297 IonicContact OE2-NZ 3.38Å; E1136-K1297 PolarHBondContact OE2-NZ 3.35Å; L1222-K1297 HydrophobicContact CD2-CG 4.32Å; D1275-K1297 IonicContact OD1-NZ 3.4Å; D1275-K1297 PolarHBondContact OD1-NZ 3.05Å; D1277-K1297 PolarHBondContact O-N 2.92Å; D1277-K1297 WeakPolarHBondContact OD1-CB 3.15Å; I1279-K1297 HydrophobicContact CD1-CB 3.59Å; I1279-K1297 HydrophobicContact CD1-CD 4.44Å; I1279-K1297 HydrophobicContact CD1-CG 3.89Å; I1279-K1297 HydrophobicContact CG1-CB 4.06Å; I1279-K1297 HydrophobicContact CG1-CG 4.48Å; K1297-I1299 VanDerWaalsContact C-N 3.33Å; K1297-I1299 PolarHBondContact O-N 3.23Å; K1297-L1300 WeakPolarHBondContact O-CB 3.08Å; K1297-L1300 PolarHBondContact O-N 2.78Å; K1297-I1301 HydrophobicContact CG-CD1 4.04Å; K1297-I1301 WeakPolarHBondContact O-CG1 3.45Å; K1297-I1301 PolarHBondContact O-N 3.08Å
1298	S	80	Confident	66.5	Low	36 Å²	36	49.1 Å²	49.1	25%	0.252	27%	0.272	S	S	.	.	H	α-helix	trans	-59.3	-42.5	179.4	55.3	0	0	0	0	112.6	D1277 Q1296 L1300 I1301 L1302	D1277-S1298 VanDerWaalsContact CG-OG 3.31Å; D1277-S1298 VanDerWaalsContact OD1-CB 3.24Å; D1277-S1298 WeakPolarHBondContact OD1-CB 3.11Å; D1277-S1298 PolarHBondContact OD1-N 3.47Å; D1277-S1298 PolarHBondContact OD1-OG 3.46Å; D1277-S1298 WeakPolarHBondContact OD2-CB 3.41Å; D1277-S1298 PolarHBondContact OD2-OG 3.34Å; Q1296-S1298 PolarHBondContact NE2-OG 3.13Å; Q1296-S1298 PolarHBondContact O-N 2.91Å; S1298-L1300 VanDerWaalsContact C-N 3.32Å; S1298-L1300 PolarHBondContact O-N 3.36Å; S1298-I1301 PolarHBondContact O-N 3.23Å; S1298-L1302 WeakPolarHBondContact O-CG 3.48Å; S1298-L1302 PolarHBondContact O-N 3.05Å
1299	I	81.1	Confident	65.5	Low	4 Å²	4	52.9 Å²	52.9	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-68.2	-33.7	179.2	-61.1	-178.2	0	0	0	111.2	N1227 Q1296 K1297 I1301 P1389 E1392 I1393 L1396	N1227-I1299 PolarHBondContact ND2-O 3.08Å; Q1296-I1299 HydrophobicContact CB-CB 4.46Å; Q1296-I1299 HydrophobicContact CB-CD1 4.18Å; Q1296-I1299 HydrophobicContact CB-CG1 4.3Å; Q1296-I1299 HydrophobicContact CG-CD1 4.38Å; Q1296-I1299 HydrophobicContact CG-CG1 4.3Å; Q1296-I1299 PolarHBondContact O-N 3.47Å; K1297-I1299 VanDerWaalsContact C-N 3.33Å; K1297-I1299 PolarHBondContact O-N 3.23Å; I1299-I1301 VanDerWaalsContact C-N 3.29Å; I1299-I1301 PolarHBondContact O-N 2.97Å; I1299-P1389 HydrophobicContact CG2-CG 4.32Å; I1299-E1392 HydrophobicContact CD1-CB 4.32Å; I1299-E1392 HydrophobicContact CG1-CB 4.13Å; I1299-I1393 HydrophobicContact CG2-CD1 4.47Å; I1299-I1393 HydrophobicContact CG2-CG1 3.67Å; I1299-L1396 HydrophobicContact CD1-CB 3.77Å; I1299-L1396 HydrophobicContact CD1-CD2 3.9Å; I1299-L1396 HydrophobicContact CD1-CG 4.36Å
1300	L	75.3	Confident	64	Low	7 Å²	7	61.1 Å²	61.1	4%	0.037	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-27.4	178.1	-67.7	167.9	0	0	0	113.4	L1222 P1223 F1226 N1227 I1279 A1295 Q1296 K1297 S1298	L1222-L1300 HydrophobicContact CD2-CB 4.06Å; L1222-L1300 HydrophobicContact CD2-CD1 4.24Å; P1223-L1300 WeakPolarHBondContact CD-O 3.49Å; P1223-L1300 HydrophobicContact CG-CB 4.43Å; P1223-L1300 WeakPolarHBondContact CG-O 3.45Å; F1226-L1300 HydrophobicContact CB-CD2 3.53Å; F1226-L1300 HydrophobicContact CD1-CD1 3.93Å; F1226-L1300 HydrophobicContact CD1-CD2 3.65Å; F1226-L1300 HydrophobicContact CD1-CG 4.4Å; F1226-L1300 HydrophobicContact CE1-CD1 4.17Å; F1226-L1300 HydrophobicContact CG-CD1 4.43Å; F1226-L1300 HydrophobicContact CG-CD2 3.82Å; N1227-L1300 WeakPolarHBondContact OD1-CD2 3.46Å; I1279-L1300 HydrophobicContact CD1-CD1 3.59Å; A1295-L1300 HydrophobicContact CB-CD1 3.84Å; Q1296-L1300 WeakPolarHBondContact O-CG 3.43Å; Q1296-L1300 PolarHBondContact O-N 3.01Å; K1297-L1300 WeakPolarHBondContact O-CB 3.08Å; K1297-L1300 PolarHBondContact O-N 2.78Å; S1298-L1300 VanDerWaalsContact C-N 3.32Å; S1298-L1300 PolarHBondContact O-N 3.36Å
1301	I	69.2	Low	62.2	Low	56 Å²	56	62.8 Å²	62.8	29%	0.287	33%	0.328	S	S	.	.	H	α-helix	trans	-90.7	-23.5	-174.4	-62	165.9	0	0	0	112.1	L1222 K1297 S1298 I1299 T1303 W1324	L1222-I1301 HydrophobicContact CD2-CD1 4.32Å; L1222-I1301 HydrophobicContact CD2-CG1 4.01Å; K1297-I1301 HydrophobicContact CG-CD1 4.04Å; K1297-I1301 WeakPolarHBondContact O-CG1 3.45Å; K1297-I1301 PolarHBondContact O-N 3.08Å; S1298-I1301 PolarHBondContact O-N 3.23Å; I1299-I1301 VanDerWaalsContact C-N 3.29Å; I1299-I1301 PolarHBondContact O-N 2.97Å; I1301-T1303 PolarHBondContact O-N 3.23Å; I1301-W1324 HydrophobicContact CD1-CH2 4.1Å
1302	L	66.1	Low	60.3	Low	82 Å²	82	68.6 Å²	68.6	43%	0.429	36%	0.363	S	S	.	.			trans	-62.4	126.9	-176.1	-75.9	168	0	0	0	112.3	S1298 P1389 E1392	S1298-L1302 WeakPolarHBondContact O-CG 3.48Å; S1298-L1302 PolarHBondContact O-N 3.05Å; L1302-P1389 HydrophobicContact CB-CB 3.93Å; L1302-P1389 HydrophobicContact CB-CG 4.31Å; L1302-E1392 HydrophobicContact CD1-CB 4.22Å; L1302-E1392 HydrophobicContact CD1-CG 3.64Å
1303	T	55.3	Low	58.1	Low	70 Å²	70	76.5 Å²	76.5	43%	0.429	40%	0.4	S	S	.	.			trans	-120.8	120.1	173.8	64.8	0	0	0	0	108.5	I1301 N1305 T1385	I1301-T1303 PolarHBondContact O-N 3.23Å; T1303-N1305 PolarHBondContact O-N 2.89Å; T1303-T1385 HydrophobicContact CG2-CG2 3.31Å
1304	E	48.5	Very low	55.8	Low	103 Å²	103	80 Å²	80	48%	0.481	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-1.8	-171.2	-98.7	-172.3	165.9	0	0	115.3	I1306 N1387	E1304-I1306 PolarHBondContact O-N 3.44Å; E1304-I1306 VanDerWaalsContact O-N 3.12Å; E1304-N1387 HydrophobicContact CB-CB 4.09Å
1305	N	38.3	Very low	53.2	Low	103 Å²	103	87.7 Å²	87.7	55%	0.551	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	15.8	-177.2	-86.6	-4.5	0	0	0	115.4	T1303 N1307	T1303-N1305 PolarHBondContact O-N 2.89Å; N1305-N1307 PolarHBondContact O-N 3.08Å; N1305-N1307 VanDerWaalsContact O-N 3.09Å
1306	I	39.7	Very low	50.9	Low	115 Å²	115	93.1 Å²	93.1	59%	0.59	49%	0.487	S	S	*	.	S	Bend	trans	-81.2	91.1	167.8	-55.4	177.3	0	0	0	107.5	E1304 L1308 T1311	E1304-I1306 PolarHBondContact O-N 3.44Å; E1304-I1306 VanDerWaalsContact O-N 3.12Å; I1306-L1308 PolarHBondContact O-N 3.21Å; I1306-T1311 HydrophobicContact CG2-CG2 4.45Å
1307	N	34.9	Very low	48.7	Very low	154 Å²	154	96.5 Å²	96.5	82%	0.824	51%	0.512	S	S	*	.			trans	-38.7	106.3	175.7	-88.9	-28	0	0	0	111.7	N1305 N1309	N1305-N1307 PolarHBondContact O-N 3.08Å; N1305-N1307 VanDerWaalsContact O-N 3.09Å; N1307-N1309 PolarHBondContact O-N 3.35Å
1308	L	33.4	Very low	46.6	Very low	121 Å²	121	103.6 Å²	103.6	63%	0.634	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	39.8	-160.6	-148.5	86.2	0	0	0	114	I1306 T1311	I1306-L1308 PolarHBondContact O-N 3.21Å; L1308-T1311 WeakPolarHBondContact CA-OG1 3.46Å; L1308-T1311 VanDerWaalsContact CD1-OG1 3.25Å; L1308-T1311 WeakPolarHBondContact CD1-OG1 3.13Å; L1308-T1311 WeakPolarHBondContact CG-OG1 3.36Å
1309	N	37.4	Very low	44.7	Very low	166 Å²	166	104.2 Å²	104.2	89%	0.888	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	4.2	173.1	-84.3	6.5	0	0	0	113.8	N1307	N1307-N1309 PolarHBondContact O-N 3.35Å
1310	K	35.4	Very low	42.6	Very low	187 Å²	187	109.4 Å²	109.4	81%	0.813	57%	0.567	S	S	*	*	S	Bend	trans	-126.5	8.3	173.6	-100.5	-173.9	175.2	-173.7	0	114.8
1311	T	32.1	Very low	40.8	Very low	43 Å²	43	112.2 Å²	112.2	26%	0.264	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-98.8	12.9	-169.9	27.2	0	0	0	0	115.2	I1306 L1308 E1313 I1314	I1306-T1311 HydrophobicContact CG2-CG2 4.45Å; L1308-T1311 WeakPolarHBondContact CA-OG1 3.46Å; L1308-T1311 VanDerWaalsContact CD1-OG1 3.25Å; L1308-T1311 WeakPolarHBondContact CD1-OG1 3.13Å; L1308-T1311 WeakPolarHBondContact CG-OG1 3.36Å; T1311-E1313 PolarHBondContact O-N 2.61Å; T1311-I1314 HydrophobicContact CG2-CD1 3.87Å; T1311-I1314 HydrophobicContact CG2-CG1 4.25Å
1312	T	36.1	Very low	39.6	Very low	142 Å²	142	114.2 Å²	114.2	87%	0.871	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-72.3	-9.3	162.4	40.6	0	0	0	0	113.1
1313	E	34.6	Very low	38.4	Very low	167 Å²	167	117.1 Å²	117.1	78%	0.78	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-100	-0.9	175	-79.7	-177.6	162.3	0	0	115.1	T1311	T1311-E1313 PolarHBondContact O-N 2.61Å
1314	I	33.1	Very low	37.6	Very low	97 Å²	97	117.5 Å²	117.5	50%	0.497	59%	0.587	S	S	.	*			trans	-100.5	24.9	-179.7	-46.2	-174.2	0	0	0	111.9	T1311	T1311-I1314 HydrophobicContact CG2-CD1 3.87Å; T1311-I1314 HydrophobicContact CG2-CG1 4.25Å
1315	L	34.3	Very low	37.3	Very low	161 Å²	161	115 Å²	115	84%	0.843	58%	0.581	S	S	*	*			trans	-101.4	19	174.4	-150.6	77.8	0	0	0	113.6
1316	D	36.3	Very low	37.4	Very low	114 Å²	114	115.9 Å²	115.9	61%	0.61	58%	0.582	S	S	*	*			trans	-99.1	120.2	166.4	-85.7	-15.4	0	0	0	109.8	Y1318 T1319	D1316-Y1318 PolarHBondContact O-N 2.78Å; D1316-T1319 HydrophobicContact CB-CG2 4.48Å; D1316-T1319 PolarHBondContact O-N 3.02Å; D1316-T1319 PolarHBondContact O-OG1 2.74Å
1317	S	40.5	Very low	37.3	Very low	88 Å²	88	113.1 Å²	113.1	62%	0.615	56%	0.564	S	S	*	*	H	α-helix	trans	-51.7	-25.2	178.3	60.8	0	0	0	0	113.1	Q1321	S1317-Q1321 PolarHBondContact O-N 3.11Å; S1317-Q1321 VanDerWaalsContact O-N 3.16Å
1318	Y	37.3	Very low	37.5	Very low	159 Å²	159	108.4 Å²	108.4	62%	0.624	54%	0.543	S	S	*	.	H	α-helix	trans	-64.3	-41.3	174.9	-159	-92.2	0	0	0	112.6	D1316 Q1321 E1322	D1316-Y1318 PolarHBondContact O-N 2.78Å; Y1318-Q1321 PolarHBondContact O-N 2.8Å; Y1318-E1322 HydrophobicContact CD1-CG 4.39Å; Y1318-E1322 HydrophobicContact CE1-CG 4.14Å; Y1318-E1322 PolarHBondContact O-N 2.88Å
1319	T	39.7	Very low	38	Very low	50 Å²	50	109.3 Å²	109.3	31%	0.307	54%	0.542	S	S	.	.	H	α-helix	trans	-69.9	-35.2	-179.8	60.5	0	0	0	0	112.5	D1316 Y1323	D1316-T1319 HydrophobicContact CB-CG2 4.48Å; D1316-T1319 PolarHBondContact O-N 3.02Å; D1316-T1319 PolarHBondContact O-OG1 2.74Å; T1319-Y1323 WeakPolarHBondContact O-CB 3.5Å; T1319-Y1323 PolarHBondContact O-N 3.03Å
1320	Q	36.9	Very low	38.1	Very low	112 Å²	112	106 Å²	106	52%	0.523	53%	0.525	S	S	.	.	H	α-helix	trans	-63.8	-43.3	170.8	-74.8	-170.5	-16	0	0	110.9	Y1323 W1324	Q1320-Y1323 WeakPolarHBondContact O-CB 3.41Å; Q1320-Y1323 PolarHBondContact O-N 3.22Å; Q1320-W1324 PolarHBondContact O-N 3.26Å
1321	Q	38.6	Very low	38	Very low	67 Å²	67	99 Å²	99	31%	0.313	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-39.8	178.8	-166.3	171.2	-17.9	0	0	112.2	I1271 S1317 Y1318 W1324 S1325	I1271-Q1321 HydrophobicContact CG2-CG 4.4Å; I1271-Q1321 VanDerWaalsContact CG2-NE2 3.33Å; S1317-Q1321 PolarHBondContact O-N 3.11Å; S1317-Q1321 VanDerWaalsContact O-N 3.16Å; Y1318-Q1321 PolarHBondContact O-N 2.8Å; Q1321-W1324 PolarHBondContact O-N 2.87Å; Q1321-S1325 VanDerWaalsContact O-CB 3.31Å; Q1321-S1325 WeakPolarHBondContact O-CB 3.45Å; Q1321-S1325 PolarHBondContact O-N 3.08Å
1322	E	43.4	Very low	38.1	Very low	97 Å²	97	101.2 Å²	101.2	45%	0.453	50%	0.503	S	S	.	.	H	α-helix	trans	-61.9	-47.8	171.4	-92.6	-171.9	155.9	0	0	111.5	Y1318 W1324 S1325 Q1326	Y1318-E1322 HydrophobicContact CD1-CG 4.39Å; Y1318-E1322 HydrophobicContact CE1-CG 4.14Å; Y1318-E1322 PolarHBondContact O-N 2.88Å; E1322-W1324 VanDerWaalsContact C-N 3.35Å; E1322-W1324 PolarHBondContact O-N 3.11Å; E1322-S1325 PolarHBondContact O-N 3.06Å; E1322-S1325 VanDerWaalsContact O-N 3.16Å; E1322-S1325 PolarHBondContact O-OG 3.33Å; E1322-Q1326 VanDerWaalsContact O-CB 3.27Å; E1322-Q1326 WeakPolarHBondContact O-CB 3.35Å; E1322-Q1326 PolarHBondContact O-N 3.27Å
1323	Y	41.1	Very low	38.1	Very low	143 Å²	143	100.5 Å²	100.5	56%	0.561	49%	0.489	S	S	*	.	H	α-helix	trans	-54	-49.8	175.5	177.1	-94.1	0	0	0	111.4	T1319 Q1320 Q1326 W1327	T1319-Y1323 WeakPolarHBondContact O-CB 3.5Å; T1319-Y1323 PolarHBondContact O-N 3.03Å; Q1320-Y1323 WeakPolarHBondContact O-CB 3.41Å; Q1320-Y1323 PolarHBondContact O-N 3.22Å; Y1323-Q1326 PolarHBondContact O-N 2.89Å; Y1323-W1327 WeakPolarHBondContact O-CB 3.42Å; Y1323-W1327 PolarHBondContact O-N 2.78Å
1324	W	37.4	Very low	37.9	Very low	78 Å²	78	97.1 Å²	97.1	30%	0.295	48%	0.48	S	S	.	.	H	α-helix	trans	-66.5	-36.7	178.2	-72.8	116.2	0	0	0	113.1	I1301 Q1320 Q1321 E1322 W1327 S1328	I1301-W1324 HydrophobicContact CD1-CH2 4.1Å; Q1320-W1324 PolarHBondContact O-N 3.26Å; Q1321-W1324 PolarHBondContact O-N 2.87Å; E1322-W1324 VanDerWaalsContact C-N 3.35Å; E1322-W1324 PolarHBondContact O-N 3.11Å; W1324-W1327 HydrophobicContact CE3-CD2 4.14Å; W1324-W1327 AromaticContact CE3-CE3 3.76Å; W1324-W1327 HydrophobicContact CE3-CE3 3.76Å; W1324-W1327 HydrophobicContact CE3-CZ3 4.02Å; W1324-W1327 HydrophobicContact CZ3-CD2 4.14Å; W1324-W1327 AromaticContact CZ3-CE3 3.9Å; W1324-W1327 HydrophobicContact CZ3-CE3 3.9Å; W1324-W1327 AromaticContact CZ3-CH2 3.87Å; W1324-W1327 HydrophobicContact CZ3-CH2 3.87Å; W1324-W1327 HydrophobicContact CZ3-CZ2 4.04Å; W1324-W1327 AromaticContact CZ3-CZ3 3.8Å; W1324-W1327 HydrophobicContact CZ3-CZ3 3.8Å; W1324-S1328 WeakPolarHBondContact O-CB 3.22Å; W1324-S1328 PolarHBondContact O-N 3.49Å; W1324-S1328 PolarHBondContact O-OG 3.42Å
1325	S	42.7	Very low	37.8	Very low	50 Å²	50	95.5 Å²	95.5	35%	0.35	48%	0.475	S	S	.	.	H	α-helix	trans	-67.4	-38.9	175.9	82.6	0	0	0	0	112.2	Q1321 E1322 S1328 K1329	Q1321-S1325 VanDerWaalsContact O-CB 3.31Å; Q1321-S1325 WeakPolarHBondContact O-CB 3.45Å; Q1321-S1325 PolarHBondContact O-N 3.08Å; E1322-S1325 PolarHBondContact O-N 3.06Å; E1322-S1325 VanDerWaalsContact O-N 3.16Å; E1322-S1325 PolarHBondContact O-OG 3.33Å; S1325-S1328 PolarHBondContact O-OG 3.42Å; S1325-K1329 WeakPolarHBondContact O-CB 3.39Å; S1325-K1329 VanDerWaalsContact O-CG 3.29Å; S1325-K1329 WeakPolarHBondContact O-CG 3.28Å; S1325-K1329 PolarHBondContact O-N 3.13Å; S1325-K1329 VanDerWaalsContact O-N 3.16Å
1326	Q	41.4	Very low	37.7	Very low	123 Å²	123	95 Å²	95	58%	0.575	47%	0.466	S	S	*	.	H	α-helix	trans	-77.1	-34.5	-179.7	-153.7	159	13.8	0	0	110.4	E1322 Y1323 N1330	E1322-Q1326 VanDerWaalsContact O-CB 3.27Å; E1322-Q1326 WeakPolarHBondContact O-CB 3.35Å; E1322-Q1326 PolarHBondContact O-N 3.27Å; Y1323-Q1326 PolarHBondContact O-N 2.89Å; Q1326-N1330 WeakPolarHBondContact O-CB 3.38Å; Q1326-N1330 PolarHBondContact O-N 3.46Å; Q1326-N1330 PolarHBondContact O-ND2 3.49Å
1327	W	37.6	Very low	37.4	Very low	56 Å²	56	100 Å²	100	21%	0.212	48%	0.476	C	S	.	.	H	α-helix	trans	-67	-47.2	173.3	-177.3	93.6	0	0	0	112.6	Y1323 W1324 K1329 N1330 I1331	Y1323-W1327 WeakPolarHBondContact O-CB 3.42Å; Y1323-W1327 PolarHBondContact O-N 2.78Å; W1324-W1327 HydrophobicContact CE3-CD2 4.14Å; W1324-W1327 AromaticContact CE3-CE3 3.76Å; W1324-W1327 HydrophobicContact CE3-CE3 3.76Å; W1324-W1327 HydrophobicContact CE3-CZ3 4.02Å; W1324-W1327 HydrophobicContact CZ3-CD2 4.14Å; W1324-W1327 AromaticContact CZ3-CE3 3.9Å; W1324-W1327 HydrophobicContact CZ3-CE3 3.9Å; W1324-W1327 AromaticContact CZ3-CH2 3.87Å; W1324-W1327 HydrophobicContact CZ3-CH2 3.87Å; W1324-W1327 HydrophobicContact CZ3-CZ2 4.04Å; W1324-W1327 AromaticContact CZ3-CZ3 3.8Å; W1324-W1327 HydrophobicContact CZ3-CZ3 3.8Å; W1327-K1329 VanDerWaalsContact C-N 3.33Å; W1327-K1329 PolarHBondContact O-N 3.29Å; W1327-N1330 PolarHBondContact O-N 3.37Å; W1327-N1330 VanDerWaalsContact O-N 3.16Å; W1327-I1331 HydrophobicContact CD2-CD1 3.57Å; W1327-I1331 HydrophobicContact CD2-CG1 4.42Å; W1327-I1331 HydrophobicContact CE3-CD1 3.51Å; W1327-I1331 HydrophobicContact CG-CD1 4.48Å; W1327-I1331 HydrophobicContact CH2-CD1 3.45Å; W1327-I1331 VanDerWaalsContact CH2-CD1 3.45Å; W1327-I1331 HydrophobicContact CZ2-CD1 3.56Å; W1327-I1331 HydrophobicContact CZ3-CD1 3.42Å; W1327-I1331 VanDerWaalsContact CZ3-CD1 3.42Å; W1327-I1331 WeakPolarHBondContact O-CG1 3.44Å; W1327-I1331 PolarHBondContact O-N 2.91Å
1328	S	38.6	Very low	36.9	Very low	55 Å²	55	99.7 Å²	99.7	39%	0.385	47%	0.474	S	S	.	.	H	α-helix	trans	-62.7	-38.6	176	59.6	0	0	0	0	112.3	W1324 S1325 H1332	W1324-S1328 WeakPolarHBondContact O-CB 3.22Å; W1324-S1328 PolarHBondContact O-N 3.49Å; W1324-S1328 PolarHBondContact O-OG 3.42Å; S1325-S1328 PolarHBondContact O-OG 3.42Å; S1328-H1332 PolarHBondContact O-N 2.89Å; S1328-H1332 VanDerWaalsContact O-N 3.12Å; S1328-H1332 PolarHBondContact O-ND1 3.25Å
