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Ephrin type-A receptor 6

Receptor tyrosine kinase which binds promiscuously GPI-anchored ephrin-A family ligands residing on adjacent cells, leading to contact-dependent bidirectional signaling into neighboring cells. The signaling pathway downstream of the receptor is referred to as forward signaling while the signaling pathway downstream of the ephrin ligand is referred to as reverse signaling.

AlphaFold DB , UniProt , Accession A0A087XL05, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 985 aa.

						>A0A087XL05_POEFO|A0A087XL05
MTFGNRFFVSLFLGITISRFSRCNQVVLLDTTSVLGELGWKTYPINGWDAITEMDEHNRPIHTFQVCNVMEPNQNNWLRSNWISRQAAQKIYVELRFTLRDCNSIPWVSGTCKETFNLFYQEMDEAHGVKFKPSQYTKIDTIAADESFTQMDLGDRILKLNTEVREVGPMTKKGFYLAFQDIGACIALVSVRVYYKKCPFTLMNLASFPDTVPRVDSSSLVEVRGACIDHAEERDTPKLFCGADGDWLVPLGRCVCSVGYEEIDGSCVACRPGFYKAYAGNIKCSKCPPHSFSYGEGASICRCEKGFFRAEKDPSTMACTRPPSPPRNPMFNMNDTCLMLEWSPPSDTGGRRDLTYNVQCKRCGPGPNQCQLCEDELRFLPRPLGLTNATVTVTDFSSHANYTFEIESLNGVSDMSTFPRQVAIITVSTDQGGPSLVGAVKKDWASPNSIALSWQQPEETTLPIIDYEVKYYEKEQEQLSYSSTRTRAPSVIVSGLKPATWYIFSVRTRTAGGFSSYSPKYEYQTTGDSSDIASDQGQVLVIVTAAVGGFTLLIILTLFLLITGRCQWYFKAKMTSEDKRRTDYQNGHVPFPGIKAYVDPDTYEDPTQAVHEFTKEIDPSRIRIERVIGAGEFGEVCSGRLRTPGKKEIAVAIKTLKGGYVERQRRDFLREASIMGQFDHPNIIRLEGVVTKSRPVMIVVEYMENGSLDSFLRQHDGHFTVIQLVGMLRGIAAGMKYLSDMGYVHRDLAARNILVNSNLVCKVSDFGLSRVLEDDPEAAYTTTGGKIPIRWTAPEAIAYRKFSSASDAWSYGIVMWEVMSYGERPYWEMSNQDVILSIEEGYRLPAPMGCPVALHQLMLHCWQKERNHRPKFVDIVSFLDKLIRNPSSLLPLVEDLQSLPESPAEDMDYPMFISVGDWLDSIKMTQYKSNFMAAGFNTLDSVARMSIEDVRRIGVELIGHQRRIISSIQTLQFQLLHEQEKGFHV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.1	Very low	31.5	Very low	236 Å²	236	150.6 Å²	150.6	100%	1.163	77%	0.767	S	S	*	*				0	83.6	0	-71.3	176.2	-170.7	0	0	108.4
2	T	32	Very low	31.4	Very low	136 Å²	136	150.1 Å²	150.1	83%	0.834	76%	0.756	S	S	*	*			trans	-168.4	69.7	179.2	27.6	0	0	0	0	109
3	F	26.3	Very low	31.5	Very low	218 Å²	218	146.8 Å²	146.8	96%	0.956	74%	0.741	S	S	*	*	S	Bend	trans	-148.5	18.8	168.4	-109.4	-80.9	0	0	0	113.3
4	G	27.6	Very low	31.3	Very low	52 Å²	52	139.2 Å²	139.2	54%	0.536	72%	0.718	S	S	.	*	S	Bend	trans	-105.9	-17.4	-172.1	0	0	0	0	0	117.5
5	N	30.1	Very low	31.2	Very low	147 Å²	147	136.3 Å²	136.3	79%	0.786	70%	0.703	S	S	*	*	S	Bend	trans	-102.1	4.2	-164.7	-92.2	5.9	0	0	0	116.7
6	R	31.2	Very low	31.2	Very low	233 Å²	233	131.9 Å²	131.9	88%	0.879	68%	0.684	S	S	*	*	S	Bend	trans	-96.8	-15.9	175.5	-75.6	-168.7	176.1	-169.3	-0.1	114.7
7	F	33.9	Very low	31.2	Very low	180 Å²	180	130.8 Å²	130.8	79%	0.789	68%	0.678	S	S	*	*	H	α-helix	trans	-86.5	-23.9	179.4	-96.7	-87.6	0	0	0	114.1
8	F	30.3	Very low	31	Very low	150 Å²	150	127.5 Å²	127.5	66%	0.658	67%	0.668	S	S	*	*	H	α-helix	trans	-78.9	-25	-178.1	-102.3	-87.4	0	0	0	114.4
9	V	34.5	Very low	30.9	Very low	99 Å²	99	131.5 Å²	131.5	60%	0.6	67%	0.673	S	S	*	*	H	α-helix	trans	-80	-32.3	-178.7	-178.6	0	0	0	0	111.8	L13	V9-L13 PolarHBondContact O-N 3.17Å
10	S	33.3	Very low	31.1	Very low	90 Å²	90	133 Å²	133	63%	0.629	68%	0.675	S	S	*	*	H	α-helix	trans	-73.5	-29.4	177.3	-64.9	0	0	0	0	113.4	G14	S10-G14 PolarHBondContact O-N 3.42Å
11	L	34.5	Very low	31.5	Very low	116 Å²	116	130.1 Å²	130.1	61%	0.607	67%	0.667	S	S	*	*	H	α-helix	trans	-75.5	-36.6	178.2	-145.3	81.5	0	0	0	111.9	I15	L11-I15 HydrophobicContact CG-CD1 4.31Å; L11-I15 WeakPolarHBondContact O-CD1 3.29Å; L11-I15 VanDerWaalsContact O-CG1 3.22Å; L11-I15 WeakPolarHBondContact O-CG1 3.32Å; L11-I15 PolarHBondContact O-N 3.21Å
12	F	30	Very low	32.3	Very low	144 Å²	144	128.5 Å²	128.5	63%	0.632	65%	0.648	S	S	*	*	H	α-helix	trans	-70.4	-38.7	175.4	-100.2	-86.3	0	0	0	112.5	G14 I15 T16	F12-G14 PolarHBondContact O-N 2.75Å; F12-I15 PolarHBondContact O-N 3.37Å; F12-T16 PolarHBondContact O-N 3.44Å; F12-T16 PolarHBondContact O-OG1 3.32Å
13	L	32.4	Very low	33.7	Very low	107 Å²	107	125.6 Å²	125.6	56%	0.56	63%	0.633	S	S	*	*	H	α-helix	trans	-65.3	-39.2	177.2	-136.9	78.1	0	0	0	111.9	V9 T16 I17	V9-L13 PolarHBondContact O-N 3.17Å; L13-T16 PolarHBondContact O-OG1 3.35Å; L13-T16 VanDerWaalsContact O-OG1 3.12Å; L13-I17 HydrophobicContact CD2-CD1 4.47Å; L13-I17 HydrophobicContact CG-CD1 4.25Å; L13-I17 WeakPolarHBondContact O-CB 3.44Å; L13-I17 VanDerWaalsContact O-CD1 3.31Å; L13-I17 WeakPolarHBondContact O-CD1 3.42Å; L13-I17 WeakPolarHBondContact O-CG1 3.49Å; L13-I17 PolarHBondContact O-N 3.03Å
14	G	29.7	Very low	36.4	Very low	41 Å²	41	116.2 Å²	116.2	42%	0.423	59%	0.592	S	S	.	*	H	α-helix	trans	-68.9	-31.1	176.4	0	0	0	0	0	114.6	S10 F12 S18	S10-G14 PolarHBondContact O-N 3.42Å; F12-G14 PolarHBondContact O-N 2.75Å; G14-S18 PolarHBondContact O-N 3.08Å; G14-S18 PolarHBondContact O-OG 2.85Å
15	I	30	Very low	39.3	Very low	95 Å²	95	115.9 Å²	115.9	49%	0.487	58%	0.577	S	S	.	*	H	α-helix	trans	-80.7	-30.9	178.2	-65.3	167.8	0	0	0	111.4	L11 F12 S18 R19	L11-I15 HydrophobicContact CG-CD1 4.31Å; L11-I15 WeakPolarHBondContact O-CD1 3.29Å; L11-I15 VanDerWaalsContact O-CG1 3.22Å; L11-I15 WeakPolarHBondContact O-CG1 3.32Å; L11-I15 PolarHBondContact O-N 3.21Å; F12-I15 PolarHBondContact O-N 3.37Å; I15-S18 PolarHBondContact O-OG 2.84Å; I15-R19 PolarHBondContact O-N 2.78Å
16	T	30	Very low	42.3	Very low	67 Å²	67	110.2 Å²	110.2	41%	0.411	55%	0.547	S	S	.	.	H	α-helix	trans	-72.9	-39.3	170.5	36.2	0	0	0	0	112.8	F12 L13 S18 R19 F20	F12-T16 PolarHBondContact O-N 3.44Å; F12-T16 PolarHBondContact O-OG1 3.32Å; L13-T16 PolarHBondContact O-OG1 3.35Å; L13-T16 VanDerWaalsContact O-OG1 3.12Å; T16-S18 PolarHBondContact O-N 3.4Å; T16-R19 PolarHBondContact O-N 2.66Å; T16-F20 WeakPolarHBondContact O-CD2 3.35Å; T16-F20 PolarHBondContact O-N 3.07Å
17	I	31.9	Very low	45.3	Very low	113 Å²	113	102 Å²	102	58%	0.579	52%	0.523	S	S	*	.	H	α-helix	trans	-68.5	-36.9	-178.4	-67.3	164.8	0	0	0	111.6	L13 S21	L13-I17 HydrophobicContact CD2-CD1 4.47Å; L13-I17 HydrophobicContact CG-CD1 4.25Å; L13-I17 WeakPolarHBondContact O-CB 3.44Å; L13-I17 VanDerWaalsContact O-CD1 3.31Å; L13-I17 WeakPolarHBondContact O-CD1 3.42Å; L13-I17 WeakPolarHBondContact O-CG1 3.49Å; L13-I17 PolarHBondContact O-N 3.03Å; I17-S21 PolarHBondContact O-N 2.93Å
18	S	28.1	Very low	48.1	Very low	71 Å²	71	94.9 Å²	94.9	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-73.2	-26.1	176.2	52.6	0	0	0	0	114	G14 I15 T16	G14-S18 PolarHBondContact O-N 3.08Å; G14-S18 PolarHBondContact O-OG 2.85Å; I15-S18 PolarHBondContact O-OG 2.84Å; T16-S18 PolarHBondContact O-N 3.4Å
19	R	29	Very low	51.1	Low	203 Å²	203	89.2 Å²	89.2	77%	0.766	47%	0.469	S	S	*	.	H	α-helix	trans	-78.9	-33.7	172.4	-97.8	-176.9	171.4	-173.3	-1.8	113.5	I15 T16	I15-R19 PolarHBondContact O-N 2.78Å; T16-R19 PolarHBondContact O-N 2.66Å
20	F	35	Very low	53.8	Low	162 Å²	162	86 Å²	86	71%	0.711	45%	0.449	S	S	*	.	H	α-helix	trans	-68.8	-34.1	176.1	-94.2	-85.5	0	0	0	112.6	T16 R22 C23	T16-F20 WeakPolarHBondContact O-CD2 3.35Å; T16-F20 PolarHBondContact O-N 3.07Å; F20-R22 PolarHBondContact O-N 3.33Å; F20-R22 VanDerWaalsContact O-N 3.1Å; F20-C23 PolarHBondContact O-N 3.13Å
21	S	38.2	Very low	56.5	Low	73 Å²	73	82 Å²	82	51%	0.51	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.1	179	-170.9	0	0	0	0	115.1	I17 N24	I17-S21 PolarHBondContact O-N 2.93Å; S21-N24 PolarHBondContact O-OD1 2.88Å; S21-N24 VanDerWaalsContact O-OD1 3.09Å
22	R	50.6	Low	58.8	Low	201 Å²	201	79.2 Å²	79.2	76%	0.758	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-9.9	176.3	-77.4	-174.3	176.2	-173.9	-0.7	114	F20 N24	F20-R22 PolarHBondContact O-N 3.33Å; F20-R22 VanDerWaalsContact O-N 3.1Å; R22-N24 VanDerWaalsContact C-N 3.34Å
23	C	61.1	Low	61.3	Low	75 Å²	75	76.2 Å²	76.2	51%	0.507	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-21.3	-173.5	-154.5	0	0	0	0	113.2	F20	F20-C23 PolarHBondContact O-N 3.13Å
24	N	82.4	Confident	63.4	Low	21 Å²	21	73.4 Å²	73.4	11%	0.112	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-1.4	178.9	63.3	-6.4	0	0	0	113.7	S21 R22 K196 K197	S21-N24 PolarHBondContact O-OD1 2.88Å; S21-N24 VanDerWaalsContact O-OD1 3.09Å; R22-N24 VanDerWaalsContact C-N 3.34Å; N24-K196 CarbonylContact O-C 3.51Å; N24-K196 VanDerWaalsContact O-CA 3.23Å; N24-K196 WeakPolarHBondContact O-CA 3.13Å; N24-K197 VanDerWaalsContact CA-O 3.27Å; N24-K197 WeakPolarHBondContact CA-O 3.4Å; N24-K197 VanDerWaalsContact CB-O 3.29Å; N24-K197 WeakPolarHBondContact CB-O 3.36Å; N24-K197 PolarHBondContact O-N 3.35Å
25	Q	90.3	Very high	65	Low	45 Å²	45	79.6 Å²	79.6	21%	0.21	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	129.6	179.8	-63.4	-178.5	5.3	0	0	111.4	Y194 Y195	Q25-Y194 HydrophobicContact CB-CD2 3.98Å; Q25-Y194 HydrophobicContact CG-CD2 3.78Å; Q25-Y194 HydrophobicContact CG-CE2 3.87Å; Q25-Y195 WeakPolarHBondContact CA-O 3.32Å
26	V	91.8	Very high	66.8	Low	28 Å²	28	76.7 Å²	76.7	17%	0.17	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	114.5	171.5	-176.4	0	0	0	0	109.1	Y194 Y195 K197	V26-Y194 CarbonylContact O-C 3.57Å; V26-Y194 WeakPolarHBondContact O-CA 3.46Å; V26-Y194 VanDerWaalsContact O-CB 3.31Å; V26-Y194 WeakPolarHBondContact O-CB 3.47Å; V26-Y195 HydrophobicContact CB-CD1 3.85Å; V26-Y195 HydrophobicContact CB-CE1 3.37Å; V26-Y195 HydrophobicContact CB-CE2 4.1Å; V26-Y195 HydrophobicContact CB-CG 4.42Å; V26-Y195 VanDerWaalsContact CB-CZ 3.5Å; V26-Y195 HydrophobicContact CG1-CD1 4.25Å; V26-Y195 HydrophobicContact CG1-CE1 3.42Å; V26-Y195 VanDerWaalsContact CG1-CE1 3.42Å; V26-Y195 HydrophobicContact CG2-CE1 4.19Å; V26-Y195 HydrophobicContact CG2-CE2 4.1Å; V26-Y195 PolarHBondContact N-O 2.9Å; V26-Y195 PolarHBondContact O-N 2.93Å; V26-K197 HydrophobicContact CG2-CD 3.65Å; V26-K197 HydrophobicContact CG2-CG 3.93Å
27	V	93.6	Very high	68.5	Low	61 Å²	61	82.3 Å²	82.3	37%	0.37	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	126.6	-178.2	179.8	0	0	0	0	110	L29 D30	V27-L29 WeakPolarHBondContact CG1-O 3.37Å; V27-D30 HydrophobicContact CG1-CB 3.83Å
28	L	93.6	Very high	70.6	Confident	30 Å²	30	77.6 Å²	77.6	16%	0.157	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-31.7	174.5	-59.4	-179.4	0	0	0	111.8	I83 Q86 A88 I91 F175 V193 Y195	L28-I83 HydrophobicContact CB-CG2 3.83Å; L28-Q86 HydrophobicContact CD2-CB 4.2Å; L28-Q86 HydrophobicContact CD2-CG 3.84Å; L28-A88 HydrophobicContact CD1-CB 4.27Å; L28-I91 HydrophobicContact CD1-CG2 3.83Å; L28-F175 HydrophobicContact CD1-CE1 4.3Å; L28-F175 HydrophobicContact CD1-CZ 4.32Å; L28-V193 HydrophobicContact CB-CG1 4.45Å; L28-V193 HydrophobicContact CD1-CG1 4.45Å; L28-V193 PolarHBondContact N-O 2.95Å; L28-Y195 HydrophobicContact CD1-CD1 4.16Å; L28-Y195 HydrophobicContact CD2-CD1 3.77Å; L28-Y195 HydrophobicContact CD2-CE1 3.74Å; L28-Y195 HydrophobicContact CG-CD1 3.97Å; L28-Y195 HydrophobicContact CG-CE1 4.43Å
29	L	93.2	Very high	73.1	Confident	31 Å²	31	76.3 Å²	76.3	16%	0.162	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	138.6	177.5	172.2	68.9	0	0	0	109.1	V27 W40 I83 R192 V193	V27-L29 WeakPolarHBondContact CG1-O 3.37Å; L29-W40 HydrophobicContact CD2-CZ2 3.97Å; L29-I83 HydrophobicContact CB-CD1 4.25Å; L29-I83 HydrophobicContact CB-CG1 4.48Å; L29-I83 HydrophobicContact CB-CG2 4.46Å; L29-I83 HydrophobicContact CD2-CD1 3.5Å; L29-I83 VanDerWaalsContact CD2-CD1 3.5Å; L29-I83 HydrophobicContact CD2-CG1 4.12Å; L29-I83 HydrophobicContact CG-CD1 4.48Å; L29-R192 CarbonylContact O-C 3.57Å; L29-R192 WeakPolarHBondContact O-CA 3.27Å; L29-V193 HydrophobicContact CB-CB 4.04Å; L29-V193 HydrophobicContact CB-CG2 4.1Å; L29-V193 HydrophobicContact CD2-CG2 4.05Å; L29-V193 PolarHBondContact N-O 2.74Å; L29-V193 VanDerWaalsContact N-O 3.13Å; L29-V193 PolarHBondContact O-N 2.87Å
30	D	91.6	Very high	76	Confident	33 Å²	33	67.7 Å²	67.7	18%	0.176	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	107.8	169.9	-176.4	-19.5	0	0	0	109	V27 T32 S33 R192	V27-D30 HydrophobicContact CG1-CB 3.83Å; D30-T32 PolarHBondContact O-N 2.94Å; D30-T32 WeakPolarHBondContact OD1-CB 3.31Å; D30-T32 PolarHBondContact OD1-N 3.23Å; D30-T32 PolarHBondContact OD1-OG1 2.97Å; D30-S33 PolarHBondContact O-N 2.75Å; D30-S33 VanDerWaalsContact O-N 3.16Å; D30-S33 PolarHBondContact O-OG 3.37Å; D30-R192 HydrophobicContact CB-CG 4.38Å
31	T	89.2	Confident	78.7	Confident	6 Å²	6	66.2 Å²	66.2	4%	0.037	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-65.2	-20.7	-175.7	59.5	0	0	0	0	113.4	S33 L38 W40 S190 V191	T31-S33 VanDerWaalsContact C-N 3.29Å; T31-S33 PolarHBondContact O-N 2.75Å; T31-L38 HydrophobicContact CG2-CD1 3.97Å; T31-L38 HydrophobicContact CG2-CD2 3.9Å; T31-W40 HydrophobicContact CG2-CH2 3.98Å; T31-W40 HydrophobicContact CG2-CZ2 3.67Å; T31-S190 WeakPolarHBondContact OG1-CA 3.12Å; T31-V191 HydrophobicContact CG2-CB 3.97Å; T31-V191 PolarHBondContact N-O 3.11Å; T31-V191 VanDerWaalsContact N-O 3.1Å; T31-V191 PolarHBondContact OG1-N 2.94Å
32	T	84.3	Confident	81.2	Confident	57 Å²	57	64.5 Å²	64.5	35%	0.35	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-77.8	-16.5	178.1	69.8	0	0	0	0	113.2	D30	D30-T32 PolarHBondContact O-N 2.94Å; D30-T32 WeakPolarHBondContact OD1-CB 3.31Å; D30-T32 PolarHBondContact OD1-N 3.23Å; D30-T32 PolarHBondContact OD1-OG1 2.97Å
33	S	80.5	Confident	83	Confident	80 Å²	80	61 Å²	61	56%	0.559	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-95	-6.2	-178	70.6	0	0	0	0	114	D30 T31	D30-S33 PolarHBondContact O-N 2.75Å; D30-S33 VanDerWaalsContact O-N 3.16Å; D30-S33 PolarHBondContact O-OG 3.37Å; T31-S33 VanDerWaalsContact C-N 3.29Å; T31-S33 PolarHBondContact O-N 2.75Å
34	V	77.8	Confident	84.3	Confident	49 Å²	49	60.4 Å²	60.4	30%	0.297	34%	0.335	S	S	.	.			trans	-88	118.6	-176.1	-173.1	0	0	0	0	109.5	G36 L38	V34-G36 VanDerWaalsContact C-N 3.33Å; V34-G36 WeakPolarHBondContact CG1-O 3.38Å; V34-G36 PolarHBondContact O-N 3.02Å; V34-L38 HydrophobicContact CB-CD2 4.15Å; V34-L38 HydrophobicContact CG1-CD2 4.29Å; V34-L38 HydrophobicContact CG2-CD2 3.89Å
35	L	63.9	Low	84.4	Confident	170 Å²	170	66.3 Å²	66.3	89%	0.89	37%	0.365	S	S	*	.			trans	-86.1	7.5	-175.9	-66.9	168	0	0	0	114.5
36	G	66.8	Low	83.9	Confident	34 Å²	34	69.9 Å²	69.9	35%	0.351	39%	0.386	S	S	.	.	S	Bend	trans	-150.7	-178.2	-178.1	0	0	0	0	0	112.3	V34 L38 H62	V34-G36 VanDerWaalsContact C-N 3.33Å; V34-G36 WeakPolarHBondContact CG1-O 3.38Å; V34-G36 PolarHBondContact O-N 3.02Å; G36-L38 PolarHBondContact O-N 2.65Å; G36-H62 PolarHBondContact O-CD2 3Å; G36-H62 PolarHBondContact O-NE2 3.39Å
37	E	66.1	Low	83.5	Confident	186 Å²	186	68.8 Å²	68.8	87%	0.869	38%	0.379	S	S	*	.			trans	-54.3	123.9	-175.3	-69.9	-175	-179.7	0	0	112.6	G39	E37-G39 PolarHBondContact O-N 2.94Å
38	L	76.3	Confident	83.5	Confident	13 Å²	13	66.1 Å²	66.1	7%	0.068	36%	0.363	C	S	.	.			trans	-62.4	-24	178.1	-83.1	162.3	0	0	0	112.8	T31 V34 G36 W40 H62 F64 N81	T31-L38 HydrophobicContact CG2-CD1 3.97Å; T31-L38 HydrophobicContact CG2-CD2 3.9Å; V34-L38 HydrophobicContact CB-CD2 4.15Å; V34-L38 HydrophobicContact CG1-CD2 4.29Å; V34-L38 HydrophobicContact CG2-CD2 3.89Å; G36-L38 PolarHBondContact O-N 2.65Å; L38-W40 HydrophobicContact CB-CG 4.38Å; L38-W40 VanDerWaalsContact O-CD1 3.28Å; L38-W40 PolarHBondContact O-N 2.8Å; L38-H62 HydrophobicContact CD1-CB 3.48Å; L38-H62 VanDerWaalsContact CD1-CB 3.48Å; L38-H62 HydrophobicContact CG-CB 4.24Å; L38-F64 HydrophobicContact CB-CE2 4.42Å; L38-F64 HydrophobicContact CB-CZ 4.18Å; L38-F64 HydrophobicContact CD1-CE2 3.7Å; L38-F64 HydrophobicContact CD1-CZ 4.23Å; L38-N81 PolarHBondContact O-ND2 2.92Å