1329	K	42.6	Very low	36.4	Very low	141 Å²	141	98.2 Å²	98.2	61%	0.613	48%	0.476	S	S	*	.	H	α-helix	trans	-61.6	-44.5	170.6	-77.7	176.2	-179.2	175.4	0	112.4	S1325 W1327 H1332 H1333	S1325-K1329 WeakPolarHBondContact O-CB 3.39Å; S1325-K1329 VanDerWaalsContact O-CG 3.29Å; S1325-K1329 WeakPolarHBondContact O-CG 3.28Å; S1325-K1329 PolarHBondContact O-N 3.13Å; S1325-K1329 VanDerWaalsContact O-N 3.16Å; W1327-K1329 VanDerWaalsContact C-N 3.33Å; W1327-K1329 PolarHBondContact O-N 3.29Å; K1329-H1332 PolarHBondContact O-N 3.26Å; K1329-H1333 PolarHBondContact O-N 2.87Å; K1329-H1333 VanDerWaalsContact O-N 3.09Å
1330	N	39.8	Very low	35.7	Very low	97 Å²	97	101.5 Å²	101.5	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-37.1	179.4	-77.3	-15.7	0	0	0	112.6	Q1326 W1327 H1333 T1334	Q1326-N1330 WeakPolarHBondContact O-CB 3.38Å; Q1326-N1330 PolarHBondContact O-N 3.46Å; Q1326-N1330 PolarHBondContact O-ND2 3.49Å; W1327-N1330 PolarHBondContact O-N 3.37Å; W1327-N1330 VanDerWaalsContact O-N 3.16Å; N1330-H1333 PolarHBondContact O-N 2.93Å; N1330-T1334 WeakPolarHBondContact O-CB 3.47Å; N1330-T1334 PolarHBondContact O-N 3.22Å; N1330-T1334 PolarHBondContact O-OG1 2.96Å
1331	I	33	Very low	35.5	Very low	38 Å²	38	103.5 Å²	103.5	20%	0.195	51%	0.505	C	S	.	.	H	α-helix	trans	-65.8	-44.5	174.6	-69.2	172	0	0	0	110.9	Q1221 W1327 H1333 T1334 V1335	Q1221-I1331 VanDerWaalsContact NE2-CD1 3.34Å; W1327-I1331 HydrophobicContact CD2-CD1 3.57Å; W1327-I1331 HydrophobicContact CD2-CG1 4.42Å; W1327-I1331 HydrophobicContact CE3-CD1 3.51Å; W1327-I1331 HydrophobicContact CG-CD1 4.48Å; W1327-I1331 HydrophobicContact CH2-CD1 3.45Å; W1327-I1331 VanDerWaalsContact CH2-CD1 3.45Å; W1327-I1331 HydrophobicContact CZ2-CD1 3.56Å; W1327-I1331 HydrophobicContact CZ3-CD1 3.42Å; W1327-I1331 VanDerWaalsContact CZ3-CD1 3.42Å; W1327-I1331 WeakPolarHBondContact O-CG1 3.44Å; W1327-I1331 PolarHBondContact O-N 2.91Å; I1331-H1333 PolarHBondContact O-N 3.1Å; I1331-T1334 PolarHBondContact O-N 3.07Å; I1331-T1334 VanDerWaalsContact O-N 3.09Å; I1331-V1335 HydrophobicContact CG2-CG2 4.11Å; I1331-V1335 WeakPolarHBondContact O-CG2 3.44Å; I1331-V1335 PolarHBondContact O-N 3.34Å
1332	H	34.6	Very low	35.2	Very low	91 Å²	91	107.7 Å²	107.7	42%	0.421	53%	0.529	S	S	.	.	H	α-helix	trans	-58.8	-38.8	176.1	-88.3	47.5	0	0	0	111.5	S1328 K1329 K1336	S1328-H1332 PolarHBondContact O-N 2.89Å; S1328-H1332 VanDerWaalsContact O-N 3.12Å; S1328-H1332 PolarHBondContact O-ND1 3.25Å; K1329-H1332 PolarHBondContact O-N 3.26Å; H1332-K1336 WeakPolarHBondContact O-CB 3.47Å; H1332-K1336 PolarHBondContact O-N 3.1Å
1333	H	35.8	Very low	34.5	Very low	126 Å²	126	111.4 Å²	111.4	58%	0.583	55%	0.547	S	S	*	.	H	α-helix	trans	-67.9	-39.2	173.1	-90	-62.5	0	0	0	113.9	K1329 N1330 I1331 R1337	K1329-H1333 PolarHBondContact O-N 2.87Å; K1329-H1333 VanDerWaalsContact O-N 3.09Å; N1330-H1333 PolarHBondContact O-N 2.93Å; I1331-H1333 PolarHBondContact O-N 3.1Å; H1333-R1337 PolarHBondContact O-N 2.06Å
1334	T	31.8	Very low	33.8	Very low	97 Å²	97	111.9 Å²	111.9	60%	0.595	56%	0.557	S	S	*	*	H	α-helix	trans	-72.1	-38.7	-177.4	-46.7	0	0	0	0	111.4	N1330 I1331 R1337 S1338	N1330-T1334 WeakPolarHBondContact O-CB 3.47Å; N1330-T1334 PolarHBondContact O-N 3.22Å; N1330-T1334 PolarHBondContact O-OG1 2.96Å; I1331-T1334 PolarHBondContact O-N 3.07Å; I1331-T1334 VanDerWaalsContact O-N 3.09Å; T1334-R1337 PolarHBondContact O-N 3.03Å; T1334-S1338 PolarHBondContact O-N 2.93Å
1335	V	31.3	Very low	33.3	Very low	62 Å²	62	112.8 Å²	112.8	38%	0.376	58%	0.576	S	S	.	*	H	α-helix	trans	-72.4	-38	174.6	179	0	0	0	0	111	I1331 R1337 S1338 I1339	I1331-V1335 HydrophobicContact CG2-CG2 4.11Å; I1331-V1335 WeakPolarHBondContact O-CG2 3.44Å; I1331-V1335 PolarHBondContact O-N 3.34Å; V1335-R1337 VanDerWaalsContact C-N 3.35Å; V1335-R1337 PolarHBondContact O-N 2.81Å; V1335-S1338 PolarHBondContact O-N 2.91Å; V1335-S1338 VanDerWaalsContact O-N 3.1Å; V1335-S1338 PolarHBondContact O-OG 3.16Å; V1335-I1339 HydrophobicContact CG1-CD1 4.41Å
1336	K	31.3	Very low	32.7	Very low	152 Å²	152	118 Å²	118	66%	0.661	60%	0.599	S	S	*	*	H	α-helix	trans	-59	-43.6	171.1	-110.4	-176.5	171.7	-178.1	0	112.2	H1332 S1338 I1339 D1340	H1332-K1336 WeakPolarHBondContact O-CB 3.47Å; H1332-K1336 PolarHBondContact O-N 3.1Å; K1336-S1338 PolarHBondContact O-N 2.96Å; K1336-I1339 PolarHBondContact O-N 3.33Å; K1336-D1340 PolarHBondContact O-N 3.03Å
1337	R	30	Very low	32	Very low	219 Å²	219	119.9 Å²	119.9	83%	0.826	61%	0.607	S	S	*	*	H	α-helix	trans	-63.2	-25	176	-85.6	-174.7	177.1	164.1	0.5	113.7	H1333 T1334 V1335 I1339	H1333-R1337 PolarHBondContact O-N 2.06Å; T1334-R1337 PolarHBondContact O-N 3.03Å; V1335-R1337 VanDerWaalsContact C-N 3.35Å; V1335-R1337 PolarHBondContact O-N 2.81Å; R1337-I1339 PolarHBondContact O-N 3.03Å
1338	S	30	Very low	31.5	Very low	81 Å²	81	123 Å²	123	57%	0.566	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-7.8	174.5	70.4	0	0	0	0	114.1	T1334 V1335 K1336	T1334-S1338 PolarHBondContact O-N 2.93Å; V1335-S1338 PolarHBondContact O-N 2.91Å; V1335-S1338 VanDerWaalsContact O-N 3.1Å; V1335-S1338 PolarHBondContact O-OG 3.16Å; K1336-S1338 PolarHBondContact O-N 2.96Å
1339	I	27.8	Very low	31.1	Very low	128 Å²	128	127.1 Å²	127.1	66%	0.656	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	-17.3	-175.4	-61.5	174.9	0	0	0	113.1	V1335 K1336 R1337 L1341	V1335-I1339 HydrophobicContact CG1-CD1 4.41Å; K1336-I1339 PolarHBondContact O-N 3.33Å; R1337-I1339 PolarHBondContact O-N 3.03Å; I1339-L1341 PolarHBondContact O-N 2.99Å
1340	D	25	Very low	30.7	Very low	119 Å²	119	126.1 Å²	126.1	64%	0.636	67%	0.665	S	S	*	*			trans	-83	80.2	172.1	-96.4	-34.2	0	0	0	112.4	K1336 N1342	K1336-D1340 PolarHBondContact O-N 3.03Å; D1340-N1342 PolarHBondContact O-N 3.01Å
1341	L	31.8	Very low	30.5	Very low	154 Å²	154	129.8 Å²	129.8	81%	0.806	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	6	177.1	-136.3	90	0	0	0	114.4	I1339	I1339-L1341 PolarHBondContact O-N 2.99Å
1342	N	32.9	Very low	30.4	Very low	154 Å²	154	138.5 Å²	138.5	82%	0.824	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	12.5	-170.9	-81	-4.2	0	0	0	115.9	D1340	D1340-N1342 PolarHBondContact O-N 3.01Å
1343	Q	27.6	Very low	30.2	Very low	176 Å²	176	143 Å²	143	82%	0.822	73%	0.732	S	S	*	*			trans	-127	69.8	172.9	-73.2	-172.6	-16.1	0	0	111.9
1344	I	27.8	Very low	30	Very low	152 Å²	152	144.1 Å²	144.1	78%	0.779	74%	0.742	S	S	*	*			trans	-119.4	82.3	154.8	-55.9	177.1	0	0	0	106.1	L1346	I1344-L1346 PolarHBondContact O-N 3.4Å; I1344-L1346 VanDerWaalsContact O-N 3.16Å
1345	S	26	Very low	29.7	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	76%	0.757	S	S	*	*			trans	-66	109.9	164.9	59.9	0	0	0	0	107.3	Q1347	S1345-Q1347 PolarHBondContact O-N 3.34Å
1346	L	29.9	Very low	29.6	Very low	160 Å²	160	150.8 Å²	150.8	84%	0.838	78%	0.776	S	S	*	*			trans	-62.5	87	170.2	-78.6	155.8	0	0	0	108.6	I1344 C1348	I1344-L1346 PolarHBondContact O-N 3.4Å; I1344-L1346 VanDerWaalsContact O-N 3.16Å; L1346-C1348 VanDerWaalsContact C-N 3.34Å; L1346-C1348 PolarHBondContact O-N 3.18Å; L1346-C1348 VanDerWaalsContact O-N 3.08Å
1347	Q	26.9	Very low	29.3	Very low	162 Å²	162	149.3 Å²	149.3	76%	0.757	79%	0.785	S	S	*	*			trans	-78.8	89.9	172.7	-152.6	164.4	-0.6	0	0	106.7	S1345 N1349	S1345-Q1347 PolarHBondContact O-N 3.34Å; Q1347-N1349 VanDerWaalsContact C-N 3.34Å; Q1347-N1349 PolarHBondContact O-N 3.48Å
1348	C	26.9	Very low	29.2	Very low	121 Å²	121	144.2 Å²	144.2	82%	0.818	78%	0.782	S	S	*	*			trans	-60.2	97	166.9	-83.4	0	0	0	0	108.3	L1346 S1350	L1346-C1348 VanDerWaalsContact C-N 3.34Å; L1346-C1348 PolarHBondContact O-N 3.18Å; L1346-C1348 VanDerWaalsContact O-N 3.08Å; C1348-S1350 PolarHBondContact O-N 3.25Å
1349	N	30.4	Very low	28.9	Very low	142 Å²	142	147.1 Å²	147.1	76%	0.759	80%	0.797	S	S	*	*			trans	-67	121.2	174.6	-99.1	-5.2	0	0	0	109.9	Q1347 Q1351	Q1347-N1349 VanDerWaalsContact C-N 3.34Å; Q1347-N1349 PolarHBondContact O-N 3.48Å; N1349-Q1351 VanDerWaalsContact C-N 3.27Å; N1349-Q1351 PolarHBondContact O-N 3.07Å
1350	S	34	Very low	28.8	Very low	120 Å²	120	145.4 Å²	145.4	84%	0.839	80%	0.797	S	S	*	*	S	Bend	trans	-77.2	49.2	-167.5	58.6	0	0	0	0	114.7	C1348	C1348-S1350 PolarHBondContact O-N 3.25Å
1351	Q	36.9	Very low	28.7	Very low	174 Å²	174	146.4 Å²	146.4	81%	0.813	81%	0.807	S	S	*	*			trans	-128.7	11.6	178.8	-99.7	-173.3	-15.1	0	0	116.6	N1349	N1349-Q1351 VanDerWaalsContact C-N 3.27Å; N1349-Q1351 PolarHBondContact O-N 3.07Å
1352	Y	30	Very low	28.4	Very low	220 Å²	220	146.6 Å²	146.6	86%	0.863	81%	0.807	S	S	*	*			trans	-133.2	94.4	164.1	-82.3	-83.5	0	0	0	110.2	N1354	Y1352-N1354 PolarHBondContact O-N 2.9Å
1353	E	30.3	Very low	27.9	Very low	185 Å²	185	150.1 Å²	150.1	86%	0.864	81%	0.809	S	S	*	*			trans	-55	120.2	159.1	-70.1	-178.8	154.3	0	0	108.6
1354	N	31.9	Very low	27.8	Very low	150 Å²	150	152.2 Å²	152.2	80%	0.802	82%	0.816	S	S	*	*			trans	128.9	57.2	167.5	-66.4	-24.3	0	0	0	113.4	Y1352	Y1352-N1354 PolarHBondContact O-N 2.9Å
1355	C	25.3	Very low	27.8	Very low	133 Å²	133	150.8 Å²	150.8	90%	0.899	82%	0.815	S	S	*	*			trans	-96.9	67	154	-72.5	0	0	0	0	109.5
1356	Q	28.2	Very low	27.9	Very low	167 Å²	167	155 Å²	155	78%	0.78	82%	0.82	S	S	*	*			trans	-108.9	111.3	166.2	-80.5	-170.7	-12.4	0	0	110.2	S1358	Q1356-S1358 PolarHBondContact O-N 3.07Å
1357	S	26.7	Very low	27.9	Very low	121 Å²	121	151.9 Å²	151.9	85%	0.846	81%	0.81	S	S	*	*			trans	-13.4	109.3	155.3	51.4	0	0	0	0	115.8
1358	S	26.4	Very low	28.4	Very low	111 Å²	111	150.3 Å²	150.3	78%	0.776	81%	0.805	S	S	*	*			trans	-143.5	119.6	150.3	53.6	0	0	0	0	110.3	Q1356	Q1356-S1358 PolarHBondContact O-N 3.07Å
1359	T	24.9	Very low	28.9	Very low	142 Å²	142	150.1 Å²	150.1	87%	0.871	80%	0.796	S	S	*	*			trans	-71.4	112.7	176.9	45.1	0	0	0	0	110.2
1360	S	24.6	Very low	29.3	Very low	93 Å²	93	149.7 Å²	149.7	65%	0.65	79%	0.79	S	S	*	*			trans	-175	123.4	149.3	45.5	0	0	0	0	111.8
1361	T	24	Very low	29.4	Very low	140 Å²	140	151 Å²	151	86%	0.859	78%	0.782	S	S	*	*			trans	38	88.2	148.7	42	0	0	0	0	118.2
1362	I	24.2	Very low	29.4	Very low	157 Å²	157	149.5 Å²	149.5	81%	0.805	77%	0.77	S	S	*	*			trans	-110.1	114.7	160.7	-61.8	178.3	0	0	0	109.5
1363	R	23.9	Very low	29.6	Very low	229 Å²	229	146.3 Å²	146.3	86%	0.864	76%	0.761	S	S	*	*			trans	-51	131.5	170	-70.1	172.3	176.2	171	-2	110.1	T1365	R1363-T1365 PolarHBondContact O-N 2.95Å
1364	F	24.4	Very low	29.9	Very low	219 Å²	219	140.9 Å²	140.9	96%	0.961	74%	0.738	S	S	*	*			trans	-55.3	91.8	173.8	-74	-88.6	0	0	0	111.5
1365	T	28.6	Very low	30.2	Very low	123 Å²	123	138 Å²	138	76%	0.755	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-91.4	131.3	156.7	40.1	0	0	0	0	107.5	R1363	R1363-T1365 PolarHBondContact O-N 2.95Å
1366	K	27.5	Very low	30.6	Very low	185 Å²	185	139.8 Å²	139.8	80%	0.804	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-53.4	137.6	-167.3	-71.4	172.8	177.3	173.6	0	111.6
1367	P	29.7	Very low	30.8	Very low	96 Å²	96	140.6 Å²	140.6	62%	0.623	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-74.3	141.2	-171.7	29.7	-32.7	0	0	0	111.5	N1369 Q1370	P1367-N1369 PolarHBondContact O-N 2.78Å; P1367-Q1370 PolarHBondContact O-N 3.3Å
1368	I	37.2	Very low	31.1	Very low	128 Å²	128	143.6 Å²	143.6	66%	0.656	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-0.7	176.8	-67.4	164	0	0	0	113.6	Q1370 Q1371	I1368-Q1370 PolarHBondContact O-N 3.19Å; I1368-Q1370 VanDerWaalsContact O-N 3.16Å; I1368-Q1371 PolarHBondContact O-N 3.03Å; I1368-Q1371 VanDerWaalsContact O-N 3.1Å
1369	N	38.9	Very low	31.6	Very low	118 Å²	118	145.7 Å²	145.7	63%	0.631	69%	0.692	S	S	*	*	H	α-helix	trans	-65.6	-9.7	172.2	-93.7	-15.8	0	0	0	115.2	P1367 K1373	P1367-N1369 PolarHBondContact O-N 2.78Å; N1369-K1373 PolarHBondContact O-N 3.31Å
1370	Q	37.4	Very low	31.8	Very low	132 Å²	132	148.9 Å²	148.9	62%	0.617	69%	0.689	S	S	*	*	H	α-helix	trans	-75.1	-33	168.1	-92.1	179.3	-37.5	0	0	112.5	P1367 I1368 Y1372 K1373 D1374	P1367-Q1370 PolarHBondContact O-N 3.3Å; I1368-Q1370 PolarHBondContact O-N 3.19Å; I1368-Q1370 VanDerWaalsContact O-N 3.16Å; Q1370-Y1372 PolarHBondContact O-N 3.38Å; Q1370-K1373 PolarHBondContact O-N 2.99Å; Q1370-D1374 WeakPolarHBondContact O-CB 3.43Å; Q1370-D1374 PolarHBondContact O-N 3.45Å
1371	Q	36.1	Very low	31.9	Very low	148 Å²	148	150.4 Å²	150.4	69%	0.692	69%	0.689	S	S	*	*	H	α-helix	trans	-71.1	-36.4	-176.7	-152.1	169.4	-8.3	0	0	112	I1368 D1374 E1375	I1368-Q1371 PolarHBondContact O-N 3.03Å; I1368-Q1371 VanDerWaalsContact O-N 3.1Å; Q1371-D1374 PolarHBondContact O-N 3.41Å; Q1371-E1375 PolarHBondContact O-N 2.95Å
1372	Y	37.1	Very low	32.3	Very low	142 Å²	142	150.3 Å²	150.3	56%	0.557	68%	0.683	S	S	*	*	H	α-helix	trans	-74.2	-33.1	173	-81.1	-77.3	0	0	0	113.5	Q1370 D1374 E1375 Y1376	Q1370-Y1372 PolarHBondContact O-N 3.38Å; Y1372-D1374 VanDerWaalsContact C-N 3.3Å; Y1372-E1375 PolarHBondContact O-N 2.92Å; Y1372-Y1376 WeakPolarHBondContact O-CD2 3.35Å; Y1372-Y1376 PolarHBondContact O-N 3.11Å
1373	K	34.9	Very low	32.7	Very low	154 Å²	154	148.8 Å²	148.8	67%	0.67	68%	0.676	S	S	*	*	H	α-helix	trans	-67.7	-33.1	172.5	-85.7	-173.7	176	-179.8	0	112.2	N1369 Q1370 R1377	N1369-K1373 PolarHBondContact O-N 3.31Å; Q1370-K1373 PolarHBondContact O-N 2.99Å; K1373-R1377 WeakPolarHBondContact O-CB 3.41Å; K1373-R1377 PolarHBondContact O-N 2.99Å
1374	D	36.9	Very low	33.3	Very low	70 Å²	70	145 Å²	145	37%	0.374	67%	0.673	S	S	.	*	H	α-helix	trans	-75.3	-29.5	175	-70.3	-21	0	0	0	112.1	Q1370 Q1371 Y1372 R1378	Q1370-D1374 WeakPolarHBondContact O-CB 3.43Å; Q1370-D1374 PolarHBondContact O-N 3.45Å; Q1371-D1374 PolarHBondContact O-N 3.41Å; Y1372-D1374 VanDerWaalsContact C-N 3.3Å; D1374-R1378 VanDerWaalsContact O-CB 3.31Å; D1374-R1378 WeakPolarHBondContact O-CB 3.49Å; D1374-R1378 WeakPolarHBondContact O-CG 3.45Å; D1374-R1378 PolarHBondContact O-N 3.16Å
1375	E	37.7	Very low	34.1	Very low	90 Å²	90	137.2 Å²	137.2	42%	0.421	64%	0.643	S	S	.	*	H	α-helix	trans	-73	-37.4	171.8	-148.6	-171.9	164.9	0	0	112.2	Q1371 Y1372 R1378 K1379	Q1371-E1375 PolarHBondContact O-N 2.95Å; Y1372-E1375 PolarHBondContact O-N 2.92Å; E1375-R1378 PolarHBondContact O-N 2.84Å; E1375-K1379 WeakPolarHBondContact O-CB 3.46Å; E1375-K1379 PolarHBondContact O-N 3.01Å; E1375-K1379 IonicContact OE1-NZ 3.78Å
1376	Y	33.4	Very low	35.2	Very low	171 Å²	171	137.4 Å²	137.4	67%	0.671	64%	0.638	S	S	*	*	H	α-helix	trans	-70.2	-32.6	170.8	-89.7	-78.3	0	0	0	112.8	Y1372 R1380	Y1372-Y1376 WeakPolarHBondContact O-CD2 3.35Å; Y1372-Y1376 PolarHBondContact O-N 3.11Å; Y1376-R1380 WeakPolarHBondContact O-CB 3.09Å; Y1376-R1380 WeakPolarHBondContact O-CG 2.97Å; Y1376-R1380 PolarHBondContact O-N 3.4Å
1377	R	31.8	Very low	36.8	Very low	184 Å²	184	132 Å²	132	69%	0.694	62%	0.618	S	S	*	*	H	α-helix	trans	-69.1	-37.9	168.8	-91.8	-178.2	177.1	163.6	-3.2	111.9	K1373 R1380 N1381	K1373-R1377 WeakPolarHBondContact O-CB 3.41Å; K1373-R1377 PolarHBondContact O-N 2.99Å; R1377-R1380 PolarHBondContact O-N 2.85Å; R1377-N1381 PolarHBondContact O-N 3.49Å; R1377-N1381 VanDerWaalsContact O-N 3.14Å
1378	R	34.4	Very low	38.9	Very low	184 Å²	184	128.2 Å²	128.2	69%	0.694	59%	0.594	S	S	*	*	H	α-helix	trans	-69.1	-35	173.8	-79.6	-172	-129.9	167.9	1.9	112.7	D1374 E1375 N1381	D1374-R1378 VanDerWaalsContact O-CB 3.31Å; D1374-R1378 WeakPolarHBondContact O-CB 3.49Å; D1374-R1378 WeakPolarHBondContact O-CG 3.45Å; D1374-R1378 PolarHBondContact O-N 3.16Å; E1375-R1378 PolarHBondContact O-N 2.84Å; R1378-N1381 WeakPolarHBondContact O-CB 3.42Å; R1378-N1381 PolarHBondContact O-N 2.88Å
1379	K	35.7	Very low	40.9	Very low	154 Å²	154	122.5 Å²	122.5	67%	0.67	57%	0.565	S	S	*	*	H	α-helix	trans	-76.7	-21.2	172.4	-78.2	-179.3	178.4	168.1	0	113.4	E1375 N1381	E1375-K1379 WeakPolarHBondContact O-CB 3.46Å; E1375-K1379 PolarHBondContact O-N 3.01Å; E1375-K1379 IonicContact OE1-NZ 3.78Å; K1379-N1381 VanDerWaalsContact C-N 3.31Å
1380	R	28.8	Very low	42.7	Very low	210 Å²	210	119.4 Å²	119.4	79%	0.792	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-7.1	166.9	-84.6	-169.8	-176.5	-177.6	1.3	114.3	Y1376 R1377 L1382	Y1376-R1380 WeakPolarHBondContact O-CB 3.09Å; Y1376-R1380 WeakPolarHBondContact O-CG 2.97Å; Y1376-R1380 PolarHBondContact O-N 3.4Å; R1377-R1380 PolarHBondContact O-N 2.85Å; R1380-L1382 PolarHBondContact O-N 3.42Å
1381	N	26.8	Very low	44.5	Very low	124 Å²	124	121.5 Å²	121.5	66%	0.663	55%	0.549	S	S	*	.			trans	-73.5	61	155.8	-65.8	-12.2	0	0	0	108.1	R1377 R1378 K1379 L1383	R1377-N1381 PolarHBondContact O-N 3.49Å; R1377-N1381 VanDerWaalsContact O-N 3.14Å; R1378-N1381 WeakPolarHBondContact O-CB 3.42Å; R1378-N1381 PolarHBondContact O-N 2.88Å; K1379-N1381 VanDerWaalsContact C-N 3.31Å; N1381-L1383 PolarHBondContact O-N 3.47Å; N1381-L1383 VanDerWaalsContact O-N 3.11Å
1382	L	32.8	Very low	46.6	Very low	139 Å²	139	117.6 Å²	117.6	73%	0.728	53%	0.531	S	S	*	.			trans	-49.4	117.8	149.6	-92.8	141.9	0	0	0	104.3	R1380 N1384	R1380-L1382 PolarHBondContact O-N 3.42Å; L1382-N1384 PolarHBondContact O-N 3Å
1383	L	33	Very low	48.8	Very low	125 Å²	125	110.9 Å²	110.9	65%	0.654	50%	0.504	S	S	*	.			trans	-33.5	114.7	178.2	-105.1	70.4	0	0	0	108.1	N1381 T1385	N1381-L1383 PolarHBondContact O-N 3.47Å; N1381-L1383 VanDerWaalsContact O-N 3.11Å; L1383-T1385 VanDerWaalsContact C-N 3.3Å; L1383-T1385 PolarHBondContact O-N 3.05Å
1384	N	36.2	Very low	50.9	Low	149 Å²	149	106.6 Å²	106.6	80%	0.797	49%	0.488	S	S	*	.			trans	-52.2	110.2	161.8	-84.1	-11.8	0	0	0	104.4	L1382 I1386	L1382-N1384 PolarHBondContact O-N 3Å; N1384-I1386 WeakPolarHBondContact O-CG1 3.35Å; N1384-I1386 PolarHBondContact O-N 3.49Å
1385	T	41.9	Very low	53	Low	55 Å²	55	108.6 Å²	108.6	34%	0.337	49%	0.493	S	S	.	.			trans	-67.9	89.1	-175.7	27.4	0	0	0	0	106.9	T1303 L1383 N1387 P1437	T1303-T1385 HydrophobicContact CG2-CG2 3.31Å; L1383-T1385 VanDerWaalsContact C-N 3.3Å; L1383-T1385 PolarHBondContact O-N 3.05Å; T1385-N1387 PolarHBondContact O-N 3.24Å; T1385-P1437 VanDerWaalsContact O-CB 3.23Å; T1385-P1437 WeakPolarHBondContact O-CB 3.36Å
1386	I	50.7	Low	55.2	Low	128 Å²	128	104.5 Å²	104.5	66%	0.656	47%	0.474	S	S	*	.			trans	-70.3	-21.2	-179.9	-68.3	163.5	0	0	0	110.4	N1384	N1384-I1386 WeakPolarHBondContact O-CG1 3.35Å; N1384-I1386 PolarHBondContact O-N 3.49Å
1387	N	61.5	Low	57.6	Low	70 Å²	70	97.6 Å²	97.6	37%	0.374	45%	0.448	S	S	.	.	S	Bend	trans	-104.1	128.1	-174	-64.8	0.1	0	0	0	111.8	E1304 T1385	E1304-N1387 HydrophobicContact CB-CB 4.09Å; T1385-N1387 PolarHBondContact O-N 3.24Å
1388	C	74.7	Confident	60	Low	17 Å²	17	93.9 Å²	93.9	12%	0.115	44%	0.442	C	S	.	.			trans	-79.9	131.5	175.2	176.6	0	0	0	0	111.1	E1390 C1438	C1388-E1390 PolarHBondContact O-N 3.38Å; C1388-E1390 PolarHBondContact SG-OE2 2.93Å; C1388-E1390 VanDerWaalsContact SG-OE2 3.33Å; C1388-C1438 VanDerWaalsContact CA-SG 3.55Å; C1388-C1438 HydrophobicContact CB-CB 3.87Å; C1388-C1438 WeakPolarHBondContact CB-SG 3.23Å; C1388-C1438 WeakPolarHBondContact SG-CA 3.41Å; C1388-C1438 WeakPolarHBondContact SG-CB 3.33Å; C1388-C1438 CovalentContact SG-SG 2.01Å; C1388-C1438 PolarHBondContact SG-SG 3.26Å
1389	P	77.5	Confident	62.3	Low	8 Å²	8	89.2 Å²	89.2	5%	0.052	42%	0.424	C	S	.	.			trans	-75.7	63.3	171.7	33	-34.6	0	0	0	111	N1227 I1299 L1302 R1391 E1392 I1393	N1227-P1389 VanDerWaalsContact ND2-CG 3.25Å; N1227-P1389 WeakPolarHBondContact ND2-CG 3.34Å; I1299-P1389 HydrophobicContact CG2-CG 4.32Å; L1302-P1389 HydrophobicContact CB-CB 3.93Å; L1302-P1389 HydrophobicContact CB-CG 4.31Å; P1389-R1391 VanDerWaalsContact C-N 3.29Å; P1389-R1391 PolarHBondContact O-N 2.69Å; P1389-E1392 PolarHBondContact O-N 2.55Å; P1389-E1392 VanDerWaalsContact O-N 3.09Å; P1389-I1393 PolarHBondContact O-N 2.03Å
1390	E	77.1	Confident	64.7	Low	53 Å²	53	81.9 Å²	81.9	25%	0.248	39%	0.393	C	S	.	.	H	α-helix	trans	-56.4	-41.5	-168.9	-174.9	62.8	-161.8	0	0	112.4	C1388 E1392 I1393 I1394 R1434	C1388-E1390 PolarHBondContact O-N 3.38Å; C1388-E1390 PolarHBondContact SG-OE2 2.93Å; C1388-E1390 VanDerWaalsContact SG-OE2 3.33Å; E1390-E1392 VanDerWaalsContact C-N 3.29Å; E1390-E1392 PolarHBondContact O-N 3.35Å; E1390-I1393 PolarHBondContact O-N 2.91Å; E1390-I1394 HydrophobicContact CG-CD1 3.9Å; E1390-I1394 VanDerWaalsContact O-CG1 3.29Å; E1390-I1394 WeakPolarHBondContact O-CG1 3.36Å; E1390-I1394 PolarHBondContact O-N 3.13Å; E1390-R1434 VanDerWaalsContact CD-NH1 3.34Å; E1390-R1434 IonicContact OE1-CZ 3.59Å; E1390-R1434 IonicContact OE1-NH1 3.93Å; E1390-R1434 PolarHBondContact OE1-NH1 3.29Å; E1390-R1434 IonicContact OE1-NH2 3.19Å; E1390-R1434 PolarHBondContact OE1-NH2 2.76Å; E1390-R1434 IonicContact OE2-NH1 3.13Å; E1390-R1434 PolarHBondContact OE2-NH1 2.97Å
1391	R	75.5	Confident	67.1	Low	177 Å²	177	72.2 Å²	72.2	67%	0.668	36%	0.357	S	S	*	.	H	α-helix	trans	-59.9	-37.9	179.6	-70	-176.7	179.2	175.9	0.7	113	P1389 K1395	P1389-R1391 VanDerWaalsContact C-N 3.29Å; P1389-R1391 PolarHBondContact O-N 2.69Å; R1391-K1395 WeakPolarHBondContact O-CG 2.8Å; R1391-K1395 PolarHBondContact O-N 3.21Å
1392	E	80.9	Confident	69.2	Low	66 Å²	66	68.5 Å²	68.5	31%	0.308	34%	0.341	S	S	.	.	H	α-helix	trans	-80.4	-34.2	-178.1	-61.1	-56	137.7	0	0	111.7	I1299 L1302 P1389 E1390 K1395 L1396	I1299-E1392 HydrophobicContact CD1-CB 4.32Å; I1299-E1392 HydrophobicContact CG1-CB 4.13Å; L1302-E1392 HydrophobicContact CD1-CB 4.22Å; L1302-E1392 HydrophobicContact CD1-CG 3.64Å; P1389-E1392 PolarHBondContact O-N 2.55Å; P1389-E1392 VanDerWaalsContact O-N 3.09Å; E1390-E1392 VanDerWaalsContact C-N 3.29Å; E1390-E1392 PolarHBondContact O-N 3.35Å; E1392-K1395 WeakPolarHBondContact O-CB 3.45Å; E1392-K1395 PolarHBondContact O-N 2.97Å; E1392-K1395 IonicContact OE1-NZ 2.74Å; E1392-K1395 PolarHBondContact OE1-NZ 2.89Å; E1392-K1395 WeakPolarHBondContact OE2-CD 3.01Å; E1392-K1395 IonicContact OE2-NZ 3.38Å; E1392-K1395 PolarHBondContact OE2-NZ 3.43Å; E1392-L1396 PolarHBondContact O-N 2.91Å
1393	I	81.7	Confident	70.5	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.7	-44	172.5	-66.8	176.3	0	0	0	110.6	H1228 I1299 P1389 E1390 K1395 L1396 E1397 R1434 C1438	H1228-I1393 HydrophobicContact CB-CD1 4.4Å; I1299-I1393 HydrophobicContact CG2-CD1 4.47Å; I1299-I1393 HydrophobicContact CG2-CG1 3.67Å; P1389-I1393 PolarHBondContact O-N 2.03Å; E1390-I1393 PolarHBondContact O-N 2.91Å; I1393-K1395 VanDerWaalsContact C-N 3.31Å; I1393-K1395 PolarHBondContact O-N 3.28Å; I1393-L1396 WeakPolarHBondContact O-CB 3.37Å; I1393-L1396 PolarHBondContact O-N 3.29Å; I1393-L1396 VanDerWaalsContact O-N 3.11Å; I1393-E1397 HydrophobicContact CG2-CG 4.42Å; I1393-E1397 WeakPolarHBondContact O-CG 3.46Å; I1393-E1397 PolarHBondContact O-N 2.97Å; I1393-R1434 HydrophobicContact CG2-CG 4.25Å; I1393-C1438 HydrophobicContact CD1-CB 4.04Å; I1393-C1438 WeakPolarHBondContact CD1-SG 3.34Å
1394	I	79.1	Confident	71.2	Confident	64 Å²	64	60.6 Å²	60.6	33%	0.328	30%	0.297	S	S	.	.	H	α-helix	trans	-61	-40.9	175.6	-68.2	167	0	0	0	110.9	E1390 L1396 E1397 N1398	E1390-I1394 HydrophobicContact CG-CD1 3.9Å; E1390-I1394 VanDerWaalsContact O-CG1 3.29Å; E1390-I1394 WeakPolarHBondContact O-CG1 3.36Å; E1390-I1394 PolarHBondContact O-N 3.13Å; I1394-L1396 VanDerWaalsContact C-N 3.33Å; I1394-L1396 PolarHBondContact O-N 3.37Å; I1394-E1397 PolarHBondContact O-N 3.01Å; I1394-N1398 WeakPolarHBondContact O-CB 3.15Å; I1394-N1398 PolarHBondContact O-N 3.1Å; I1394-N1398 PolarHBondContact O-ND2 3.37Å
1395	K	81.4	Confident	71.2	Confident	113 Å²	113	54.7 Å²	54.7	49%	0.491	26%	0.263	S	S	.	.	H	α-helix	trans	-61.7	-40.1	174.2	-76.4	171.6	-177.3	172.2	0	112.1	R1391 E1392 I1393 R1399	R1391-K1395 WeakPolarHBondContact O-CG 2.8Å; R1391-K1395 PolarHBondContact O-N 3.21Å; E1392-K1395 WeakPolarHBondContact O-CB 3.45Å; E1392-K1395 PolarHBondContact O-N 2.97Å; E1392-K1395 IonicContact OE1-NZ 2.74Å; E1392-K1395 PolarHBondContact OE1-NZ 2.89Å; E1392-K1395 WeakPolarHBondContact OE2-CD 3.01Å; E1392-K1395 IonicContact OE2-NZ 3.38Å; E1392-K1395 PolarHBondContact OE2-NZ 3.43Å; I1393-K1395 VanDerWaalsContact C-N 3.31Å; I1393-K1395 PolarHBondContact O-N 3.28Å; K1395-R1399 VanDerWaalsContact O-CG 3.25Å; K1395-R1399 WeakPolarHBondContact O-CG 3.35Å; K1395-R1399 PolarHBondContact O-N 2.91Å
1396	L	84.8	Confident	71.5	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-46.3	175.8	178.4	61.6	0	0	0	111.4	V1230 L1262 W1294 Q1296 I1299 E1392 I1393 I1394 N1398 R1399 L1400	V1230-L1396 HydrophobicContact CG2-CD2 4.44Å; L1262-L1396 HydrophobicContact CD2-CD1 3.73Å; W1294-L1396 HydrophobicContact CH2-CD1 4.31Å; Q1296-L1396 HydrophobicContact CB-CD2 4.28Å; I1299-L1396 HydrophobicContact CD1-CB 3.77Å; I1299-L1396 HydrophobicContact CD1-CD2 3.9Å; I1299-L1396 HydrophobicContact CD1-CG 4.36Å; E1392-L1396 PolarHBondContact O-N 2.91Å; I1393-L1396 WeakPolarHBondContact O-CB 3.37Å; I1393-L1396 PolarHBondContact O-N 3.29Å; I1393-L1396 VanDerWaalsContact O-N 3.11Å; I1394-L1396 VanDerWaalsContact C-N 3.33Å; I1394-L1396 PolarHBondContact O-N 3.37Å; L1396-N1398 PolarHBondContact O-N 2.87Å; L1396-R1399 PolarHBondContact O-N 3.29Å; L1396-R1399 VanDerWaalsContact O-N 3.14Å; L1396-L1400 HydrophobicContact CD1-CD1 3.62Å; L1396-L1400 HydrophobicContact CD1-CG 4.01Å; L1396-L1400 HydrophobicContact CG-CD1 3.97Å; L1396-L1400 PolarHBondContact O-N 2.73Å; L1396-L1400 VanDerWaalsContact O-N 3.11Å
1397	E	83.5	Confident	71.5	Confident	25 Å²	25	54.8 Å²	54.8	12%	0.117	26%	0.259	C	S	.	.	H	α-helix	trans	-55.8	-51.3	176.2	-74.5	171.7	176.3	0	0	110.9	I1393 I1394 R1399 L1400 L1401 I1432 R1434	I1393-E1397 HydrophobicContact CG2-CG 4.42Å; I1393-E1397 WeakPolarHBondContact O-CG 3.46Å; I1393-E1397 PolarHBondContact O-N 2.97Å; I1394-E1397 PolarHBondContact O-N 3.01Å; E1397-R1399 PolarHBondContact O-N 3.29Å; E1397-R1399 VanDerWaalsContact O-N 3.11Å; E1397-L1400 PolarHBondContact O-N 2.97Å; E1397-L1401 WeakPolarHBondContact O-CA 2.76Å; E1397-L1401 VanDerWaalsContact O-CB 3.27Å; E1397-L1401 WeakPolarHBondContact O-CB 3.47Å; E1397-L1401 PolarHBondContact O-N 3.23Å; E1397-I1432 HydrophobicContact CB-CD1 4.28Å; E1397-I1432 HydrophobicContact CG-CB 4.39Å; E1397-I1432 HydrophobicContact CG-CD1 3.79Å; E1397-I1432 HydrophobicContact CG-CG2 4.09Å; E1397-R1434 IonicContact OE1-CZ 3.62Å; E1397-R1434 IonicContact OE1-NE 2.73Å; E1397-R1434 PolarHBondContact OE1-NE 3.07Å; E1397-R1434 IonicContact OE1-NH2 3.93Å; E1397-R1434 PolarHBondContact OE1-NH2 3.18Å; E1397-R1434 IonicContact OE2-CZ 2.75Å; E1397-R1434 IonicContact OE2-NE 3.74Å; E1397-R1434 IonicContact OE2-NH2 2.83Å; E1397-R1434 PolarHBondContact OE2-NH2 3.27Å
1398	N	81.7	Confident	70.4	Confident	107 Å²	107	55.1 Å²	55.1	57%	0.572	26%	0.26	S	S	*	.	H	α-helix	trans	-62	-21.7	179.9	-69.2	-14.9	0	0	0	114	I1394 L1396	I1394-N1398 WeakPolarHBondContact O-CB 3.15Å; I1394-N1398 PolarHBondContact O-N 3.1Å; I1394-N1398 PolarHBondContact O-ND2 3.37Å; L1396-N1398 PolarHBondContact O-N 2.87Å
1399	R	82.8	Confident	69.5	Low	85 Å²	85	58.5 Å²	58.5	32%	0.321	28%	0.275	S	S	.	.	H	α-helix	trans	-87.6	-38.1	178.9	-74.6	178.7	72.5	-179.5	14.3	113.4	Y1261 L1262 K1395 L1396 E1397	Y1261-R1399 WeakPolarHBondContact CE1-O 3.48Å; Y1261-R1399 PolarHBondContact O-NH2 3.45Å; Y1261-R1399 PolarHBondContact OH-O 2.84Å; L1262-R1399 PolarHBondContact O-NH1 2.99Å; L1262-R1399 PolarHBondContact O-NH2 3.29Å; K1395-R1399 VanDerWaalsContact O-CG 3.25Å; K1395-R1399 WeakPolarHBondContact O-CG 3.35Å; K1395-R1399 PolarHBondContact O-N 2.91Å; L1396-R1399 PolarHBondContact O-N 3.29Å; L1396-R1399 VanDerWaalsContact O-N 3.14Å; E1397-R1399 PolarHBondContact O-N 3.29Å; E1397-R1399 VanDerWaalsContact O-N 3.11Å
1400	L	85.1	Confident	69.2	Low	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-88.6	-29.7	-176.8	-68.4	178.5	0	0	0	112.2	V1230 Y1261 L1262 W1294 L1396 E1397 P1411 S1412 F1415 I1430 I1432	V1230-L1400 HydrophobicContact CG1-CD1 4.19Å; V1230-L1400 HydrophobicContact CG2-CD1 4.19Å; Y1261-L1400 HydrophobicContact CD1-CD2 4.48Å; Y1261-L1400 HydrophobicContact CE1-CD2 4.37Å; L1262-L1400 HydrophobicContact CD2-CD2 4.24Å; W1294-L1400 HydrophobicContact CH2-CD1 3.79Å; W1294-L1400 HydrophobicContact CZ2-CD1 3.63Å; W1294-L1400 HydrophobicContact CZ2-CD2 4.32Å; L1396-L1400 HydrophobicContact CD1-CD1 3.62Å; L1396-L1400 HydrophobicContact CD1-CG 4.01Å; L1396-L1400 HydrophobicContact CG-CD1 3.97Å; L1396-L1400 PolarHBondContact O-N 2.73Å; L1396-L1400 VanDerWaalsContact O-N 3.11Å; E1397-L1400 PolarHBondContact O-N 2.97Å; L1400-P1411 WeakPolarHBondContact O-CA 3.24Å; L1400-S1412 PolarHBondContact O-N 3.44Å; L1400-F1415 HydrophobicContact CD2-CD1 4.45Å; L1400-F1415 HydrophobicContact CD2-CD2 4.13Å; L1400-F1415 HydrophobicContact CD2-CE1 4.22Å; L1400-F1415 HydrophobicContact CD2-CE2 3.88Å; L1400-F1415 HydrophobicContact CD2-CG 4.4Å; L1400-F1415 HydrophobicContact CD2-CZ 3.92Å; L1400-I1430 HydrophobicContact CB-CD1 3.92Å; L1400-I1430 HydrophobicContact CD1-CD1 4.44Å; L1400-I1432 HydrophobicContact CB-CD1 4.13Å; L1400-I1432 HydrophobicContact CD1-CD1 3.91Å
1401	L	81.3	Confident	69.2	Low	7 Å²	7	59.5 Å²	59.5	4%	0.037	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.5	-174.5	-52.5	175.3	0	0	0	108.3	E1397 Q1409 Q1410 I1430 I1432	E1397-L1401 WeakPolarHBondContact O-CA 2.76Å; E1397-L1401 VanDerWaalsContact O-CB 3.27Å; E1397-L1401 WeakPolarHBondContact O-CB 3.47Å; E1397-L1401 PolarHBondContact O-N 3.23Å; L1401-Q1409 HydrophobicContact CB-CB 4.27Å; L1401-Q1409 HydrophobicContact CD1-CB 3.98Å; L1401-Q1409 HydrophobicContact CD1-CG 4.08Å; L1401-Q1409 HydrophobicContact CD2-CB 4.29Å; L1401-Q1409 HydrophobicContact CG-CB 4.42Å; L1401-Q1410 WeakPolarHBondContact CA-O 3.43Å; L1401-I1430 HydrophobicContact CD2-CB 4.29Å; L1401-I1430 HydrophobicContact CD2-CD1 4.12Å; L1401-I1430 HydrophobicContact CD2-CG1 4.11Å; L1401-I1430 HydrophobicContact CD2-CG2 3.29Å; L1401-I1432 HydrophobicContact CD1-CB 4.37Å; L1401-I1432 HydrophobicContact CD1-CD1 3.57Å; L1401-I1432 HydrophobicContact CD1-CG1 3.91Å; L1401-I1432 HydrophobicContact CG-CD1 3.87Å; L1401-I1432 HydrophobicContact CG-CG1 4.42Å
1402	S	70.7	Confident	69.5	Low	47 Å²	47	51.6 Å²	51.6	33%	0.329	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	118	162.5	-179.9	0	0	0	0	106.6	I1404 Q1410	S1402-I1404 PolarHBondContact O-N 2.82Å; S1402-Q1410 PolarHBondContact N-O 3.35Å
1403	E	58.5	Low	69.5	Low	87 Å²	87	54.6 Å²	54.6	41%	0.407	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	96.7	172.3	-155.3	178	-161.4	0	0	108.1	S367 S368	S367-E1403 WeakPolarHBondContact CB-OE1 3.34Å; S367-E1403 PolarHBondContact OG-OE1 2.72Å; S368-E1403 VanDerWaalsContact OG-CD 3.3Å; S368-E1403 PolarHBondContact OG-OE1 3.24Å; S368-E1403 PolarHBondContact OG-OE2 3.41Å
1404	I	47.8	Very low	69.6	Low	10 Å²	10	59.9 Å²	59.9	5%	0.051	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-21.5	177.8	-73.3	-179.6	0	0	0	110.7	K380 N401 Y410 S1402 Q1410	K380-I1404 HydrophobicContact CD-CG2 4.1Å; K380-I1404 PolarHBondContact NZ-O 3.46Å; N401-I1404 HydrophobicContact CB-CG2 3.69Å; Y410-I1404 WeakPolarHBondContact CE1-O 3.38Å; Y410-I1404 PolarHBondContact OH-O 3.38Å; S1402-I1404 PolarHBondContact O-N 2.82Å; I1404-Q1410 HydrophobicContact CD1-CB 3.78Å; I1404-Q1410 HydrophobicContact CD1-CG 4.08Å
1405	R	36.4	Very low	70.1	Confident	26 Å²	26	56.8 Å²	56.8	10%	0.098	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.9	156.1	171.1	-114	179.5	-165.9	-121.5	18.8	108.1	Q400 Y410 D1407 L1408	Q400-R1405 PolarHBondContact O-NE 2.94Å; Q400-R1405 PolarHBondContact O-NH2 3.22Å; Y410-R1405 HydrophobicContact CD1-CG 4.23Å; Y410-R1405 HydrophobicContact CD2-CG 3.79Å; Y410-R1405 HydrophobicContact CE1-CG 4.18Å; Y410-R1405 HydrophobicContact CE2-CG 3.74Å; Y410-R1405 HydrophobicContact CG-CG 4.08Å; R1405-D1407 PolarHBondContact O-N 2.91Å; R1405-L1408 PolarHBondContact O-N 2.93Å