39	G	79.8	Confident	83.3	Confident	45 Å²	45	68.6 Å²	68.6	46%	0.464	38%	0.376	S	S	.	.			trans	66.3	18	176	0	0	0	0	0	115	E37 N81	E37-G39 PolarHBondContact O-N 2.94Å; G39-N81 PolarHBondContact O-OD1 2.86Å
40	W	90.7	Very high	83.1	Confident	22 Å²	22	70.8 Å²	70.8	8%	0.083	40%	0.399	C	S	.	.			trans	-66.7	146	177.5	-71.2	16.4	0	0	0	110.6	L29 T31 L38 F64 L78 R79 F179 L188 V191	L29-W40 HydrophobicContact CD2-CZ2 3.97Å; T31-W40 HydrophobicContact CG2-CH2 3.98Å; T31-W40 HydrophobicContact CG2-CZ2 3.67Å; L38-W40 HydrophobicContact CB-CG 4.38Å; L38-W40 VanDerWaalsContact O-CD1 3.28Å; L38-W40 PolarHBondContact O-N 2.8Å; W40-F64 HydrophobicContact CB-CE1 4.16Å; W40-F64 HydrophobicContact CB-CE2 4.46Å; W40-F64 HydrophobicContact CB-CZ 3.73Å; W40-F64 AromaticContact CD2-CE2 3.96Å; W40-F64 HydrophobicContact CD2-CE2 3.96Å; W40-F64 HydrophobicContact CD2-CZ 4.11Å; W40-F64 HydrophobicContact CE3-CD2 4.14Å; W40-F64 AromaticContact CE3-CE2 3.71Å; W40-F64 HydrophobicContact CE3-CE2 3.71Å; W40-F64 HydrophobicContact CE3-CZ 4.12Å; W40-F64 HydrophobicContact CG-CE2 4.31Å; W40-F64 AromaticContact CG-CZ 3.98Å; W40-F64 HydrophobicContact CG-CZ 3.98Å; W40-F64 HydrophobicContact CZ3-CD2 4.43Å; W40-F64 HydrophobicContact CZ3-CE2 4.27Å; W40-L78 HydrophobicContact CB-CD1 3.91Å; W40-L78 HydrophobicContact CE3-CD1 4.01Å; W40-L78 HydrophobicContact CE3-CD2 3.84Å; W40-L78 HydrophobicContact CE3-CG 3.79Å; W40-L78 HydrophobicContact CZ3-CD2 4.1Å; W40-L78 HydrophobicContact CZ3-CG 4.39Å; W40-R79 CarbonylContact C-O 3.59Å; W40-R79 WeakPolarHBondContact CA-O 3.04Å; W40-R79 VanDerWaalsContact CB-O 3.26Å; W40-R79 WeakPolarHBondContact CB-O 3.09Å; W40-F179 HydrophobicContact CE3-CE2 4.42Å; W40-F179 AromaticContact CH2-CE2 3.94Å; W40-F179 HydrophobicContact CH2-CE2 3.94Å; W40-F179 HydrophobicContact CH2-CZ 4.44Å; W40-F179 HydrophobicContact CZ3-CD2 4.1Å; W40-F179 AromaticContact CZ3-CE2 3.49Å; W40-F179 HydrophobicContact CZ3-CE2 3.49Å; W40-F179 VanDerWaalsContact CZ3-CE2 3.49Å; W40-F179 HydrophobicContact CZ3-CZ 4.29Å; W40-L188 HydrophobicContact CZ3-CD2 4.41Å; W40-V191 HydrophobicContact CH2-CB 3.85Å; W40-V191 HydrophobicContact CH2-CG1 4.16Å; W40-V191 HydrophobicContact CH2-CG2 3.75Å; W40-V191 HydrophobicContact CZ3-CG2 4.22Å
41	K	90.2	Very high	82.7	Confident	130 Å²	130	71.8 Å²	71.8	57%	0.565	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	137.8	-173.6	-61	-165.3	-176.9	-175	0	110.8	R79	K41-R79 PolarHBondContact N-O 2.87Å; K41-R79 PolarHBondContact O-N 2.77Å
42	T	91.8	Very high	82.4	Confident	38 Å²	38	75.4 Å²	75.4	23%	0.233	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145.6	178.7	61.2	0	0	0	0	111.1	P44 N46 W48 W77 L78	T42-P44 CarbonylContact C-O 3.47Å; T42-N46 PolarHBondContact OG1-N 3.14Å; T42-W48 HydrophobicContact CG2-CB 3.8Å; T42-W77 CarbonylContact C-O 3.56Å; T42-W77 VanDerWaalsContact CA-O 3.27Å; T42-W77 WeakPolarHBondContact CA-O 3.4Å; T42-L78 HydrophobicContact CG2-CD1 3.83Å
43	Y	89.3	Confident	82	Confident	126 Å²	126	75.9 Å²	75.9	49%	0.494	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	120.5	176.4	-176.7	-93.1	0	0	0	111.1	W77 F131	Y43-W77 PolarHBondContact N-O 2.86Å; Y43-W77 WeakPolarHBondContact O-CB 3.41Å; Y43-W77 PolarHBondContact O-N 3.3Å; Y43-F131 AromaticContact CD1-CD1 3.73Å; Y43-F131 HydrophobicContact CD1-CD1 3.73Å; Y43-F131 AromaticContact CD1-CE1 3.52Å; Y43-F131 HydrophobicContact CD1-CE1 3.52Å; Y43-F131 HydrophobicContact CD2-CD1 4.08Å; Y43-F131 HydrophobicContact CE1-CD1 4.41Å; Y43-F131 HydrophobicContact CE1-CE1 4.32Å; Y43-F131 AromaticContact CG-CD1 3.52Å; Y43-F131 HydrophobicContact CG-CD1 3.52Å; Y43-F131 AromaticContact CG-CE1 3.71Å; Y43-F131 HydrophobicContact CG-CE1 3.71Å
44	P	88.1	Confident	81.8	Confident	64 Å²	64	78.1 Å²	78.1	42%	0.416	43%	0.427	S	S	.	.	S	Bend	cis	-60.8	165.9	-5.1	28.6	-35.2	0	0	0	112.1	T42 N46 G47	T42-P44 CarbonylContact C-O 3.47Å; P44-N46 PolarHBondContact O-N 2.79Å; P44-G47 PolarHBondContact O-N 3.08Å
45	I	83.2	Confident	81.5	Confident	145 Å²	145	77.2 Å²	77.2	74%	0.744	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	128.1	176.7	-63	171.4	0	0	0	107.5
46	N	80.2	Confident	81.8	Confident	120 Å²	120	78.1 Å²	78.1	64%	0.642	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	19.2	-173.9	-45.6	-27.1	0	0	0	115.7	T42 P44 W48	T42-N46 PolarHBondContact OG1-N 3.14Å; P44-N46 PolarHBondContact O-N 2.79Å; N46-W48 VanDerWaalsContact C-N 3.3Å
47	G	83.6	Confident	82.1	Confident	4 Å²	4	82.9 Å²	82.9	4%	0.041	43%	0.433	C	S	.	.	S	Bend	trans	-71.7	-24.5	171	0	0	0	0	0	113.7	P44 V66	P44-G47 PolarHBondContact O-N 3.08Å; G47-V66 WeakPolarHBondContact O-CG2 3.14Å
48	W	92.7	Very high	82.4	Confident	5 Å²	5	80.4 Å²	80.4	2%	0.019	43%	0.426	C	S	.	.	S	Bend	trans	-129.6	139.9	170.4	-76.1	79.9	0	0	0	108.2	T42 N46 F64 V66 N76 L78 F179 D181 I186 L188	T42-W48 HydrophobicContact CG2-CB 3.8Å; N46-W48 VanDerWaalsContact C-N 3.3Å; W48-F64 HydrophobicContact CE3-CB 4Å; W48-F64 HydrophobicContact CZ3-CB 4.48Å; W48-V66 HydrophobicContact CD2-CB 3.95Å; W48-V66 HydrophobicContact CD2-CG1 3.76Å; W48-V66 HydrophobicContact CE3-CB 4.01Å; W48-V66 HydrophobicContact CE3-CG1 3.74Å; W48-V66 HydrophobicContact CG-CB 4.35Å; W48-V66 HydrophobicContact CH2-CG1 3.61Å; W48-V66 HydrophobicContact CZ2-CG1 3.6Å; W48-V66 HydrophobicContact CZ3-CB 4.39Å; W48-V66 HydrophobicContact CZ3-CG1 3.68Å; W48-N76 PolarHBondContact NE1-O 2.99Å; W48-L78 HydrophobicContact CB-CB 4.29Å; W48-L78 HydrophobicContact CB-CD1 4.41Å; W48-L78 HydrophobicContact CD2-CB 3.93Å; W48-L78 HydrophobicContact CD2-CD2 4.18Å; W48-L78 HydrophobicContact CE3-CD2 4.15Å; W48-L78 HydrophobicContact CG-CB 3.72Å; W48-L78 HydrophobicContact CG-CD2 4.49Å; W48-F179 HydrophobicContact CZ2-CB 4.41Å; W48-D181 HydrophobicContact CZ2-CB 3.69Å; W48-I186 HydrophobicContact CH2-CG2 3.63Å; W48-I186 HydrophobicContact CZ2-CG2 4.45Å; W48-I186 HydrophobicContact CZ3-CG2 4.09Å; W48-L188 HydrophobicContact CZ3-CB 4.48Å
49	D	90.8	Very high	82.4	Confident	82 Å²	82	86.3 Å²	86.3	44%	0.439	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130.7	178.7	-68	-40	0	0	0	110.5	F64 Q65	D49-F64 CarbonylContact O-C 3.6Å; D49-F64 VanDerWaalsContact O-CA 3.3Å; D49-F64 WeakPolarHBondContact O-CA 3.37Å; D49-Q65 HydrophobicContact CB-CG 4.18Å; D49-Q65 PolarHBondContact N-O 3.15Å; D49-Q65 PolarHBondContact O-N 3.36Å
50	A	87.8	Confident	82.3	Confident	77 Å²	77	87.1 Å²	87.1	64%	0.636	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	123.1	173.1	0	0	0	0	0	109.7	F64	A50-F64 HydrophobicContact CB-CD1 3.91Å; A50-F64 HydrophobicContact CB-CE1 3.65Å; A50-F64 HydrophobicContact CB-CZ 4.45Å
51	I	84.8	Confident	81.8	Confident	55 Å²	55	86.7 Å²	86.7	28%	0.282	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.1	179.5	-58.6	-170.4	0	0	0	109	E53 H62 T63 Q65	I51-E53 HydrophobicContact CG2-CG 4.12Å; I51-H62 CarbonylContact O-C 3.57Å; I51-H62 WeakPolarHBondContact O-CA 3.41Å; I51-T63 PolarHBondContact N-O 2.94Å; I51-T63 PolarHBondContact O-N 2.94Å; I51-T63 VanDerWaalsContact O-O 3.14Å; I51-T63 PolarHBondContact O-OG1 2.85Å; I51-Q65 HydrophobicContact CD1-CG 3.59Å; I51-Q65 VanDerWaalsContact CD1-NE2 3.27Å; I51-Q65 HydrophobicContact CG1-CG 4.17Å
52	T	81.6	Confident	81.4	Confident	82 Å²	82	82.1 Å²	82.1	50%	0.503	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	115.6	171.2	-53.2	0	0	0	0	108.4	P60 I61 H62	T52-P60 HydrophobicContact CG2-CB 3.75Å; T52-I61 CarbonylContact C-O 3.59Å; T52-I61 WeakPolarHBondContact CA-O 3.41Å; T52-H62 PolarHBondContact OG1-ND1 3.47Å
53	E	76.6	Confident	81.2	Confident	66 Å²	66	80.3 Å²	80.3	31%	0.308	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	165.7	177.4	-70.5	175.5	-146	0	0	110.3	I51 P60 I61 T63	I51-E53 HydrophobicContact CG2-CG 4.12Å; E53-P60 CarbonylContact O-C 3.54Å; E53-P60 WeakPolarHBondContact O-CA 3.45Å; E53-I61 HydrophobicContact CB-CD1 4.5Å; E53-I61 HydrophobicContact CB-CG1 4.08Å; E53-I61 PolarHBondContact N-O 3.34Å; E53-I61 WeakPolarHBondContact O-CG1 3.43Å; E53-I61 PolarHBondContact O-N 2.93Å; E53-T63 HydrophobicContact CB-CG2 4.19Å; E53-T63 HydrophobicContact CG-CG2 4.22Å; E53-T63 PolarHBondContact OE1-OG1 2.76Å
54	M	76.6	Confident	81.3	Confident	127 Å²	127	74.9 Å²	74.9	63%	0.626	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.1	173	-66.7	-67	179.6	0	0	108.9	R59 P60	M54-R59 WeakPolarHBondContact CA-O 3.22Å; M54-P60 HydrophobicContact SD-CB 4.32Å
55	D	70	Confident	81.6	Confident	30 Å²	30	75.4 Å²	75.4	16%	0.16	39%	0.389	C	S	.	.			trans	-70.3	174.5	171.6	78.7	-3.5	0	0	0	111.8	H57 N58 R59 I61	D55-H57 PolarHBondContact O-N 2.04Å; D55-H57 VanDerWaalsContact OD1-C 3.22Å; D55-H57 VanDerWaalsContact OD1-CA 3.28Å; D55-H57 WeakPolarHBondContact OD1-CA 3.42Å; D55-H57 WeakPolarHBondContact OD1-CB 3.28Å; D55-H57 PolarHBondContact OD1-N 2.89Å; D55-N58 PolarHBondContact O-N 2.94Å; D55-N58 PolarHBondContact OD1-N 3.03Å; D55-N58 VanDerWaalsContact OD1-N 3.13Å; D55-R59 PolarHBondContact N-O 2.87Å; D55-R59 WeakPolarHBondContact OD1-CB 3.48Å; D55-R59 PolarHBondContact OD1-N 2.71Å; D55-R59 IonicContact OD1-NE 3.5Å; D55-R59 IonicContact OD2-CZ 2.64Å; D55-R59 VanDerWaalsContact OD2-CZ 3.27Å; D55-R59 IonicContact OD2-NE 2.68Å; D55-R59 PolarHBondContact OD2-NE 2.93Å; D55-R59 IonicContact OD2-NH2 3.92Å; D55-R59 PolarHBondContact OD2-NH2 2.85Å; D55-I61 HydrophobicContact CB-CD1 4.25Å; D55-I61 HydrophobicContact CB-CG1 4.49Å; D55-I61 HydrophobicContact CB-CG2 3.92Å
56	E	71.1	Confident	82.1	Confident	189 Å²	189	68.7 Å²	68.7	88%	0.883	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-15.8	177.2	-61.6	-179.7	163.1	0	0	114.1
57	H	72.8	Confident	82.8	Confident	135 Å²	135	65.7 Å²	65.7	63%	0.625	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	14.9	-179.6	-57.6	77.5	0	0	0	112.3	D55 R59	D55-H57 PolarHBondContact O-N 2.04Å; D55-H57 VanDerWaalsContact OD1-C 3.22Å; D55-H57 VanDerWaalsContact OD1-CA 3.28Å; D55-H57 WeakPolarHBondContact OD1-CA 3.42Å; D55-H57 WeakPolarHBondContact OD1-CB 3.28Å; D55-H57 PolarHBondContact OD1-N 2.89Å; H57-R59 VanDerWaalsContact C-N 3.26Å; H57-R59 HydrophobicContact CB-CG 4.48Å; H57-R59 PolarHBondContact O-N 2.7Å
58	N	73.7	Confident	83.1	Confident	134 Å²	134	68.3 Å²	68.3	72%	0.717	36%	0.356	S	S	*	.	S	Bend	trans	58.4	30.7	-177	-64.3	-37.3	0	0	0	114.3	D55	D55-N58 PolarHBondContact O-N 2.94Å; D55-N58 PolarHBondContact OD1-N 3.03Å; D55-N58 VanDerWaalsContact OD1-N 3.13Å
59	R	75.4	Confident	83	Confident	136 Å²	136	68.3 Å²	68.3	51%	0.513	36%	0.356	S	S	.	.			trans	-95.7	136.4	172.6	-60.2	179.1	-64.4	176.5	3.2	109.4	M54 D55 H57 I61	M54-R59 WeakPolarHBondContact CA-O 3.22Å; D55-R59 PolarHBondContact N-O 2.87Å; D55-R59 WeakPolarHBondContact OD1-CB 3.48Å; D55-R59 PolarHBondContact OD1-N 2.71Å; D55-R59 IonicContact OD1-NE 3.5Å; D55-R59 IonicContact OD2-CZ 2.64Å; D55-R59 VanDerWaalsContact OD2-CZ 3.27Å; D55-R59 IonicContact OD2-NE 2.68Å; D55-R59 PolarHBondContact OD2-NE 2.93Å; D55-R59 IonicContact OD2-NH2 3.92Å; D55-R59 PolarHBondContact OD2-NH2 2.85Å; H57-R59 VanDerWaalsContact C-N 3.26Å; H57-R59 HydrophobicContact CB-CG 4.48Å; H57-R59 PolarHBondContact O-N 2.7Å; R59-I61 PolarHBondContact O-N 3.41Å
60	P	76.6	Confident	82.8	Confident	62 Å²	62	69.6 Å²	69.6	40%	0.403	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	122.5	175.1	27.7	-32.8	0	0	0	109.3	T52 E53 M54	T52-P60 HydrophobicContact CG2-CB 3.75Å; E53-P60 CarbonylContact O-C 3.54Å; E53-P60 WeakPolarHBondContact O-CA 3.45Å; M54-P60 HydrophobicContact SD-CB 4.32Å
61	I	80.8	Confident	82.7	Confident	14 Å²	14	71.1 Å²	71.1	7%	0.072	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	140.4	172	57.6	167.6	0	0	0	109.3	T52 E53 D55 R59 T63 V189	T52-I61 CarbonylContact C-O 3.59Å; T52-I61 WeakPolarHBondContact CA-O 3.41Å; E53-I61 HydrophobicContact CB-CD1 4.5Å; E53-I61 HydrophobicContact CB-CG1 4.08Å; E53-I61 PolarHBondContact N-O 3.34Å; E53-I61 WeakPolarHBondContact O-CG1 3.43Å; E53-I61 PolarHBondContact O-N 2.93Å; D55-I61 HydrophobicContact CB-CD1 4.25Å; D55-I61 HydrophobicContact CB-CG1 4.49Å; D55-I61 HydrophobicContact CB-CG2 3.92Å; R59-I61 PolarHBondContact O-N 3.41Å; I61-T63 HydrophobicContact CD1-CG2 4.13Å; I61-T63 HydrophobicContact CG1-CG2 4.27Å; I61-V189 HydrophobicContact CD1-CG1 3.98Å
62	H	81.8	Confident	82.5	Confident	33 Å²	33	72.8 Å²	72.8	15%	0.153	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.4	177.6	-64.9	-61.3	0	0	0	109.8	G36 L38 I51 T52	G36-H62 PolarHBondContact O-CD2 3Å; G36-H62 PolarHBondContact O-NE2 3.39Å; L38-H62 HydrophobicContact CD1-CB 3.48Å; L38-H62 VanDerWaalsContact CD1-CB 3.48Å; L38-H62 HydrophobicContact CG-CB 4.24Å; I51-H62 CarbonylContact O-C 3.57Å; I51-H62 WeakPolarHBondContact O-CA 3.41Å; T52-H62 PolarHBondContact OG1-ND1 3.47Å
63	T	87.5	Confident	82.6	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	154.6	178	65.1	0	0	0	0	110	I51 E53 I61 L188 V189	I51-T63 PolarHBondContact N-O 2.94Å; I51-T63 PolarHBondContact O-N 2.94Å; I51-T63 VanDerWaalsContact O-O 3.14Å; I51-T63 PolarHBondContact O-OG1 2.85Å; E53-T63 HydrophobicContact CB-CG2 4.19Å; E53-T63 HydrophobicContact CG-CG2 4.22Å; E53-T63 PolarHBondContact OE1-OG1 2.76Å; I61-T63 HydrophobicContact CD1-CG2 4.13Å; I61-T63 HydrophobicContact CG1-CG2 4.27Å; T63-L188 WeakPolarHBondContact CA-O 3.5Å; T63-V189 HydrophobicContact CG2-CG1 4.48Å
64	F	92.6	Very high	83.2	Confident	13 Å²	13	74.6 Å²	74.6	6%	0.057	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129	172.7	-68.6	-88.2	0	0	0	109.8	L38 W40 W48 D49 A50 L78 A187 L188	L38-F64 HydrophobicContact CB-CE2 4.42Å; L38-F64 HydrophobicContact CB-CZ 4.18Å; L38-F64 HydrophobicContact CD1-CE2 3.7Å; L38-F64 HydrophobicContact CD1-CZ 4.23Å; W40-F64 HydrophobicContact CB-CE1 4.16Å; W40-F64 HydrophobicContact CB-CE2 4.46Å; W40-F64 HydrophobicContact CB-CZ 3.73Å; W40-F64 AromaticContact CD2-CE2 3.96Å; W40-F64 HydrophobicContact CD2-CE2 3.96Å; W40-F64 HydrophobicContact CD2-CZ 4.11Å; W40-F64 HydrophobicContact CE3-CD2 4.14Å; W40-F64 AromaticContact CE3-CE2 3.71Å; W40-F64 HydrophobicContact CE3-CE2 3.71Å; W40-F64 HydrophobicContact CE3-CZ 4.12Å; W40-F64 HydrophobicContact CG-CE2 4.31Å; W40-F64 AromaticContact CG-CZ 3.98Å; W40-F64 HydrophobicContact CG-CZ 3.98Å; W40-F64 HydrophobicContact CZ3-CD2 4.43Å; W40-F64 HydrophobicContact CZ3-CE2 4.27Å; W48-F64 HydrophobicContact CE3-CB 4Å; W48-F64 HydrophobicContact CZ3-CB 4.48Å; D49-F64 CarbonylContact O-C 3.6Å; D49-F64 VanDerWaalsContact O-CA 3.3Å; D49-F64 WeakPolarHBondContact O-CA 3.37Å; A50-F64 HydrophobicContact CB-CD1 3.91Å; A50-F64 HydrophobicContact CB-CE1 3.65Å; A50-F64 HydrophobicContact CB-CZ 4.45Å; F64-L78 HydrophobicContact CB-CD2 3.55Å; F64-L78 HydrophobicContact CD1-CD1 3.65Å; F64-L78 HydrophobicContact CD1-CD2 3.94Å; F64-L78 HydrophobicContact CD1-CG 4.46Å; F64-L78 HydrophobicContact CD2-CD2 3.94Å; F64-L78 HydrophobicContact CE1-CD1 3.76Å; F64-L78 HydrophobicContact CG-CD1 4.14Å; F64-L78 HydrophobicContact CG-CD2 3.55Å; F64-L78 HydrophobicContact CG-CG 4.49Å; F64-L78 HydrophobicContact CZ-CD1 4.34Å; F64-A187 CarbonylContact O-C 3.53Å; F64-A187 WeakPolarHBondContact O-CA 3.3Å; F64-L188 HydrophobicContact CB-CB 4.44Å; F64-L188 PolarHBondContact N-O 3.49Å; F64-L188 WeakPolarHBondContact O-CB 3.43Å; F64-L188 PolarHBondContact O-N 2.73Å