1406	K	49.7	Very low	70.2	Confident	86 Å²	86	54 Å²	54	37%	0.374	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-37.5	-34.2	177.2	-54.5	-179.3	179	-104.6	0	115.3	S367	S367-K1406 VanDerWaalsContact N-CE 3.31Å; S367-K1406 VanDerWaalsContact N-CG 3.3Å; S367-K1406 VanDerWaalsContact O-CD 3.26Å; S367-K1406 WeakPolarHBondContact O-CD 3.2Å; S367-K1406 WeakPolarHBondContact O-CE 3.15Å; S367-K1406 WeakPolarHBondContact O-CG 3.18Å; S367-K1406 PolarHBondContact O-NZ 3.06Å; S367-K1406 VanDerWaalsContact OG-CA 3.26Å; S367-K1406 WeakPolarHBondContact OG-CA 3.38Å; S367-K1406 WeakPolarHBondContact OG-CB 3.29Å; S367-K1406 WeakPolarHBondContact OG-CG 3.36Å
1407	D	49.7	Very low	70.2	Confident	98 Å²	98	59.5 Å²	59.5	52%	0.524	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	2.6	-171.2	-42.5	-35	0	0	0	114.1	R1405	R1405-D1407 PolarHBondContact O-N 2.91Å
1408	L	37.7	Very low	70.3	Confident	78 Å²	78	60.4 Å²	60.4	41%	0.408	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	95	-178.1	-102.5	137.7	0	0	0	110.2	R1405	R1405-L1408 PolarHBondContact O-N 2.93Å
1409	Q	56.3	Low	70.5	Confident	88 Å²	88	55.3 Å²	55.3	41%	0.411	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	113.8	170.5	-69.1	171.6	-12.6	0	0	107.9	L1401	L1401-Q1409 HydrophobicContact CB-CB 4.27Å; L1401-Q1409 HydrophobicContact CD1-CB 3.98Å; L1401-Q1409 HydrophobicContact CD1-CG 4.08Å; L1401-Q1409 HydrophobicContact CD2-CB 4.29Å; L1401-Q1409 HydrophobicContact CG-CB 4.42Å
1410	Q	70.5	Confident	70.4	Confident	68 Å²	68	57.5 Å²	57.5	32%	0.318	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	153.7	166.7	-80	-175.7	-16.4	0	0	108.8	L1401 S1402 I1404 S1412	L1401-Q1410 WeakPolarHBondContact CA-O 3.43Å; S1402-Q1410 PolarHBondContact N-O 3.35Å; I1404-Q1410 HydrophobicContact CD1-CB 3.78Å; I1404-Q1410 HydrophobicContact CD1-CG 4.08Å; Q1410-S1412 PolarHBondContact O-N 3.39Å
1411	P	78	Confident	70.2	Confident	13 Å²	13	64 Å²	64	8%	0.084	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	139.3	172.8	4.1	-0.8	0	0	0	109.9	L1400 I1413 F1415 I1416 L1427 I1430	L1400-P1411 WeakPolarHBondContact O-CA 3.24Å; P1411-I1413 PolarHBondContact O-N 3.08Å; P1411-F1415 HydrophobicContact CB-CD1 4.48Å; P1411-I1416 HydrophobicContact CB-CD1 3.84Å; P1411-I1416 HydrophobicContact CB-CG1 3.7Å; P1411-I1416 HydrophobicContact CG-CD1 3.81Å; P1411-I1416 HydrophobicContact CG-CG1 4.06Å; P1411-L1427 HydrophobicContact CB-CD2 3.55Å; P1411-L1427 HydrophobicContact CG-CD2 3.78Å; P1411-L1427 HydrophobicContact CG-CG 4.27Å; P1411-I1430 HydrophobicContact CB-CB 4.35Å; P1411-I1430 HydrophobicContact CB-CG2 3.44Å; P1411-I1430 VanDerWaalsContact CB-CG2 3.44Å; P1411-I1430 HydrophobicContact CG-CB 4.4Å; P1411-I1430 HydrophobicContact CG-CG2 3.55Å
1412	S	81.3	Confident	70.1	Confident	12 Å²	12	65.9 Å²	65.9	8%	0.084	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-49.9	132.4	174.8	153.8	0	0	0	0	109.8	Y1261 L1400 Q1410 D1414 F1415 I1416	Y1261-S1412 PolarHBondContact OH-OG 2.77Å; L1400-S1412 PolarHBondContact O-N 3.44Å; Q1410-S1412 PolarHBondContact O-N 3.39Å; S1412-D1414 PolarHBondContact O-N 3.09Å; S1412-D1414 PolarHBondContact OG-N 3.49Å; S1412-F1415 CarbonylContact O-C 3.57Å; S1412-F1415 WeakPolarHBondContact O-CA 3.27Å; S1412-F1415 WeakPolarHBondContact O-CB 3.32Å; S1412-F1415 PolarHBondContact O-N 2.85Å; S1412-F1415 PolarHBondContact OG-N 3.32Å; S1412-I1416 WeakPolarHBondContact O-CG1 3.26Å; S1412-I1416 PolarHBondContact O-N 3.23Å
1413	I	81.5	Confident	70.3	Confident	128 Å²	128	65.1 Å²	65.1	66%	0.656	33%	0.325	S	S	*	.	H	α-helix	trans	-59.7	-40.3	179.5	-63.6	171.3	0	0	0	110.1	P1411 F1415 I1416 K1417	P1411-I1413 PolarHBondContact O-N 3.08Å; I1413-F1415 VanDerWaalsContact C-N 3.27Å; I1413-F1415 PolarHBondContact O-N 3.04Å; I1413-I1416 PolarHBondContact O-N 3.08Å; I1413-K1417 VanDerWaalsContact O-CB 3.23Å; I1413-K1417 WeakPolarHBondContact O-CB 3.34Å; I1413-K1417 PolarHBondContact O-N 3.14Å
1414	D	84	Confident	71.1	Confident	111 Å²	111	61 Å²	61	59%	0.594	31%	0.306	S	S	*	.	H	α-helix	trans	-62.9	-38.2	176.6	-64.6	-29	0	0	0	110.9	Y1261 S1412 H1418	Y1261-D1414 HydrophobicContact CE2-CB 4.45Å; S1412-D1414 PolarHBondContact O-N 3.09Å; S1412-D1414 PolarHBondContact OG-N 3.49Å; D1414-H1418 VanDerWaalsContact O-CB 3.25Å; D1414-H1418 WeakPolarHBondContact O-CB 3.35Å; D1414-H1418 PolarHBondContact O-N 3.34Å
1415	F	89.5	Confident	72.4	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.9	-45.8	175.9	-176.8	-117	0	0	0	112.7	M1232 L1258 Y1261 L1400 P1411 S1412 I1413 K1417 H1418 L1419 L1427 I1430	M1232-F1415 HydrophobicContact CE-CE1 3.65Å; M1232-F1415 HydrophobicContact CE-CZ 3.51Å; M1232-F1415 HydrophobicContact SD-CE1 4.38Å; M1232-F1415 HydrophobicContact SD-CZ 4.29Å; L1258-F1415 HydrophobicContact CD2-CE2 3.74Å; L1258-F1415 HydrophobicContact CD2-CZ 3.45Å; L1258-F1415 VanDerWaalsContact CD2-CZ 3.45Å; Y1261-F1415 AromaticContact CD1-CD2 3.48Å; Y1261-F1415 HydrophobicContact CD1-CD2 3.48Å; Y1261-F1415 VanDerWaalsContact CD1-CD2 3.48Å; Y1261-F1415 AromaticContact CD1-CE2 3.99Å; Y1261-F1415 HydrophobicContact CD1-CE2 3.99Å; Y1261-F1415 HydrophobicContact CD1-CG 4.47Å; Y1261-F1415 HydrophobicContact CD2-CD2 4.08Å; Y1261-F1415 HydrophobicContact CE1-CB 4.05Å; Y1261-F1415 AromaticContact CE1-CD2 3.58Å; Y1261-F1415 HydrophobicContact CE1-CD2 3.58Å; Y1261-F1415 HydrophobicContact CE1-CE2 4.43Å; Y1261-F1415 HydrophobicContact CE1-CG 4.15Å; Y1261-F1415 HydrophobicContact CE2-CB 4.08Å; Y1261-F1415 HydrophobicContact CE2-CD2 4.17Å; Y1261-F1415 AromaticContact CG-CD2 3.74Å; Y1261-F1415 HydrophobicContact CG-CD2 3.74Å; Y1261-F1415 HydrophobicContact CG-CE2 4.27Å; Y1261-F1415 AromaticContact CZ-CD2 3.94Å; L1400-F1415 HydrophobicContact CD2-CD1 4.45Å; L1400-F1415 HydrophobicContact CD2-CD2 4.13Å; L1400-F1415 HydrophobicContact CD2-CE1 4.22Å; L1400-F1415 HydrophobicContact CD2-CE2 3.88Å; L1400-F1415 HydrophobicContact CD2-CG 4.4Å; L1400-F1415 HydrophobicContact CD2-CZ 3.92Å; P1411-F1415 HydrophobicContact CB-CD1 4.48Å; S1412-F1415 CarbonylContact O-C 3.57Å; S1412-F1415 WeakPolarHBondContact O-CA 3.27Å; S1412-F1415 WeakPolarHBondContact O-CB 3.32Å; S1412-F1415 PolarHBondContact O-N 2.85Å; S1412-F1415 PolarHBondContact OG-N 3.32Å; I1413-F1415 VanDerWaalsContact C-N 3.27Å; I1413-F1415 PolarHBondContact O-N 3.04Å; F1415-K1417 VanDerWaalsContact C-N 3.32Å; F1415-K1417 PolarHBondContact O-N 2.79Å; F1415-H1418 PolarHBondContact O-N 3.21Å; F1415-L1419 HydrophobicContact CD1-CD1 4.04Å; F1415-L1419 HydrophobicContact CD2-CG 4.46Å; F1415-L1419 HydrophobicContact CE1-CD1 3.45Å; F1415-L1419 VanDerWaalsContact CE1-CD1 3.45Å; F1415-L1419 HydrophobicContact CE1-CG 4.3Å; F1415-L1419 HydrophobicContact CE2-CD1 4.08Å; F1415-L1419 HydrophobicContact CE2-CD2 4.3Å; F1415-L1419 HydrophobicContact CE2-CG 4.08Å; F1415-L1419 HydrophobicContact CZ-CD1 3.48Å; F1415-L1419 VanDerWaalsContact CZ-CD1 3.48Å; F1415-L1419 HydrophobicContact CZ-CD2 4.27Å; F1415-L1419 HydrophobicContact CZ-CG 3.99Å; F1415-L1419 WeakPolarHBondContact O-CG 3.19Å; F1415-L1419 PolarHBondContact O-N 2.85Å; F1415-L1427 HydrophobicContact CD1-CD2 4Å; F1415-L1427 HydrophobicContact CE1-CD2 3.78Å; F1415-I1430 HydrophobicContact CE1-CD1 4.03Å
1416	I	83.6	Confident	74.4	Confident	55 Å²	55	64.7 Å²	64.7	28%	0.282	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-45.7	175.9	-63.5	169.9	0	0	0	110.1	P1411 S1412 I1413 L1419 K1420 L1427	P1411-I1416 HydrophobicContact CB-CD1 3.84Å; P1411-I1416 HydrophobicContact CB-CG1 3.7Å; P1411-I1416 HydrophobicContact CG-CD1 3.81Å; P1411-I1416 HydrophobicContact CG-CG1 4.06Å; S1412-I1416 WeakPolarHBondContact O-CG1 3.26Å; S1412-I1416 PolarHBondContact O-N 3.23Å; I1413-I1416 PolarHBondContact O-N 3.08Å; I1416-L1419 PolarHBondContact O-N 3Å; I1416-K1420 WeakPolarHBondContact O-CB 3.26Å; I1416-K1420 PolarHBondContact O-N 3.15Å; I1416-L1427 HydrophobicContact CG1-CD2 4.4Å
1417	K	84.2	Confident	76	Confident	118 Å²	118	61.1 Å²	61.1	51%	0.513	31%	0.311	S	S	.	.	H	α-helix	trans	-60.2	-47.4	178.6	-178.2	178.5	171.8	-174.3	0	110.5	I1413 F1415 L1419 K1420 E1421	I1413-K1417 VanDerWaalsContact O-CB 3.23Å; I1413-K1417 WeakPolarHBondContact O-CB 3.34Å; I1413-K1417 PolarHBondContact O-N 3.14Å; F1415-K1417 VanDerWaalsContact C-N 3.32Å; F1415-K1417 PolarHBondContact O-N 2.79Å; K1417-L1419 PolarHBondContact O-N 3.29Å; K1417-K1420 PolarHBondContact O-N 3.47Å; K1417-E1421 WeakPolarHBondContact CE-OE1 3.46Å; K1417-E1421 HydrophobicContact CG-CG 4.33Å; K1417-E1421 WeakPolarHBondContact CG-OE1 3.35Å; K1417-E1421 IonicContact NZ-OE1 3.9Å; K1417-E1421 WeakPolarHBondContact O-CB 3.4Å; K1417-E1421 VanDerWaalsContact O-CG 3.31Å; K1417-E1421 WeakPolarHBondContact O-CG 3.34Å; K1417-E1421 PolarHBondContact O-N 3.28Å
1418	H	86.8	Confident	77.3	Confident	44 Å²	44	60.7 Å²	60.7	20%	0.204	31%	0.309	C	S	.	.	H	α-helix	trans	-58.8	-46.6	176	178.8	75.8	0	0	0	112.6	A1257 Y1261 D1414 F1415 K1420 E1421 T1422	A1257-H1418 PolarHBondContact O-CD2 3.25Å; A1257-H1418 PolarHBondContact O-NE2 3.48Å; Y1261-H1418 HydrophobicContact CD2-CB 4.14Å; D1414-H1418 VanDerWaalsContact O-CB 3.25Å; D1414-H1418 WeakPolarHBondContact O-CB 3.35Å; D1414-H1418 PolarHBondContact O-N 3.34Å; F1415-H1418 PolarHBondContact O-N 3.21Å; H1418-K1420 VanDerWaalsContact C-N 3.32Å; H1418-K1420 PolarHBondContact O-N 2.79Å; H1418-E1421 PolarHBondContact O-N 2.79Å; H1418-T1422 WeakPolarHBondContact O-CB 3.48Å; H1418-T1422 VanDerWaalsContact O-CG2 3.31Å; H1418-T1422 WeakPolarHBondContact O-CG2 3.35Å; H1418-T1422 PolarHBondContact O-N 3.16Å; H1418-T1422 PolarHBondContact O-OG1 3.41Å
1419	L	85.7	Confident	79.3	Confident	1 Å²	1	62 Å²	62	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-63.8	-36.2	177.1	-72.1	178.7	0	0	0	112.9	F1234 A1257 F1415 I1416 K1417 T1422 G1423 V1424 L1427	F1234-L1419 HydrophobicContact CE1-CD1 4.07Å; F1234-L1419 HydrophobicContact CZ-CD1 4.19Å; A1257-L1419 HydrophobicContact CB-CD2 4.06Å; F1415-L1419 HydrophobicContact CD1-CD1 4.04Å; F1415-L1419 HydrophobicContact CD2-CG 4.46Å; F1415-L1419 HydrophobicContact CE1-CD1 3.45Å; F1415-L1419 VanDerWaalsContact CE1-CD1 3.45Å; F1415-L1419 HydrophobicContact CE1-CG 4.3Å; F1415-L1419 HydrophobicContact CE2-CD1 4.08Å; F1415-L1419 HydrophobicContact CE2-CD2 4.3Å; F1415-L1419 HydrophobicContact CE2-CG 4.08Å; F1415-L1419 HydrophobicContact CZ-CD1 3.48Å; F1415-L1419 VanDerWaalsContact CZ-CD1 3.48Å; F1415-L1419 HydrophobicContact CZ-CD2 4.27Å; F1415-L1419 HydrophobicContact CZ-CG 3.99Å; F1415-L1419 WeakPolarHBondContact O-CG 3.19Å; F1415-L1419 PolarHBondContact O-N 2.85Å; I1416-L1419 PolarHBondContact O-N 3Å; K1417-L1419 PolarHBondContact O-N 3.29Å; L1419-T1422 VanDerWaalsContact CA-OG1 3.3Å; L1419-T1422 WeakPolarHBondContact CA-OG1 2.93Å; L1419-T1422 PolarHBondContact O-OG1 3.43Å; L1419-G1423 PolarHBondContact O-N 3.22Å; L1419-V1424 HydrophobicContact CB-CB 4.48Å; L1419-V1424 HydrophobicContact CD2-CB 4.29Å; L1419-V1424 HydrophobicContact CD2-CG1 4.44Å; L1419-V1424 HydrophobicContact CD2-CG2 4.05Å; L1419-V1424 PolarHBondContact O-N 3Å; L1419-L1427 HydrophobicContact CD1-CB 4.3Å; L1419-L1427 HydrophobicContact CD1-CD2 3.96Å
1420	K	80.1	Confident	80.7	Confident	130 Å²	130	58.2 Å²	58.2	57%	0.565	30%	0.295	S	S	*	.	H	α-helix	trans	-72	-43	176.9	-170.4	174.1	-177.9	174	0	111.9	I1416 K1417 H1418 T1422 G1423	I1416-K1420 WeakPolarHBondContact O-CB 3.26Å; I1416-K1420 PolarHBondContact O-N 3.15Å; K1417-K1420 PolarHBondContact O-N 3.47Å; H1418-K1420 VanDerWaalsContact C-N 3.32Å; H1418-K1420 PolarHBondContact O-N 2.79Å; K1420-T1422 VanDerWaalsContact C-N 3.34Å; K1420-G1423 PolarHBondContact O-N 3.08Å; K1420-G1423 VanDerWaalsContact O-N 3.09Å
1421	E	81.1	Confident	81.1	Confident	138 Å²	138	59.2 Å²	59.2	65%	0.645	30%	0.3	S	S	*	.	H	α-helix	trans	-66.6	-35.4	177.8	-74.8	177.1	174.2	0	0	112.2	K1417 H1418 G1423	K1417-E1421 WeakPolarHBondContact CE-OE1 3.46Å; K1417-E1421 HydrophobicContact CG-CG 4.33Å; K1417-E1421 WeakPolarHBondContact CG-OE1 3.35Å; K1417-E1421 IonicContact NZ-OE1 3.9Å; K1417-E1421 WeakPolarHBondContact O-CB 3.4Å; K1417-E1421 VanDerWaalsContact O-CG 3.31Å; K1417-E1421 WeakPolarHBondContact O-CG 3.34Å; K1417-E1421 PolarHBondContact O-N 3.28Å; H1418-E1421 PolarHBondContact O-N 2.79Å; E1421-G1423 PolarHBondContact O-N 3.17Å
1422	T	79.5	Confident	81.3	Confident	45 Å²	45	59.3 Å²	59.3	28%	0.276	30%	0.3	S	S	.	.	H	α-helix	trans	-73	-17.3	172.2	50.7	0	0	0	0	112.9	A1257 H1418 L1419 K1420	A1257-T1422 HydrophobicContact CB-CG2 3.97Å; H1418-T1422 WeakPolarHBondContact O-CB 3.48Å; H1418-T1422 VanDerWaalsContact O-CG2 3.31Å; H1418-T1422 WeakPolarHBondContact O-CG2 3.35Å; H1418-T1422 PolarHBondContact O-N 3.16Å; H1418-T1422 PolarHBondContact O-OG1 3.41Å; L1419-T1422 VanDerWaalsContact CA-OG1 3.3Å; L1419-T1422 WeakPolarHBondContact CA-OG1 2.93Å; L1419-T1422 PolarHBondContact O-OG1 3.43Å; K1420-T1422 VanDerWaalsContact C-N 3.34Å
1423	G	75.1	Confident	81.4	Confident	31 Å²	31	61.2 Å²	61.2	32%	0.32	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	19.9	175.5	0	0	0	0	0	114.7	L1419 K1420 E1421 G1425	L1419-G1423 PolarHBondContact O-N 3.22Å; K1420-G1423 PolarHBondContact O-N 3.08Å; K1420-G1423 VanDerWaalsContact O-N 3.09Å; E1421-G1423 PolarHBondContact O-N 3.17Å; G1423-G1425 VanDerWaalsContact C-N 3.3Å
1424	V	75.3	Confident	81.4	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.012	29%	0.29	C	S	.	.			trans	-67	-33.4	177.4	177.1	0	0	0	0	111.4	F1234 W1242 L1253 L1254 A1257 F1290 L1419	F1234-V1424 HydrophobicContact CD1-CG1 4.28Å; F1234-V1424 HydrophobicContact CE1-CG1 3.64Å; F1234-V1424 HydrophobicContact CZ-CG1 4.01Å; W1242-V1424 WeakPolarHBondContact CZ2-O 3.23Å; W1242-V1424 PolarHBondContact NE1-O 2.85Å; L1253-V1424 HydrophobicContact CD2-CG2 4.48Å; L1253-V1424 HydrophobicContact CG-CG2 4.15Å; L1254-V1424 HydrophobicContact CB-CG1 4.23Å; L1254-V1424 HydrophobicContact CD1-CG1 3.59Å; L1254-V1424 HydrophobicContact CG-CG1 4.49Å; A1257-V1424 HydrophobicContact CB-CG2 3.94Å; F1290-V1424 HydrophobicContact CZ-CG1 4.36Å; L1419-V1424 HydrophobicContact CB-CB 4.48Å; L1419-V1424 HydrophobicContact CD2-CB 4.29Å; L1419-V1424 HydrophobicContact CD2-CG1 4.44Å; L1419-V1424 HydrophobicContact CD2-CG2 4.05Å; L1419-V1424 PolarHBondContact O-N 3Å
1425	G	75.2	Confident	81.1	Confident	9 Å²	9	55.1 Å²	55.1	9%	0.093	27%	0.27	C	S	.	.			trans	132.1	-171.6	-179.6	0	0	0	0	0	111.8	G1423	G1423-G1425 VanDerWaalsContact C-N 3.3Å
1426	Q	78.3	Confident	80.5	Confident	104 Å²	104	56.5 Å²	56.5	49%	0.486	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	114.6	176.7	-176.6	165.2	-7.5	0	0	109.6	F1234 S1235 D1428	F1234-Q1426 VanDerWaalsContact CA-O 3.3Å; F1234-Q1426 WeakPolarHBondContact CA-O 3.36Å; S1235-Q1426 PolarHBondContact N-O 3.35Å; Q1426-D1428 PolarHBondContact O-N 3.3Å
1427	L	82	Confident	79.7	Confident	10 Å²	10	55.5 Å²	55.5	5%	0.052	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	117.1	174.1	-178.9	71.5	0	0	0	108.9	M1232 F1234 P1411 F1415 I1416 L1419 E1429 I1430	M1232-L1427 HydrophobicContact CB-CD1 3.78Å; M1232-L1427 HydrophobicContact CG-CD1 4.05Å; M1232-L1427 HydrophobicContact SD-CD1 4.49Å; F1234-L1427 HydrophobicContact CD1-CB 4.2Å; F1234-L1427 HydrophobicContact CD1-CD1 4.19Å; F1234-L1427 HydrophobicContact CD2-CD1 4.29Å; F1234-L1427 HydrophobicContact CE1-CB 4Å; F1234-L1427 HydrophobicContact CE1-CD1 3.82Å; F1234-L1427 HydrophobicContact CE2-CD1 3.93Å; F1234-L1427 HydrophobicContact CG-CD1 4.42Å; F1234-L1427 HydrophobicContact CZ-CD1 3.68Å; P1411-L1427 HydrophobicContact CB-CD2 3.55Å; P1411-L1427 HydrophobicContact CG-CD2 3.78Å; P1411-L1427 HydrophobicContact CG-CG 4.27Å; F1415-L1427 HydrophobicContact CD1-CD2 4Å; F1415-L1427 HydrophobicContact CE1-CD2 3.78Å; I1416-L1427 HydrophobicContact CG1-CD2 4.4Å; L1419-L1427 HydrophobicContact CD1-CB 4.3Å; L1419-L1427 HydrophobicContact CD1-CD2 3.96Å; L1427-E1429 WeakPolarHBondContact CD1-O 3.2Å; L1427-I1430 HydrophobicContact CD2-CB 4.44Å