65	Q	93.4	Very high	83.9	Confident	74 Å²	74	72 Å²	72	35%	0.346	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	154.9	-179.1	68.1	168	35.4	0	0	113.1	D49 I51 I186 A187	D49-Q65 HydrophobicContact CB-CG 4.18Å; D49-Q65 PolarHBondContact N-O 3.15Å; D49-Q65 PolarHBondContact O-N 3.36Å; I51-Q65 HydrophobicContact CD1-CG 3.59Å; I51-Q65 VanDerWaalsContact CD1-NE2 3.27Å; I51-Q65 HydrophobicContact CG1-CG 4.17Å; Q65-I186 VanDerWaalsContact CA-O 3.25Å; Q65-I186 WeakPolarHBondContact CA-O 3.4Å; Q65-A187 HydrophobicContact CB-CB 3.99Å
66	V	94.8	Very high	85	Confident	5 Å²	5	70.9 Å²	70.9	3%	0.03	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	140.6	169.6	60.7	0	0	0	0	108.5	G47 W48 N68 N76 D181 C185 I186	G47-V66 WeakPolarHBondContact O-CG2 3.14Å; W48-V66 HydrophobicContact CD2-CB 3.95Å; W48-V66 HydrophobicContact CD2-CG1 3.76Å; W48-V66 HydrophobicContact CE3-CB 4.01Å; W48-V66 HydrophobicContact CE3-CG1 3.74Å; W48-V66 HydrophobicContact CG-CB 4.35Å; W48-V66 HydrophobicContact CH2-CG1 3.61Å; W48-V66 HydrophobicContact CZ2-CG1 3.6Å; W48-V66 HydrophobicContact CZ3-CB 4.39Å; W48-V66 HydrophobicContact CZ3-CG1 3.68Å; V66-N68 HydrophobicContact CG2-CB 4.49Å; V66-N76 HydrophobicContact CG2-CB 4.45Å; V66-D181 HydrophobicContact CG1-CB 3.69Å; V66-D181 WeakPolarHBondContact CG2-OD2 3.34Å; V66-C185 WeakPolarHBondContact O-CA 3.42Å; V66-I186 HydrophobicContact CG1-CG2 3.58Å; V66-I186 PolarHBondContact N-O 3.01Å; V66-I186 PolarHBondContact O-N 3.46Å
67	C	93	Very high	86.2	Confident	57 Å²	57	62.2 Å²	62.2	39%	0.385	32%	0.319	S	S	.	.			trans	-149.5	47.7	179.6	-166.7	0	0	0	0	111.3	V69 C185	C67-V69 PolarHBondContact O-N 3.43Å; C67-C185 HydrophobicContact CB-CB 3.95Å; C67-C185 WeakPolarHBondContact CB-SG 3.02Å; C67-C185 WeakPolarHBondContact SG-CB 3.37Å; C67-C185 CovalentContact SG-SG 2.05Å; C67-C185 PolarHBondContact SG-SG 3.31Å
68	N	91.1	Very high	87.2	Confident	58 Å²	58	55.8 Å²	55.8	31%	0.31	29%	0.289	S	S	.	.			trans	-85.2	44.2	-178.9	-64	-8.9	0	0	0	112	V66 M70 E71 Q74	V66-N68 HydrophobicContact CG2-CB 4.49Å; N68-M70 PolarHBondContact O-N 2.62Å; N68-E71 PolarHBondContact O-N 3.45Å; N68-Q74 HydrophobicContact CB-CG 4.18Å; N68-Q74 PolarHBondContact ND2-OE1 3.23Å; N68-Q74 WeakPolarHBondContact O-CG 3.23Å
69	V	90.3	Very high	88.2	Confident	5 Å²	5	50 Å²	50	3%	0.03	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-17.2	-170.7	-66.7	0	0	0	0	114.6	C67 I105 V108 T111 C112 C185	C67-V69 PolarHBondContact O-N 3.43Å; V69-I105 HydrophobicContact CG1-CD1 4.22Å; V69-I105 HydrophobicContact CG2-CD1 3.98Å; V69-I105 HydrophobicContact CG2-CG2 4.14Å; V69-V108 HydrophobicContact CB-CB 4.44Å; V69-V108 HydrophobicContact CB-CG1 4.02Å; V69-V108 HydrophobicContact CG2-CG1 3.65Å; V69-T111 VanDerWaalsContact O-CB 3.31Å; V69-T111 WeakPolarHBondContact O-CB 3.43Å; V69-T111 PolarHBondContact O-OG1 2.05Å; V69-C112 HydrophobicContact CB-CB 4.18Å; V69-C112 HydrophobicContact CG1-CB 4.37Å; V69-C185 HydrophobicContact CG1-CB 3.78Å
70	M	87.3	Confident	89	Confident	109 Å²	109	43.6 Å²	43.6	54%	0.537	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-19.7	-178.7	-64.4	-73	177.7	0	0	112.8	N68 I105 P106 V108	N68-M70 PolarHBondContact O-N 2.62Å; M70-I105 HydrophobicContact CE-CG2 4.1Å; M70-P106 VanDerWaalsContact CE-O 3.25Å; M70-P106 WeakPolarHBondContact CE-O 3.09Å; M70-V108 HydrophobicContact CE-CG1 3.55Å; M70-V108 HydrophobicContact CG-CG1 4.17Å; M70-V108 HydrophobicContact SD-CG1 3.4Å; M70-V108 WeakPolarHBondContact SD-CG1 3.41Å
71	E	85.1	Confident	89.7	Confident	110 Å²	110	44.1 Å²	44.1	51%	0.514	23%	0.233	S	C	.	.	S	Bend	trans	-96.4	132.3	-173.8	-69.2	-177.1	-176.8	0	0	110.8	N68 Q74	N68-E71 PolarHBondContact O-N 3.45Å; E71-Q74 HydrophobicContact CB-CG 4.38Å; E71-Q74 PolarHBondContact OE2-NE2 2.79Å
72	P	80.8	Confident	90.3	Very high	90 Å²	90	47 Å²	47	58%	0.584	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	155.4	174.1	30.3	-33.9	0	0	0	111.5	Q74 T111	P72-Q74 PolarHBondContact O-N 2.81Å; P72-T111 HydrophobicContact CB-CG2 4.1Å
73	N	82.7	Confident	90.8	Very high	163 Å²	163	45.8 Å²	45.8	87%	0.872	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	39.2	174.2	-55.8	-42.9	0	0	0	115.3
74	Q	89.3	Confident	91.1	Very high	22 Å²	22	48.2 Å²	48.2	10%	0.103	25%	0.254	C	S	.	.			trans	-59.9	146.9	173.2	-69.8	-60.6	-68.2	0	0	112.2	N68 E71 P72 N76 I182	N68-Q74 HydrophobicContact CB-CG 4.18Å; N68-Q74 PolarHBondContact ND2-OE1 3.23Å; N68-Q74 WeakPolarHBondContact O-CG 3.23Å; E71-Q74 HydrophobicContact CB-CG 4.38Å; E71-Q74 PolarHBondContact OE2-NE2 2.79Å; P72-Q74 PolarHBondContact O-N 2.81Å; Q74-N76 PolarHBondContact OE1-ND2 3.42Å; Q74-I182 WeakPolarHBondContact O-CA 3.19Å
75	N	91.8	Very high	91.1	Very high	72 Å²	72	50 Å²	50	39%	0.385	26%	0.261	S	S	.	.			trans	-156.5	62.9	179	-171.4	23.8	0	0	0	110.2	W77 Q180 D181	N75-W77 PolarHBondContact OD1-NE1 3.01Å; N75-Q180 PolarHBondContact OD1-NE2 2.92Å; N75-D181 CarbonylContact C-O 3.54Å; N75-D181 WeakPolarHBondContact CA-O 3.19Å
76	N	94	Very high	91.1	Very high	7 Å²	7	51.7 Å²	51.7	4%	0.037	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	117.4	-173.2	-56.6	-53.9	0	0	0	110.4	W48 V66 Q74 Q180 D181	W48-N76 PolarHBondContact NE1-O 2.99Å; V66-N76 HydrophobicContact CG2-CB 4.45Å; Q74-N76 PolarHBondContact OE1-ND2 3.42Å; N76-Q180 CarbonylContact O-C 3.44Å; N76-Q180 WeakPolarHBondContact O-CA 3.43Å; N76-D181 HydrophobicContact CB-CB 4.14Å; N76-D181 PolarHBondContact N-O 2.7Å; N76-D181 PolarHBondContact ND2-OD2 2.8Å; N76-D181 PolarHBondContact O-N 3.46Å
77	W	95	Very high	90.8	Very high	8 Å²	8	54 Å²	54	3%	0.03	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	134.6	-179.9	-66	74.8	0	0	0	111.3	T42 Y43 N75 F119 F131 P133 Y136 A178 F179 Q180	T42-W77 CarbonylContact C-O 3.56Å; T42-W77 VanDerWaalsContact CA-O 3.27Å; T42-W77 WeakPolarHBondContact CA-O 3.4Å; Y43-W77 PolarHBondContact N-O 2.86Å; Y43-W77 WeakPolarHBondContact O-CB 3.41Å; Y43-W77 PolarHBondContact O-N 3.3Å; N75-W77 PolarHBondContact OD1-NE1 3.01Å; W77-F119 HydrophobicContact CH2-CD1 4.11Å; W77-F119 AromaticContact CH2-CD2 3.9Å; W77-F119 HydrophobicContact CH2-CD2 3.9Å; W77-F119 AromaticContact CH2-CE1 3.97Å; W77-F119 HydrophobicContact CH2-CE1 3.97Å; W77-F119 AromaticContact CH2-CE2 3.71Å; W77-F119 HydrophobicContact CH2-CE2 3.71Å; W77-F119 HydrophobicContact CH2-CG 4.1Å; W77-F119 AromaticContact CH2-CZ 3.78Å; W77-F119 HydrophobicContact CH2-CZ 3.78Å; W77-F119 HydrophobicContact CZ3-CB 4.28Å; W77-F119 HydrophobicContact CZ3-CD1 4.23Å; W77-F119 AromaticContact CZ3-CD2 3.69Å; W77-F119 HydrophobicContact CZ3-CD2 3.69Å; W77-F119 AromaticContact CZ3-CE2 3.99Å; W77-F119 HydrophobicContact CZ3-CE2 3.99Å; W77-F119 AromaticContact CZ3-CG 3.83Å; W77-F119 HydrophobicContact CZ3-CG 3.83Å; W77-F119 HydrophobicContact CZ3-CZ 4.42Å; W77-F131 HydrophobicContact CB-CE1 3.95Å; W77-F131 HydrophobicContact CB-CE2 4.38Å; W77-F131 HydrophobicContact CB-CZ 3.56Å; W77-F131 HydrophobicContact CD2-CE1 4.23Å; W77-F131 HydrophobicContact CD2-CE2 4.45Å; W77-F131 AromaticContact CD2-CZ 3.49Å; W77-F131 HydrophobicContact CD2-CZ 3.49Å; W77-F131 VanDerWaalsContact CD2-CZ 3.49Å; W77-F131 HydrophobicContact CE3-CE2 4.16Å; W77-F131 AromaticContact CE3-CZ 3.6Å; W77-F131 HydrophobicContact CE3-CZ 3.6Å; W77-F131 AromaticContact CG-CE1 3.87Å; W77-F131 HydrophobicContact CG-CE1 3.87Å; W77-F131 AromaticContact CG-CZ 3.47Å; W77-F131 HydrophobicContact CG-CZ 3.47Å; W77-F131 VanDerWaalsContact CG-CZ 3.47Å; W77-F131 HydrophobicContact CZ3-CZ 4.42Å; W77-P133 HydrophobicContact CH2-CB 4.22Å; W77-P133 HydrophobicContact CZ2-CB 3.79Å; W77-P133 HydrophobicContact CZ2-CG 4.41Å; W77-Y136 HydrophobicContact CZ3-CG 4.5Å; W77-A178 HydrophobicContact CE3-CB 4.01Å; W77-A178 HydrophobicContact CZ3-CB 4.24Å; W77-F179 CarbonylContact C-O 3.42Å; W77-F179 VanDerWaalsContact CA-O 3.27Å; W77-F179 WeakPolarHBondContact CA-O 3.36Å; W77-Q180 HydrophobicContact CD2-CB 4.02Å; W77-Q180 HydrophobicContact CD2-CG 4.15Å; W77-Q180 HydrophobicContact CE3-CB 4.11Å; W77-Q180 HydrophobicContact CH2-CB 4.27Å; W77-Q180 HydrophobicContact CH2-CG 4.48Å; W77-Q180 HydrophobicContact CZ2-CB 4.14Å; W77-Q180 HydrophobicContact CZ2-CG 3.89Å; W77-Q180 HydrophobicContact CZ3-CB 4.25Å
78	L	95.3	Very high	90.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.1	167.6	172.3	67.9	0	0	0	108	W40 T42 W48 F64 A178 F179 L188	W40-L78 HydrophobicContact CB-CD1 3.91Å; W40-L78 HydrophobicContact CE3-CD1 4.01Å; W40-L78 HydrophobicContact CE3-CD2 3.84Å; W40-L78 HydrophobicContact CE3-CG 3.79Å; W40-L78 HydrophobicContact CZ3-CD2 4.1Å; W40-L78 HydrophobicContact CZ3-CG 4.39Å; T42-L78 HydrophobicContact CG2-CD1 3.83Å; W48-L78 HydrophobicContact CB-CB 4.29Å; W48-L78 HydrophobicContact CB-CD1 4.41Å; W48-L78 HydrophobicContact CD2-CB 3.93Å; W48-L78 HydrophobicContact CD2-CD2 4.18Å; W48-L78 HydrophobicContact CE3-CD2 4.15Å; W48-L78 HydrophobicContact CG-CB 3.72Å; W48-L78 HydrophobicContact CG-CD2 4.49Å; F64-L78 HydrophobicContact CB-CD2 3.55Å; F64-L78 HydrophobicContact CD1-CD1 3.65Å; F64-L78 HydrophobicContact CD1-CD2 3.94Å; F64-L78 HydrophobicContact CD1-CG 4.46Å; F64-L78 HydrophobicContact CD2-CD2 3.94Å; F64-L78 HydrophobicContact CE1-CD1 3.76Å; F64-L78 HydrophobicContact CG-CD1 4.14Å; F64-L78 HydrophobicContact CG-CD2 3.55Å; F64-L78 HydrophobicContact CG-CG 4.49Å; F64-L78 HydrophobicContact CZ-CD1 4.34Å; L78-A178 CarbonylContact O-C 3.47Å; L78-A178 WeakPolarHBondContact O-CA 3.33Å; L78-F179 HydrophobicContact CB-CB 4.27Å; L78-F179 HydrophobicContact CB-CD2 4.46Å; L78-F179 HydrophobicContact CD2-CD2 4.2Å; L78-F179 HydrophobicContact CG-CD2 4.28Å; L78-F179 PolarHBondContact N-O 2.84Å; L78-F179 PolarHBondContact O-N 3.08Å; L78-L188 HydrophobicContact CD2-CD2 4.21Å
79	R	93.2	Very high	90.4	Very high	13 Å²	13	52.4 Å²	52.4	5%	0.049	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.7	-177.4	-170.8	-155	68.5	175.1	9.5	111.4	W40 K41 Y136 L177 A178	W40-R79 CarbonylContact C-O 3.59Å; W40-R79 WeakPolarHBondContact CA-O 3.04Å; W40-R79 VanDerWaalsContact CB-O 3.26Å; W40-R79 WeakPolarHBondContact CB-O 3.09Å; K41-R79 PolarHBondContact N-O 2.87Å; K41-R79 PolarHBondContact O-N 2.77Å; R79-Y136 WeakPolarHBondContact CD-OH 3.25Å; R79-Y136 HydrophobicContact CG-CE1 4.33Å; R79-L177 WeakPolarHBondContact CA-O 2.92Å; R79-L177 WeakPolarHBondContact CG-O 3.46Å; R79-A178 HydrophobicContact CB-CB 4.39Å; R79-A178 HydrophobicContact CG-CB 4.32Å
80	S	93.2	Very high	90.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-63.8	171.9	174.3	77.9	0	0	0	0	113.4	Y176 L177	S80-Y176 WeakPolarHBondContact O-CD1 3.26Å; S80-L177 PolarHBondContact N-O 2.79Å; S80-L177 PolarHBondContact OG-N 2.85Å; S80-L177 PolarHBondContact OG-O 3.17Å
81	N	91.3	Very high	90.7	Very high	74 Å²	74	48.5 Å²	48.5	40%	0.396	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-71.5	170.9	159.3	-66.3	-22.9	0	0	0	110.8	L38 G39 I83	L38-N81 PolarHBondContact O-ND2 2.92Å; G39-N81 PolarHBondContact O-OD1 2.86Å; N81-I83 PolarHBondContact O-N 2.85Å
82	W	92.4	Very high	91.1	Very high	73 Å²	73	43.8 Å²	43.8	28%	0.277	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-68.3	126.4	175.2	-175.9	84.4	0	0	0	109.8	M123 A126 K173 Y176	W82-M123 PolarHBondContact NE1-O 2.84Å; W82-A126 HydrophobicContact CB-CB 3.86Å; W82-A126 HydrophobicContact CD2-CB 3.94Å; W82-A126 HydrophobicContact CE3-CB 4.16Å; W82-A126 HydrophobicContact CG-CB 3.82Å; W82-K173 HydrophobicContact CZ2-CB 4.29Å; W82-Y176 HydrophobicContact CB-CD1 4.41Å; W82-Y176 HydrophobicContact CB-CE1 3.68Å; W82-Y176 HydrophobicContact CB-CE2 4.35Å; W82-Y176 AromaticContact CD1-CE2 3.7Å; W82-Y176 AromaticContact CD1-CZ 3.83Å; W82-Y176 HydrophobicContact CG-CE2 4.43Å; W82-Y176 VanDerWaalsContact N-CE1 3.27Å
83	I	93.8	Very high	91.9	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.046	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	122.9	-179.8	-54.9	167.1	0	0	0	107.7	L28 L29 N81 G174 F175 L177 V193	L28-I83 HydrophobicContact CB-CG2 3.83Å; L29-I83 HydrophobicContact CB-CD1 4.25Å; L29-I83 HydrophobicContact CB-CG1 4.48Å; L29-I83 HydrophobicContact CB-CG2 4.46Å; L29-I83 HydrophobicContact CD2-CD1 3.5Å; L29-I83 VanDerWaalsContact CD2-CD1 3.5Å; L29-I83 HydrophobicContact CD2-CG1 4.12Å; L29-I83 HydrophobicContact CG-CD1 4.48Å; N81-I83 PolarHBondContact O-N 2.85Å; I83-G174 CarbonylContact O-C 3.44Å; I83-G174 WeakPolarHBondContact O-CA 3.11Å; I83-F175 HydrophobicContact CB-CD2 4.43Å; I83-F175 HydrophobicContact CB-CE1 4.13Å; I83-F175 HydrophobicContact CB-CE2 4.02Å; I83-F175 HydrophobicContact CB-CZ 3.85Å; I83-F175 HydrophobicContact CD1-CD2 4.38Å; I83-F175 HydrophobicContact CD1-CE2 3.76Å; I83-F175 HydrophobicContact CD1-CZ 4.23Å; I83-F175 HydrophobicContact CG1-CE2 4.47Å; I83-F175 HydrophobicContact CG2-CE1 3.96Å; I83-F175 HydrophobicContact CG2-CE2 4.21Å; I83-F175 HydrophobicContact CG2-CZ 3.61Å; I83-F175 PolarHBondContact N-O 2.81Å; I83-F175 PolarHBondContact O-N 3.47Å; I83-L177 HydrophobicContact CD1-CD1 4.22Å; I83-L177 HydrophobicContact CD1-CG 4.22Å; I83-V193 HydrophobicContact CD1-CG2 4.26Å
84	S	93.9	Very high	92.5	Very high	50 Å²	50	32.8 Å²	32.8	35%	0.35	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	132.9	173.4	-177.1	0	0	0	0	109.8	Q86	S84-Q86 VanDerWaalsContact C-N 3.26Å; S84-Q86 PolarHBondContact O-N 3.49Å; S84-Q86 PolarHBondContact OG-N 2.68Å
85	R	92.1	Very high	92.8	Very high	52 Å²	52	31.8 Å²	31.8	20%	0.196	16%	0.161	C	C	.	.			trans	-75.1	-17.1	176.4	91.5	168.4	178.8	126.6	-4.7	113.1	A87 A88 M170 K172 K173 F175	R85-A87 PolarHBondContact O-N 2.79Å; R85-A88 VanDerWaalsContact CD-O 3.28Å; R85-A88 WeakPolarHBondContact CD-O 3.43Å; R85-A88 PolarHBondContact NH1-O 3.05Å; R85-A88 WeakPolarHBondContact O-CB 3.39Å; R85-A88 PolarHBondContact O-N 2.85Å; R85-M170 PolarHBondContact NH1-O 2.79Å; R85-K172 WeakPolarHBondContact CD-O 3.45Å; R85-K172 PolarHBondContact NE-O 3.23Å; R85-K172 VanDerWaalsContact NE-O 3.12Å; R85-K173 PolarHBondContact N-O 3.34Å; R85-F175 HydrophobicContact CB-CD1 4.33Å; R85-F175 HydrophobicContact CB-CE1 4.24Å
86	Q	92.9	Very high	92.9	Very high	109 Å²	109	33 Å²	33	51%	0.509	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	-124.2	-169.3	-56.9	-179.1	4.4	0	0	111.5	L28 S84 Y195	L28-Q86 HydrophobicContact CD2-CB 4.2Å; L28-Q86 HydrophobicContact CD2-CG 3.84Å; S84-Q86 VanDerWaalsContact C-N 3.26Å; S84-Q86 PolarHBondContact O-N 3.49Å; S84-Q86 PolarHBondContact OG-N 2.68Å; Q86-Y195 HydrophobicContact CB-CE1 4.44Å
87	A	88.9	Confident	92.9	Very high	53 Å²	53	32.7 Å²	32.7	44%	0.438	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-0.2	176.6	0	0	0	0	0	113.6	R85 Q89 V212	R85-A87 PolarHBondContact O-N 2.79Å; A87-Q89 PolarHBondContact O-N 2.95Å; A87-V212 HydrophobicContact CB-CG2 3.97Å
88	A	88.6	Confident	92.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.161	C	C	.	.			trans	-67.1	121.5	-173.6	0	0	0	0	0	111.7	L28 R85 I91 Y195	L28-A88 HydrophobicContact CD1-CB 4.27Å; R85-A88 VanDerWaalsContact CD-O 3.28Å; R85-A88 WeakPolarHBondContact CD-O 3.43Å; R85-A88 PolarHBondContact NH1-O 3.05Å; R85-A88 WeakPolarHBondContact O-CB 3.39Å; R85-A88 PolarHBondContact O-N 2.85Å; A88-I91 HydrophobicContact CB-CG2 3.78Å; A88-Y195 HydrophobicContact CB-CD1 3.62Å; A88-Y195 HydrophobicContact CB-CD2 4.11Å; A88-Y195 HydrophobicContact CB-CE1 4.3Å; A88-Y195 HydrophobicContact CB-CG 3.48Å; A88-Y195 VanDerWaalsContact CB-CG 3.48Å