1428	D	78.1	Confident	79.2	Confident	90 Å²	90	50.3 Å²	50.3	48%	0.481	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-41.7	179.6	-64	-28.3	0	0	0	111.4	H1233 S1235 Q1426	H1233-D1428 PolarHBondContact O-N 3.37Å; S1235-D1428 WeakPolarHBondContact CB-OD2 3.35Å; S1235-D1428 PolarHBondContact N-OD2 3.17Å; S1235-D1428 PolarHBondContact OG-OD1 3.3Å; S1235-D1428 PolarHBondContact OG-OD2 3.21Å; Q1426-D1428 PolarHBondContact O-N 3.3Å
1429	E	79.9	Confident	78.6	Confident	104 Å²	104	53.3 Å²	53.3	49%	0.486	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	145.5	-173.5	-171.5	176.1	-162.4	0	0	111.7	M1232 H1233 L1427	M1232-E1429 CarbonylContact C-O 3.55Å; M1232-E1429 WeakPolarHBondContact CA-O 3.44Å; H1233-E1429 HydrophobicContact CB-CB 4.2Å; H1233-E1429 PolarHBondContact N-O 3.33Å; H1233-E1429 IonicContact ND1-OE2 2.67Å; H1233-E1429 PolarHBondContact O-N 3.25Å; L1427-E1429 WeakPolarHBondContact CD1-O 3.2Å
1430	I	84.8	Confident	77.2	Confident	9 Å²	9	60.7 Å²	60.7	5%	0.046	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.7	172	-174.6	173.8	0	0	0	109.3	V1230 V1231 M1232 L1400 L1401 P1411 F1415 L1427	V1230-I1430 HydrophobicContact CG1-CD1 4.12Å; V1230-I1430 HydrophobicContact CG1-CG1 3.97Å; V1231-I1430 CarbonylContact O-C 3.55Å; V1231-I1430 VanDerWaalsContact O-CA 3.31Å; V1231-I1430 WeakPolarHBondContact O-CA 3.07Å; M1232-I1430 HydrophobicContact CE-CD1 3.45Å; M1232-I1430 VanDerWaalsContact CE-CD1 3.45Å; M1232-I1430 HydrophobicContact CE-CG1 4.12Å; M1232-I1430 HydrophobicContact CG-CB 4.3Å; M1232-I1430 HydrophobicContact CG-CD1 4.2Å; M1232-I1430 HydrophobicContact CG-CG1 3.86Å; L1400-I1430 HydrophobicContact CB-CD1 3.92Å; L1400-I1430 HydrophobicContact CD1-CD1 4.44Å; L1401-I1430 HydrophobicContact CD2-CB 4.29Å; L1401-I1430 HydrophobicContact CD2-CD1 4.12Å; L1401-I1430 HydrophobicContact CD2-CG1 4.11Å; L1401-I1430 HydrophobicContact CD2-CG2 3.29Å; P1411-I1430 HydrophobicContact CB-CB 4.35Å; P1411-I1430 HydrophobicContact CB-CG2 3.44Å; P1411-I1430 VanDerWaalsContact CB-CG2 3.44Å; P1411-I1430 HydrophobicContact CG-CB 4.4Å; P1411-I1430 HydrophobicContact CG-CG2 3.55Å; F1415-I1430 HydrophobicContact CE1-CD1 4.03Å; L1427-I1430 HydrophobicContact CD2-CB 4.44Å
1431	Q	80	Confident	75.6	Confident	89 Å²	89	60.5 Å²	60.5	42%	0.416	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	135.4	177.2	-174	-179.3	-3.6	0	0	109.6	V1230 V1231 E1433	V1230-Q1431 CarbonylContact C-O 3.55Å; V1230-Q1431 WeakPolarHBondContact CA-O 3Å; V1231-Q1431 HydrophobicContact CB-CB 4.44Å; V1231-Q1431 PolarHBondContact N-O 3.49Å; V1231-Q1431 PolarHBondContact O-N 3.04Å; Q1431-E1433 HydrophobicContact CG-CG 4.32Å
1432	I	82.3	Confident	73.5	Confident	16 Å²	16	62 Å²	62	8%	0.082	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	120.4	173.5	-59.1	177.5	0	0	0	107.7	V1230 E1397 L1400 L1401	V1230-I1432 HydrophobicContact CG1-CG1 4.06Å; V1230-I1432 HydrophobicContact CG2-CG1 4.04Å; V1230-I1432 HydrophobicContact CG2-CG2 4.46Å; E1397-I1432 HydrophobicContact CB-CD1 4.28Å; E1397-I1432 HydrophobicContact CG-CB 4.39Å; E1397-I1432 HydrophobicContact CG-CD1 3.79Å; E1397-I1432 HydrophobicContact CG-CG2 4.09Å; L1400-I1432 HydrophobicContact CB-CD1 4.13Å; L1400-I1432 HydrophobicContact CD1-CD1 3.91Å; L1401-I1432 HydrophobicContact CD1-CB 4.37Å; L1401-I1432 HydrophobicContact CD1-CD1 3.57Å; L1401-I1432 HydrophobicContact CD1-CG1 3.91Å; L1401-I1432 HydrophobicContact CG-CD1 3.87Å; L1401-I1432 HydrophobicContact CG-CG1 4.42Å
1433	E	81.5	Confident	71.2	Confident	51 Å²	51	69.4 Å²	69.4	24%	0.238	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	119.7	178.7	-63.8	-175.8	173	0	0	109.2	H1228 R1229 Q1431	H1228-E1433 CarbonylContact C-O 3.46Å; H1228-E1433 WeakPolarHBondContact CA-O 3.12Å; R1229-E1433 HydrophobicContact CG-CB 3.98Å; R1229-E1433 IonicContact CZ-OE2 3.48Å; R1229-E1433 PolarHBondContact N-O 3.26Å; R1229-E1433 IonicContact NE-OE2 2.72Å; R1229-E1433 PolarHBondContact NE-OE2 2.91Å; R1229-E1433 IonicContact NH2-OE2 3.61Å; R1229-E1433 PolarHBondContact NH2-OE2 3.46Å; R1229-E1433 PolarHBondContact O-N 2.9Å; Q1431-E1433 HydrophobicContact CG-CG 4.32Å
1434	R	82.3	Confident	69.3	Low	79 Å²	79	71.7 Å²	71.7	30%	0.298	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	130.4	172.6	-61.7	-176.9	179.2	-164.7	-2.3	109.6	E1390 I1393 E1397 C1438	E1390-R1434 VanDerWaalsContact CD-NH1 3.34Å; E1390-R1434 IonicContact OE1-CZ 3.59Å; E1390-R1434 IonicContact OE1-NH1 3.93Å; E1390-R1434 PolarHBondContact OE1-NH1 3.29Å; E1390-R1434 IonicContact OE1-NH2 3.19Å; E1390-R1434 PolarHBondContact OE1-NH2 2.76Å; E1390-R1434 IonicContact OE2-NH1 3.13Å; E1390-R1434 PolarHBondContact OE2-NH1 2.97Å; I1393-R1434 HydrophobicContact CG2-CG 4.25Å; E1397-R1434 IonicContact OE1-CZ 3.62Å; E1397-R1434 IonicContact OE1-NE 2.73Å; E1397-R1434 PolarHBondContact OE1-NE 3.07Å; E1397-R1434 IonicContact OE1-NH2 3.93Å; E1397-R1434 PolarHBondContact OE1-NH2 3.18Å; E1397-R1434 IonicContact OE2-CZ 2.75Å; E1397-R1434 IonicContact OE2-NE 3.74Å; E1397-R1434 IonicContact OE2-NH2 2.83Å; E1397-R1434 PolarHBondContact OE2-NH2 3.27Å; R1434-C1438 HydrophobicContact CB-CB 4.32Å
1435	L	78	Confident	67.1	Low	33 Å²	33	76.8 Å²	76.8	17%	0.173	41%	0.405	C	S	.	.			trans	-128.6	167.5	-170.1	-63.7	179.8	0	0	0	111.6	F1226 N1227 R1229 C1438	F1226-L1435 CarbonylContact O-C 3.5Å; F1226-L1435 VanDerWaalsContact O-C 3.31Å; F1226-L1435 WeakPolarHBondContact O-CB 3.17Å; N1227-L1435 CarbonylContact C-O 3.57Å; N1227-L1435 VanDerWaalsContact CA-O 3.29Å; N1227-L1435 WeakPolarHBondContact CA-O 3.14Å; N1227-L1435 PolarHBondContact O-N 3.31Å; R1229-L1435 HydrophobicContact CB-CD1 4.07Å; R1229-L1435 HydrophobicContact CG-CD1 3.66Å; R1229-L1435 HydrophobicContact CG-CG 4.41Å; L1435-C1438 WeakPolarHBondContact O-CB 3.38Å; L1435-C1438 PolarHBondContact O-N 3.48Å; L1435-C1438 VanDerWaalsContact O-N 3.14Å
1436	G	76.1	Confident	65	Low	29 Å²	29	81.7 Å²	81.7	30%	0.299	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	54.3	-126.9	174.8	0	0	0	0	0	113.7	F1226 C1438 I1439	F1226-G1436 PolarHBondContact O-N 3.04Å; G1436-C1438 PolarHBondContact O-N 3.44Å; G1436-I1439 VanDerWaalsContact N-CD1 3.33Å; G1436-I1439 WeakPolarHBondContact O-CB 3.12Å; G1436-I1439 WeakPolarHBondContact O-CD1 3.43Å; G1436-I1439 WeakPolarHBondContact O-CG1 3.42Å; G1436-I1439 PolarHBondContact O-N 3.32Å
1437	P	67.6	Low	62.7	Low	33 Å²	33	84.5 Å²	84.5	21%	0.214	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-65.9	-18.3	-176.8	27.3	-33	0	0	0	113.8	T1385 I1439	T1385-P1437 VanDerWaalsContact O-CB 3.23Å; T1385-P1437 WeakPolarHBondContact O-CB 3.36Å; P1437-I1439 VanDerWaalsContact C-N 3.26Å; P1437-I1439 PolarHBondContact O-N 3.12Å
1438	C	73.7	Confident	60	Low	9 Å²	9	92.7 Å²	92.7	6%	0.061	49%	0.487	C	S	.	.	G	3₁₀ helix	trans	-84	5.6	179.1	-62.2	0	0	0	0	114.1	C1388 I1393 R1434 L1435 G1436 Q1440	C1388-C1438 VanDerWaalsContact CA-SG 3.55Å; C1388-C1438 HydrophobicContact CB-CB 3.87Å; C1388-C1438 WeakPolarHBondContact CB-SG 3.23Å; C1388-C1438 WeakPolarHBondContact SG-CA 3.41Å; C1388-C1438 WeakPolarHBondContact SG-CB 3.33Å; C1388-C1438 CovalentContact SG-SG 2.01Å; C1388-C1438 PolarHBondContact SG-SG 3.26Å; I1393-C1438 HydrophobicContact CD1-CB 4.04Å; I1393-C1438 WeakPolarHBondContact CD1-SG 3.34Å; R1434-C1438 HydrophobicContact CB-CB 4.32Å; L1435-C1438 WeakPolarHBondContact O-CB 3.38Å; L1435-C1438 PolarHBondContact O-N 3.48Å; L1435-C1438 VanDerWaalsContact O-N 3.14Å; G1436-C1438 PolarHBondContact O-N 3.44Å; C1438-Q1440 VanDerWaalsContact C-N 3.33Å
1439	I	73.6	Confident	57.7	Low	108 Å²	108	95.8 Å²	95.8	55%	0.554	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-75.9	-18.1	178.5	-69.4	170	0	0	0	112.2	G1436 P1437 T1441	G1436-I1439 VanDerWaalsContact N-CD1 3.33Å; G1436-I1439 WeakPolarHBondContact O-CB 3.12Å; G1436-I1439 WeakPolarHBondContact O-CD1 3.43Å; G1436-I1439 WeakPolarHBondContact O-CG1 3.42Å; G1436-I1439 PolarHBondContact O-N 3.32Å; P1437-I1439 VanDerWaalsContact C-N 3.26Å; P1437-I1439 PolarHBondContact O-N 3.12Å; I1439-T1441 PolarHBondContact O-N 3.04Å
1440	Q	56	Low	55.2	Low	156 Å²	156	96.5 Å²	96.5	73%	0.729	52%	0.515	S	S	*	.			trans	-64.6	118.6	-169.9	-69.5	-169.2	19.3	0	0	113.5	C1438	C1438-Q1440 VanDerWaalsContact C-N 3.33Å
1441	T	47.8	Very low	52.6	Low	126 Å²	126	99.2 Å²	99.2	77%	0.773	55%	0.546	S	S	*	.			trans	-68	132.5	179.8	40.5	0	0	0	0	112.1	I1439 K1443	I1439-T1441 PolarHBondContact O-N 3.04Å; T1441-K1443 PolarHBondContact O-N 3.5Å
1442	H	35.6	Very low	50.2	Low	170 Å²	170	101.4 Å²	101.4	79%	0.787	57%	0.568	S	S	*	*			trans	-46	109.8	172.8	-81.7	-93.5	0	0	0	111.1	A1444	H1442-A1444 PolarHBondContact O-N 2.88Å
1443	K	32.6	Very low	47.5	Very low	199 Å²	199	103.5 Å²	103.5	87%	0.865	59%	0.593	S	S	*	*			trans	-64.8	112.4	174	-76	-179.9	177.1	175.6	0	109.4	T1441	T1441-K1443 PolarHBondContact O-N 3.5Å
1444	A	33.9	Very low	45	Very low	79 Å²	79	111.2 Å²	111.2	65%	0.653	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-60.5	138	168.3	0	0	0	0	0	110.5	H1442	H1442-A1444 PolarHBondContact O-N 2.88Å
1445	P	30.4	Very low	42.3	Very low	109 Å²	109	117.3 Å²	117.3	71%	0.708	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-67.3	148.4	177.1	28.2	-32.1	0	0	0	110.7	I1447	P1445-I1447 PolarHBondContact O-N 3.37Å
1446	P	31	Very low	40	Very low	113 Å²	113	119.1 Å²	119.1	73%	0.734	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-70.1	118	-172.3	28.3	-32.8	0	0	0	110.6	F1448	P1446-F1448 PolarHBondContact O-N 3.31Å; P1446-F1448 VanDerWaalsContact O-N 3.08Å
1447	I	29.2	Very low	37.7	Very low	162 Å²	162	124.8 Å²	124.8	83%	0.831	71%	0.708	S	S	*	*			trans	-73.3	100.7	173.1	-61	171.3	0	0	0	107.7	P1445 I1449	P1445-I1447 PolarHBondContact O-N 3.37Å; I1447-I1449 PolarHBondContact O-N 2.94Å
1448	F	26	Very low	35.8	Very low	182 Å²	182	130.9 Å²	130.9	80%	0.798	73%	0.734	S	S	*	*			trans	-62.1	122.4	162.5	-96.6	-98	0	0	0	108.7	P1446 P1450	P1446-F1448 PolarHBondContact O-N 3.31Å; P1446-F1448 VanDerWaalsContact O-N 3.08Å; F1448-P1450 VanDerWaalsContact O-CD 3.27Å; F1448-P1450 WeakPolarHBondContact O-CD 3.49Å
1449	I	29.3	Very low	33.5	Very low	156 Å²	156	138.4 Å²	138.4	80%	0.8	77%	0.768	S	S	*	*			trans	-78	109.2	168.9	-58.4	170.7	0	0	0	106.3	I1447 G1451	I1447-I1449 PolarHBondContact O-N 2.94Å; I1449-G1451 PolarHBondContact O-N 2.77Å
1450	P	27.2	Very low	31	Very low	118 Å²	118	140.6 Å²	140.6	77%	0.766	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-82.5	116.7	-179.4	23.5	-11.3	0	0	0	108.7	F1448	F1448-P1450 VanDerWaalsContact O-CD 3.27Å; F1448-P1450 WeakPolarHBondContact O-CD 3.49Å
1451	G	30.9	Very low	29.6	Very low	66 Å²	66	143.2 Å²	143.2	68%	0.68	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-63.5	146.2	165.6	0	0	0	0	0	110.6	I1449	I1449-G1451 PolarHBondContact O-N 2.77Å
1452	P	29	Very low	28.4	Very low	135 Å²	135	143.1 Å²	143.1	88%	0.877	78%	0.781	S	S	*	*	S	Bend	trans	-80.3	133.5	-173.6	32.2	-31.7	0	0	0	111
1453	G	25.6	Very low	28	Very low	60 Å²	60	140.8 Å²	140.8	62%	0.619	78%	0.781	S	S	*	*			trans	99	106	164.7	0	0	0	0	0	113.4
1454	F	29.3	Very low	27.5	Very low	214 Å²	214	137.3 Å²	137.3	94%	0.939	77%	0.771	S	S	*	*				-175.3	117.7	102.6	-94.3	-75	0	0	0	107.3
1455	E	25.4	Very low	27.1	Very low	206 Å²	206	141.8 Å²	141.8	96%	0.963	77%	0.773	S	S	*	*			trans	-57.9	130.8	166.8	-72.6	169.5	141.1	0	0	109.3
1456	G	30.6	Very low	26.7	Very low	71 Å²	71	143 Å²	143	73%	0.732	77%	0.769	S	S	*	*			trans	-173.2	109.3	177.7	0	0	0	0	0	111.4
1457	N	26.6	Very low	26.5	Very low	149 Å²	149	142.8 Å²	142.8	80%	0.797	76%	0.761	S	S	*	*			trans	-58	154.9	-175.8	-59.4	-40.1	0	0	0	115.3
1458	H	27.6	Very low	26.2	Very low	161 Å²	161	143.5 Å²	143.5	75%	0.745	76%	0.759	S	S	*	*			trans	137.3	102.2	144.8	-76.1	-53.9	0	0	0	111.8
1459	E	25.3	Very low	26.3	Very low	166 Å²	166	146.3 Å²	146.3	78%	0.776	76%	0.764	S	S	*	*				85.8	107.2	93.2	-83.9	-176.3	-174.3	0	0	114.1
1460	M	22.9	Very low	25.9	Very low	154 Å²	154	146.3 Å²	146.3	76%	0.759	76%	0.76	S	S	*	*				60.5	105.7	127.6	-128.8	174.1	82.9	0	0	118.7
1461	F	26.1	Very low	25.9	Very low	212 Å²	212	152.1 Å²	152.1	93%	0.93	77%	0.769	S	S	*	*			trans	-147.4	107.8	133.7	-92.5	-72.9	0	0	0	110.4
1462	I	21.3	Very low	25.5	Very low	124 Å²	124	156.7 Å²	156.7	64%	0.636	77%	0.77	S	S	*	*			trans	-100.2	134.1	168	-65	167.7	0	0	0	107.5	N1464	I1462-N1464 HydrophobicContact CG2-CB 4.16Å
1463	P	27.2	Very low	25.3	Very low	121 Å²	121	158.5 Å²	158.5	79%	0.786	77%	0.767	S	S	*	*			trans	-120.5	100.7	144.4	28.7	-13.4	0	0	0	107.9
1464	N	23.7	Very low	25.2	Very low	125 Å²	125	159.8 Å²	159.8	67%	0.668	77%	0.766	S	S	*	*				36.7	123.9	70.6	-84.4	7.6	0	0	0	112.5	I1462	I1462-N1464 HydrophobicContact CG2-CB 4.16Å
1465	Y	24.5	Very low	24.9	Very low	174 Å²	174	155.2 Å²	155.2	68%	0.682	76%	0.755	S	S	*	*			cis	-160.6	137	12.2	-122.7	-121.1	0	0	0	104.3
1466	E	23	Very low	24.9	Very low	135 Å²	135	151.4 Å²	151.4	63%	0.631	74%	0.742	S	S	*	*				77.6	136.9	82.1	-132.2	-170.2	-137.5	0	0	116.5
1467	N	25.4	Very low	24.5	Very low	108 Å²	108	153.6 Å²	153.6	58%	0.578	75%	0.746	S	S	*	*			trans	97.3	103.1	148.7	-69	-35	0	0	0	123.3
1468	K	23	Very low	24.6	Very low	177 Å²	177	150 Å²	150	77%	0.77	75%	0.745	S	S	*	*				50.6	130.4	108.7	-70.8	-177.9	177.2	178.4	0	120.3
1469	R	27.6	Very low	25.5	Very low	241 Å²	241	148.4 Å²	148.4	91%	0.909	75%	0.748	S	S	*	*			trans	-175.6	93.9	136.6	-95.4	162	-166.2	-158	4.3	105.9
1470	E	22.2	Very low	25.7	Very low	156 Å²	156	146.5 Å²	146.5	73%	0.729	75%	0.753	S	S	*	*				41.7	97.8	81.7	-121.8	-179.1	177.4	0	0	112.9
1471	Y	26.9	Very low	25.8	Very low	239 Å²	239	142.3 Å²	142.3	94%	0.937	75%	0.75	S	S	*	*			trans	-129.2	123.2	148.6	-108.9	-87.6	0	0	0	108
1472	K	21.7	Very low	25.6	Very low	162 Å²	162	137.9 Å²	137.9	70%	0.704	75%	0.745	S	S	*	*			trans	-111.6	173.8	-170.9	-155.5	176.5	-171.9	174.5	0	106.5
1473	E	25.4	Very low	26	Very low	174 Å²	174	137.2 Å²	137.2	81%	0.813	75%	0.751	S	S	*	*			trans	84.7	136.2	163.8	-68	178.5	169.3	0	0	116.5
1474	S	23.1	Very low	25.9	Very low	86 Å²	86	136.2 Å²	136.2	60%	0.601	75%	0.747	S	S	*	*			cis	156.8	157.6	-19.1	46.5	0	0	0	0	105.2
1475	V	23.4	Very low	26	Very low	118 Å²	118	135.4 Å²	135.4	72%	0.715	75%	0.751	S	S	*	*			trans	73.5	136.9	143.8	157.7	0	0	0	0	114.7
1476	D	24.5	Very low	27.1	Very low	126 Å²	126	132.3 Å²	132.3	67%	0.674	75%	0.752	S	S	*	*			cis	-173.2	158.1	-0.9	-107.9	-16.6	0	0	0	107.6
1477	S	24	Very low	27.1	Very low	117 Å²	117	131 Å²	131	82%	0.818	76%	0.758	S	S	*	*			trans	64.4	133.6	136.1	68.7	0	0	0	0	122
1478	G	27.5	Very low	27.1	Very low	75 Å²	75	134.5 Å²	134.5	77%	0.773	78%	0.776	S	S	*	*			trans	156.5	100.4	148.3	0	0	0	0	0	116.3
1479	P	46.9	Very low	27.2	Very low	127 Å²	127	130.6 Å²	130.6	83%	0.825	77%	0.771	S	S	*	*			trans	-100.9	156.4	-177.6	37.5	-30.5	0	0	0	113.8
1480	S	28.8	Very low	27	Very low	125 Å²	125	124 Å²	124	87%	0.874	76%	0.761	S	S	*	*			trans	-177.1	121.7	152.7	39.9	0	0	0	0	107.6
1481	G	25.2	Very low	27.2	Very low	67 Å²	67	125.1 Å²	125.1	69%	0.691	77%	0.772	S	S	*	*				105.8	92.4	74.3	0	0	0	0	0	108.2
1482	S	23.2	Very low	27	Very low	118 Å²	118	118.5 Å²	118.5	83%	0.825	76%	0.761	S	S	*	*				79.2	114.3	99.5	67.3	0	0	0	0	115.9
1483	S	28.9	Very low	27.3	Very low	110 Å²	110	118 Å²	118	77%	0.769	77%	0.771	S	S	*	*			trans	-179.1	102.4	143.5	43.6	0	0	0	0	109.9
1484	S	26	Very low	27.3	Very low	100 Å²	100	115 Å²	115	70%	0.699	77%	0.769	S	S	*	*				75.5	97	103	67.6	0	0	0	0	114.5
1485	S	24.4	Very low	27.7	Very low	108 Å²	108	116.1 Å²	116.1	76%	0.755	78%	0.777	S	S	*	*				92.4	163.1	89.9	67	0	0	0	0	113.6
1486	P	47.7	Very low	28.1	Very low	109 Å²	109	118.1 Å²	118.1	71%	0.708	78%	0.782	S	S	*	*			cis	-137	166.4	-46.7	38.5	-21.6	0	0	0	114
1487	S	22.9	Very low	28.6	Very low	107 Å²	107	120 Å²	120	75%	0.748	79%	0.787	S	S	*	*			trans	36.7	119.7	144.9	63.8	0	0	0	0	121.6
1488	L	26.7	Very low	29.4	Very low	182 Å²	182	122.1 Å²	122.1	95%	0.953	79%	0.789	S	S	*	*			trans	-130.8	131.5	140.5	-151.1	80	0	0	0	109.5
1489	S	24.8	Very low	29.9	Very low	95 Å²	95	127 Å²	127	66%	0.664	79%	0.792	S	S	*	*			trans	-100.6	148.8	-160.2	48.1	0	0	0	0	113.7
1490	S	23.6	Very low	29.5	Very low	102 Å²	102	127.9 Å²	127.9	71%	0.713	79%	0.787	S	S	*	*			trans	51.3	116.4	138.8	64.7	0	0	0	0	120.3
1491	L	25.3	Very low	30.1	Very low	181 Å²	181	128 Å²	128	95%	0.948	78%	0.778	S	S	*	*			trans	-131.6	120.5	139.6	-147.6	79.8	0	0	0	109.3
1492	S	23.8	Very low	31.2	Very low	100 Å²	100	127.4 Å²	127.4	70%	0.699	77%	0.771	S	S	*	*			trans	-97	137.6	-173	44.5	0	0	0	0	111.8
1493	T	27.8	Very low	32.3	Very low	150 Å²	150	125.4 Å²	125.4	92%	0.92	76%	0.757	S	S	*	*			trans	-145	99.8	155.2	35.9	0	0	0	0	110.4
1494	S	25.5	Very low	33.1	Very low	111 Å²	111	129.2 Å²	129.2	78%	0.776	76%	0.755	S	S	*	*			trans	-90.5	129.1	170.4	51.1	0	0	0	0	110.6
1495	S	30.2	Very low	34.3	Very low	110 Å²	110	129.9 Å²	129.9	77%	0.769	75%	0.754	S	S	*	*			trans	165.4	128.6	140.1	47.7	0	0	0	0	108.8
1496	I	32.5	Very low	35.6	Very low	161 Å²	161	130.4 Å²	130.4	83%	0.826	75%	0.747	S	S	*	*			trans	138.9	66.1	170.3	-67	151.8	0	0	0	105.8
1497	Q	34	Very low	35.8	Very low	166 Å²	166	131 Å²	131	78%	0.776	74%	0.744	S	S	*	*			trans	-145.6	18.9	170.5	-145.5	143.2	-3.5	0	0	114.9
1498	D	41.1	Very low	37.3	Very low	160 Å²	160	131.8 Å²	131.8	86%	0.856	74%	0.739	S	S	*	*	S	Bend	trans	-107.1	-0.2	173.3	-77.2	-35.1	0	0	0	114.8
1499	E	38.4	Very low	39.2	Very low	178 Å²	178	125.7 Å²	125.7	83%	0.832	72%	0.72	S	S	*	*	S	Bend	trans	-92.7	-4.6	175.7	-100.8	-175.3	161.3	0	0	115.2
1500	M	38.3	Very low	41.5	Very low	146 Å²	146	124.7 Å²	124.7	72%	0.719	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-9.2	-177.1	-91.7	-177.6	146.9	0	0	115.4	S1503	M1500-S1503 PolarHBondContact O-OG 3.36Å
1501	N	42.3	Very low	43.7	Very low	128 Å²	128	124.7 Å²	124.7	68%	0.684	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-7.3	-177.3	-78.1	-21.6	0	0	0	115.1
1502	G	47.7	Very low	46	Very low	54 Å²	54	121.1 Å²	121.1	56%	0.557	68%	0.683	S	S	*	*	S	Bend	trans	-79.3	-30.9	174.3	0	0	0	0	0	114.3	R1504	G1502-R1504 PolarHBondContact O-N 2.83Å
1503	S	47.3	Very low	48.4	Very low	76 Å²	76	119.8 Å²	119.8	53%	0.531	67%	0.672	S	S	.	*	H	α-helix	trans	-78.4	-19.5	-171.7	55.7	0	0	0	0	114.4	M1500	M1500-S1503 PolarHBondContact O-OG 3.36Å
1504	R	45	Very low	51.2	Low	190 Å²	190	117.6 Å²	117.6	72%	0.717	65%	0.653	S	S	*	*	H	α-helix	trans	-71.4	-27.5	179.2	-96.3	-177.4	165.9	-173.2	-3.7	114.1	G1502	G1502-R1504 PolarHBondContact O-N 2.83Å
1505	V	50.7	Low	53.7	Low	113 Å²	113	115 Å²	115	69%	0.685	64%	0.635	S	S	*	*	H	α-helix	trans	-78	-36.1	-176.4	-178.1	0	0	0	0	111.7	G1509	V1505-G1509 PolarHBondContact O-N 3Å
1506	I	52.6	Low	56.4	Low	119 Å²	119	114 Å²	114	61%	0.61	62%	0.62	S	S	*	*	H	α-helix	trans	-70	-38.1	179.4	-60.5	175.3	0	0	0	110.8	T1510	I1506-T1510 PolarHBondContact O-N 2.7Å; I1506-T1510 PolarHBondContact O-OG1 2.93Å
1507	L	52.2	Low	59	Low	121 Å²	121	110.2 Å²	110.2	63%	0.634	61%	0.608	S	S	*	*	I	π-helix	trans	-69.2	-39.3	-175.4	-150.3	114.4	0	0	0	112.6
1508	L	53.4	Low	61.6	Low	124 Å²	124	107 Å²	107	65%	0.649	60%	0.596	S	S	*	*	I	π-helix	trans	-81.3	-34.7	178.5	-95.9	89.5	0	0	0	113.4
1509	G	65.8	Low	63.9	Low	54 Å²	54	104.1 Å²	104.1	56%	0.557	58%	0.579	S	S	*	*	I	π-helix	trans	-76.8	-30.1	-173.4	0	0	0	0	0	114.8	V1505	V1505-G1509 PolarHBondContact O-N 3Å
1510	T	74.7	Confident	66.4	Low	74 Å²	74	101 Å²	101	45%	0.454	57%	0.567	S	S	.	*	I	π-helix	trans	-112.8	-42	-169.2	61.6	0	0	0	0	113.6	I1506 P1513 I1514	I1506-T1510 PolarHBondContact O-N 2.7Å; I1506-T1510 PolarHBondContact O-OG1 2.93Å; T1510-P1513 WeakPolarHBondContact O-CD 3.34Å; T1510-I1514 WeakPolarHBondContact O-CD1 3.46Å; T1510-I1514 WeakPolarHBondContact O-CG1 3.39Å
1511	L	69.4	Low	68.9	Low	102 Å²	102	99.3 Å²	99.3	53%	0.534	56%	0.56	S	S	.	*	I	π-helix	trans	-77.3	-40.4	-171.1	-133.2	93.3	0	0	0	112.4	I1514 C1515	L1511-I1514 PolarHBondContact O-N 2.91Å; L1511-C1515 PolarHBondContact O-N 3.35Å; L1511-C1515 PolarHBondContact O-SG 2.93Å; L1511-C1515 VanDerWaalsContact O-SG 3.4Å
1512	L	73.4	Confident	71	Confident	106 Å²	106	97.9 Å²	97.9	56%	0.555	55%	0.552	S	S	*	*	H	α-helix	trans	-60.1	-46.2	-176.5	-163.6	78.8	0	0	0	113.3	I1514 C1515 I1516	L1512-I1514 VanDerWaalsContact C-N 3.33Å; L1512-I1514 PolarHBondContact O-N 3.39Å; L1512-C1515 PolarHBondContact O-N 2.88Å; L1512-I1516 HydrophobicContact CG-CD1 4.27Å; L1512-I1516 WeakPolarHBondContact O-CG1 3.49Å; L1512-I1516 PolarHBondContact O-N 3.03Å; L1512-I1516 VanDerWaalsContact O-N 3.07Å
1513	P	74	Confident	73	Confident	72 Å²	72	100.5 Å²	100.5	47%	0.468	55%	0.552	S	S	.	*	H	α-helix	trans	-64.8	-34	176.1	7.3	-9.9	0	0	0	113.5	T1510 I1516 S1517	T1510-P1513 WeakPolarHBondContact O-CD 3.34Å; P1513-I1516 PolarHBondContact O-N 3.3Å; P1513-S1517 PolarHBondContact O-N 3.32Å
1514	I	86.1	Confident	74.8	Confident	104 Å²	104	99 Å²	99	53%	0.533	55%	0.549	S	S	.	.	H	α-helix	trans	-66.7	-43.4	177.9	-63.6	170.5	0	0	0	110.3	T1510 L1511 L1512 S1517 L1518	T1510-I1514 WeakPolarHBondContact O-CD1 3.46Å; T1510-I1514 WeakPolarHBondContact O-CG1 3.39Å; L1511-I1514 PolarHBondContact O-N 2.91Å; L1512-I1514 VanDerWaalsContact C-N 3.33Å; L1512-I1514 PolarHBondContact O-N 3.39Å; I1514-S1517 PolarHBondContact O-N 3.28Å; I1514-L1518 HydrophobicContact CG2-CD1 4.42Å; I1514-L1518 PolarHBondContact O-N 3.43Å
1515	C	78.8	Confident	77	Confident	58 Å²	58	94.1 Å²	94.1	39%	0.392	54%	0.536	S	S	.	.	H	α-helix	trans	-62.7	-42	176.1	-69.4	0	0	0	0	112.1	L1511 L1512 S1517 L1518 I1519	L1511-C1515 PolarHBondContact O-N 3.35Å; L1511-C1515 PolarHBondContact O-SG 2.93Å; L1511-C1515 VanDerWaalsContact O-SG 3.4Å; L1512-C1515 PolarHBondContact O-N 2.88Å; C1515-S1517 VanDerWaalsContact C-N 3.32Å; C1515-S1517 PolarHBondContact O-N 3.07Å; C1515-L1518 PolarHBondContact O-N 3.38Å; C1515-I1519 VanDerWaalsContact O-CG1 3.28Å; C1515-I1519 WeakPolarHBondContact O-CG1 3.39Å; C1515-I1519 PolarHBondContact O-N 2.91Å
1516	I	86.7	Confident	78.3	Confident	89 Å²	89	94.1 Å²	94.1	46%	0.456	53%	0.532	S	S	.	.	H	α-helix	trans	-62	-41.7	176.8	-67.1	165.7	0	0	0	110.6	L1512 P1513 L1518 I1519 I1520	L1512-I1516 HydrophobicContact CG-CD1 4.27Å; L1512-I1516 WeakPolarHBondContact O-CG1 3.49Å; L1512-I1516 PolarHBondContact O-N 3.03Å; L1512-I1516 VanDerWaalsContact O-N 3.07Å; P1513-I1516 PolarHBondContact O-N 3.3Å; I1516-L1518 PolarHBondContact O-N 2.88Å; I1516-I1519 PolarHBondContact O-N 2.72Å; I1516-I1520 HydrophobicContact CG2-CD1 4.06Å; I1516-I1520 WeakPolarHBondContact O-CG1 2.87Å; I1516-I1520 PolarHBondContact O-N 2.99Å; I1516-I1520 VanDerWaalsContact O-N 3.1Å
1517	S	86.4	Confident	79.6	Confident	81 Å²	81	91.2 Å²	91.2	57%	0.566	53%	0.526	S	S	*	.	H	α-helix	trans	-64.4	-40.1	178.1	-149.4	0	0	0	0	112.5	P1513 I1514 C1515 I1520 L1521	P1513-S1517 PolarHBondContact O-N 3.32Å; I1514-S1517 PolarHBondContact O-N 3.28Å; C1515-S1517 VanDerWaalsContact C-N 3.32Å; C1515-S1517 PolarHBondContact O-N 3.07Å; S1517-I1520 PolarHBondContact O-N 3.23Å; S1517-L1521 PolarHBondContact O-N 3.46Å; S1517-L1521 VanDerWaalsContact O-N 3.11Å
1518	L	89.2	Confident	81	Confident	99 Å²	99	91.6 Å²	91.6	52%	0.518	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-38.7	174.8	-91.6	163.6	0	0	0	112.9	I1514 C1515 I1516 L1521 L1522	I1514-L1518 HydrophobicContact CG2-CD1 4.42Å; I1514-L1518 PolarHBondContact O-N 3.43Å; C1515-L1518 PolarHBondContact O-N 3.38Å; I1516-L1518 PolarHBondContact O-N 2.88Å; L1518-L1521 PolarHBondContact O-N 3.27Å; L1518-L1522 PolarHBondContact O-N 2.93Å
1519	I	90	Very high	82.2	Confident	99 Å²	99	89.5 Å²	89.5	51%	0.508	51%	0.514	S	S	.	.	H	α-helix	trans	-65.7	-42	177.8	-68.7	164	0	0	0	110.7	C1515 I1516 L1521 L1522 L1523	C1515-I1519 VanDerWaalsContact O-CG1 3.28Å; C1515-I1519 WeakPolarHBondContact O-CG1 3.39Å; C1515-I1519 PolarHBondContact O-N 2.91Å; I1516-I1519 PolarHBondContact O-N 2.72Å; I1519-L1521 VanDerWaalsContact C-N 3.3Å; I1519-L1521 PolarHBondContact O-N 3.32Å; I1519-L1522 PolarHBondContact O-N 3.38Å; I1519-L1523 HydrophobicContact CG2-CD1 4.13Å; I1519-L1523 WeakPolarHBondContact O-CG 3.35Å; I1519-L1523 PolarHBondContact O-N 3.48Å
1520	I	90.3	Very high	82.7	Confident	112 Å²	112	95.5 Å²	95.5	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-61.7	-41.4	176	-66.6	166.7	0	0	0	110.6	I1516 S1517 L1523 G1524	I1516-I1520 HydrophobicContact CG2-CD1 4.06Å; I1516-I1520 WeakPolarHBondContact O-CG1 2.87Å; I1516-I1520 PolarHBondContact O-N 2.99Å; I1516-I1520 VanDerWaalsContact O-N 3.1Å; S1517-I1520 PolarHBondContact O-N 3.23Å; I1520-L1523 PolarHBondContact O-N 3.02Å; I1520-G1524 PolarHBondContact O-N 2.86Å
1521	L	90.8	Very high	82.7	Confident	110 Å²	110	100.4 Å²	100.4	58%	0.576	53%	0.532	S	S	*	.	H	α-helix	trans	-64.7	-42.5	177.7	-164.1	123.9	0	0	0	112	S1517 L1518 I1519 G1524 I1525	S1517-L1521 PolarHBondContact O-N 3.46Å; S1517-L1521 VanDerWaalsContact O-N 3.11Å; L1518-L1521 PolarHBondContact O-N 3.27Å; I1519-L1521 VanDerWaalsContact C-N 3.3Å; I1519-L1521 PolarHBondContact O-N 3.32Å; L1521-G1524 PolarHBondContact O-N 3.39Å; L1521-I1525 HydrophobicContact CD2-CD1 3.88Å; L1521-I1525 WeakPolarHBondContact O-CG1 3.47Å; L1521-I1525 PolarHBondContact O-N 3.09Å; L1521-I1525 VanDerWaalsContact O-N 3.08Å
1522	L	86.2	Confident	82.4	Confident	99 Å²	99	104.5 Å²	104.5	52%	0.518	54%	0.54	S	S	.	.	H	α-helix	trans	-64.8	-40.3	176.1	-91.8	158.8	0	0	0	112.8	L1518 I1519 G1524 I1525 L1526	L1518-L1522 PolarHBondContact O-N 2.93Å; I1519-L1522 PolarHBondContact O-N 3.38Å; L1522-G1524 VanDerWaalsContact C-N 3.32Å; L1522-G1524 PolarHBondContact O-N 3.3Å; L1522-I1525 PolarHBondContact O-N 3.49Å; L1522-L1526 PolarHBondContact O-N 2.82Å
1523	L	89.3	Confident	81.4	Confident	108 Å²	108	107.9 Å²	107.9	57%	0.565	55%	0.551	S	S	*	*	H	α-helix	trans	-63.8	-38.5	174.4	-77.6	169.4	0	0	0	111.7	I1519 I1520 L1526 A1527	I1519-L1523 HydrophobicContact CG2-CD1 4.13Å; I1519-L1523 WeakPolarHBondContact O-CG 3.35Å; I1519-L1523 PolarHBondContact O-N 3.48Å; I1520-L1523 PolarHBondContact O-N 3.02Å; L1523-L1526 PolarHBondContact O-N 2.89Å; L1523-A1527 WeakPolarHBondContact O-CB 3.31Å; L1523-A1527 PolarHBondContact O-N 3.33Å
1524	G	86.1	Confident	79.8	Confident	44 Å²	44	110.2 Å²	110.2	45%	0.454	56%	0.559	S	S	.	*	H	α-helix	trans	-61	-42.7	173.2	0	0	0	0	0	112.9	I1520 L1521 L1522 A1527 F1528	I1520-G1524 PolarHBondContact O-N 2.86Å; L1521-G1524 PolarHBondContact O-N 3.39Å; L1522-G1524 VanDerWaalsContact C-N 3.32Å; L1522-G1524 PolarHBondContact O-N 3.3Å; G1524-A1527 PolarHBondContact O-N 3.49Å; G1524-F1528 WeakPolarHBondContact O-CB 3.46Å; G1524-F1528 PolarHBondContact O-N 3Å
1525	I	90.2	Very high	77.3	Confident	89 Å²	89	107.3 Å²	107.3	46%	0.456	56%	0.555	S	S	.	*	H	α-helix	trans	-65.5	-43.9	177.1	-65.4	164.5	0	0	0	110.8	L1521 L1522 F1528 V1529	L1521-I1525 HydrophobicContact CD2-CD1 3.88Å; L1521-I1525 WeakPolarHBondContact O-CG1 3.47Å; L1521-I1525 PolarHBondContact O-N 3.09Å; L1521-I1525 VanDerWaalsContact O-N 3.08Å; L1522-I1525 PolarHBondContact O-N 3.49Å; I1525-F1528 WeakPolarHBondContact O-CB 3.31Å; I1525-F1528 PolarHBondContact O-N 2.81Å; I1525-V1529 HydrophobicContact CG2-CG2 4.4Å; I1525-V1529 VanDerWaalsContact O-CG2 3.32Å; I1525-V1529 WeakPolarHBondContact O-CG2 3.42Å; I1525-V1529 PolarHBondContact O-N 2.87Å
1526	L	79.2	Confident	75.1	Confident	113 Å²	113	114.1 Å²	114.1	59%	0.592	58%	0.578	S	S	*	*	H	α-helix	trans	-63.8	-41.4	178.2	-85.2	162.2	0	0	0	112.2	L1522 L1523 F1528 V1529 W1530	L1522-L1526 PolarHBondContact O-N 2.82Å; L1523-L1526 PolarHBondContact O-N 2.89Å; L1526-F1528 VanDerWaalsContact C-N 3.32Å; L1526-F1528 PolarHBondContact O-N 3Å; L1526-V1529 PolarHBondContact O-N 3.25Å; L1526-W1530 WeakPolarHBondContact O-CB 3.46Å; L1526-W1530 PolarHBondContact O-N 3.1Å
1527	A	79.6	Confident	72.3	Confident	58 Å²	58	115.4 Å²	115.4	48%	0.479	60%	0.595	S	S	.	*	H	α-helix	trans	-61.4	-41.2	174.1	0	0	0	0	0	111.7	L1523 G1524 W1530 Y1531	L1523-A1527 WeakPolarHBondContact O-CB 3.31Å; L1523-A1527 PolarHBondContact O-N 3.33Å; G1524-A1527 PolarHBondContact O-N 3.49Å; A1527-W1530 PolarHBondContact O-N 3.02Å; A1527-Y1531 WeakPolarHBondContact O-CB 3.33Å; A1527-Y1531 PolarHBondContact O-N 3.23Å
1528	F	82.1	Confident	69.4	Low	128 Å²	128	117.4 Å²	117.4	56%	0.561	61%	0.607	S	S	*	*	H	α-helix	trans	-65.1	-41.7	177.1	-175.2	-99.6	0	0	0	112.7	G1524 I1525 L1526 R1532	G1524-F1528 WeakPolarHBondContact O-CB 3.46Å; G1524-F1528 PolarHBondContact O-N 3Å; I1525-F1528 WeakPolarHBondContact O-CB 3.31Å; I1525-F1528 PolarHBondContact O-N 2.81Å; L1526-F1528 VanDerWaalsContact C-N 3.32Å; L1526-F1528 PolarHBondContact O-N 3Å; F1528-R1532 PolarHBondContact O-N 3.39Å; F1528-R1532 VanDerWaalsContact O-N 3.08Å
1529	V	77.4	Confident	66.6	Low	80 Å²	80	118 Å²	118	49%	0.485	62%	0.617	S	S	.	*	H	α-helix	trans	-67.3	-40.8	176.9	172.8	0	0	0	0	111.1	I1525 L1526 R1532 K1533	I1525-V1529 HydrophobicContact CG2-CG2 4.4Å; I1525-V1529 VanDerWaalsContact O-CG2 3.32Å; I1525-V1529 WeakPolarHBondContact O-CG2 3.42Å; I1525-V1529 PolarHBondContact O-N 2.87Å; L1526-V1529 PolarHBondContact O-N 3.25Å; V1529-R1532 PolarHBondContact O-N 3.26Å; V1529-K1533 PolarHBondContact O-N 3.28Å; V1529-K1533 VanDerWaalsContact O-N 3.09Å
1530	W	76.2	Confident	63.5	Low	181 Å²	181	121.1 Å²	121.1	69%	0.686	64%	0.635	S	S	*	*	H	α-helix	trans	-64.8	-42.7	177.3	-172.7	79.1	0	0	0	112	L1526 A1527 R1532 K1533 N1534	L1526-W1530 WeakPolarHBondContact O-CB 3.46Å; L1526-W1530 PolarHBondContact O-N 3.1Å; A1527-W1530 PolarHBondContact O-N 3.02Å; W1530-R1532 VanDerWaalsContact C-N 3.33Å; W1530-R1532 PolarHBondContact O-N 2.83Å; W1530-K1533 PolarHBondContact O-N 3.48Å; W1530-K1533 VanDerWaalsContact O-N 3.15Å; W1530-N1534 PolarHBondContact O-N 3.45Å
1531	Y	74.4	Confident	60.4	Low	177 Å²	177	119.3 Å²	119.3	69%	0.694	64%	0.644	S	S	*	*	H	α-helix	trans	-61.5	-39.7	174.9	-173.5	-101.4	0	0	0	112.4	A1527 K1533 G1535	A1527-Y1531 WeakPolarHBondContact O-CB 3.33Å; A1527-Y1531 PolarHBondContact O-N 3.23Å; Y1531-K1533 VanDerWaalsContact C-N 3.32Å; Y1531-K1533 PolarHBondContact O-N 3.04Å; Y1531-G1535 PolarHBondContact O-N 2.71Å
1532	R	64.5	Low	57.2	Low	188 Å²	188	121.8 Å²	121.8	71%	0.709	66%	0.657	S	S	*	*	H	α-helix	trans	-66.8	-31.1	175	-86.1	-168.6	105.4	153.6	5.7	113.5	F1528 V1529 W1530	F1528-R1532 PolarHBondContact O-N 3.39Å; F1528-R1532 VanDerWaalsContact O-N 3.08Å; V1529-R1532 PolarHBondContact O-N 3.26Å; W1530-R1532 VanDerWaalsContact C-N 3.33Å; W1530-R1532 PolarHBondContact O-N 2.83Å
1533	K	52.1	Low	54.2	Low	177 Å²	177	122.8 Å²	122.8	77%	0.77	67%	0.667	S	S	*	*	H	α-helix	trans	-80.3	-29.6	-172.8	-160.7	172.6	-179.2	179.7	0	113.4	V1529 W1530 Y1531	V1529-K1533 PolarHBondContact O-N 3.28Å; V1529-K1533 VanDerWaalsContact O-N 3.09Å; W1530-K1533 PolarHBondContact O-N 3.48Å; W1530-K1533 VanDerWaalsContact O-N 3.15Å; Y1531-K1533 VanDerWaalsContact C-N 3.32Å; Y1531-K1533 PolarHBondContact O-N 3.04Å
1534	N	40.4	Very low	51.1	Low	121 Å²	121	122.1 Å²	122.1	65%	0.647	67%	0.671	S	S	*	*	H	α-helix	trans	-101.3	-3.5	-179	-73.8	-5.4	0	0	0	114.2	W1530	W1530-N1534 PolarHBondContact O-N 3.45Å
1535	G	33.2	Very low	48.3	Very low	43 Å²	43	127.5 Å²	127.5	44%	0.443	68%	0.684	S	S	.	*			trans	-95.7	107.4	177.1	0	0	0	0	0	113.1	Y1531	Y1531-G1535 PolarHBondContact O-N 2.71Å