89	Q	87.4	Confident	92.6	Very high	82 Å²	82	33 Å²	33	38%	0.383	16%	0.161	S	C	.	.	S	Bend	trans	-93	-26.4	167.8	-57	-172.1	-4.8	0	0	112.4	A87 P169 M170 V215	A87-Q89 PolarHBondContact O-N 2.95Å; Q89-P169 CarbonylContact O-C 3.49Å; Q89-P169 WeakPolarHBondContact O-CA 3.26Å; Q89-M170 PolarHBondContact O-N 2.79Å; Q89-V215 HydrophobicContact CB-CG2 3.35Å; Q89-V215 WeakPolarHBondContact O-CG2 3.27Å
90	K	89.9	Confident	92.5	Very high	32 Å²	32	34.9 Å²	34.9	14%	0.139	17%	0.168	C	C	.	.	S	Bend	trans	-128.4	138.3	170.9	178.6	-177.2	-88.5	-168.1	0	107.4	Y92 E166 V167 Y195 V215	K90-Y92 HydrophobicContact CD-CE2 4.39Å; K90-Y92 HydrophobicContact CG-CE2 4.42Å; K90-E166 HydrophobicContact CD-CB 4.43Å; K90-E166 WeakPolarHBondContact CE-OE2 3.38Å; K90-E166 IonicContact NZ-OE2 2.8Å; K90-E166 PolarHBondContact NZ-OE2 2.86Å; K90-V167 WeakPolarHBondContact CA-O 3.45Å; K90-Y195 WeakPolarHBondContact O-CB 3.49Å; K90-V215 VanDerWaalsContact CE-O 3.3Å; K90-V215 WeakPolarHBondContact CE-O 3.32Å; K90-V215 PolarHBondContact NZ-O 3.45Å
91	I	93	Very high	92.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	154.9	176.4	62.9	173.2	0	0	0	109.8	L28 A88 V167 M170 F175 V193	L28-I91 HydrophobicContact CD1-CG2 3.83Å; A88-I91 HydrophobicContact CB-CG2 3.78Å; I91-V167 HydrophobicContact CD1-CB 4.07Å; I91-V167 HydrophobicContact CG1-CB 3.67Å; I91-V167 HydrophobicContact CG1-CG2 4.33Å; I91-V167 WeakPolarHBondContact CG1-O 3.44Å; I91-V167 PolarHBondContact N-O 2.85Å; I91-V167 PolarHBondContact O-N 2.84Å; I91-M170 HydrophobicContact CD1-CE 4.11Å; I91-M170 HydrophobicContact CD1-SD 4.23Å; I91-M170 HydrophobicContact CG1-CG 4.42Å; I91-M170 HydrophobicContact CG1-SD 4.37Å; I91-M170 HydrophobicContact CG2-CG 4.27Å; I91-F175 HydrophobicContact CD1-CD1 4.36Å; I91-F175 HydrophobicContact CD1-CD2 3.92Å; I91-F175 HydrophobicContact CD1-CE1 3.84Å; I91-F175 HydrophobicContact CD1-CE2 3.31Å; I91-F175 HydrophobicContact CD1-CG 4.41Å; I91-F175 HydrophobicContact CD1-CZ 3.28Å; I91-F175 HydrophobicContact CG2-CE1 4.25Å; I91-F175 HydrophobicContact CG2-CZ 4.27Å; I91-V193 HydrophobicContact CB-CG1 4.34Å; I91-V193 HydrophobicContact CD1-CG1 4.32Å
92	Y	94.1	Very high	92	Very high	11 Å²	11	33.7 Å²	33.7	4%	0.043	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.5	176	-62.3	-98.3	0	0	0	107.5	K90 V164 R165 E166 V193 Y194 K196	K90-Y92 HydrophobicContact CD-CE2 4.39Å; K90-Y92 HydrophobicContact CG-CE2 4.42Å; Y92-V164 HydrophobicContact CD1-CG1 4.36Å; Y92-R165 WeakPolarHBondContact CA-O 3.04Å; Y92-E166 HydrophobicContact CD1-CG 3.76Å; Y92-E166 HydrophobicContact CE1-CG 3.6Å; Y92-E166 WeakPolarHBondContact CE1-OE1 3.49Å; Y92-V193 VanDerWaalsContact O-CA 3.31Å; Y92-V193 WeakPolarHBondContact O-CA 3.48Å; Y92-Y194 HydrophobicContact CD2-CD2 4.35Å; Y92-Y194 HydrophobicContact CD2-CE2 4.11Å; Y92-Y194 HydrophobicContact CG-CD2 4.48Å; Y92-Y194 AromaticContact CG-CE2 3.93Å; Y92-Y194 HydrophobicContact CG-CE2 3.93Å; Y92-Y194 PolarHBondContact N-O 3.18Å; Y92-Y194 PolarHBondContact O-N 2.97Å; Y92-K196 HydrophobicContact CD2-CG 4.18Å; Y92-K196 HydrophobicContact CE1-CD 4.41Å; Y92-K196 HydrophobicContact CE2-CB 4.32Å; Y92-K196 HydrophobicContact CE2-CD 3.77Å; Y92-K196 HydrophobicContact CE2-CG 3.68Å
93	V	96.6	Very high	91.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	105.8	177.2	-175.4	0	0	0	0	107.3	L95 L118 V164 R165 V167 L177 V191 V193	V93-L95 HydrophobicContact CG1-CD2 3.69Å; V93-L95 HydrophobicContact CG1-CG 4.22Å; V93-L118 HydrophobicContact CB-CD2 4.39Å; V93-L118 HydrophobicContact CG1-CD2 4.15Å; V93-V164 CarbonylContact O-C 3.59Å; V93-V164 WeakPolarHBondContact O-CA 3.38Å; V93-R165 PolarHBondContact N-O 2.64Å; V93-R165 PolarHBondContact O-N 3.09Å; V93-V167 HydrophobicContact CG2-CG2 4.19Å; V93-L177 HydrophobicContact CG1-CD1 3.88Å; V93-L177 HydrophobicContact CG2-CD1 4.02Å; V93-L177 HydrophobicContact CG2-CD2 4.11Å; V93-V191 HydrophobicContact CG1-CG1 4.43Å; V93-V193 HydrophobicContact CG2-CG1 4.45Å
94	E	96.7	Very high	91.3	Very high	21 Å²	21	36.1 Å²	36.1	10%	0.098	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	121.8	173.2	177.5	-173.1	144	0	0	108.6	R96 T162 E163 V164 R192 Y194	E94-R96 IonicContact OE1-CZ 2.68Å; E94-R96 IonicContact OE1-NE 2.78Å; E94-R96 PolarHBondContact OE1-NE 3.44Å; E94-R96 IonicContact OE1-NH2 2.99Å; E94-R96 PolarHBondContact OE1-NH2 2.71Å; E94-T162 HydrophobicContact CG-CG2 4.1Å; E94-E163 CarbonylContact C-O 3.56Å; E94-E163 WeakPolarHBondContact CA-O 3.23Å; E94-V164 HydrophobicContact CB-CG2 4.11Å; E94-V164 HydrophobicContact CG-CG2 4.12Å; E94-R192 HydrophobicContact CB-CB 4.25Å; E94-R192 PolarHBondContact N-O 2.89Å; E94-R192 PolarHBondContact O-N 2.95Å; E94-R192 IonicContact OE2-NH1 2.82Å; E94-R192 PolarHBondContact OE2-NH1 3Å; E94-Y194 HydrophobicContact CB-CE1 4.2Å
95	L	95.3	Very high	90.8	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.6	179.4	-55.4	-178.8	0	0	0	108.6	V93 F97 F116 L118 I142 T162 E163 F179 L188 V191	V93-L95 HydrophobicContact CG1-CD2 3.69Å; V93-L95 HydrophobicContact CG1-CG 4.22Å; L95-F97 HydrophobicContact CB-CD1 4.34Å; L95-F116 HydrophobicContact CD1-CE2 4.05Å; L95-F116 HydrophobicContact CD1-CZ 3.98Å; L95-L118 HydrophobicContact CD1-CD2 4.26Å; L95-I142 HydrophobicContact CD1-CD1 4.47Å; L95-I142 HydrophobicContact CD1-CG1 4.13Å; L95-T162 CarbonylContact O-C 3.58Å; L95-T162 VanDerWaalsContact O-CA 3.28Å; L95-T162 WeakPolarHBondContact O-CA 3.25Å; L95-E163 PolarHBondContact N-O 3.2Å; L95-E163 PolarHBondContact O-N 3.32Å; L95-F179 HydrophobicContact CD1-CE1 4.18Å; L95-F179 HydrophobicContact CD2-CE1 3.6Å; L95-F179 HydrophobicContact CD2-CZ 4.03Å; L95-L188 HydrophobicContact CD2-CD1 4.47Å; L95-V191 HydrophobicContact CD2-CB 4.39Å; L95-V191 HydrophobicContact CD2-CG1 4Å; L95-V191 HydrophobicContact CD2-CG2 3.9Å
96	R	93.8	Very high	90.4	Very high	99 Å²	99	35.8 Å²	35.8	37%	0.374	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.7	164.6	-53.4	-176.2	-174.4	-164.7	-4.7	109.6	E94 L160 N161 T162 V189 S190	E94-R96 IonicContact OE1-CZ 2.68Å; E94-R96 IonicContact OE1-NE 2.78Å; E94-R96 PolarHBondContact OE1-NE 3.44Å; E94-R96 IonicContact OE1-NH2 2.99Å; E94-R96 PolarHBondContact OE1-NH2 2.71Å; R96-L160 HydrophobicContact CB-CD1 4.06Å; R96-L160 HydrophobicContact CB-CG 4.38Å; R96-N161 WeakPolarHBondContact CA-O 3.42Å; R96-T162 HydrophobicContact CG-CG2 4.19Å; R96-V189 WeakPolarHBondContact O-CA 3.38Å; R96-V189 WeakPolarHBondContact O-CB 3.36Å; R96-V189 PolarHBondContact O-N 2.86Å; R96-S190 VanDerWaalsContact CB-OG 3.27Å; R96-S190 WeakPolarHBondContact CB-OG 3.48Å; R96-S190 WeakPolarHBondContact CD-OG 3.11Å; R96-S190 VanDerWaalsContact CG-OG 3.24Å; R96-S190 WeakPolarHBondContact CG-OG 3.28Å; R96-S190 PolarHBondContact N-O 3.2Å; R96-S190 PolarHBondContact O-N 3.22Å
97	F	93.4	Very high	89.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	158.3	-173.9	65.7	-81.5	0	0	0	111.6	L95 L99 F116 I142 A144 N161 E163 I186 A187 L188	L95-F97 HydrophobicContact CB-CD1 4.34Å; F97-L99 HydrophobicContact CD2-CB 4.32Å; F97-L99 HydrophobicContact CE2-CB 4.23Å; F97-L99 HydrophobicContact CE2-CD1 4.41Å; F97-F116 HydrophobicContact CD1-CE1 4.19Å; F97-F116 HydrophobicContact CD1-CZ 4.17Å; F97-F116 AromaticContact CD2-CE1 3.9Å; F97-F116 HydrophobicContact CD2-CE1 3.9Å; F97-F116 HydrophobicContact CE1-CE1 4.1Å; F97-F116 HydrophobicContact CE1-CZ 4.26Å; F97-F116 AromaticContact CE2-CE1 3.78Å; F97-F116 HydrophobicContact CE2-CE1 3.78Å; F97-F116 HydrophobicContact CG-CE1 4.11Å; F97-F116 HydrophobicContact CG-CZ 4.34Å; F97-F116 AromaticContact CZ-CE1 3.9Å; F97-F116 HydrophobicContact CZ-CE1 3.9Å; F97-I142 HydrophobicContact CE1-CG2 3.72Å; F97-I142 HydrophobicContact CZ-CG2 3.73Å; F97-A144 HydrophobicContact CE2-CB 3.97Å; F97-A144 HydrophobicContact CZ-CB 4.4Å; F97-N161 HydrophobicContact CD1-CB 4.22Å; F97-N161 HydrophobicContact CD2-CB 4.38Å; F97-N161 HydrophobicContact CE1-CB 3.84Å; F97-N161 HydrophobicContact CE2-CB 4.02Å; F97-N161 HydrophobicContact CG-CB 4.47Å; F97-N161 HydrophobicContact CZ-CB 3.72Å; F97-N161 PolarHBondContact N-O 2.83Å; F97-N161 VanDerWaalsContact N-O 3.09Å; F97-N161 WeakPolarHBondContact O-CB 3.12Å; F97-N161 PolarHBondContact O-N 2.76Å; F97-N161 PolarHBondContact O-ND2 2.83Å; F97-E163 HydrophobicContact CE1-CB 4.19Å; F97-E163 HydrophobicContact CE1-CG 3.85Å; F97-E163 HydrophobicContact CZ-CG 4.27Å; F97-I186 HydrophobicContact CB-CD1 4.16Å; F97-I186 HydrophobicContact CB-CG1 4.33Å; F97-I186 HydrophobicContact CD2-CD1 3.72Å; F97-I186 HydrophobicContact CD2-CG1 4.21Å; F97-I186 HydrophobicContact CE2-CD1 4.45Å; F97-I186 HydrophobicContact CG-CD1 4.12Å; F97-A187 CarbonylContact C-O 3.46Å; F97-A187 WeakPolarHBondContact CA-O 3.05Å; F97-A187 VanDerWaalsContact CB-O 3.27Å; F97-A187 WeakPolarHBondContact CB-O 3.45Å; F97-L188 HydrophobicContact CB-CD1 4.11Å
98	T	91.6	Very high	89.5	Confident	12 Å²	12	39.8 Å²	39.8	7%	0.074	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.9	170.3	63	0	0	0	0	108.6	L158 L160 I186 A187 V189	T98-L158 HydrophobicContact CG2-CB 4.38Å; T98-L160 HydrophobicContact CG2-CD1 4.15Å; T98-I186 WeakPolarHBondContact O-CA 3.29Å; T98-A187 PolarHBondContact N-O 3.35Å; T98-A187 PolarHBondContact O-N 2.03Å; T98-A187 WeakPolarHBondContact OG1-CB 3.44Å; T98-V189 HydrophobicContact CG2-CG2 4.25Å
99	L	92.6	Very high	88.6	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	133.2	178.7	-170.1	142	0	0	0	109.8	F97 E114 A144 S147 F148	F97-L99 HydrophobicContact CD2-CB 4.32Å; F97-L99 HydrophobicContact CE2-CB 4.23Å; F97-L99 HydrophobicContact CE2-CD1 4.41Å; L99-E114 VanDerWaalsContact CD1-O 3.26Å; L99-E114 WeakPolarHBondContact CD1-O 3.28Å; L99-E114 HydrophobicContact CD2-CB 3.8Å; L99-E114 HydrophobicContact CD2-CG 4.11Å; L99-A144 HydrophobicContact CB-CB 3.8Å; L99-A144 HydrophobicContact CD1-CB 4.4Å; L99-A144 HydrophobicContact CD2-CB 4.35Å; L99-A144 HydrophobicContact CG-CB 4.4Å; L99-S147 VanDerWaalsContact O-CA 3.24Å; L99-S147 WeakPolarHBondContact O-CA 3.41Å; L99-S147 WeakPolarHBondContact O-CB 3.41Å; L99-F148 VanDerWaalsContact C-CE1 3.4Å; L99-F148 WeakPolarHBondContact O-CD1 3.43Å; L99-F148 WeakPolarHBondContact O-CE1 3.07Å; L99-F148 PolarHBondContact O-N 2.86Å
100	R	90.3	Very high	88.1	Confident	53 Å²	53	45.2 Å²	45.2	20%	0.2	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-90.8	134	179.5	-172.1	173.3	174.1	177.8	-2.9	110.6	C102 S104 I105 F148 C185	R100-C102 PolarHBondContact O-N 2.92Å; R100-S104 WeakPolarHBondContact CG-OG 3.47Å; R100-S104 PolarHBondContact NE-OG 2.95Å; R100-S104 PolarHBondContact NH2-O 3.18Å; R100-I105 HydrophobicContact CG-CD1 4.28Å; R100-I105 HydrophobicContact CG-CG1 4.32Å; R100-F148 HydrophobicContact CB-CD2 4.35Å; R100-F148 HydrophobicContact CB-CE1 3.99Å; R100-F148 HydrophobicContact CB-CE2 3.74Å; R100-F148 HydrophobicContact CB-CZ 3.55Å; R100-F148 HydrophobicContact CG-CD2 4.15Å; R100-F148 HydrophobicContact CG-CE2 3.72Å; R100-F148 HydrophobicContact CG-CZ 4.08Å; R100-C185 HydrophobicContact CB-CB 3.97Å; R100-C185 PolarHBondContact N-O 3.14Å
101	D	87.2	Confident	87.9	Confident	29 Å²	29	45.4 Å²	45.4	16%	0.155	25%	0.247	C	C	.	.			trans	-60.9	128	176.2	-179.8	-10.5	0	0	0	110.3	N103 S104 E114 F148 T149	D101-N103 PolarHBondContact O-N 2.99Å; D101-N103 VanDerWaalsContact OD1-CB 3.27Å; D101-N103 WeakPolarHBondContact OD1-CB 3.43Å; D101-N103 PolarHBondContact OD1-N 2.95Å; D101-N103 PolarHBondContact OD1-ND2 2.85Å; D101-N103 VanDerWaalsContact OD1-ND2 3.09Å; D101-S104 WeakPolarHBondContact O-CB 3.36Å; D101-S104 PolarHBondContact O-N 2.76Å; D101-S104 PolarHBondContact O-OG 2.78Å; D101-E114 VanDerWaalsContact CA-OE1 3.31Å; D101-E114 WeakPolarHBondContact CA-OE1 3.18Å; D101-F148 PolarHBondContact N-O 3.24Å; D101-T149 HydrophobicContact CB-CG2 4.23Å
102	C	87.3	Confident	87.7	Confident	20 Å²	20	46 Å²	46	14%	0.135	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-61	-32.2	178.7	-74	0	0	0	0	112.5	R100 S104 I105 C112 K113 E114	R100-C102 PolarHBondContact O-N 2.92Å; C102-S104 PolarHBondContact O-N 3.02Å; C102-I105 PolarHBondContact O-N 2.82Å; C102-I105 VanDerWaalsContact O-N 3.14Å; C102-C112 VanDerWaalsContact CA-SG 3.51Å; C102-C112 HydrophobicContact CB-CB 3.74Å; C102-C112 WeakPolarHBondContact CB-SG 3.38Å; C102-C112 WeakPolarHBondContact SG-CB 3.42Å; C102-C112 CovalentContact SG-SG 2.03Å; C102-C112 PolarHBondContact SG-SG 2.82Å; C102-K113 PolarHBondContact SG-N 3.07Å; C102-E114 HydrophobicContact CB-CG 4.25Å; C102-E114 PolarHBondContact N-OE1 3.2Å; C102-E114 VanDerWaalsContact SG-CG 3.54Å
103	N	86.3	Confident	87.4	Confident	120 Å²	120	49.8 Å²	49.8	64%	0.642	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-67	-20.5	176.6	-61.1	-52.4	0	0	0	112.5	D101 I105	D101-N103 PolarHBondContact O-N 2.99Å; D101-N103 VanDerWaalsContact OD1-CB 3.27Å; D101-N103 WeakPolarHBondContact OD1-CB 3.43Å; D101-N103 PolarHBondContact OD1-N 2.95Å; D101-N103 PolarHBondContact OD1-ND2 2.85Å; D101-N103 VanDerWaalsContact OD1-ND2 3.09Å; N103-I105 VanDerWaalsContact C-N 3.28Å
104	S	85	Confident	87.1	Confident	14 Å²	14	53.4 Å²	53.4	10%	0.098	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-84.1	-1	176.4	82.3	0	0	0	0	113.9	R100 D101 C102	R100-S104 WeakPolarHBondContact CG-OG 3.47Å; R100-S104 PolarHBondContact NE-OG 2.95Å; R100-S104 PolarHBondContact NH2-O 3.18Å; D101-S104 WeakPolarHBondContact O-CB 3.36Å; D101-S104 PolarHBondContact O-N 2.76Å; D101-S104 PolarHBondContact O-OG 2.78Å; C102-S104 PolarHBondContact O-N 3.02Å
105	I	84.8	Confident	86.9	Confident	18 Å²	18	54.3 Å²	54.3	9%	0.092	29%	0.292	C	S	.	.	S	Bend	trans	-114.1	118.9	179.1	-52.2	176	0	0	0	108	V69 M70 R100 C102 N103 V108 C185	V69-I105 HydrophobicContact CG1-CD1 4.22Å; V69-I105 HydrophobicContact CG2-CD1 3.98Å; V69-I105 HydrophobicContact CG2-CG2 4.14Å; M70-I105 HydrophobicContact CE-CG2 4.1Å; R100-I105 HydrophobicContact CG-CD1 4.28Å; R100-I105 HydrophobicContact CG-CG1 4.32Å; C102-I105 PolarHBondContact O-N 2.82Å; C102-I105 VanDerWaalsContact O-N 3.14Å; N103-I105 VanDerWaalsContact C-N 3.28Å; I105-V108 HydrophobicContact CB-CG1 4.32Å; I105-V108 HydrophobicContact CB-CG2 3.79Å; I105-V108 HydrophobicContact CG2-CB 4.48Å; I105-V108 HydrophobicContact CG2-CG1 3.6Å; I105-V108 HydrophobicContact CG2-CG2 4.02Å; I105-V108 WeakPolarHBondContact O-CG2 3.41Å; I105-C185 HydrophobicContact CD1-CB 4.03Å
106	P	82.1	Confident	86.9	Confident	77 Å²	77	54.3 Å²	54.3	50%	0.5	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	145.7	178.9	28.5	-32.8	0	0	0	110.7	M70	M70-P106 VanDerWaalsContact CE-O 3.25Å; M70-P106 WeakPolarHBondContact CE-O 3.09Å
107	W	79.3	Confident	87	Confident	241 Å²	241	50.1 Å²	50.1	91%	0.913	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	20.8	172.2	-43.8	104.1	0	0	0	117.8