1536	K	32.3	Very low	45.1	Very low	201 Å²	201	129 Å²	129	87%	0.874	70%	0.698	S	S	*	*			trans	111	95.3	145.9	-60.3	177.1	178.3	-177.4	0	117.5
1537	S	29.6	Very low	42.5	Very low	116 Å²	116	128.8 Å²	128.8	81%	0.811	71%	0.706	S	S	*	*			trans	-42.5	137.4	149.8	-175.5	0	0	0	0	113.5
1538	C	25	Very low	40.2	Very low	123 Å²	123	133.3 Å²	133.3	83%	0.831	72%	0.72	S	S	*	*			trans	-78.4	134.4	174.5	-58.9	0	0	0	0	111.5
1539	P	29.6	Very low	37.7	Very low	111 Å²	111	133.8 Å²	133.8	72%	0.721	73%	0.733	S	S	*	*			trans	-135.8	130.9	141.8	32	-15.9	0	0	0	113
1540	N	26	Very low	35.3	Very low	165 Å²	165	137.8 Å²	137.8	88%	0.882	75%	0.752	S	S	*	*			trans	37.9	123.5	139.9	-58.3	-15.1	0	0	0	120.7
1541	G	25.3	Very low	33.2	Very low	74 Å²	74	135.1 Å²	135.1	76%	0.763	76%	0.761	S	S	*	*				102.9	105.5	124.3	0	0	0	0	0	118.2
1542	L	22.8	Very low	30.9	Very low	162 Å²	162	129.9 Å²	129.9	85%	0.848	76%	0.761	S	S	*	*				65.8	134.1	129.8	-134.5	75.6	0	0	0	121.9
1543	T	23.9	Very low	29	Very low	120 Å²	120	130.3 Å²	130.3	74%	0.736	77%	0.77	S	S	*	*			trans	75	123	153.4	58.1	0	0	0	0	121
1544	S	22.4	Very low	27.7	Very low	94 Å²	94	126.3 Å²	126.3	66%	0.657	77%	0.765	S	S	*	*				128.2	144.3	124.9	68.1	0	0	0	0	116.5
1545	H	28.6	Very low	27	Very low	157 Å²	157	127 Å²	127	73%	0.727	77%	0.773	S	S	*	*			trans	87.1	104.2	163.7	-59.3	-65.4	0	0	0	118.1
1546	T	22.9	Very low	26.7	Very low	120 Å²	120	131.2 Å²	131.2	74%	0.736	79%	0.79	S	S	*	*				75.4	129.5	72.9	55.5	0	0	0	0	115.8
1547	S	24.4	Very low	26.9	Very low	108 Å²	108	128.4 Å²	128.4	76%	0.755	79%	0.785	S	S	*	*			trans	98.6	145.2	159.9	78.4	0	0	0	0	119
1548	I	31.9	Very low	26.8	Very low	153 Å²	153	129.7 Å²	129.7	79%	0.785	78%	0.781	S	S	*	*			trans	90.2	83.4	169.3	-47.7	163.8	0	0	0	113.8
1549	V	29.1	Very low	27.4	Very low	138 Å²	138	131.1 Å²	131.1	84%	0.836	78%	0.776	S	S	*	*				77.7	104.7	74.5	-177.6	0	0	0	0	113.9
1550	N	26.7	Very low	27.2	Very low	165 Å²	165	131.9 Å²	131.9	88%	0.882	78%	0.779	S	S	*	*			trans	-95.9	149.4	169.7	-87	-29.6	0	0	0	111.2
1551	S	32.2	Very low	27.2	Very low	125 Å²	125	131.2 Å²	131.2	87%	0.874	77%	0.77	S	S	*	*			trans	-150	125	153.2	57.1	0	0	0	0	106.8
1552	G	25.3	Very low	27.5	Very low	67 Å²	67	135.8 Å²	135.8	69%	0.691	77%	0.769	S	S	*	*			cis	154.5	103.8	4	0	0	0	0	0	107.7
1553	H	26.3	Very low	27.8	Very low	196 Å²	196	135.4 Å²	135.4	91%	0.907	77%	0.765	S	S	*	*			trans	167.4	129.9	163.2	-95.6	-76.8	0	0	0	104.5
1554	S	23.8	Very low	27.8	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	76%	0.761	S	S	*	*			cis	-168.8	130	-0.1	44.5	0	0	0	0	106.4
1555	V	24.9	Very low	28.3	Very low	136 Å²	136	138.2 Å²	138.2	82%	0.824	77%	0.773	S	S	*	*			trans	65	95.3	136.2	-170.5	0	0	0	0	117.8
1556	V	28.1	Very low	28.2	Very low	131 Å²	131	134.4 Å²	134.4	79%	0.794	76%	0.761	S	S	*	*				168.6	107.5	108.4	174	0	0	0	0	107.2
1557	N	36.7	Very low	28.3	Very low	142 Å²	142	135.1 Å²	135.1	76%	0.759	76%	0.759	S	S	*	*			trans	-119.1	129.5	151.6	-177.8	15.1	0	0	0	105.1
1558	L	27.6	Very low	28.6	Very low	142 Å²	142	135.7 Å²	135.7	74%	0.743	76%	0.758	S	S	*	*			trans	-163.9	129.2	158.7	-149	76.2	0	0	0	105.2
1559	E	37.2	Very low	28.3	Very low	154 Å²	154	132.9 Å²	132.9	72%	0.72	75%	0.752	S	S	*	*			trans	72.4	99.8	178.1	-53	171.6	165.6	0	0	114.2	E1561	E1559-E1561 VanDerWaalsContact C-N 3.3Å
1560	T	26.1	Very low	28.4	Very low	126 Å²	126	132 Å²	132	77%	0.773	75%	0.749	S	S	*	*			cis	12.6	70.8	33.6	54.3	0	0	0	0	113.6
1561	E	24.4	Very low	28.2	Very low	151 Å²	151	132.5 Å²	132.5	71%	0.706	74%	0.743	S	S	*	*			trans	-166.7	76.2	135.4	-114.5	179.6	177.6	0	0	109.1	E1559	E1559-E1561 VanDerWaalsContact C-N 3.3Å
1562	K	32.9	Very low	27.8	Very low	170 Å²	170	135 Å²	135	74%	0.739	74%	0.738	S	S	*	*				170.8	116.7	124	-89.4	148.9	-165.6	169.3	0	106.5
1563	M	27.7	Very low	27.6	Very low	155 Å²	155	139 Å²	139	76%	0.764	74%	0.743	S	S	*	*				52.8	92.5	89.7	-63	176.5	147.2	0	0	108
1564	L	25.2	Very low	27.5	Very low	125 Å²	125	135.2 Å²	135.2	65%	0.654	73%	0.734	S	S	*	*				67.9	84.2	103.9	-71.1	153.8	0	0	0	111.3	T1566	L1564-T1566 VanDerWaalsContact C-N 3.34Å; L1564-T1566 WeakPolarHBondContact CB-OG1 3.34Å; L1564-T1566 HydrophobicContact CD2-CG2 4.07Å; L1564-T1566 PolarHBondContact O-OG1 2.72Å
1565	T	31.5	Very low	27.4	Very low	148 Å²	148	135 Å²	135	91%	0.908	73%	0.733	S	S	*	*				-94.8	71.8	114.2	51.3	0	0	0	0	106.8
1566	T	27.6	Very low	27.4	Very low	77 Å²	77	135.8 Å²	135.8	47%	0.472	73%	0.732	S	S	.	*				43.3	98.8	92.7	-7.9	0	0	0	0	113.2	L1564	L1564-T1566 VanDerWaalsContact C-N 3.34Å; L1564-T1566 WeakPolarHBondContact CB-OG1 3.34Å; L1564-T1566 HydrophobicContact CD2-CG2 4.07Å; L1564-T1566 PolarHBondContact O-OG1 2.72Å
1567	I	25.5	Very low	27.2	Very low	135 Å²	135	133 Å²	133	69%	0.692	73%	0.729	S	S	*	*				65.2	111	126.2	-59	179.9	0	0	0	114.1
1568	T	29.9	Very low	26.6	Very low	120 Å²	120	137.3 Å²	137.3	74%	0.736	74%	0.735	S	S	*	*				-172.1	128.4	56.8	0.6	0	0	0	0	110.2
1569	S	26.3	Very low	26.4	Very low	94 Å²	94	138.9 Å²	138.9	66%	0.657	74%	0.739	S	S	*	*			trans	-71.1	142.6	144.9	58.7	0	0	0	0	109.3
1570	P	30.7	Very low	25.8	Very low	118 Å²	118	136.8 Å²	136.8	77%	0.766	74%	0.741	S	S	*	*				-130.4	104.3	126.4	30.7	-17.6	0	0	0	107.9
1571	K	23.1	Very low	25.7	Very low	177 Å²	177	139.1 Å²	139.1	77%	0.77	74%	0.741	S	S	*	*				46.8	131.7	82	-97.2	-176.3	-176.7	174	0	114.9
1572	K	22.9	Very low	25.7	Very low	177 Å²	177	138.2 Å²	138.2	77%	0.77	74%	0.741	S	S	*	*			trans	87.1	110.9	153.2	-75.2	-179.7	169.3	-177.8	0	115.3
1573	L	21.9	Very low	25.2	Very low	150 Å²	150	135.9 Å²	135.9	79%	0.785	74%	0.74	S	S	*	*				55.1	121.5	80.2	-90.2	92.3	0	0	0	110.3
1574	T	23.8	Very low	25.1	Very low	118 Å²	118	137.8 Å²	137.8	72%	0.724	74%	0.744	S	S	*	*				168.3	110.3	104.5	41.2	0	0	0	0	106.4
1575	S	22.5	Very low	26	Very low	90 Å²	90	136.2 Å²	136.2	63%	0.629	74%	0.742	S	S	*	*				72.8	128	91.9	91.5	0	0	0	0	113.6
1576	N	23.4	Very low	25.7	Very low	151 Å²	151	135.7 Å²	135.7	81%	0.807	73%	0.733	S	S	*	*			trans	75.8	95.1	143.4	-56.7	-13.4	0	0	0	116.6
1577	G	23.9	Very low	25.5	Very low	72 Å²	72	138.4 Å²	138.4	74%	0.742	75%	0.745	S	S	*	*				66.3	118.1	98.6	0	0	0	0	0	117
1578	R	24.2	Very low	25.4	Very low	234 Å²	234	139 Å²	139	88%	0.883	75%	0.747	S	S	*	*			trans	167.6	114.3	134.1	-97.7	167.7	171.8	167.3	-2.1	106.1
1579	Q	24.6	Very low	25.2	Very low	175 Å²	175	139.7 Å²	139.7	82%	0.818	75%	0.746	S	S	*	*				55.3	124.7	89.8	-91.3	-167.1	-1.3	0	0	114.1
1580	S	23.4	Very low	25	Very low	109 Å²	109	140.7 Å²	140.7	76%	0.762	75%	0.753	S	S	*	*			trans	73	152.8	156.9	94.9	0	0	0	0	113.9
1581	K	23.5	Very low	24.9	Very low	176 Å²	176	138.6 Å²	138.6	77%	0.765	75%	0.753	S	S	*	*			cis	-172.8	144.8	-7.8	-125.8	177	-179.9	178.3	0	101.4
1582	N	24.7	Very low	24.9	Very low	132 Å²	132	135.2 Å²	135.2	71%	0.706	75%	0.751	S	S	*	*			trans	54.2	141.1	142.9	-65.3	-6.8	0	0	0	121.8
1583	T	22.4	Very low	25	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	75%	0.753	S	S	*	*			trans	78.4	108.4	138.3	31.2	0	0	0	0	119.2
1584	K	25.7	Very low	25.2	Very low	195 Å²	195	131.6 Å²	131.6	85%	0.848	75%	0.748	S	S	*	*				66.3	162.9	113.9	-105.9	-167.7	-179.5	-176.6	0	117.2
1585	P	45	Very low	25.3	Very low	93 Å²	93	132.7 Å²	132.7	60%	0.604	75%	0.754	S	S	*	*				-117.7	-170	-118.6	33.4	-12.6	0	0	0	111.9
1586	D	24.7	Very low	25.6	Very low	136 Å²	136	132.1 Å²	132.1	73%	0.727	76%	0.763	S	S	*	*			trans	98.1	136.8	152.8	-56.8	-28.4	0	0	0	119
1587	N	24.1	Very low	25.7	Very low	135 Å²	135	130.2 Å²	130.2	72%	0.722	76%	0.761	S	S	*	*			trans	91.8	99.5	147.8	-74.2	-14.1	0	0	0	120.4
1588	M	22.4	Very low	25.8	Very low	148 Å²	148	134.1 Å²	134.1	73%	0.729	77%	0.765	S	S	*	*				76	147.2	109.4	-74.9	178.7	84.2	0	0	119.6
1589	N	25.2	Very low	26	Very low	133 Å²	133	132.9 Å²	132.9	71%	0.711	77%	0.766	S	S	*	*			trans	91.7	101.5	159.7	-60.3	-21.5	0	0	0	115.4
1590	S	23.1	Very low	26.1	Very low	115 Å²	115	130.4 Å²	130.4	80%	0.804	76%	0.763	S	S	*	*				90.9	126.4	56.8	72.7	0	0	0	0	113.1
1591	G	27.6	Very low	26.4	Very low	75 Å²	75	131.3 Å²	131.3	77%	0.773	77%	0.768	S	S	*	*			trans	115.6	133.4	175.6	0	0	0	0	0	112.3
1592	S	24.3	Very low	26.6	Very low	105 Å²	105	130.9 Å²	130.9	73%	0.734	77%	0.773	S	S	*	*			cis	-174.9	144.6	-7.7	52.3	0	0	0	0	107.2
1593	I	24.8	Very low	26.7	Very low	156 Å²	156	129.5 Å²	129.5	80%	0.8	77%	0.774	S	S	*	*			trans	108.3	114.4	155.5	-54.9	165.3	0	0	0	119.4
1594	S	25.5	Very low	27.1	Very low	96 Å²	96	130.2 Å²	130.2	67%	0.671	78%	0.78	S	S	*	*			trans	61.6	106.1	145.9	76.1	0	0	0	0	124.4
1595	T	26.7	Very low	27.2	Very low	141 Å²	141	127.2 Å²	127.2	87%	0.865	78%	0.778	S	S	*	*				35.5	121.8	126.2	56.5	0	0	0	0	121.7
1596	G	27.6	Very low	26.4	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	79%	0.792	S	S	*	*				103	77.9	123.1	0	0	0	0	0	116.4
1597	S	25.4	Very low	26.8	Very low	110 Å²	110	131.4 Å²	131.4	77%	0.769	79%	0.792	S	S	*	*			trans	-58.2	135.3	162.8	54	0	0	0	0	112.3
1598	D	27.6	Very low	27	Very low	154 Å²	154	133.9 Å²	133.9	82%	0.824	80%	0.802	S	S	*	*			trans	-154.9	91.1	138.7	-95.4	-22.1	0	0	0	108.8
1599	K	28.4	Very low	27.3	Very low	209 Å²	209	134.5 Å²	134.5	91%	0.909	81%	0.806	S	S	*	*			trans	-134.1	83.9	164.5	-84.1	-169.9	178.1	178.5	0	108.7	C1601	K1599-C1601 PolarHBondContact O-N 3.27Å
1600	T	27	Very low	27.5	Very low	123 Å²	123	135.7 Å²	135.7	76%	0.755	81%	0.812	S	S	*	*			trans	-79.8	101.1	168	-1.5	0	0	0	0	108.8
1601	C	28.4	Very low	27.8	Very low	128 Å²	128	136.8 Å²	136.8	87%	0.865	81%	0.814	S	S	*	*			trans	-122	104.1	156.9	-85.7	0	0	0	0	107.9	K1599	K1599-C1601 PolarHBondContact O-N 3.27Å
1602	L	28.3	Very low	27.8	Very low	167 Å²	167	140.4 Å²	140.4	87%	0.874	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.2	123.6	178.9	-78.6	154.1	0	0	0	110.9
1603	S	26.6	Very low	28.1	Very low	103 Å²	103	144.6 Å²	144.6	72%	0.72	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-70.2	128.5	170.8	-41.5	0	0	0	0	110.8	T1605	S1603-T1605 PolarHBondContact O-N 3.23Å
1604	P	31.3	Very low	28.3	Very low	134 Å²	134	148.4 Å²	148.4	87%	0.87	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-81.7	116.3	175.2	30.3	-29.2	0	0	0	110.8
1605	T	27.8	Very low	28.5	Very low	133 Å²	133	149.1 Å²	149.1	82%	0.816	83%	0.83	S	S	*	*			trans	-88.9	101.2	171.3	34.6	0	0	0	0	110.8	S1603	S1603-T1605 PolarHBondContact O-N 3.23Å
1606	K	28	Very low	28.7	Very low	203 Å²	203	147.9 Å²	147.9	88%	0.883	82%	0.824	S	S	*	*				175.4	145.8	122.5	-103.2	176.3	174.8	172.4	0	112
1607	P	33.5	Very low	28.8	Very low	113 Å²	113	154.3 Å²	154.3	73%	0.734	83%	0.83	S	S	*	*			trans	-93.2	140.6	-153.1	35.6	-33	0	0	0	113.5	I1609	P1607-I1609 PolarHBondContact O-N 3.18Å
1608	M	27.4	Very low	28.9	Very low	187 Å²	187	154 Å²	154	92%	0.921	82%	0.824	S	S	*	*			trans	-70.3	114.2	167.7	-73.6	178.6	-79.9	0	0	109.8
1609	I	27.9	Very low	28.9	Very low	161 Å²	161	151.6 Å²	151.6	83%	0.826	82%	0.817	S	S	*	*			trans	-76.5	124	167.2	-66.7	171.4	0	0	0	107.9	P1607 T1611	P1607-I1609 PolarHBondContact O-N 3.18Å; I1609-T1611 PolarHBondContact O-N 3.28Å
1610	L	30.9	Very low	28.8	Very low	159 Å²	159	147.6 Å²	147.6	83%	0.832	81%	0.812	S	S	*	*			trans	-65.7	119.7	-176.9	-72.4	147.3	0	0	0	111.6	N1612	L1610-N1612 VanDerWaalsContact C-N 3.35Å; L1610-N1612 PolarHBondContact O-N 3.49Å; L1610-N1612 VanDerWaalsContact O-N 3.11Å
1611	T	29.2	Very low	28.8	Very low	137 Å²	137	148.4 Å²	148.4	84%	0.84	81%	0.812	S	S	*	*			trans	-78.6	79.6	166.4	32.8	0	0	0	0	109.9	I1609	I1609-T1611 PolarHBondContact O-N 3.28Å
1612	N	28	Very low	28.6	Very low	151 Å²	151	151.7 Å²	151.7	81%	0.807	81%	0.808	S	S	*	*			trans	-161.8	65.9	168.1	-98.9	-20.7	0	0	0	111.8	L1610	L1610-N1612 VanDerWaalsContact C-N 3.35Å; L1610-N1612 PolarHBondContact O-N 3.49Å; L1610-N1612 VanDerWaalsContact O-N 3.11Å
1613	E	29.4	Very low	28.4	Very low	194 Å²	194	150 Å²	150	91%	0.907	80%	0.8	S	S	*	*			trans	-132.8	105.5	155.6	-71.7	-168.7	170.3	0	0	108.5
1614	R	30.1	Very low	28.4	Very low	235 Å²	235	149.5 Å²	149.5	89%	0.887	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-65.2	138.3	165.2	-75.1	173.1	175.5	161.6	-4.7	107.5
1615	P	29.7	Very low	28.1	Very low	112 Å²	112	145.5 Å²	145.5	73%	0.727	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-65.2	134.5	-179.1	27.2	-31.7	0	0	0	109.6
1616	P	31.4	Very low	28.1	Very low	114 Å²	114	147.1 Å²	147.1	74%	0.74	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-70.9	133.4	-178.4	29.7	-34.7	0	0	0	110.5	T1618	P1616-T1618 VanDerWaalsContact C-N 3.29Å; P1616-T1618 PolarHBondContact O-N 3.22Å
1617	F	29.7	Very low	28	Very low	213 Å²	213	140.1 Å²	140.1	93%	0.934	75%	0.747	S	S	*	*			trans	-69.3	83.4	168.7	-73.5	-86.3	0	0	0	109.6
1618	T	26.5	Very low	27.7	Very low	103 Å²	103	139.5 Å²	139.5	63%	0.632	74%	0.738	S	S	*	*			trans	-75.4	131.8	149.1	39	0	0	0	0	107.4	P1616	P1616-T1618 VanDerWaalsContact C-N 3.29Å; P1616-T1618 PolarHBondContact O-N 3.22Å
1619	P	27.6	Very low	27.5	Very low	105 Å²	105	136.4 Å²	136.4	68%	0.682	74%	0.735	S	S	*	*			trans	-57	150.8	172.6	25.6	-31.4	0	0	0	109	D1621	P1619-D1621 PolarHBondContact O-N 3.09Å
1620	P	26.7	Very low	27.5	Very low	124 Å²	124	131.9 Å²	131.9	81%	0.805	72%	0.715	S	S	*	*			trans	-56	114.9	-168.7	22.3	-32.1	0	0	0	109.7	Y1622	P1620-Y1622 PolarHBondContact O-N 2.87Å
1621	D	25.6	Very low	27.4	Very low	140 Å²	140	129.5 Å²	129.5	75%	0.749	70%	0.703	S	S	*	*			trans	-52.4	112.8	170.9	-75.6	-34.5	0	0	0	107.5	P1619 N1623	P1619-D1621 PolarHBondContact O-N 3.09Å; D1621-N1623 PolarHBondContact O-N 2.76Å
1622	Y	24.3	Very low	27.4	Very low	197 Å²	197	131.4 Å²	131.4	77%	0.773	69%	0.694	S	S	*	*			trans	-52.1	109.2	169.5	-126	-100.4	0	0	0	106.7	P1620 P1624	P1620-Y1622 PolarHBondContact O-N 2.87Å; Y1622-P1624 WeakPolarHBondContact O-CD 3.48Å; Y1622-P1624 WeakPolarHBondContact O-CG 3.34Å
1623	N	24.4	Very low	27.4	Very low	133 Å²	133	132 Å²	132	71%	0.711	70%	0.697	S	S	*	*			trans	-74.1	103.4	175.8	-167.6	6.5	0	0	0	106.6	D1621 G1625	D1621-N1623 PolarHBondContact O-N 2.76Å; N1623-G1625 PolarHBondContact O-N 3.37Å
1624	P	28	Very low	27.4	Very low	91 Å²	91	128.5 Å²	128.5	59%	0.591	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-74.1	11.3	-170.1	-9.4	28.1	0	0	0	112.7	Y1622 F1626 T1627	Y1622-P1624 WeakPolarHBondContact O-CD 3.48Å; Y1622-P1624 WeakPolarHBondContact O-CG 3.34Å; P1624-F1626 PolarHBondContact O-N 3.04Å; P1624-T1627 PolarHBondContact O-N 3.4Å; P1624-T1627 VanDerWaalsContact O-O 3.09Å
1625	G	24.8	Very low	27.1	Very low	51 Å²	51	125.6 Å²	125.6	53%	0.526	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-61.6	1	170.5	0	0	0	0	0	114.8	N1623	N1623-G1625 PolarHBondContact O-N 3.37Å
1626	F	27.7	Very low	26.9	Very low	167 Å²	167	126.7 Å²	126.7	73%	0.732	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-88.1	-4.2	169.1	-93.3	-86.4	0	0	0	114.9	Y1061 P1624	Y1061-F1626 HydrophobicContact CE2-CE1 4.39Å; Y1061-F1626 WeakPolarHBondContact OH-CE1 3.42Å; P1624-F1626 PolarHBondContact O-N 3.04Å
1627	T	26.4	Very low	26.5	Very low	55 Å²	55	129.3 Å²	129.3	34%	0.337	70%	0.697	S	S	.	*	S	Bend	trans	-150.8	122.9	172.4	53.8	0	0	0	0	110.5	P1624	P1624-T1627 PolarHBondContact O-N 3.4Å; P1624-T1627 VanDerWaalsContact O-O 3.09Å
1628	D	25.7	Very low	26.3	Very low	101 Å²	101	127 Å²	127	54%	0.54	69%	0.693	S	S	.	*			trans	101.1	110.8	169	-56.6	-34.7	0	0	0	117.9	R1229 T1630	R1229-D1628 IonicContact CZ-OD2 3.19Å; R1229-D1628 IonicContact NH1-OD1 3.18Å; R1229-D1628 IonicContact NH1-OD2 3.05Å; R1229-D1628 PolarHBondContact NH1-OD2 2.7Å; R1229-D1628 IonicContact NH2-OD2 3.75Å; D1628-T1630 PolarHBondContact O-N 3.44Å
1629	S	24.7	Very low	26	Very low	121 Å²	121	126.1 Å²	126.1	85%	0.846	69%	0.691	S	S	*	*			trans	-61.6	109.3	163.8	48.1	0	0	0	0	110.9