108	V	84.2	Confident	87.2	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.024	28%	0.277	C	S	.	.			trans	-113.2	13.6	-178.4	-58.3	0	0	0	0	115.1	V69 M70 I105 G110 T111 C112	V69-V108 HydrophobicContact CB-CB 4.44Å; V69-V108 HydrophobicContact CB-CG1 4.02Å; V69-V108 HydrophobicContact CG2-CG1 3.65Å; M70-V108 HydrophobicContact CE-CG1 3.55Å; M70-V108 HydrophobicContact CG-CG1 4.17Å; M70-V108 HydrophobicContact SD-CG1 3.4Å; M70-V108 WeakPolarHBondContact SD-CG1 3.41Å; I105-V108 HydrophobicContact CB-CG1 4.32Å; I105-V108 HydrophobicContact CB-CG2 3.79Å; I105-V108 HydrophobicContact CG2-CB 4.48Å; I105-V108 HydrophobicContact CG2-CG1 3.6Å; I105-V108 HydrophobicContact CG2-CG2 4.02Å; I105-V108 WeakPolarHBondContact O-CG2 3.41Å; V108-G110 PolarHBondContact O-N 3.04Å; V108-G110 VanDerWaalsContact O-N 3.1Å; V108-T111 PolarHBondContact O-N 2.9Å; V108-T111 PolarHBondContact O-OG1 3.49Å; V108-C112 HydrophobicContact CB-CB 3.78Å; V108-C112 HydrophobicContact CG2-CB 3.51Å; V108-C112 PolarHBondContact O-N 3.19Å; V108-C112 VanDerWaalsContact O-N 3.08Å
109	S	70.4	Confident	87.4	Confident	126 Å²	126	50.6 Å²	50.6	88%	0.881	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	113.8	-177.7	-56.8	0	0	0	0	111.2
110	G	76.1	Confident	87.5	Confident	70 Å²	70	52.5 Å²	52.5	72%	0.722	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.6	-21	178.8	0	0	0	0	0	115.5	V108	V108-G110 PolarHBondContact O-N 3.04Å; V108-G110 VanDerWaalsContact O-N 3.1Å
111	T	85.1	Confident	87.7	Confident	36 Å²	36	50.7 Å²	50.7	22%	0.221	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-34.8	175.4	52.3	0	0	0	0	112.4	V69 P72 V108	V69-T111 VanDerWaalsContact O-CB 3.31Å; V69-T111 WeakPolarHBondContact O-CB 3.43Å; V69-T111 PolarHBondContact O-OG1 2.05Å; P72-T111 HydrophobicContact CB-CG2 4.1Å; V108-T111 PolarHBondContact O-N 2.9Å; V108-T111 PolarHBondContact O-OG1 3.49Å
112	C	88.8	Confident	87.9	Confident	14 Å²	14	50.8 Å²	50.8	10%	0.095	28%	0.279	C	S	.	.			trans	-71.3	142.9	179.4	-172.2	0	0	0	0	112.8	V69 C102 V108 G183	V69-C112 HydrophobicContact CB-CB 4.18Å; V69-C112 HydrophobicContact CG1-CB 4.37Å; C102-C112 VanDerWaalsContact CA-SG 3.51Å; C102-C112 HydrophobicContact CB-CB 3.74Å; C102-C112 WeakPolarHBondContact CB-SG 3.38Å; C102-C112 WeakPolarHBondContact SG-CB 3.42Å; C102-C112 CovalentContact SG-SG 2.03Å; C102-C112 PolarHBondContact SG-SG 2.82Å; V108-C112 HydrophobicContact CB-CB 3.78Å; V108-C112 HydrophobicContact CG2-CB 3.51Å; V108-C112 PolarHBondContact O-N 3.19Å; V108-C112 VanDerWaalsContact O-N 3.08Å; C112-G183 CarbonylContact C-O 3.57Å; C112-G183 VanDerWaalsContact CA-O 3.28Å; C112-G183 WeakPolarHBondContact CA-O 3.41Å
113	K	89.8	Confident	88.1	Confident	90 Å²	90	51.9 Å²	51.9	39%	0.391	28%	0.282	S	S	.	.	B	Isolated β-bridge	trans	-130.2	151.9	176.4	-58.7	-63.7	173.6	-164.6	0	110.4	C102 I182 G183 A184	C102-K113 PolarHBondContact SG-N 3.07Å; K113-I182 HydrophobicContact CB-CG1 4.49Å; K113-I182 HydrophobicContact CG-CD1 4.26Å; K113-I182 HydrophobicContact CG-CG1 4.17Å; K113-G183 PolarHBondContact N-O 2.92Å; K113-A184 WeakPolarHBondContact O-CA 3.36Å; K113-A184 WeakPolarHBondContact O-CB 3.28Å
114	E	90.1	Very high	88.2	Confident	75 Å²	75	49.9 Å²	49.9	35%	0.35	27%	0.271	S	S	.	.	S	Bend	trans	-110.1	24.8	178.1	-59.3	-173.7	138.7	0	0	112.1	L99 D101 C102	L99-E114 VanDerWaalsContact CD1-O 3.26Å; L99-E114 WeakPolarHBondContact CD1-O 3.28Å; L99-E114 HydrophobicContact CD2-CB 3.8Å; L99-E114 HydrophobicContact CD2-CG 4.11Å; D101-E114 VanDerWaalsContact CA-OE1 3.31Å; D101-E114 WeakPolarHBondContact CA-OE1 3.18Å; C102-E114 HydrophobicContact CB-CG 4.25Å; C102-E114 PolarHBondContact N-OE1 3.2Å; C102-E114 VanDerWaalsContact SG-CG 3.54Å
115	T	91.7	Very high	88.2	Confident	40 Å²	40	56.1 Å²	56.1	25%	0.245	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	148.9	-176.7	63.6	0	0	0	0	111	T141 I142 A143	T115-T141 HydrophobicContact CG2-CG2 4.02Å; T115-I142 CarbonylContact C-O 3.25Å; T115-I142 WeakPolarHBondContact CA-O 3.4Å; T115-I142 WeakPolarHBondContact CB-O 3.38Å; T115-A143 HydrophobicContact CG2-CB 3.94Å
116	F	94.8	Very high	87.6	Confident	1 Å²	1	57.3 Å²	57.3	0%	0.004	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	164	168.7	68.1	-77.1	0	0	0	109.6	L95 F97 I142 F179 I186	L95-F116 HydrophobicContact CD1-CE2 4.05Å; L95-F116 HydrophobicContact CD1-CZ 3.98Å; F97-F116 HydrophobicContact CD1-CE1 4.19Å; F97-F116 HydrophobicContact CD1-CZ 4.17Å; F97-F116 AromaticContact CD2-CE1 3.9Å; F97-F116 HydrophobicContact CD2-CE1 3.9Å; F97-F116 HydrophobicContact CE1-CE1 4.1Å; F97-F116 HydrophobicContact CE1-CZ 4.26Å; F97-F116 AromaticContact CE2-CE1 3.78Å; F97-F116 HydrophobicContact CE2-CE1 3.78Å; F97-F116 HydrophobicContact CG-CE1 4.11Å; F97-F116 HydrophobicContact CG-CZ 4.34Å; F97-F116 AromaticContact CZ-CE1 3.9Å; F97-F116 HydrophobicContact CZ-CE1 3.9Å; F116-I142 HydrophobicContact CD1-CB 3.96Å; F116-I142 HydrophobicContact CD1-CG2 4.33Å; F116-I142 HydrophobicContact CD2-CB 4.38Å; F116-I142 HydrophobicContact CD2-CG1 4.48Å; F116-I142 HydrophobicContact CE1-CB 3.51Å; F116-I142 HydrophobicContact CE1-CG1 4.38Å; F116-I142 HydrophobicContact CE1-CG2 3.45Å; F116-I142 VanDerWaalsContact CE1-CG2 3.45Å; F116-I142 HydrophobicContact CE2-CB 3.96Å; F116-I142 HydrophobicContact CE2-CG1 3.94Å; F116-I142 HydrophobicContact CE2-CG2 4.36Å; F116-I142 HydrophobicContact CG-CB 4.39Å; F116-I142 HydrophobicContact CZ-CB 3.53Å; F116-I142 HydrophobicContact CZ-CG1 3.91Å; F116-I142 HydrophobicContact CZ-CG2 3.48Å; F116-I142 VanDerWaalsContact CZ-CG2 3.48Å; F116-I142 PolarHBondContact N-O 3.13Å; F116-I142 PolarHBondContact O-N 3.14Å; F116-F179 HydrophobicContact CD2-CD1 4.38Å; F116-F179 AromaticContact CE2-CD1 3.95Å; F116-F179 HydrophobicContact CE2-CD1 3.95Å; F116-I186 HydrophobicContact CB-CD1 4.46Å; F116-I186 HydrophobicContact CD1-CD1 3.15Å; F116-I186 HydrophobicContact CD2-CD1 4.33Å; F116-I186 HydrophobicContact CE1-CD1 3.2Å; F116-I186 HydrophobicContact CE2-CD1 4.38Å; F116-I186 HydrophobicContact CG-CD1 3.74Å; F116-I186 HydrophobicContact CZ-CD1 3.85Å
117	N	95.8	Very high	86.9	Confident	12 Å²	12	61.7 Å²	61.7	6%	0.064	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	139.6	-177.6	-60.8	-52.4	0	0	0	111.2	F119 K138 T141 F179 Q180	N117-F119 HydrophobicContact CB-CD2 4.07Å; N117-F119 HydrophobicContact CB-CE2 3.41Å; N117-F119 VanDerWaalsContact CB-CE2 3.41Å; N117-F119 HydrophobicContact CB-CZ 4.24Å; N117-K138 VanDerWaalsContact OD1-CE 3.28Å; N117-K138 WeakPolarHBondContact OD1-CE 3.2Å; N117-K138 PolarHBondContact OD1-NZ 3.16Å; N117-K138 VanDerWaalsContact OD1-NZ 3.13Å; N117-T141 PolarHBondContact OD1-OG1 3.43Å; N117-F179 CarbonylContact O-C 3.52Å; N117-F179 WeakPolarHBondContact O-CA 3.45Å; N117-Q180 HydrophobicContact CB-CB 4.21Å; N117-Q180 PolarHBondContact N-O 2.82Å; N117-Q180 PolarHBondContact ND2-OE1 2.82Å; N117-Q180 PolarHBondContact O-N 2.93Å
118	L	97.4	Very high	86	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	136.8	173.4	178.6	66.3	0	0	0	110	V93 L95 I139 D140 I142 R165 F179	V93-L118 HydrophobicContact CB-CD2 4.39Å; V93-L118 HydrophobicContact CG1-CD2 4.15Å; L95-L118 HydrophobicContact CD1-CD2 4.26Å; L118-I139 HydrophobicContact CB-CB 4.36Å; L118-I139 HydrophobicContact CD2-CB 4.14Å; L118-I139 HydrophobicContact CD2-CD1 3.86Å; L118-I139 HydrophobicContact CD2-CG2 4.07Å; L118-I139 HydrophobicContact CG-CB 4.08Å; L118-I139 HydrophobicContact CG-CD1 3.73Å; L118-I139 HydrophobicContact CG-CG1 4.38Å; L118-I139 WeakPolarHBondContact O-CB 3.4Å; L118-I139 PolarHBondContact O-N 2.88Å; L118-D140 PolarHBondContact N-O 2.99Å; L118-D140 PolarHBondContact O-N 3.03Å; L118-I142 HydrophobicContact CB-CD1 4.32Å; L118-I142 HydrophobicContact CB-CG1 4.07Å; L118-R165 HydrophobicContact CD2-CB 4.19Å; L118-R165 HydrophobicContact CD2-CG 4.36Å; L118-F179 HydrophobicContact CD1-CD1 3.85Å; L118-F179 HydrophobicContact CD1-CE1 3.46Å; L118-F179 VanDerWaalsContact CD1-CE1 3.46Å; L118-F179 HydrophobicContact CD1-CZ 3.99Å
119	F	96.3	Very high	84.9	Confident	21 Å²	21	55.5 Å²	55.5	9%	0.092	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	159.6	-177.6	-72.5	-98.2	0	0	0	112.1	W77 N117 Y136 T137 K138 L177 A178 Q180	W77-F119 HydrophobicContact CH2-CD1 4.11Å; W77-F119 AromaticContact CH2-CD2 3.9Å; W77-F119 HydrophobicContact CH2-CD2 3.9Å; W77-F119 AromaticContact CH2-CE1 3.97Å; W77-F119 HydrophobicContact CH2-CE1 3.97Å; W77-F119 AromaticContact CH2-CE2 3.71Å; W77-F119 HydrophobicContact CH2-CE2 3.71Å; W77-F119 HydrophobicContact CH2-CG 4.1Å; W77-F119 AromaticContact CH2-CZ 3.78Å; W77-F119 HydrophobicContact CH2-CZ 3.78Å; W77-F119 HydrophobicContact CZ3-CB 4.28Å; W77-F119 HydrophobicContact CZ3-CD1 4.23Å; W77-F119 AromaticContact CZ3-CD2 3.69Å; W77-F119 HydrophobicContact CZ3-CD2 3.69Å; W77-F119 AromaticContact CZ3-CE2 3.99Å; W77-F119 HydrophobicContact CZ3-CE2 3.99Å; W77-F119 AromaticContact CZ3-CG 3.83Å; W77-F119 HydrophobicContact CZ3-CG 3.83Å; W77-F119 HydrophobicContact CZ3-CZ 4.42Å; N117-F119 HydrophobicContact CB-CD2 4.07Å; N117-F119 HydrophobicContact CB-CE2 3.41Å; N117-F119 VanDerWaalsContact CB-CE2 3.41Å; N117-F119 HydrophobicContact CB-CZ 4.24Å; F119-Y136 HydrophobicContact CB-CD1 4.11Å; F119-T137 VanDerWaalsContact CA-O 3.29Å; F119-T137 WeakPolarHBondContact CA-O 3.3Å; F119-T137 VanDerWaalsContact CD1-C 3.48Å; F119-K138 HydrophobicContact CD1-CB 3.84Å; F119-K138 HydrophobicContact CD1-CG 4.39Å; F119-K138 VanDerWaalsContact CD1-N 3.34Å; F119-K138 HydrophobicContact CE1-CB 3.43Å; F119-K138 VanDerWaalsContact CE1-CB 3.43Å; F119-K138 HydrophobicContact CE1-CD 4.47Å; F119-K138 HydrophobicContact CE1-CG 3.92Å; F119-K138 HydrophobicContact CE2-CG 4.36Å; F119-K138 HydrophobicContact CZ-CB 3.93Å; F119-K138 HydrophobicContact CZ-CD 4.13Å; F119-K138 HydrophobicContact CZ-CG 3.89Å; F119-L177 WeakPolarHBondContact O-CA 3.5Å; F119-A178 HydrophobicContact CB-CB 4.19Å; F119-A178 PolarHBondContact N-O 3.16Å; F119-A178 PolarHBondContact O-N 2.96Å; F119-Q180 HydrophobicContact CD2-CB 4.21Å; F119-Q180 HydrophobicContact CE2-CB 3.81Å
120	Y	95.8	Very high	85.1	Confident	41 Å²	41	57.9 Å²	57.9	16%	0.161	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	160.9	169.7	79.9	-64.2	0	0	0	113.5	E122 T137 I139 V167 M170 Y176	Y120-E122 HydrophobicContact CD2-CG 4.21Å; Y120-E122 HydrophobicContact CE2-CG 3.95Å; Y120-T137 HydrophobicContact CE1-CG2 3.9Å; Y120-T137 PolarHBondContact N-O 2.95Å; Y120-T137 PolarHBondContact O-N 2.72Å; Y120-I139 HydrophobicContact CD1-CD1 3.83Å; Y120-I139 HydrophobicContact CD1-CG1 3.49Å; Y120-I139 VanDerWaalsContact CD1-CG1 3.49Å; Y120-I139 HydrophobicContact CE1-CG1 4.18Å; Y120-I139 HydrophobicContact CG-CD1 4.12Å; Y120-I139 HydrophobicContact CG-CG1 4.28Å; Y120-V167 HydrophobicContact CD1-CG1 3.87Å; Y120-V167 HydrophobicContact CD2-CG1 3.77Å; Y120-V167 HydrophobicContact CE1-CG1 3.8Å; Y120-V167 HydrophobicContact CE2-CG1 3.7Å; Y120-V167 HydrophobicContact CG-CG1 3.86Å; Y120-M170 HydrophobicContact CD2-CE 4.37Å; Y120-M170 HydrophobicContact CD2-SD 4.46Å; Y120-M170 HydrophobicContact CE2-SD 4.17Å; Y120-Y176 CarbonylContact C-O 3.51Å; Y120-Y176 WeakPolarHBondContact CA-O 3.3Å
121	Q	93.4	Very high	85.4	Confident	16 Å²	16	56.7 Å²	56.7	8%	0.075	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	122.4	173.7	-177	-176.3	24.5	0	0	110.6	M123 Q135 Y136 F175 Y176	Q121-M123 HydrophobicContact CG-CG 4.28Å; Q121-Q135 VanDerWaalsContact NE2-CB 3.26Å; Q121-Q135 VanDerWaalsContact NE2-OE1 3.09Å; Q121-Y136 HydrophobicContact CB-CD1 3.89Å; Q121-Y136 HydrophobicContact CB-CD2 4.47Å; Q121-Y136 HydrophobicContact CB-CE1 3.74Å; Q121-Y136 HydrophobicContact CB-CE2 4.3Å; Q121-Y136 HydrophobicContact CB-CG 4.24Å; Q121-Y136 VanDerWaalsContact OE1-CZ 3.23Å; Q121-Y136 PolarHBondContact OE1-OH 3.21Å; Q121-F175 CarbonylContact O-C 3.56Å; Q121-F175 WeakPolarHBondContact O-CA 3.4Å; Q121-F175 WeakPolarHBondContact O-CB 3.01Å; Q121-Y176 PolarHBondContact N-O 3.34Å; Q121-Y176 PolarHBondContact O-N 2.68Å
122	E	92.8	Very high	85.4	Confident	31 Å²	31	60.2 Å²	60.2	15%	0.145	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	133.3	176.6	-72.9	-171.8	-104.7	0	0	113.1	Y120 M170 T171 K172 F175	Y120-E122 HydrophobicContact CD2-CG 4.21Å; Y120-E122 HydrophobicContact CE2-CG 3.95Å; E122-M170 HydrophobicContact CG-CE 3.66Å; E122-M170 HydrophobicContact CG-SD 4.35Å; E122-T171 PolarHBondContact OE2-N 3.47Å; E122-T171 PolarHBondContact OE2-OG1 3.28Å; E122-K172 HydrophobicContact CB-CB 4.11Å; E122-K172 HydrophobicContact CB-CD 4Å; E122-K172 HydrophobicContact CB-CG 4.06Å; E122-K172 WeakPolarHBondContact O-CD 3.48Å; E122-K172 PolarHBondContact O-NZ 3.03Å; E122-K172 PolarHBondContact OE2-N 3.17Å; E122-F175 HydrophobicContact CG-CB 4.43Å
123	M	89.6	Confident	85.2	Confident	43 Å²	43	61.9 Å²	61.9	21%	0.212	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	140.8	-176.6	-69.4	-74.5	-61.2	0	0	111.9	W82 Q121 V129 G174 Y176	W82-M123 PolarHBondContact NE1-O 2.84Å; Q121-M123 HydrophobicContact CG-CG 4.28Å; M123-V129 HydrophobicContact CE-CG2 3.3Å; M123-V129 HydrophobicContact SD-CG2 4.37Å; M123-G174 PolarHBondContact N-O 2.74Å; M123-G174 CarbonylContact O-C 3.53Å; M123-G174 VanDerWaalsContact O-C 3.32Å; M123-G174 PolarHBondContact O-N 3.15Å; M123-G174 VanDerWaalsContact O-N 3.1Å; M123-Y176 HydrophobicContact CB-CE2 4.23Å; M123-Y176 HydrophobicContact CG-CD2 4.16Å; M123-Y176 HydrophobicContact CG-CE2 4.05Å
124	D	88.8	Confident	85	Confident	77 Å²	77	63 Å²	63	41%	0.412	34%	0.341	S	S	.	.	S	Bend	trans	-80.2	-22.4	177.6	-69.3	-57	0	0	0	114.2	K172 K173	D124-K172 WeakPolarHBondContact OD1-CA 2.99Å; D124-K172 WeakPolarHBondContact OD1-CB 3.16Å; D124-K173 HydrophobicContact CB-CD 4.5Å; D124-K173 PolarHBondContact OD1-N 2.89Å
125	E	84.4	Confident	84.8	Confident	146 Å²	146	63.4 Å²	63.4	68%	0.682	34%	0.344	S	S	*	.			trans	-129.6	149.5	-175.7	-65.6	-175.2	178.7	0	0	112.9
126	A	74.1	Confident	84.8	Confident	42 Å²	42	62.2 Å²	62.2	35%	0.347	34%	0.335	S	S	.	.	S	Bend	trans	-85.4	-12.9	-173.5	0	0	0	0	0	115.2	W82 Y176	W82-A126 HydrophobicContact CB-CB 3.86Å; W82-A126 HydrophobicContact CD2-CB 3.94Å; W82-A126 HydrophobicContact CE3-CB 4.16Å; W82-A126 HydrophobicContact CG-CB 3.82Å; A126-Y176 PolarHBondContact O-OH 2.9Å
127	H	67.5	Low	84.7	Confident	169 Å²	169	66 Å²	66	78%	0.782	36%	0.358	S	S	*	.	S	Bend	trans	-109.3	145.7	-169.2	-66.2	91	0	0	0	113.6
128	G	59.8	Low	84.7	Confident	83 Å²	83	70.2 Å²	70.2	86%	0.856	38%	0.376	S	S	*	.			trans	92.3	0.3	158.4	0	0	0	0	0	118.9	K130	G128-K130 PolarHBondContact O-N 2.84Å
129	V	61.6	Low	84.5	Confident	33 Å²	33	72.1 Å²	72.1	20%	0.2	39%	0.385	C	S	.	.			trans	-82.3	110.3	-178	-168.3	0	0	0	0	111.3	M123 F131	M123-V129 HydrophobicContact CE-CG2 3.3Å; M123-V129 HydrophobicContact SD-CG2 4.37Å; V129-F131 PolarHBondContact O-N 2.94Å
130	K	73.4	Confident	84.4	Confident	176 Å²	176	74.1 Å²	74.1	77%	0.765	40%	0.397	S	S	*	.			trans	-60.7	129.6	162.5	-70.9	-174.5	178.7	-177.3	0	108.5	G128 K132	G128-K130 PolarHBondContact O-N 2.84Å; K130-K132 PolarHBondContact O-N 2.87Å