1630	T	26.4	Very low	25.8	Very low	66 Å²	66	130 Å²	130	41%	0.405	70%	0.7	S	S	.	*			trans	-112	126.6	-179.1	54.6	0	0	0	0	113.4	Q354 F355 D1628	Q354-T1630 PolarHBondContact N-O 3.29Å; F355-T1630 PolarHBondContact N-OG1 3.41Å; D1628-T1630 PolarHBondContact O-N 3.44Å
1631	D	30.4	Very low	25.8	Very low	109 Å²	109	129.8 Å²	129.8	58%	0.583	70%	0.701	S	S	*	*			trans	-141.7	122.4	167.7	-131.9	-6.6	0	0	0	112	F355	F355-D1631 WeakPolarHBondContact CE2-OD1 3.15Å
1632	R	28.3	Very low	25.6	Very low	177 Å²	177	131.5 Å²	131.5	67%	0.668	71%	0.705	S	S	*	*			trans	68.9	122.6	150.6	-67.7	178.7	-177	-159.1	-1.8	125.2	F355	F355-R1632 HydrophobicContact CD2-CG 4.25Å; F355-R1632 HydrophobicContact CE1-CG 4.41Å; F355-R1632 HydrophobicContact CE2-CB 4.08Å; F355-R1632 HydrophobicContact CE2-CG 3.28Å; F355-R1632 HydrophobicContact CZ-CB 4.13Å; F355-R1632 HydrophobicContact CZ-CG 3.4Å
1633	L	27.2	Very low	25.7	Very low	163 Å²	163	130 Å²	130	85%	0.853	71%	0.708	S	S	*	*			trans	-138.9	150.2	149.8	-87.1	168.6	0	0	0	112.8
1634	P	30.9	Very low	26.1	Very low	122 Å²	122	128.5 Å²	128.5	79%	0.792	71%	0.706	S	S	*	*			trans	-109.4	168.3	-173.8	40.6	-32	0	0	0	117.1
1635	M	23.4	Very low	25.7	Very low	174 Å²	174	131.1 Å²	131.1	86%	0.857	71%	0.714	S	S	*	*			trans	-48.9	153.7	176.4	-72.1	173.6	151	0	0	118.6
1636	T	24.3	Very low	25.8	Very low	135 Å²	135	136.9 Å²	136.9	83%	0.828	73%	0.727	S	S	*	*			trans	-166.8	106.7	139.8	18.5	0	0	0	0	108.5
1637	H	22.6	Very low	25.6	Very low	169 Å²	169	135.5 Å²	135.5	78%	0.782	73%	0.728	S	S	*	*				55.2	118.9	97.7	-90.8	-80.5	0	0	0	116.4
1638	L	25.6	Very low	25.7	Very low	165 Å²	165	139.9 Å²	139.9	86%	0.864	76%	0.755	S	S	*	*			trans	173.1	88.2	148.2	-90.6	155.6	0	0	0	106.7
1639	S	22	Very low	25.5	Very low	84 Å²	84	141.1 Å²	141.1	59%	0.587	76%	0.761	S	S	*	*				57.9	122.2	82.3	74.6	0	0	0	0	116.5
1640	Q	22.4	Very low	25.5	Very low	187 Å²	187	142.9 Å²	142.9	87%	0.874	76%	0.756	S	S	*	*			trans	80.5	135.9	155.5	-60.6	172.9	-3.5	0	0	116.1
1641	S	25.8	Very low	25.4	Very low	118 Å²	118	145.4 Å²	145.4	83%	0.825	77%	0.771	S	S	*	*			cis	-163.3	160.6	31.2	40.5	0	0	0	0	111.7
1642	Q	22.2	Very low	24.9	Very low	176 Å²	176	147 Å²	147	82%	0.822	78%	0.779	S	S	*	*			trans	-60.4	158.8	177.5	-67	151.9	-39	0	0	113.5
1643	I	27.1	Very low	24.8	Very low	166 Å²	166	145.5 Å²	145.5	85%	0.851	79%	0.79	S	S	*	*				-166.4	133	109.1	-85.4	147.7	0	0	0	110
1644	P	31.4	Very low	24.5	Very low	101 Å²	101	143.5 Å²	143.5	66%	0.656	78%	0.784	S	S	*	*			trans	-102.7	-174.7	-176.4	41.4	-36	0	0	0	113.5
1645	L	21.2	Very low	24.2	Very low	146 Å²	146	141.2 Å²	141.2	76%	0.764	78%	0.782	S	S	*	*			trans	112.3	128.4	171.3	-66.4	145.8	0	0	0	111
1646	Q	26.7	Very low	24.2	Very low	172 Å²	172	141.8 Å²	141.8	80%	0.804	79%	0.785	S	S	*	*			cis	-166	141.3	36.4	-132	162.7	8.4	0	0	111.8
1647	N	22.8	Very low	24	Very low	138 Å²	138	143.7 Å²	143.7	74%	0.738	79%	0.787	S	S	*	*			trans	-21.6	146.5	164.1	-57.8	-21.2	0	0	0	119.9
1648	T	27.7	Very low	24.2	Very low	148 Å²	148	143.8 Å²	143.8	91%	0.908	79%	0.793	S	S	*	*				-159.7	138.2	110.4	43.1	0	0	0	0	112
1649	N	22.9	Very low	24.2	Very low	126 Å²	126	142.1 Å²	142.1	67%	0.674	78%	0.784	S	S	*	*			trans	-88.9	161.2	-170	-95.1	6.9	0	0	0	114.6
1650	E	23.1	Very low	24.4	Very low	158 Å²	158	150.3 Å²	150.3	74%	0.738	80%	0.802	S	S	*	*			trans	78	148.4	138.9	-77.5	165.2	-141	0	0	118.6
1651	T	24.4	Very low	24.5	Very low	119 Å²	119	149.3 Å²	149.3	73%	0.73	80%	0.797	S	S	*	*			cis	-163.8	163.2	5.4	14.1	0	0	0	0	108.7
1652	L	21.5	Very low	24.4	Very low	143 Å²	143	150.7 Å²	150.7	75%	0.749	80%	0.795	S	S	*	*			trans	-41.8	149.6	171.2	-77	75	0	0	0	115.8
1653	V	25.1	Very low	24.7	Very low	146 Å²	146	151.9 Å²	151.9	89%	0.885	80%	0.801	S	S	*	*				-147.8	123.8	122.8	177.9	0	0	0	0	110.8
1654	T	21.2	Very low	24.6	Very low	121 Å²	121	150.4 Å²	150.4	74%	0.742	80%	0.8	S	S	*	*			trans	-74.6	146.9	167.2	38.9	0	0	0	0	112.9
1655	G	24.2	Very low	24.1	Very low	73 Å²	73	155 Å²	155	75%	0.753	81%	0.809	S	S	*	*			trans	-174.1	100.4	165.4	0	0	0	0	0	116.6
1656	M	23.4	Very low	24.4	Very low	186 Å²	186	154 Å²	154	92%	0.916	81%	0.81	S	S	*	*			trans	64.2	103.8	145.1	-56.2	179.3	96.5	0	0	118.4
1657	M	21	Very low	24.5	Very low	176 Å²	176	150.3 Å²	150.3	87%	0.867	80%	0.803	S	S	*	*				41.8	105.8	78.9	-87.6	-168.1	179	0	0	114.6
1658	D	27.4	Very low	24.7	Very low	170 Å²	170	153.1 Å²	153.1	91%	0.909	81%	0.809	S	S	*	*			trans	-154	141.1	130.6	-119.8	-22.3	0	0	0	113.6
1659	I	23.9	Very low	24.7	Very low	131 Å²	131	152.2 Å²	152.2	67%	0.672	80%	0.804	S	S	*	*			trans	-93.3	131.4	-166.7	-69.2	161.3	0	0	0	109.8	Q1661	I1659-Q1661 HydrophobicContact CG2-CG 4.49Å
1660	R	26.7	Very low	25	Very low	255 Å²	255	153.3 Å²	153.3	96%	0.962	81%	0.808	S	S	*	*			trans	-140.1	139.2	150	-81.3	-163.6	176.8	-179.6	-0.8	112.2
1661	Q	24.6	Very low	25.2	Very low	166 Å²	166	157.2 Å²	157.2	78%	0.776	82%	0.816	S	S	*	*			trans	-88.2	155.6	-156.6	-68.7	157.2	-37.3	0	0	114	I1659	I1659-Q1661 HydrophobicContact CG2-CG 4.49Å
1662	N	24.3	Very low	25.5	Very low	147 Å²	147	157.3 Å²	157.3	79%	0.786	82%	0.819	S	S	*	*			trans	40.7	103.9	139.2	-65.2	-15.7	0	0	0	119.2
1663	Q	27.6	Very low	26	Very low	201 Å²	201	156.6 Å²	156.6	94%	0.939	82%	0.816	S	S	*	*			trans	-138.7	146.2	136.1	-75	-166.6	-12.7	0	0	111.4
1664	T	25.3	Very low	26.7	Very low	135 Å²	135	154.9 Å²	154.9	83%	0.828	81%	0.808	S	S	*	*			trans	-90.1	153.3	-150.6	37.3	0	0	0	0	115
1665	K	21.6	Very low	27.3	Very low	197 Å²	197	156.3 Å²	156.3	86%	0.857	80%	0.801	S	S	*	*			trans	-44.7	129.9	171.7	-66	167.4	174.1	173.2	0	114
1666	T	28	Very low	27.7	Very low	127 Å²	127	163.8 Å²	163.8	78%	0.779	81%	0.806	S	S	*	*			trans	-118.5	105.6	149.1	47.7	0	0	0	0	108.5
1667	S	27.1	Very low	28.1	Very low	94 Å²	94	161.5 Å²	161.5	66%	0.657	80%	0.798	S	S	*	*			trans	-69.2	120.3	177.9	45.3	0	0	0	0	111.5	T1669	S1667-T1669 PolarHBondContact O-N 3.28Å
1668	F	27.8	Very low	28.5	Very low	196 Å²	196	157.7 Å²	157.7	86%	0.86	78%	0.78	S	S	*	*			trans	-73.4	108	163.8	-76.4	-90.2	0	0	0	109.1
1669	T	28.2	Very low	28.8	Very low	130 Å²	130	153.1 Å²	153.1	80%	0.798	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-72.8	130	169	41.6	0	0	0	0	109.8	S1667	S1667-T1669 PolarHBondContact O-N 3.28Å
1670	L	28.9	Very low	29.4	Very low	148 Å²	148	149.2 Å²	149.2	78%	0.775	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-66.1	128.7	179	-79.6	93.4	0	0	0	110.8
1671	R	27.6	Very low	29.8	Very low	240 Å²	240	140.8 Å²	140.8	91%	0.906	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-67.9	133.4	167.3	-86.4	-177.7	176.6	170.7	-1.2	110.4
1672	P	29.7	Very low	30.2	Very low	121 Å²	121	140.5 Å²	140.5	79%	0.786	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-65.9	145.7	174.2	-16.8	29.8	0	0	0	112.8
1673	N	32.2	Very low	30.7	Very low	129 Å²	129	140.6 Å²	140.6	69%	0.69	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-57.9	120.9	-176.6	-167.6	-2.6	0	0	0	112.8	Y1675	N1673-Y1675 VanDerWaalsContact C-N 3.34Å; N1673-Y1675 PolarHBondContact O-N 3.45Å; N1673-Y1675 WeakPolarHBondContact OD1-CD2 3.19Å
1674	P	39.7	Very low	30.9	Very low	109 Å²	109	137.6 Å²	137.6	71%	0.708	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	5.4	-165.8	30.6	-35.4	0	0	0	116.5
1675	Y	34.2	Very low	31.1	Very low	151 Å²	151	140.6 Å²	140.6	59%	0.592	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	11.6	-168.1	-61.9	-68.8	0	0	0	116.7	I507 N1673	I507-Y1675 HydrophobicContact CD1-CE1 4.16Å; N1673-Y1675 VanDerWaalsContact C-N 3.34Å; N1673-Y1675 PolarHBondContact O-N 3.45Å; N1673-Y1675 WeakPolarHBondContact OD1-CD2 3.19Å
1676	R	31.8	Very low	31.6	Very low	230 Å²	230	137.7 Å²	137.7	87%	0.868	72%	0.724	S	S	*	*	S	Bend	trans	-82.5	-20	-168.3	-143.3	173.8	-173.8	-156	-0.5	116.4
1677	N	32.4	Very low	31.6	Very low	138 Å²	138	135.1 Å²	135.1	74%	0.738	72%	0.724	S	S	*	*			trans	-140.6	64.4	-169.2	-61.6	-29.1	0	0	0	114.1
1678	L	30.7	Very low	31.6	Very low	96 Å²	96	139.4 Å²	139.4	50%	0.503	74%	0.735	S	S	.	*	P	Polyproline II helix	trans	-90.2	126.5	170.4	-73	166.6	0	0	0	110.5	I566	I566-L1678 HydrophobicContact CD1-CD2 4.11Å
1679	P	33	Very low	31.7	Very low	75 Å²	75	135.5 Å²	135.5	49%	0.487	73%	0.73	S	S	.	*	P	Polyproline II helix	trans	-83.7	153.9	167.5	30.9	-29.8	0	0	0	112.2
1680	P	36.2	Very low	31.8	Very low	49 Å²	49	135 Å²	135	32%	0.318	73%	0.729	S	S	.	*	P	Polyproline II helix	trans	-80.1	160.2	-172.4	32.1	-35	0	0	0	114	D859 V950	D859-P1680 HydrophobicContact CB-CG 3.78Å; D859-P1680 VanDerWaalsContact CG-CG 3.43Å; D859-P1680 WeakPolarHBondContact OD2-CD 3.38Å; D859-P1680 WeakPolarHBondContact OD2-CG 3.46Å; V950-P1680 HydrophobicContact CG2-CB 4.06Å
1681	A	34.1	Very low	32	Very low	78 Å²	78	134 Å²	134	65%	0.645	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-73.5	136.5	-173.5	0	0	0	0	0	113.1
1682	I	34.6	Very low	32.1	Very low	159 Å²	159	127.1 Å²	127.1	82%	0.815	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-76.6	124.6	178.3	-63.2	169.9	0	0	0	109.5
1683	E	33.8	Very low	32.2	Very low	149 Å²	149	126.7 Å²	126.7	70%	0.696	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-59.6	141.3	178.9	-68.8	-179.3	167.8	0	0	112.4
1684	T	32	Very low	32.1	Very low	139 Å²	139	129.5 Å²	129.5	85%	0.853	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-54.1	135.2	-175.5	45.7	0	0	0	0	113.4
1685	K	29.4	Very low	31.6	Very low	197 Å²	197	131.4 Å²	131.4	86%	0.857	74%	0.737	S	S	*	*			trans	-45.8	142.3	-177.2	-71.6	176.7	176.7	174.3	0	114.3	G1687	K1685-G1687 PolarHBondContact O-N 3.23Å
1686	P	32.1	Very low	31.4	Very low	136 Å²	136	129.8 Å²	129.8	88%	0.883	75%	0.745	S	S	*	*	S	Bend	trans	-70.8	127.9	174.5	29.9	-31.9	0	0	0	110.2
1687	G	29.2	Very low	31.2	Very low	74 Å²	74	129.9 Å²	129.9	76%	0.763	75%	0.747	S	S	*	*			trans	153	-4.7	174	0	0	0	0	0	117.3	K1685	K1685-G1687 PolarHBondContact O-N 3.23Å
1688	M	25.9	Very low	31.1	Very low	183 Å²	183	127.3 Å²	127.3	90%	0.901	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-87.8	123.4	169.7	-78.6	-158.1	171.2	0	0	110.7
1689	P	30	Very low	31.1	Very low	115 Å²	115	128.8 Å²	128.8	75%	0.747	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-68.8	138.8	-179.6	27.5	-31.5	0	0	0	110.2
1690	P	30.9	Very low	30.8	Very low	119 Å²	119	135.3 Å²	135.3	77%	0.773	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.1	141	-176.6	27.9	-32.5	0	0	0	110.6	A1692	P1690-A1692 PolarHBondContact O-N 2.79Å
1691	P	32.1	Very low	30.4	Very low	127 Å²	127	144 Å²	144	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-63.4	134.1	179.2	25.8	-31.6	0	0	0	110.2	S1693	P1691-S1693 PolarHBondContact O-N 3.22Å
1692	A	30	Very low	30	Very low	96 Å²	96	149.4 Å²	149.4	79%	0.793	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-46.2	129.7	-173.5	0	0	0	0	0	113.1	P1690 Q1694	P1690-A1692 PolarHBondContact O-N 2.79Å; A1692-Q1694 PolarHBondContact O-N 3.41Å; A1692-Q1694 VanDerWaalsContact O-N 3.16Å
1693	S	32.4	Very low	29.7	Very low	112 Å²	112	148.6 Å²	148.6	78%	0.783	81%	0.813	S	S	*	*			trans	-51.1	113.8	174	50.9	0	0	0	0	111.2	P1691 I1695	P1691-S1693 PolarHBondContact O-N 3.22Å; S1693-I1695 PolarHBondContact O-N 3.49Å
1694	Q	30.7	Very low	29.4	Very low	188 Å²	188	148.7 Å²	148.7	88%	0.879	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-58	130.5	166.8	-72.1	177.7	-15	0	0	109.5	A1692	A1692-Q1694 PolarHBondContact O-N 3.41Å; A1692-Q1694 VanDerWaalsContact O-N 3.16Å
1695	I	28.5	Very low	29.2	Very low	148 Å²	148	147.9 Å²	147.9	76%	0.759	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-58.3	131.3	-174.9	-64.2	164.7	0	0	0	110.1	S1693 Y1697	S1693-I1695 PolarHBondContact O-N 3.49Å; I1695-Y1697 PolarHBondContact O-N 2.99Å
1696	P	29.1	Very low	29.1	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.6	120.3	-178	28.4	-31.6	0	0	0	110.9	A1698	P1696-A1698 PolarHBondContact O-N 3.17Å
1697	Y	29	Very low	29	Very low	231 Å²	231	145.9 Å²	145.9	91%	0.906	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-63.2	117.6	172.1	-83.1	-92.4	0	0	0	110.6	I1695	I1695-Y1697 PolarHBondContact O-N 2.99Å
1698	A	29.2	Very low	28.8	Very low	85 Å²	85	150 Å²	150	70%	0.702	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-69.3	142.2	173.3	0	0	0	0	0	111.4	P1696 F1700	P1696-A1698 PolarHBondContact O-N 3.17Å; A1698-F1700 PolarHBondContact O-N 3.09Å
1699	P	30.1	Very low	28.9	Very low	127 Å²	127	145.5 Å²	145.5	83%	0.825	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-76.2	124.3	-172	30.4	-35.8	0	0	0	112.6	R1701	P1699-R1701 PolarHBondContact O-N 3.16Å; P1699-R1701 VanDerWaalsContact O-N 3.16Å
1700	F	27.3	Very low	28.9	Very low	212 Å²	212	145.1 Å²	145.1	93%	0.93	79%	0.79	S	S	*	*			trans	-63.7	107.3	173.8	-110.7	-96.4	0	0	0	111.2	A1698 K1702	A1698-F1700 PolarHBondContact O-N 3.09Å; F1700-K1702 PolarHBondContact O-N 2.98Å
1701	R	27.5	Very low	29	Very low	232 Å²	232	147.2 Å²	147.2	88%	0.875	79%	0.793	S	S	*	*			trans	-76.7	105.2	171.5	-119.3	178.6	-179.4	174.2	-0.1	109.3	P1699 I1703	P1699-R1701 PolarHBondContact O-N 3.16Å; P1699-R1701 VanDerWaalsContact O-N 3.16Å; R1701-I1703 PolarHBondContact O-N 3.22Å
1702	K	27	Very low	28.9	Very low	191 Å²	191	148.1 Å²	148.1	83%	0.83	79%	0.791	S	S	*	*			trans	-76.4	102.6	165.8	-91.2	-177.9	175.4	177.2	0	109.1	F1700 M1704	F1700-K1702 PolarHBondContact O-N 2.98Å; K1702-M1704 PolarHBondContact O-N 3.29Å
1703	I	26.6	Very low	29	Very low	141 Å²	141	152 Å²	152	72%	0.723	79%	0.793	S	S	*	*			trans	-75.9	102.8	168.4	-62.6	169.7	0	0	0	106.8	R1701 T1705	R1701-I1703 PolarHBondContact O-N 3.22Å; I1703-T1705 HydrophobicContact CG2-CG2 4.25Å; I1703-T1705 PolarHBondContact O-N 3.17Å
1704	M	28	Very low	28.7	Very low	151 Å²	151	156.4 Å²	156.4	74%	0.744	80%	0.797	S	S	*	*			trans	-85	95.6	164.2	-80.8	-176.4	170	0	0	107.8	K1702 F1706	K1702-M1704 PolarHBondContact O-N 3.29Å; M1704-F1706 HydrophobicContact CB-CE2 4.26Å; M1704-F1706 PolarHBondContact O-N 3.3Å
1705	T	27.4	Very low	28.6	Very low	123 Å²	123	160.2 Å²	160.2	76%	0.755	82%	0.816	S	S	*	*			trans	-74.4	109.7	167	17.1	0	0	0	0	108.6	I1703 P1707	I1703-T1705 HydrophobicContact CG2-CG2 4.25Å; I1703-T1705 PolarHBondContact O-N 3.17Å; T1705-P1707 WeakPolarHBondContact O-CD 3.29Å
1706	F	27.9	Very low	28.6	Very low	182 Å²	182	160.9 Å²	160.9	80%	0.798	82%	0.818	S	S	*	*			trans	-88	116.1	164.4	-75.1	-85.4	0	0	0	108.5	M1704	M1704-F1706 HydrophobicContact CB-CE2 4.26Å; M1704-F1706 PolarHBondContact O-N 3.3Å
1707	P	29.5	Very low	28.6	Very low	109 Å²	109	163.1 Å²	163.1	71%	0.708	82%	0.821	S	S	*	*			trans	-100.1	118.1	168.5	33.6	-22.2	0	0	0	108.9	T1705	T1705-P1707 WeakPolarHBondContact O-CD 3.29Å
1708	N	26.6	Very low	28.5	Very low	160 Å²	160	159.3 Å²	159.3	86%	0.856	82%	0.816	S	S	*	*			trans	-179.7	134.6	155.7	-91.2	-14.3	0	0	0	103.5
1709	S	28.1	Very low	28.5	Very low	88 Å²	88	163.7 Å²	163.7	62%	0.615	82%	0.823	S	S	*	*			cis	171.9	124.5	2.3	42.7	0	0	0	0	101.1
1710	S	28.8	Very low	28.4	Very low	107 Å²	107	166 Å²	166	75%	0.748	82%	0.823	S	S	*	*			trans	17.3	117.1	156.7	59.8	0	0	0	0	118
1711	I	33.6	Very low	28.5	Very low	164 Å²	164	162.9 Å²	162.9	84%	0.841	82%	0.816	S	S	*	*				-147.4	98.9	130	-81.6	121.2	0	0	0	105.6
1712	D	29.2	Very low	28.5	Very low	146 Å²	146	158 Å²	158	78%	0.781	81%	0.812	S	S	*	*			trans	-55.4	127.9	144.1	-86.2	-46	0	0	0	107.5
1713	H	32.7	Very low	28.7	Very low	177 Å²	177	155.5 Å²	155.5	82%	0.819	81%	0.81	S	S	*	*			trans	-174.4	126.2	131.1	-97.8	-63.2	0	0	0	110.3	Q1715	H1713-Q1715 PolarHBondContact O-N 3.26Å
1714	K	26.2	Very low	28.8	Very low	204 Å²	204	156.7 Å²	156.7	89%	0.887	82%	0.817	S	S	*	*			trans	-42.2	123.1	170.5	-66.2	167.6	172.9	175.4	0	113.8
1715	Q	27.9	Very low	28.9	Very low	269 Å²	269	157.2 Å²	157.2	100%	1.257	82%	0.824	S	S	*	*				-177.5	0	124.9	-102.9	177.9	-12.6	0	0	107.1	H1713	H1713-Q1715 PolarHBondContact O-N 3.26Å

Retrieved 1,715 of 1,715 residues in 351.4 ms (Link to these results)

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