131	F	83.5	Confident	84.2	Confident	45 Å²	45	74.6 Å²	74.6	20%	0.197	40%	0.404	C	S	.	.			trans	-59.1	125.2	179.3	179.2	-104.7	0	0	0	110.7	Y43 W77 V129 P133 Y136	Y43-F131 AromaticContact CD1-CD1 3.73Å; Y43-F131 HydrophobicContact CD1-CD1 3.73Å; Y43-F131 AromaticContact CD1-CE1 3.52Å; Y43-F131 HydrophobicContact CD1-CE1 3.52Å; Y43-F131 HydrophobicContact CD2-CD1 4.08Å; Y43-F131 HydrophobicContact CE1-CD1 4.41Å; Y43-F131 HydrophobicContact CE1-CE1 4.32Å; Y43-F131 AromaticContact CG-CD1 3.52Å; Y43-F131 HydrophobicContact CG-CD1 3.52Å; Y43-F131 AromaticContact CG-CE1 3.71Å; Y43-F131 HydrophobicContact CG-CE1 3.71Å; W77-F131 HydrophobicContact CB-CE1 3.95Å; W77-F131 HydrophobicContact CB-CE2 4.38Å; W77-F131 HydrophobicContact CB-CZ 3.56Å; W77-F131 HydrophobicContact CD2-CE1 4.23Å; W77-F131 HydrophobicContact CD2-CE2 4.45Å; W77-F131 AromaticContact CD2-CZ 3.49Å; W77-F131 HydrophobicContact CD2-CZ 3.49Å; W77-F131 VanDerWaalsContact CD2-CZ 3.49Å; W77-F131 HydrophobicContact CE3-CE2 4.16Å; W77-F131 AromaticContact CE3-CZ 3.6Å; W77-F131 HydrophobicContact CE3-CZ 3.6Å; W77-F131 AromaticContact CG-CE1 3.87Å; W77-F131 HydrophobicContact CG-CE1 3.87Å; W77-F131 AromaticContact CG-CZ 3.47Å; W77-F131 HydrophobicContact CG-CZ 3.47Å; W77-F131 VanDerWaalsContact CG-CZ 3.47Å; W77-F131 HydrophobicContact CZ3-CZ 4.42Å; V129-F131 PolarHBondContact O-N 2.94Å; F131-P133 HydrophobicContact CD1-CG 4.46Å; F131-P133 HydrophobicContact CE1-CG 3.67Å; F131-P133 HydrophobicContact CZ-CG 4.06Å; F131-Y136 HydrophobicContact CD2-CE2 4.08Å; F131-Y136 HydrophobicContact CE2-CD2 4.31Å; F131-Y136 AromaticContact CE2-CE2 3.88Å; F131-Y136 HydrophobicContact CE2-CE2 3.88Å
132	K	84.6	Confident	84.2	Confident	110 Å²	110	73.8 Å²	73.8	48%	0.478	40%	0.401	S	S	.	.			trans	-138.3	107.7	178.9	-72.2	-176.7	-179.8	-175.7	0	108.8	K130 S134 Q135 Y136	K130-K132 PolarHBondContact O-N 2.87Å; K132-S134 PolarHBondContact O-N 2.81Å; K132-S134 VanDerWaalsContact O-N 3.15Å; K132-Q135 HydrophobicContact CB-CG 4.02Å; K132-Q135 PolarHBondContact O-N 2.95Å; K132-Q135 VanDerWaalsContact O-N 3.13Å; K132-Y136 WeakPolarHBondContact O-CD2 3.43Å
133	P	84.1	Confident	84	Confident	48 Å²	48	74.5 Å²	74.5	31%	0.312	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-52.6	-36.7	-178.6	-30.6	35.8	0	0	0	114.4	W77 F131 Q135 Y136	W77-P133 HydrophobicContact CH2-CB 4.22Å; W77-P133 HydrophobicContact CZ2-CB 3.79Å; W77-P133 HydrophobicContact CZ2-CG 4.41Å; F131-P133 HydrophobicContact CD1-CG 4.46Å; F131-P133 HydrophobicContact CE1-CG 3.67Å; F131-P133 HydrophobicContact CZ-CG 4.06Å; P133-Q135 PolarHBondContact O-N 2.96Å; P133-Q135 VanDerWaalsContact O-N 3.08Å; P133-Y136 PolarHBondContact O-N 2.97Å; P133-Y136 VanDerWaalsContact O-N 3.14Å
134	S	84.6	Confident	83.8	Confident	113 Å²	113	73.8 Å²	73.8	79%	0.79	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-65.8	-12	-177.4	64.9	0	0	0	0	115.3	K132	K132-S134 PolarHBondContact O-N 2.81Å; K132-S134 VanDerWaalsContact O-N 3.15Å
135	Q	87.2	Confident	83.2	Confident	85 Å²	85	76.5 Å²	76.5	40%	0.397	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-95.4	-4.7	179.1	-57.8	-175.5	-29.5	0	0	113.1	Q121 K132 P133	Q121-Q135 VanDerWaalsContact NE2-CB 3.26Å; Q121-Q135 VanDerWaalsContact NE2-OE1 3.09Å; K132-Q135 HydrophobicContact CB-CG 4.02Å; K132-Q135 PolarHBondContact O-N 2.95Å; K132-Q135 VanDerWaalsContact O-N 3.13Å; P133-Q135 PolarHBondContact O-N 2.96Å; P133-Q135 VanDerWaalsContact O-N 3.08Å
136	Y	91.5	Very high	82.9	Confident	14 Å²	14	74.4 Å²	74.4	6%	0.055	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-94	131	179	-77.9	-100.5	0	0	0	109.6	W77 R79 F119 Q121 F131 K132 P133 A178	W77-Y136 HydrophobicContact CZ3-CG 4.5Å; R79-Y136 WeakPolarHBondContact CD-OH 3.25Å; R79-Y136 HydrophobicContact CG-CE1 4.33Å; F119-Y136 HydrophobicContact CB-CD1 4.11Å; Q121-Y136 HydrophobicContact CB-CD1 3.89Å; Q121-Y136 HydrophobicContact CB-CD2 4.47Å; Q121-Y136 HydrophobicContact CB-CE1 3.74Å; Q121-Y136 HydrophobicContact CB-CE2 4.3Å; Q121-Y136 HydrophobicContact CB-CG 4.24Å; Q121-Y136 VanDerWaalsContact OE1-CZ 3.23Å; Q121-Y136 PolarHBondContact OE1-OH 3.21Å; F131-Y136 HydrophobicContact CD2-CE2 4.08Å; F131-Y136 HydrophobicContact CE2-CD2 4.31Å; F131-Y136 AromaticContact CE2-CE2 3.88Å; F131-Y136 HydrophobicContact CE2-CE2 3.88Å; K132-Y136 WeakPolarHBondContact O-CD2 3.43Å; P133-Y136 PolarHBondContact O-N 2.97Å; P133-Y136 VanDerWaalsContact O-N 3.14Å; Y136-A178 HydrophobicContact CD1-CB 3.61Å; Y136-A178 HydrophobicContact CE1-CB 3.57Å
137	T	93.4	Very high	83.3	Confident	80 Å²	80	74.5 Å²	74.5	49%	0.491	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	129.6	174.1	-56.8	0	0	0	0	108.7	F119 Y120 I139	F119-T137 VanDerWaalsContact CA-O 3.29Å; F119-T137 WeakPolarHBondContact CA-O 3.3Å; F119-T137 VanDerWaalsContact CD1-C 3.48Å; Y120-T137 HydrophobicContact CE1-CG2 3.9Å; Y120-T137 PolarHBondContact N-O 2.95Å; Y120-T137 PolarHBondContact O-N 2.72Å; T137-I139 PolarHBondContact O-N 2.78Å
138	K	93.8	Very high	83.9	Confident	102 Å²	102	67.3 Å²	67.3	44%	0.443	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	128.2	176.7	-169.3	173.8	172.3	-179.3	0	109.3	N117 F119 T141	N117-K138 VanDerWaalsContact OD1-CE 3.28Å; N117-K138 WeakPolarHBondContact OD1-CE 3.2Å; N117-K138 PolarHBondContact OD1-NZ 3.16Å; N117-K138 VanDerWaalsContact OD1-NZ 3.13Å; F119-K138 HydrophobicContact CD1-CB 3.84Å; F119-K138 HydrophobicContact CD1-CG 4.39Å; F119-K138 VanDerWaalsContact CD1-N 3.34Å; F119-K138 HydrophobicContact CE1-CB 3.43Å; F119-K138 VanDerWaalsContact CE1-CB 3.43Å; F119-K138 HydrophobicContact CE1-CD 4.47Å; F119-K138 HydrophobicContact CE1-CG 3.92Å; F119-K138 HydrophobicContact CE2-CG 4.36Å; F119-K138 HydrophobicContact CZ-CB 3.93Å; F119-K138 HydrophobicContact CZ-CD 4.13Å; F119-K138 HydrophobicContact CZ-CG 3.89Å; K138-T141 VanDerWaalsContact CE-OG1 3.24Å; K138-T141 WeakPolarHBondContact CE-OG1 3.25Å; K138-T141 PolarHBondContact NZ-OG1 2.78Å
139	I	93.4	Very high	84.9	Confident	39 Å²	39	64.9 Å²	64.9	20%	0.2	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-59.6	172.3	-62.2	170.1	0	0	0	108.2	L118 Y120 T137 R165 V167 L177	L118-I139 HydrophobicContact CB-CB 4.36Å; L118-I139 HydrophobicContact CD2-CB 4.14Å; L118-I139 HydrophobicContact CD2-CD1 3.86Å; L118-I139 HydrophobicContact CD2-CG2 4.07Å; L118-I139 HydrophobicContact CG-CB 4.08Å; L118-I139 HydrophobicContact CG-CD1 3.73Å; L118-I139 HydrophobicContact CG-CG1 4.38Å; L118-I139 WeakPolarHBondContact O-CB 3.4Å; L118-I139 PolarHBondContact O-N 2.88Å; Y120-I139 HydrophobicContact CD1-CD1 3.83Å; Y120-I139 HydrophobicContact CD1-CG1 3.49Å; Y120-I139 VanDerWaalsContact CD1-CG1 3.49Å; Y120-I139 HydrophobicContact CE1-CG1 4.18Å; Y120-I139 HydrophobicContact CG-CD1 4.12Å; Y120-I139 HydrophobicContact CG-CG1 4.28Å; T137-I139 PolarHBondContact O-N 2.78Å; I139-R165 HydrophobicContact CG2-CB 4Å; I139-R165 HydrophobicContact CG2-CG 4.47Å; I139-V167 HydrophobicContact CD1-CG1 4.37Å; I139-V167 HydrophobicContact CD1-CG2 3.45Å; I139-V167 VanDerWaalsContact CD1-CG2 3.45Å; I139-V167 HydrophobicContact CG1-CG2 4.02Å; I139-V167 HydrophobicContact CG2-CG2 4.06Å; I139-L177 HydrophobicContact CD1-CD2 4.29Å
140	D	94.1	Very high	85.4	Confident	64 Å²	64	69.4 Å²	69.4	34%	0.342	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	169.2	-178.4	-155.8	2.3	0	0	0	112.3	L118 I142 R165	L118-D140 PolarHBondContact N-O 2.99Å; L118-D140 PolarHBondContact O-N 3.03Å; D140-I142 HydrophobicContact CB-CD1 4.15Å; D140-R165 HydrophobicContact CB-CG 4.47Å; D140-R165 IonicContact OD2-CZ 2.77Å; D140-R165 IonicContact OD2-NE 2.69Å; D140-R165 PolarHBondContact OD2-NE 2.9Å; D140-R165 IonicContact OD2-NH2 3.82Å
141	T	92.8	Very high	85.2	Confident	50 Å²	50	68.2 Å²	68.2	31%	0.307	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121.8	161.9	-66.4	0	0	0	0	109	T115 N117 K138	T115-T141 HydrophobicContact CG2-CG2 4.02Å; N117-T141 PolarHBondContact OD1-OG1 3.43Å; K138-T141 VanDerWaalsContact CE-OG1 3.24Å; K138-T141 WeakPolarHBondContact CE-OG1 3.25Å; K138-T141 PolarHBondContact NZ-OG1 2.78Å
142	I	93	Very high	84.8	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	124.2	-177.7	-48.1	-57.9	0	0	0	108.7	L95 F97 T115 F116 L118 D140 E163 R165	L95-I142 HydrophobicContact CD1-CD1 4.47Å; L95-I142 HydrophobicContact CD1-CG1 4.13Å; F97-I142 HydrophobicContact CE1-CG2 3.72Å; F97-I142 HydrophobicContact CZ-CG2 3.73Å; T115-I142 CarbonylContact C-O 3.25Å; T115-I142 WeakPolarHBondContact CA-O 3.4Å; T115-I142 WeakPolarHBondContact CB-O 3.38Å; F116-I142 HydrophobicContact CD1-CB 3.96Å; F116-I142 HydrophobicContact CD1-CG2 4.33Å; F116-I142 HydrophobicContact CD2-CB 4.38Å; F116-I142 HydrophobicContact CD2-CG1 4.48Å; F116-I142 HydrophobicContact CE1-CB 3.51Å; F116-I142 HydrophobicContact CE1-CG1 4.38Å; F116-I142 HydrophobicContact CE1-CG2 3.45Å; F116-I142 VanDerWaalsContact CE1-CG2 3.45Å; F116-I142 HydrophobicContact CE2-CB 3.96Å; F116-I142 HydrophobicContact CE2-CG1 3.94Å; F116-I142 HydrophobicContact CE2-CG2 4.36Å; F116-I142 HydrophobicContact CG-CB 4.39Å; F116-I142 HydrophobicContact CZ-CB 3.53Å; F116-I142 HydrophobicContact CZ-CG1 3.91Å; F116-I142 HydrophobicContact CZ-CG2 3.48Å; F116-I142 VanDerWaalsContact CZ-CG2 3.48Å; F116-I142 PolarHBondContact N-O 3.13Å; F116-I142 PolarHBondContact O-N 3.14Å; L118-I142 HydrophobicContact CB-CD1 4.32Å; L118-I142 HydrophobicContact CB-CG1 4.07Å; D140-I142 HydrophobicContact CB-CD1 4.15Å; I142-E163 HydrophobicContact CG2-CB 4.11Å; I142-E163 HydrophobicContact CG2-CG 3.9Å; I142-R165 HydrophobicContact CD1-CG 3.93Å
143	A	89.4	Confident	83.9	Confident	46 Å²	46	66.2 Å²	66.2	38%	0.38	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	158.2	172.7	0	0	0	0	0	109.4	T115	T115-A143 HydrophobicContact CG2-CB 3.94Å
144	A	84	Confident	83.1	Confident	27 Å²	27	66.9 Å²	66.9	22%	0.223	38%	0.38	C	S	.	.			trans	-84.8	141.2	172	0	0	0	0	0	110.8	F97 L99	F97-A144 HydrophobicContact CE2-CB 3.97Å; F97-A144 HydrophobicContact CZ-CB 4.4Å; L99-A144 HydrophobicContact CB-CB 3.8Å; L99-A144 HydrophobicContact CD1-CB 4.4Å; L99-A144 HydrophobicContact CD2-CB 4.35Å; L99-A144 HydrophobicContact CG-CB 4.4Å
145	D	75.9	Confident	82.3	Confident	134 Å²	134	67.1 Å²	67.1	72%	0.717	37%	0.373	S	S	*	.	S	Bend	trans	-72.9	-39.3	166.6	-74.6	-24.3	0	0	0	110.6	N161	D145-N161 PolarHBondContact N-OD1 3.47Å
146	E	79.9	Confident	81.4	Confident	103 Å²	103	74 Å²	74	48%	0.481	40%	0.395	S	S	.	.	S	Bend	trans	-129	121.9	176.3	-65.2	-170.2	-172.6	0	0	110.4	K159 N161	E146-K159 HydrophobicContact CB-CB 3.99Å; E146-K159 HydrophobicContact CB-CG 4.29Å; E146-K159 VanDerWaalsContact OE2-CD 3.27Å; E146-K159 WeakPolarHBondContact OE2-CD 3.33Å; E146-K159 WeakPolarHBondContact OE2-CE 3.22Å; E146-K159 IonicContact OE2-NZ 3.48Å; E146-K159 PolarHBondContact OE2-NZ 2.92Å; E146-N161 PolarHBondContact N-OD1 3.05Å; E146-N161 PolarHBondContact O-ND2 2.84Å; E146-N161 PolarHBondContact O-OD1 3.5Å
147	S	82.6	Confident	80.3	Confident	43 Å²	43	77 Å²	77	30%	0.301	41%	0.411	S	S	.	.			trans	-98.2	153.2	168.4	56.7	0	0	0	0	110.6	L99	L99-S147 VanDerWaalsContact O-CA 3.24Å; L99-S147 WeakPolarHBondContact O-CA 3.41Å; L99-S147 WeakPolarHBondContact O-CB 3.41Å
148	F	78.7	Confident	79.3	Confident	19 Å²	19	78.3 Å²	78.3	8%	0.083	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-101.3	144.6	176.3	66.3	-90.5	0	0	0	111.5	L99 R100 D101 D152 L153 K159	L99-F148 VanDerWaalsContact C-CE1 3.4Å; L99-F148 WeakPolarHBondContact O-CD1 3.43Å; L99-F148 WeakPolarHBondContact O-CE1 3.07Å; L99-F148 PolarHBondContact O-N 2.86Å; R100-F148 HydrophobicContact CB-CD2 4.35Å; R100-F148 HydrophobicContact CB-CE1 3.99Å; R100-F148 HydrophobicContact CB-CE2 3.74Å; R100-F148 HydrophobicContact CB-CZ 3.55Å; R100-F148 HydrophobicContact CG-CD2 4.15Å; R100-F148 HydrophobicContact CG-CE2 3.72Å; R100-F148 HydrophobicContact CG-CZ 4.08Å; D101-F148 PolarHBondContact N-O 3.24Å; F148-D152 HydrophobicContact CB-CB 4.15Å; F148-L153 HydrophobicContact CD2-CD1 3.94Å; F148-L153 HydrophobicContact CD2-CG 4.1Å; F148-L153 HydrophobicContact CE2-CD1 3.83Å; F148-L153 HydrophobicContact CE2-CG 4.13Å; F148-K159 HydrophobicContact CB-CB 4.39Å; F148-K159 HydrophobicContact CB-CG 4.11Å
149	T	81.4	Confident	78.7	Confident	32 Å²	32	76.4 Å²	76.4	20%	0.196	41%	0.406	C	S	.	.			trans	-108.4	178.7	-177.8	71.8	0	0	0	0	111.9	D101 M151 D152 L153	D101-T149 HydrophobicContact CB-CG2 4.23Å; T149-M151 PolarHBondContact O-N 3.03Å; T149-M151 PolarHBondContact OG1-N 3.16Å; T149-D152 WeakPolarHBondContact CB-OD2 3.45Å; T149-D152 PolarHBondContact N-OD2 2.99Å; T149-D152 PolarHBondContact O-N 2.91Å; T149-D152 PolarHBondContact OG1-OD2 2.79Å; T149-L153 PolarHBondContact O-N 2.82Å; T149-L153 VanDerWaalsContact O-N 3.12Å
150	Q	72.1	Confident	78.3	Confident	128 Å²	128	78.7 Å²	78.7	60%	0.598	42%	0.419	S	S	*	.	H	α-helix	trans	-66.7	-24.8	176.7	-169.9	160.4	3.7	0	0	113.2	G154	Q150-G154 PolarHBondContact O-N 3.4Å
151	M	69.8	Low	78.1	Confident	150 Å²	150	76 Å²	76	74%	0.739	40%	0.404	S	S	*	.	H	α-helix	trans	-70.3	-43.4	172.6	-67	-173.6	-66.6	0	0	110.9	T149 L153 G154 D155	T149-M151 PolarHBondContact O-N 3.03Å; T149-M151 PolarHBondContact OG1-N 3.16Å; M151-L153 VanDerWaalsContact C-N 3.31Å; M151-L153 PolarHBondContact O-N 2.92Å; M151-G154 WeakPolarHBondContact O-CA 3.43Å; M151-G154 PolarHBondContact O-N 2.88Å; M151-D155 PolarHBondContact O-N 3.2Å; M151-D155 VanDerWaalsContact O-N 3.13Å
152	D	73.4	Confident	78.1	Confident	34 Å²	34	76.6 Å²	76.6	18%	0.182	41%	0.408	C	S	.	.	H	α-helix	trans	-64.4	-36.2	178.6	-55.5	-62.4	0	0	0	112.1	F148 T149 G154 D155 R156 I157	F148-D152 HydrophobicContact CB-CB 4.15Å; T149-D152 WeakPolarHBondContact CB-OD2 3.45Å; T149-D152 PolarHBondContact N-OD2 2.99Å; T149-D152 PolarHBondContact O-N 2.91Å; T149-D152 PolarHBondContact OG1-OD2 2.79Å; D152-G154 VanDerWaalsContact C-N 3.3Å; D152-G154 PolarHBondContact O-N 2.65Å; D152-D155 CarbonylContact O-C 3.58Å; D152-D155 PolarHBondContact O-N 3.29Å; D152-R156 PolarHBondContact O-N 2.03Å; D152-I157 HydrophobicContact CB-CB 4.39Å; D152-I157 WeakPolarHBondContact CB-O 3.25Å; D152-I157 PolarHBondContact O-N 3.25Å
153	L	67.8	Low	78.1	Confident	80 Å²	80	77.9 Å²	77.9	42%	0.419	41%	0.414	S	S	.	.	H	α-helix	trans	-60.8	-36.7	170.3	-90	146.1	0	0	0	112.6	F148 T149 M151 D155 R156	F148-L153 HydrophobicContact CD2-CD1 3.94Å; F148-L153 HydrophobicContact CD2-CG 4.1Å; F148-L153 HydrophobicContact CE2-CD1 3.83Å; F148-L153 HydrophobicContact CE2-CG 4.13Å; T149-L153 PolarHBondContact O-N 2.82Å; T149-L153 VanDerWaalsContact O-N 3.12Å; M151-L153 VanDerWaalsContact C-N 3.31Å; M151-L153 PolarHBondContact O-N 2.92Å; L153-D155 VanDerWaalsContact C-N 3.35Å; L153-R156 PolarHBondContact O-N 3.17Å
154	G	65.9	Low	78.4	Confident	62 Å²	62	78.6 Å²	78.6	64%	0.639	41%	0.413	S	S	*	.	H	α-helix	trans	-65.7	-37.4	175.5	0	0	0	0	0	112.8	Q150 M151 D152 R156	Q150-G154 PolarHBondContact O-N 3.4Å; M151-G154 WeakPolarHBondContact O-CA 3.43Å; M151-G154 PolarHBondContact O-N 2.88Å; D152-G154 VanDerWaalsContact C-N 3.3Å; D152-G154 PolarHBondContact O-N 2.65Å; G154-R156 VanDerWaalsContact C-N 3.34Å
155	D	68	Low	78.8	Confident	118 Å²	118	80 Å²	80	63%	0.631	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	1.2	178	-68	-24.8	0	0	0	113.6	M151 D152 L153 I157	M151-D155 PolarHBondContact O-N 3.2Å; M151-D155 VanDerWaalsContact O-N 3.13Å; D152-D155 CarbonylContact O-C 3.58Å; D152-D155 PolarHBondContact O-N 3.29Å; L153-D155 VanDerWaalsContact C-N 3.35Å; D155-I157 HydrophobicContact CB-CD1 3.81Å; D155-I157 HydrophobicContact CB-CG1 3.92Å; D155-I157 PolarHBondContact O-N 3.47Å
156	R	69.4	Low	79.6	Confident	228 Å²	228	78.3 Å²	78.3	86%	0.86	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	31.6	-174.9	-56	-178.5	176	-171.5	-2	113.8	D152 L153 G154	D152-R156 PolarHBondContact O-N 2.03Å; L153-R156 PolarHBondContact O-N 3.17Å; G154-R156 VanDerWaalsContact C-N 3.34Å
157	I	68.4	Low	80.1	Confident	79 Å²	79	73.8 Å²	73.8	41%	0.405	38%	0.38	S	S	.	.			trans	-95.3	108.3	178.3	-58.8	174.6	0	0	0	108	D152 D155 K159	D152-I157 HydrophobicContact CB-CB 4.39Å; D152-I157 WeakPolarHBondContact CB-O 3.25Å; D152-I157 PolarHBondContact O-N 3.25Å; D155-I157 HydrophobicContact CB-CD1 3.81Å; D155-I157 HydrophobicContact CB-CG1 3.92Å; D155-I157 PolarHBondContact O-N 3.47Å; I157-K159 HydrophobicContact CG2-CD 4.14Å
158	L	71.6	Confident	80.2	Confident	106 Å²	106	73.2 Å²	73.2	56%	0.555	38%	0.381	S	S	*	.			trans	-94.3	130.5	169.5	-66.6	174.4	0	0	0	109.4	T98	T98-L158 HydrophobicContact CG2-CB 4.38Å
159	K	80.6	Confident	80.7	Confident	62 Å²	62	76.2 Å²	76.2	27%	0.27	40%	0.403	S	S	.	.			trans	-90.6	103.6	177.4	-61.1	-54.9	-158.6	139.4	0	110	E146 F148 I157 N161	E146-K159 HydrophobicContact CB-CB 3.99Å; E146-K159 HydrophobicContact CB-CG 4.29Å; E146-K159 VanDerWaalsContact OE2-CD 3.27Å; E146-K159 WeakPolarHBondContact OE2-CD 3.33Å; E146-K159 WeakPolarHBondContact OE2-CE 3.22Å; E146-K159 IonicContact OE2-NZ 3.48Å; E146-K159 PolarHBondContact OE2-NZ 2.92Å; F148-K159 HydrophobicContact CB-CB 4.39Å; F148-K159 HydrophobicContact CB-CG 4.11Å; I157-K159 HydrophobicContact CG2-CD 4.14Å; K159-N161 PolarHBondContact O-ND2 3.38Å
160	L	86.4	Confident	81.1	Confident	88 Å²	88	75 Å²	75	46%	0.461	39%	0.394	S	S	.	.			trans	-88.5	115.3	-179.6	-172.5	68.7	0	0	0	110.5	R96 T98 V189	R96-L160 HydrophobicContact CB-CD1 4.06Å; R96-L160 HydrophobicContact CB-CG 4.38Å; T98-L160 HydrophobicContact CG2-CD1 4.15Å; L160-V189 HydrophobicContact CD1-CB 3.93Å; L160-V189 HydrophobicContact CD1-CG1 4.2Å; L160-V189 HydrophobicContact CD1-CG2 3.71Å
161	N	88.9	Confident	81.9	Confident	6 Å²	6	73.5 Å²	73.5	3%	0.032	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	148.5	176.9	-63	-88.3	0	0	0	110.1	R96 F97 D145 E146 K159	R96-N161 WeakPolarHBondContact CA-O 3.42Å; F97-N161 HydrophobicContact CD1-CB 4.22Å; F97-N161 HydrophobicContact CD2-CB 4.38Å; F97-N161 HydrophobicContact CE1-CB 3.84Å; F97-N161 HydrophobicContact CE2-CB 4.02Å; F97-N161 HydrophobicContact CG-CB 4.47Å; F97-N161 HydrophobicContact CZ-CB 3.72Å; F97-N161 PolarHBondContact N-O 2.83Å; F97-N161 VanDerWaalsContact N-O 3.09Å; F97-N161 WeakPolarHBondContact O-CB 3.12Å; F97-N161 PolarHBondContact O-N 2.76Å; F97-N161 PolarHBondContact O-ND2 2.83Å; D145-N161 PolarHBondContact N-OD1 3.47Å; E146-N161 PolarHBondContact N-OD1 3.05Å; E146-N161 PolarHBondContact O-ND2 2.84Å; E146-N161 PolarHBondContact O-OD1 3.5Å; K159-N161 PolarHBondContact O-ND2 3.38Å
162	T	92.6	Very high	83	Confident	64 Å²	64	70.1 Å²	70.1	39%	0.393	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	114.4	174.8	-58.3	0	0	0	0	110.6	E94 L95 R96	E94-T162 HydrophobicContact CG-CG2 4.1Å; L95-T162 CarbonylContact O-C 3.58Å; L95-T162 VanDerWaalsContact O-CA 3.28Å; L95-T162 WeakPolarHBondContact O-CA 3.25Å; R96-T162 HydrophobicContact CG-CG2 4.19Å
163	E	93.8	Very high	83.9	Confident	27 Å²	27	75.4 Å²	75.4	13%	0.126	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.6	-178.3	-76	-64.9	126.9	0	0	110.8	E94 L95 F97 I142 R165	E94-E163 CarbonylContact C-O 3.56Å; E94-E163 WeakPolarHBondContact CA-O 3.23Å; L95-E163 PolarHBondContact N-O 3.2Å; L95-E163 PolarHBondContact O-N 3.32Å; F97-E163 HydrophobicContact CE1-CB 4.19Å; F97-E163 HydrophobicContact CE1-CG 3.85Å; F97-E163 HydrophobicContact CZ-CG 4.27Å; I142-E163 HydrophobicContact CG2-CB 4.11Å; I142-E163 HydrophobicContact CG2-CG 3.9Å; E163-R165 IonicContact OE2-CZ 3.27Å; E163-R165 IonicContact OE2-NH1 3.4Å; E163-R165 PolarHBondContact OE2-NH1 3.07Å; E163-R165 IonicContact OE2-NH2 2.92Å; E163-R165 PolarHBondContact OE2-NH2 2.87Å
164	V	94.4	Very high	85.1	Confident	61 Å²	61	71.6 Å²	71.6	37%	0.37	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.5	177	-175.3	0	0	0	0	110	Y92 V93 E94	Y92-V164 HydrophobicContact CD1-CG1 4.36Å; V93-V164 CarbonylContact O-C 3.59Å; V93-V164 WeakPolarHBondContact O-CA 3.38Å; E94-V164 HydrophobicContact CB-CG2 4.11Å; E94-V164 HydrophobicContact CG-CG2 4.12Å
165	R	94.4	Very high	86.5	Confident	55 Å²	55	68.6 Å²	68.6	21%	0.208	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.8	174.5	-66.4	-63.4	177.6	-77.6	-5	111.9	Y92 V93 L118 I139 D140 I142 E163	Y92-R165 WeakPolarHBondContact CA-O 3.04Å; V93-R165 PolarHBondContact N-O 2.64Å; V93-R165 PolarHBondContact O-N 3.09Å; L118-R165 HydrophobicContact CD2-CB 4.19Å; L118-R165 HydrophobicContact CD2-CG 4.36Å; I139-R165 HydrophobicContact CG2-CB 4Å; I139-R165 HydrophobicContact CG2-CG 4.47Å; D140-R165 HydrophobicContact CB-CG 4.47Å; D140-R165 IonicContact OD2-CZ 2.77Å; D140-R165 IonicContact OD2-NE 2.69Å; D140-R165 PolarHBondContact OD2-NE 2.9Å; D140-R165 IonicContact OD2-NH2 3.82Å; I142-R165 HydrophobicContact CD1-CG 3.93Å; E163-R165 IonicContact OE2-CZ 3.27Å; E163-R165 IonicContact OE2-NH1 3.4Å; E163-R165 PolarHBondContact OE2-NH1 3.07Å; E163-R165 IonicContact OE2-NH2 2.92Å; E163-R165 PolarHBondContact OE2-NH2 2.87Å
166	E	91.5	Very high	87.7	Confident	100 Å²	100	63.3 Å²	63.3	47%	0.467	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.1	177.8	-56.2	-170.1	-178.7	0	0	110.6	K90 Y92	K90-E166 HydrophobicContact CD-CB 4.43Å; K90-E166 WeakPolarHBondContact CE-OE2 3.38Å; K90-E166 IonicContact NZ-OE2 2.8Å; K90-E166 PolarHBondContact NZ-OE2 2.86Å; Y92-E166 HydrophobicContact CD1-CG 3.76Å; Y92-E166 HydrophobicContact CE1-CG 3.6Å; Y92-E166 WeakPolarHBondContact CE1-OE1 3.49Å
167	V	90.7	Very high	89	Confident	7 Å²	7	52.5 Å²	52.5	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	129.3	179.3	-168.5	0	0	0	0	109.6	K90 I91 V93 Y120 I139 M170	K90-V167 WeakPolarHBondContact CA-O 3.45Å; I91-V167 HydrophobicContact CD1-CB 4.07Å; I91-V167 HydrophobicContact CG1-CB 3.67Å; I91-V167 HydrophobicContact CG1-CG2 4.33Å; I91-V167 WeakPolarHBondContact CG1-O 3.44Å; I91-V167 PolarHBondContact N-O 2.85Å; I91-V167 PolarHBondContact O-N 2.84Å; V93-V167 HydrophobicContact CG2-CG2 4.19Å; Y120-V167 HydrophobicContact CD1-CG1 3.87Å; Y120-V167 HydrophobicContact CD2-CG1 3.77Å; Y120-V167 HydrophobicContact CE1-CG1 3.8Å; Y120-V167 HydrophobicContact CE2-CG1 3.7Å; Y120-V167 HydrophobicContact CG-CG1 3.86Å; I139-V167 HydrophobicContact CD1-CG1 4.37Å; I139-V167 HydrophobicContact CD1-CG2 3.45Å; I139-V167 VanDerWaalsContact CD1-CG2 3.45Å; I139-V167 HydrophobicContact CG1-CG2 4.02Å; I139-V167 HydrophobicContact CG2-CG2 4.06Å; V167-M170 HydrophobicContact CG1-SD 4.1Å
168	G	84.5	Confident	90.3	Very high	32 Å²	32	48.7 Å²	48.7	33%	0.33	26%	0.258	S	S	.	.			trans	160.7	171.9	177.6	0	0	0	0	0	112.1
169	P	88.6	Confident	91.5	Very high	82 Å²	82	43.7 Å²	43.7	53%	0.532	23%	0.231	S	C	.	.			cis	-71.5	129.4	4.2	26.4	-33.4	0	0	0	113.5	Q89 V215	Q89-P169 CarbonylContact O-C 3.49Å; Q89-P169 WeakPolarHBondContact O-CA 3.26Å; P169-V215 HydrophobicContact CB-CB 4.2Å; P169-V215 HydrophobicContact CB-CG1 3.83Å; P169-V215 HydrophobicContact CB-CG2 3.82Å; P169-V215 HydrophobicContact CG-CG1 4.41Å
170	M	89.9	Confident	92.3	Very high	5 Å²	5	42 Å²	42	3%	0.025	23%	0.225	C	C	.	.			trans	-82.1	127.2	173.4	-55.7	-60	-72.4	0	0	109.8	R85 Q89 I91 Y120 E122 V167 F175	R85-M170 PolarHBondContact NH1-O 2.79Å; Q89-M170 PolarHBondContact O-N 2.79Å; I91-M170 HydrophobicContact CD1-CE 4.11Å; I91-M170 HydrophobicContact CD1-SD 4.23Å; I91-M170 HydrophobicContact CG1-CG 4.42Å; I91-M170 HydrophobicContact CG1-SD 4.37Å; I91-M170 HydrophobicContact CG2-CG 4.27Å; Y120-M170 HydrophobicContact CD2-CE 4.37Å; Y120-M170 HydrophobicContact CD2-SD 4.46Å; Y120-M170 HydrophobicContact CE2-SD 4.17Å; E122-M170 HydrophobicContact CG-CE 3.66Å; E122-M170 HydrophobicContact CG-SD 4.35Å; V167-M170 HydrophobicContact CG1-SD 4.1Å; M170-F175 HydrophobicContact CE-CB 3.65Å; M170-F175 HydrophobicContact CE-CD1 3.39Å; M170-F175 HydrophobicContact CE-CD2 4.29Å; M170-F175 HydrophobicContact CE-CE1 4.12Å; M170-F175 HydrophobicContact CE-CG 3.51Å
171	T	89.9	Confident	92.7	Very high	98 Å²	98	37.9 Å²	37.9	60%	0.601	20%	0.203	S	C	*	.			trans	-115.4	-33.7	-172.7	58.3	0	0	0	0	113.2	E122	E122-T171 PolarHBondContact OE2-N 3.47Å; E122-T171 PolarHBondContact OE2-OG1 3.28Å
172	K	92.5	Very high	92.8	Very high	79 Å²	79	40.3 Å²	40.3	34%	0.343	22%	0.215	S	C	.	.	S	Bend	trans	-88	171.9	-177.8	-60.3	-163.4	-167	166.7	0	113.2	R85 E122 D124 G174	R85-K172 WeakPolarHBondContact CD-O 3.45Å; R85-K172 PolarHBondContact NE-O 3.23Å; R85-K172 VanDerWaalsContact NE-O 3.12Å; E122-K172 HydrophobicContact CB-CB 4.11Å; E122-K172 HydrophobicContact CB-CD 4Å; E122-K172 HydrophobicContact CB-CG 4.06Å; E122-K172 WeakPolarHBondContact O-CD 3.48Å; E122-K172 PolarHBondContact O-NZ 3.03Å; E122-K172 PolarHBondContact OE2-N 3.17Å; D124-K172 WeakPolarHBondContact OD1-CA 2.99Å; D124-K172 WeakPolarHBondContact OD1-CB 3.16Å; K172-G174 VanDerWaalsContact C-N 3.26Å; K172-G174 PolarHBondContact O-N 2.8Å
173	K	92.5	Very high	92.7	Very high	144 Å²	144	37.3 Å²	37.3	63%	0.626	20%	0.197	S	C	*	.	S	Bend	trans	-66	-22.9	-177.1	-66.1	179.1	-179.6	176.6	0	114.8	W82 R85 D124	W82-K173 HydrophobicContact CZ2-CB 4.29Å; R85-K173 PolarHBondContact N-O 3.34Å; D124-K173 HydrophobicContact CB-CD 4.5Å; D124-K173 PolarHBondContact OD1-N 2.89Å
174	G	93.2	Very high	92.6	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	-172.7	177.2	0	0	0	0	0	112.9	I83 M123 K172	I83-G174 CarbonylContact O-C 3.44Å; I83-G174 WeakPolarHBondContact O-CA 3.11Å; M123-G174 PolarHBondContact N-O 2.74Å; M123-G174 CarbonylContact O-C 3.53Å; M123-G174 VanDerWaalsContact O-C 3.32Å; M123-G174 PolarHBondContact O-N 3.15Å; M123-G174 VanDerWaalsContact O-N 3.1Å; K172-G174 VanDerWaalsContact C-N 3.26Å; K172-G174 PolarHBondContact O-N 2.8Å
175	F	94.6	Very high	92.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	163.9	-173.2	59.5	-81.2	0	0	0	112.2	L28 I83 R85 I91 Q121 E122 M170 L177 V193	L28-F175 HydrophobicContact CD1-CE1 4.3Å; L28-F175 HydrophobicContact CD1-CZ 4.32Å; I83-F175 HydrophobicContact CB-CD2 4.43Å; I83-F175 HydrophobicContact CB-CE1 4.13Å; I83-F175 HydrophobicContact CB-CE2 4.02Å; I83-F175 HydrophobicContact CB-CZ 3.85Å; I83-F175 HydrophobicContact CD1-CD2 4.38Å; I83-F175 HydrophobicContact CD1-CE2 3.76Å; I83-F175 HydrophobicContact CD1-CZ 4.23Å; I83-F175 HydrophobicContact CG1-CE2 4.47Å; I83-F175 HydrophobicContact CG2-CE1 3.96Å; I83-F175 HydrophobicContact CG2-CE2 4.21Å; I83-F175 HydrophobicContact CG2-CZ 3.61Å; I83-F175 PolarHBondContact N-O 2.81Å; I83-F175 PolarHBondContact O-N 3.47Å; R85-F175 HydrophobicContact CB-CD1 4.33Å; R85-F175 HydrophobicContact CB-CE1 4.24Å; I91-F175 HydrophobicContact CD1-CD1 4.36Å; I91-F175 HydrophobicContact CD1-CD2 3.92Å; I91-F175 HydrophobicContact CD1-CE1 3.84Å; I91-F175 HydrophobicContact CD1-CE2 3.31Å; I91-F175 HydrophobicContact CD1-CG 4.41Å; I91-F175 HydrophobicContact CD1-CZ 3.28Å; I91-F175 HydrophobicContact CG2-CE1 4.25Å; I91-F175 HydrophobicContact CG2-CZ 4.27Å; Q121-F175 CarbonylContact O-C 3.56Å; Q121-F175 WeakPolarHBondContact O-CA 3.4Å; Q121-F175 WeakPolarHBondContact O-CB 3.01Å; E122-F175 HydrophobicContact CG-CB 4.43Å; M170-F175 HydrophobicContact CE-CB 3.65Å; M170-F175 HydrophobicContact CE-CD1 3.39Å; M170-F175 HydrophobicContact CE-CD2 4.29Å; M170-F175 HydrophobicContact CE-CE1 4.12Å; M170-F175 HydrophobicContact CE-CG 3.51Å; F175-L177 HydrophobicContact CD2-CD2 4.25Å; F175-L177 HydrophobicContact CD2-CG 4.33Å; F175-L177 HydrophobicContact CE2-CD2 4.21Å; F175-L177 HydrophobicContact CE2-CG 4.14Å; F175-V193 HydrophobicContact CE2-CG1 4.21Å; F175-V193 HydrophobicContact CZ-CG1 3.86Å
176	Y	94.3	Very high	92.6	Very high	7 Å²	7	31.5 Å²	31.5	3%	0.027	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	144.1	168.1	-65.1	-86.5	0	0	0	109.4	S80 W82 Y120 Q121 M123 A126	S80-Y176 WeakPolarHBondContact O-CD1 3.26Å; W82-Y176 HydrophobicContact CB-CD1 4.41Å; W82-Y176 HydrophobicContact CB-CE1 3.68Å; W82-Y176 HydrophobicContact CB-CE2 4.35Å; W82-Y176 AromaticContact CD1-CE2 3.7Å; W82-Y176 AromaticContact CD1-CZ 3.83Å; W82-Y176 HydrophobicContact CG-CE2 4.43Å; W82-Y176 VanDerWaalsContact N-CE1 3.27Å; Y120-Y176 CarbonylContact C-O 3.51Å; Y120-Y176 WeakPolarHBondContact CA-O 3.3Å; Q121-Y176 PolarHBondContact N-O 3.34Å; Q121-Y176 PolarHBondContact O-N 2.68Å; M123-Y176 HydrophobicContact CB-CE2 4.23Å; M123-Y176 HydrophobicContact CG-CD2 4.16Å; M123-Y176 HydrophobicContact CG-CE2 4.05Å; A126-Y176 PolarHBondContact O-OH 2.9Å
177	L	95.9	Very high	92.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	147.1	163.7	-66	179.4	0	0	0	109.5	R79 S80 I83 V93 F119 I139 F175 F179 V191 V193	R79-L177 WeakPolarHBondContact CA-O 2.92Å; R79-L177 WeakPolarHBondContact CG-O 3.46Å; S80-L177 PolarHBondContact N-O 2.79Å; S80-L177 PolarHBondContact OG-N 2.85Å; S80-L177 PolarHBondContact OG-O 3.17Å; I83-L177 HydrophobicContact CD1-CD1 4.22Å; I83-L177 HydrophobicContact CD1-CG 4.22Å; V93-L177 HydrophobicContact CG1-CD1 3.88Å; V93-L177 HydrophobicContact CG2-CD1 4.02Å; V93-L177 HydrophobicContact CG2-CD2 4.11Å; F119-L177 WeakPolarHBondContact O-CA 3.5Å; I139-L177 HydrophobicContact CD1-CD2 4.29Å; F175-L177 HydrophobicContact CD2-CD2 4.25Å; F175-L177 HydrophobicContact CD2-CG 4.33Å; F175-L177 HydrophobicContact CE2-CD2 4.21Å; F175-L177 HydrophobicContact CE2-CG 4.14Å; L177-F179 HydrophobicContact CB-CE2 4.36Å; L177-V191 HydrophobicContact CD1-CG1 4.31Å; L177-V193 HydrophobicContact CD1-CG2 3.53Å
178	A	95.7	Very high	92.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	148.7	171.3	0	0	0	0	0	111.6	W77 L78 R79 F119 Y136	W77-A178 HydrophobicContact CE3-CB 4.01Å; W77-A178 HydrophobicContact CZ3-CB 4.24Å; L78-A178 CarbonylContact O-C 3.47Å; L78-A178 WeakPolarHBondContact O-CA 3.33Å; R79-A178 HydrophobicContact CB-CB 4.39Å; R79-A178 HydrophobicContact CG-CB 4.32Å; F119-A178 HydrophobicContact CB-CB 4.19Å; F119-A178 PolarHBondContact N-O 3.16Å; F119-A178 PolarHBondContact O-N 2.96Å; Y136-A178 HydrophobicContact CD1-CB 3.61Å; Y136-A178 HydrophobicContact CE1-CB 3.57Å
179	F	97.2	Very high	93	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.1	-178.2	-53.8	-91.5	0	0	0	107.1	W40 W48 W77 L78 L95 F116 N117 L118 L177 L188 V191	W40-F179 HydrophobicContact CE3-CE2 4.42Å; W40-F179 AromaticContact CH2-CE2 3.94Å; W40-F179 HydrophobicContact CH2-CE2 3.94Å; W40-F179 HydrophobicContact CH2-CZ 4.44Å; W40-F179 HydrophobicContact CZ3-CD2 4.1Å; W40-F179 AromaticContact CZ3-CE2 3.49Å; W40-F179 HydrophobicContact CZ3-CE2 3.49Å; W40-F179 VanDerWaalsContact CZ3-CE2 3.49Å; W40-F179 HydrophobicContact CZ3-CZ 4.29Å; W48-F179 HydrophobicContact CZ2-CB 4.41Å; W77-F179 CarbonylContact C-O 3.42Å; W77-F179 VanDerWaalsContact CA-O 3.27Å; W77-F179 WeakPolarHBondContact CA-O 3.36Å; L78-F179 HydrophobicContact CB-CB 4.27Å; L78-F179 HydrophobicContact CB-CD2 4.46Å; L78-F179 HydrophobicContact CD2-CD2 4.2Å; L78-F179 HydrophobicContact CG-CD2 4.28Å; L78-F179 PolarHBondContact N-O 2.84Å; L78-F179 PolarHBondContact O-N 3.08Å; L95-F179 HydrophobicContact CD1-CE1 4.18Å; L95-F179 HydrophobicContact CD2-CE1 3.6Å; L95-F179 HydrophobicContact CD2-CZ 4.03Å; F116-F179 HydrophobicContact CD2-CD1 4.38Å; F116-F179 AromaticContact CE2-CD1 3.95Å; F116-F179 HydrophobicContact CE2-CD1 3.95Å; N117-F179 CarbonylContact O-C 3.52Å; N117-F179 WeakPolarHBondContact O-CA 3.45Å; L118-F179 HydrophobicContact CD1-CD1 3.85Å; L118-F179 HydrophobicContact CD1-CE1 3.46Å; L118-F179 VanDerWaalsContact CD1-CE1 3.46Å; L118-F179 HydrophobicContact CD1-CZ 3.99Å; L177-F179 HydrophobicContact CB-CE2 4.36Å; F179-L188 HydrophobicContact CD1-CD2 4.06Å; F179-L188 HydrophobicContact CD2-CD2 4.26Å; F179-L188 HydrophobicContact CE1-CD2 3.97Å; F179-L188 HydrophobicContact CE2-CD2 4.21Å; F179-L188 HydrophobicContact CG-CD2 4.21Å; F179-L188 HydrophobicContact CZ-CD2 4.06Å; F179-V191 HydrophobicContact CE1-CG2 4.35Å; F179-V191 HydrophobicContact CE2-CG2 4.43Å; F179-V191 HydrophobicContact CZ-CG1 4.11Å; F179-V191 HydrophobicContact CZ-CG2 3.76Å
180	Q	96.1	Very high	93.1	Very high	28 Å²	28	23.1 Å²	23.1	13%	0.131	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120	179.8	179.5	-162.5	38.3	0	0	109.1	N75 N76 W77 N117 F119 I182	N75-Q180 PolarHBondContact OD1-NE2 2.92Å; N76-Q180 CarbonylContact O-C 3.44Å; N76-Q180 WeakPolarHBondContact O-CA 3.43Å; W77-Q180 HydrophobicContact CD2-CB 4.02Å; W77-Q180 HydrophobicContact CD2-CG 4.15Å; W77-Q180 HydrophobicContact CE3-CB 4.11Å; W77-Q180 HydrophobicContact CH2-CB 4.27Å; W77-Q180 HydrophobicContact CH2-CG 4.48Å; W77-Q180 HydrophobicContact CZ2-CB 4.14Å; W77-Q180 HydrophobicContact CZ2-CG 3.89Å; W77-Q180 HydrophobicContact CZ3-CB 4.25Å; N117-Q180 HydrophobicContact CB-CB 4.21Å; N117-Q180 PolarHBondContact N-O 2.82Å; N117-Q180 PolarHBondContact ND2-OE1 2.82Å; N117-Q180 PolarHBondContact O-N 2.93Å; F119-Q180 HydrophobicContact CD2-CB 4.21Å; F119-Q180 HydrophobicContact CE2-CB 3.81Å; Q180-I182 HydrophobicContact CG-CG2 4.22Å
181	D	95.2	Very high	93.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	138	168	162.5	55.5	0	0	0	110.3	W48 V66 N75 N76 G183 A184	W48-D181 HydrophobicContact CZ2-CB 3.69Å; V66-D181 HydrophobicContact CG1-CB 3.69Å; V66-D181 WeakPolarHBondContact CG2-OD2 3.34Å; N75-D181 CarbonylContact C-O 3.54Å; N75-D181 WeakPolarHBondContact CA-O 3.19Å; N76-D181 HydrophobicContact CB-CB 4.14Å; N76-D181 PolarHBondContact N-O 2.7Å; N76-D181 PolarHBondContact ND2-OD2 2.8Å; N76-D181 PolarHBondContact O-N 3.46Å; D181-G183 PolarHBondContact OD1-N 3.48Å; D181-A184 WeakPolarHBondContact OD1-CB 3.28Å; D181-A184 PolarHBondContact OD1-N 2.84Å
182	I	91.4	Very high	93.6	Very high	58 Å²	58	20.1 Å²	20.1	30%	0.297	10%	0.096	S	C	.	.	S	Bend	trans	-123.5	18	-179.9	57.7	163.7	0	0	0	112.2	Q74 K113 Q180	Q74-I182 WeakPolarHBondContact O-CA 3.19Å; K113-I182 HydrophobicContact CB-CG1 4.49Å; K113-I182 HydrophobicContact CG-CD1 4.26Å; K113-I182 HydrophobicContact CG-CG1 4.17Å; Q180-I182 HydrophobicContact CG-CG2 4.22Å
183	G	90.3	Very high	93.7	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.08	C	C	.	.	S	Bend	trans	125.2	30.1	177	0	0	0	0	0	114	C112 K113 D181	C112-G183 CarbonylContact C-O 3.57Å; C112-G183 VanDerWaalsContact CA-O 3.28Å; C112-G183 WeakPolarHBondContact CA-O 3.41Å; K113-G183 PolarHBondContact N-O 2.92Å; D181-G183 PolarHBondContact OD1-N 3.48Å
184	A	92.6	Very high	93.9	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.053	C	C	.	.	B	Isolated β-bridge	trans	-95	159.8	176.2	0	0	0	0	0	112.4	K113 D181 I186	K113-A184 WeakPolarHBondContact O-CA 3.36Å; K113-A184 WeakPolarHBondContact O-CB 3.28Å; D181-A184 WeakPolarHBondContact OD1-CB 3.28Å; D181-A184 PolarHBondContact OD1-N 2.84Å; A184-I186 HydrophobicContact CB-CG2 4.26Å
185	C	92.9	Very high	93.8	Very high	16 Å²	16	11.1 Å²	11.1	11%	0.108	6%	0.056	C	C	.	.			trans	-108.1	95.3	168.5	-166.6	0	0	0	0	108.7	V66 C67 V69 R100 I105	V66-C185 WeakPolarHBondContact O-CA 3.42Å; C67-C185 HydrophobicContact CB-CB 3.95Å; C67-C185 WeakPolarHBondContact CB-SG 3.02Å; C67-C185 WeakPolarHBondContact SG-CB 3.37Å; C67-C185 CovalentContact SG-SG 2.05Å; C67-C185 PolarHBondContact SG-SG 3.31Å; V69-C185 HydrophobicContact CG1-CB 3.78Å; R100-C185 HydrophobicContact CB-CB 3.97Å; R100-C185 PolarHBondContact N-O 3.14Å; I105-C185 HydrophobicContact CD1-CB 4.03Å
186	I	94.6	Very high	93.7	Very high	5 Å²	5	12.7 Å²	12.7	3%	0.026	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142	-168.2	175.4	166.7	0	0	0	111.1	W48 Q65 V66 F97 T98 F116 A184	W48-I186 HydrophobicContact CH2-CG2 3.63Å; W48-I186 HydrophobicContact CZ2-CG2 4.45Å; W48-I186 HydrophobicContact CZ3-CG2 4.09Å; Q65-I186 VanDerWaalsContact CA-O 3.25Å; Q65-I186 WeakPolarHBondContact CA-O 3.4Å; V66-I186 HydrophobicContact CG1-CG2 3.58Å; V66-I186 PolarHBondContact N-O 3.01Å; V66-I186 PolarHBondContact O-N 3.46Å; F97-I186 HydrophobicContact CB-CD1 4.16Å; F97-I186 HydrophobicContact CB-CG1 4.33Å; F97-I186 HydrophobicContact CD2-CD1 3.72Å; F97-I186 HydrophobicContact CD2-CG1 4.21Å; F97-I186 HydrophobicContact CE2-CD1 4.45Å; F97-I186 HydrophobicContact CG-CD1 4.12Å; T98-I186 WeakPolarHBondContact O-CA 3.29Å; F116-I186 HydrophobicContact CB-CD1 4.46Å; F116-I186 HydrophobicContact CD1-CD1 3.15Å; F116-I186 HydrophobicContact CD2-CD1 4.33Å; F116-I186 HydrophobicContact CE1-CD1 3.2Å; F116-I186 HydrophobicContact CE2-CD1 4.38Å; F116-I186 HydrophobicContact CG-CD1 3.74Å; F116-I186 HydrophobicContact CZ-CD1 3.85Å; A184-I186 HydrophobicContact CB-CG2 4.26Å
187	A	92.6	Very high	93.5	Very high	12 Å²	12	14.4 Å²	14.4	10%	0.099	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.1	163.4	0	0	0	0	0	109.9	F64 Q65 F97 T98 V189	F64-A187 CarbonylContact O-C 3.53Å; F64-A187 WeakPolarHBondContact O-CA 3.3Å; Q65-A187 HydrophobicContact CB-CB 3.99Å; F97-A187 CarbonylContact C-O 3.46Å; F97-A187 WeakPolarHBondContact CA-O 3.05Å; F97-A187 VanDerWaalsContact CB-O 3.27Å; F97-A187 WeakPolarHBondContact CB-O 3.45Å; T98-A187 PolarHBondContact N-O 3.35Å; T98-A187 PolarHBondContact O-N 2.03Å; T98-A187 WeakPolarHBondContact OG1-CB 3.44Å; A187-V189 PolarHBondContact O-N 2.82Å
188	L	93.5	Very high	93.3	Very high	3 Å²	3	14.4 Å²	14.4	2%	0.016	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	105.1	174.1	-171.7	62.9	0	0	0	108.7	W40 W48 T63 F64 L78 L95 F97 F179 V191	W40-L188 HydrophobicContact CZ3-CD2 4.41Å; W48-L188 HydrophobicContact CZ3-CB 4.48Å; T63-L188 WeakPolarHBondContact CA-O 3.5Å; F64-L188 HydrophobicContact CB-CB 4.44Å; F64-L188 PolarHBondContact N-O 3.49Å; F64-L188 WeakPolarHBondContact O-CB 3.43Å; F64-L188 PolarHBondContact O-N 2.73Å; L78-L188 HydrophobicContact CD2-CD2 4.21Å; L95-L188 HydrophobicContact CD2-CD1 4.47Å; F97-L188 HydrophobicContact CB-CD1 4.11Å; F179-L188 HydrophobicContact CD1-CD2 4.06Å; F179-L188 HydrophobicContact CD2-CD2 4.26Å; F179-L188 HydrophobicContact CE1-CD2 3.97Å; F179-L188 HydrophobicContact CE2-CD2 4.21Å; F179-L188 HydrophobicContact CG-CD2 4.21Å; F179-L188 HydrophobicContact CZ-CD2 4.06Å; L188-V191 HydrophobicContact CD1-CG2 4.02Å; L188-V191 HydrophobicContact CD2-CG2 3.58Å; L188-V191 HydrophobicContact CG-CG2 3.85Å
189	V	90.4	Very high	93.2	Very high	23 Å²	23	16 Å²	16	14%	0.139	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-42	-172.9	178.8	0	0	0	0	111.6	I61 T63 R96 T98 L160 A187	I61-V189 HydrophobicContact CD1-CG1 3.98Å; T63-V189 HydrophobicContact CG2-CG1 4.48Å; R96-V189 WeakPolarHBondContact O-CA 3.38Å; R96-V189 WeakPolarHBondContact O-CB 3.36Å; R96-V189 PolarHBondContact O-N 2.86Å; T98-V189 HydrophobicContact CG2-CG2 4.25Å; L160-V189 HydrophobicContact CD1-CB 3.93Å; L160-V189 HydrophobicContact CD1-CG1 4.2Å; L160-V189 HydrophobicContact CD1-CG2 3.71Å; A187-V189 PolarHBondContact O-N 2.82Å
190	S	90.9	Very high	93	Very high	7 Å²	7	21.7 Å²	21.7	5%	0.049	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	145.5	175	73.1	0	0	0	0	113.3	T31 R96	T31-S190 WeakPolarHBondContact OG1-CA 3.12Å; R96-S190 VanDerWaalsContact CB-OG 3.27Å; R96-S190 WeakPolarHBondContact CB-OG 3.48Å; R96-S190 WeakPolarHBondContact CD-OG 3.11Å; R96-S190 VanDerWaalsContact CG-OG 3.24Å; R96-S190 WeakPolarHBondContact CG-OG 3.28Å; R96-S190 PolarHBondContact N-O 3.2Å; R96-S190 PolarHBondContact O-N 3.22Å
191	V	94.2	Very high	92.7	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.006	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	118.9	169	-178.7	0	0	0	0	108.5	T31 W40 V93 L95 L177 F179 L188 V193	T31-V191 HydrophobicContact CG2-CB 3.97Å; T31-V191 PolarHBondContact N-O 3.11Å; T31-V191 VanDerWaalsContact N-O 3.1Å; T31-V191 PolarHBondContact OG1-N 2.94Å; W40-V191 HydrophobicContact CH2-CB 3.85Å; W40-V191 HydrophobicContact CH2-CG1 4.16Å; W40-V191 HydrophobicContact CH2-CG2 3.75Å; W40-V191 HydrophobicContact CZ3-CG2 4.22Å; V93-V191 HydrophobicContact CG1-CG1 4.43Å; L95-V191 HydrophobicContact CD2-CB 4.39Å; L95-V191 HydrophobicContact CD2-CG1 4Å; L95-V191 HydrophobicContact CD2-CG2 3.9Å; L177-V191 HydrophobicContact CD1-CG1 4.31Å; F179-V191 HydrophobicContact CE1-CG2 4.35Å; F179-V191 HydrophobicContact CE2-CG2 4.43Å; F179-V191 HydrophobicContact CZ-CG1 4.11Å; F179-V191 HydrophobicContact CZ-CG2 3.76Å; L188-V191 HydrophobicContact CD1-CG2 4.02Å; L188-V191 HydrophobicContact CD2-CG2 3.58Å; L188-V191 HydrophobicContact CG-CG2 3.85Å; V191-V193 HydrophobicContact CG1-CG2 4.21Å
192	R	95.1	Very high	92.5	Very high	39 Å²	39	27 Å²	27	15%	0.147	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.4	177.2	-176.7	176.5	175.8	-101.5	-5.1	109.4	L29 D30 E94 Y194	L29-R192 CarbonylContact O-C 3.57Å; L29-R192 WeakPolarHBondContact O-CA 3.27Å; D30-R192 HydrophobicContact CB-CG 4.38Å; E94-R192 HydrophobicContact CB-CB 4.25Å; E94-R192 PolarHBondContact N-O 2.89Å; E94-R192 PolarHBondContact O-N 2.95Å; E94-R192 IonicContact OE2-NH1 2.82Å; E94-R192 PolarHBondContact OE2-NH1 3Å; R192-Y194 HydrophobicContact CG-CD1 4.28Å
193	V	95.6	Very high	92.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	126.6	178.7	-169.6	0	0	0	0	108.6	L28 L29 I83 I91 Y92 V93 F175 L177 V191	L28-V193 HydrophobicContact CB-CG1 4.45Å; L28-V193 HydrophobicContact CD1-CG1 4.45Å; L28-V193 PolarHBondContact N-O 2.95Å; L29-V193 HydrophobicContact CB-CB 4.04Å; L29-V193 HydrophobicContact CB-CG2 4.1Å; L29-V193 HydrophobicContact CD2-CG2 4.05Å; L29-V193 PolarHBondContact N-O 2.74Å; L29-V193 VanDerWaalsContact N-O 3.13Å; L29-V193 PolarHBondContact O-N 2.87Å; I83-V193 HydrophobicContact CD1-CG2 4.26Å; I91-V193 HydrophobicContact CB-CG1 4.34Å; I91-V193 HydrophobicContact CD1-CG1 4.32Å; Y92-V193 VanDerWaalsContact O-CA 3.31Å; Y92-V193 WeakPolarHBondContact O-CA 3.48Å; V93-V193 HydrophobicContact CG2-CG1 4.45Å; F175-V193 HydrophobicContact CE2-CG1 4.21Å; F175-V193 HydrophobicContact CZ-CG1 3.86Å; L177-V193 HydrophobicContact CD1-CG2 3.53Å; V191-V193 HydrophobicContact CG1-CG2 4.21Å
194	Y	94.8	Very high	92.3	Very high	16 Å²	16	30.8 Å²	30.8	6%	0.063	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	164.7	-179.3	64	-86.7	0	0	0	111.5	Q25 V26 Y92 E94 R192 K196	Q25-Y194 HydrophobicContact CB-CD2 3.98Å; Q25-Y194 HydrophobicContact CG-CD2 3.78Å; Q25-Y194 HydrophobicContact CG-CE2 3.87Å; V26-Y194 CarbonylContact O-C 3.57Å; V26-Y194 WeakPolarHBondContact O-CA 3.46Å; V26-Y194 VanDerWaalsContact O-CB 3.31Å; V26-Y194 WeakPolarHBondContact O-CB 3.47Å; Y92-Y194 HydrophobicContact CD2-CD2 4.35Å; Y92-Y194 HydrophobicContact CD2-CE2 4.11Å; Y92-Y194 HydrophobicContact CG-CD2 4.48Å; Y92-Y194 AromaticContact CG-CE2 3.93Å; Y92-Y194 HydrophobicContact CG-CE2 3.93Å; Y92-Y194 PolarHBondContact N-O 3.18Å; Y92-Y194 PolarHBondContact O-N 2.97Å; E94-Y194 HydrophobicContact CB-CE1 4.2Å; R192-Y194 HydrophobicContact CG-CD1 4.28Å; Y194-K196 HydrophobicContact CE2-CG 4.41Å
195	Y	92.8	Very high	92.3	Very high	19 Å²	19	31 Å²	31	8%	0.075	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	159.2	166.2	71.6	-83.9	0	0	0	110.2	Q25 V26 L28 Q86 A88 K90 K197 V212	Q25-Y195 WeakPolarHBondContact CA-O 3.32Å; V26-Y195 HydrophobicContact CB-CD1 3.85Å; V26-Y195 HydrophobicContact CB-CE1 3.37Å; V26-Y195 HydrophobicContact CB-CE2 4.1Å; V26-Y195 HydrophobicContact CB-CG 4.42Å; V26-Y195 VanDerWaalsContact CB-CZ 3.5Å; V26-Y195 HydrophobicContact CG1-CD1 4.25Å; V26-Y195 HydrophobicContact CG1-CE1 3.42Å; V26-Y195 VanDerWaalsContact CG1-CE1 3.42Å; V26-Y195 HydrophobicContact CG2-CE1 4.19Å; V26-Y195 HydrophobicContact CG2-CE2 4.1Å; V26-Y195 PolarHBondContact N-O 2.9Å; V26-Y195 PolarHBondContact O-N 2.93Å; L28-Y195 HydrophobicContact CD1-CD1 4.16Å; L28-Y195 HydrophobicContact CD2-CD1 3.77Å; L28-Y195 HydrophobicContact CD2-CE1 3.74Å; L28-Y195 HydrophobicContact CG-CD1 3.97Å; L28-Y195 HydrophobicContact CG-CE1 4.43Å; Q86-Y195 HydrophobicContact CB-CE1 4.44Å; A88-Y195 HydrophobicContact CB-CD1 3.62Å; A88-Y195 HydrophobicContact CB-CD2 4.11Å; A88-Y195 HydrophobicContact CB-CE1 4.3Å; A88-Y195 HydrophobicContact CB-CG 3.48Å; A88-Y195 VanDerWaalsContact CB-CG 3.48Å; K90-Y195 WeakPolarHBondContact O-CB 3.49Å; Y195-K197 HydrophobicContact CE2-CB 4.49Å; Y195-V212 HydrophobicContact CD2-CG1 4.23Å; Y195-V212 HydrophobicContact CD2-CG2 4.47Å; Y195-V212 HydrophobicContact CE2-CG1 4.43Å; Y195-V212 HydrophobicContact CE2-CG2 3.87Å
196	K	91.3	Very high	92.3	Very high	32 Å²	32	30.3 Å²	30.3	14%	0.139	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145.5	179.5	-62.5	178.1	-178.6	170.3	0	110.4	N24 Y92 Y194 P213 D244	N24-K196 CarbonylContact O-C 3.51Å; N24-K196 VanDerWaalsContact O-CA 3.23Å; N24-K196 WeakPolarHBondContact O-CA 3.13Å; Y92-K196 HydrophobicContact CD2-CG 4.18Å; Y92-K196 HydrophobicContact CE1-CD 4.41Å; Y92-K196 HydrophobicContact CE2-CB 4.32Å; Y92-K196 HydrophobicContact CE2-CD 3.77Å; Y92-K196 HydrophobicContact CE2-CG 3.68Å; Y194-K196 HydrophobicContact CE2-CG 4.41Å; K196-P213 WeakPolarHBondContact O-CD 3.37Å; K196-D244 WeakPolarHBondContact CD-O 3.27Å; K196-D244 IonicContact NZ-OD1 3.53Å; K196-D244 PolarHBondContact NZ-OD1 2.95Å
197	K	91.4	Very high	92.3	Very high	43 Å²	43	31.6 Å²	31.6	19%	0.187	16%	0.162	C	C	.	.			trans	-140.6	148.8	171.3	70.6	169.6	-176.9	173	0	110.3	N24 V26 Y195 P199 D210 T211 G245	N24-K197 VanDerWaalsContact CA-O 3.27Å; N24-K197 WeakPolarHBondContact CA-O 3.4Å; N24-K197 VanDerWaalsContact CB-O 3.29Å; N24-K197 WeakPolarHBondContact CB-O 3.36Å; N24-K197 PolarHBondContact O-N 3.35Å; V26-K197 HydrophobicContact CG2-CD 3.65Å; V26-K197 HydrophobicContact CG2-CG 3.93Å; Y195-K197 HydrophobicContact CE2-CB 4.49Å; K197-P199 WeakPolarHBondContact O-CD 3.32Å; K197-D210 HydrophobicContact CD-CB 4.34Å; K197-D210 VanDerWaalsContact NZ-CG 3.26Å; K197-D210 IonicContact NZ-OD1 3.88Å; K197-D210 PolarHBondContact NZ-OD1 2.96Å; K197-D210 IonicContact NZ-OD2 3.17Å; K197-D210 PolarHBondContact NZ-OD2 3.1Å; K197-T211 CarbonylContact C-O 3.59Å; K197-T211 WeakPolarHBondContact CA-O 3.42Å; K197-G245 VanDerWaalsContact O-O 3.13Å
198	C	91.4	Very high	92.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-78.5	118.4	164.3	-57.3	0	0	0	0	108.8	D210 T211 C241 G245 D246 W247	C198-D210 WeakPolarHBondContact O-CA 3.49Å; C198-T211 PolarHBondContact N-O 2.88Å; C198-T211 PolarHBondContact O-N 3.5Å; C198-C241 HydrophobicContact CB-CB 3.77Å; C198-C241 WeakPolarHBondContact CB-SG 3.43Å; C198-C241 WeakPolarHBondContact SG-CA 3.02Å; C198-C241 WeakPolarHBondContact SG-CB 3.3Å; C198-C241 CovalentContact SG-SG 2.02Å; C198-C241 PolarHBondContact SG-SG 3.35Å; C198-G245 WeakPolarHBondContact CA-O 3.15Å; C198-D246 PolarHBondContact SG-O 2.9Å; C198-W247 HydrophobicContact CB-CD2 3.73Å; C198-W247 VanDerWaalsContact CB-CE2 3.49Å; C198-W247 HydrophobicContact CB-CE3 4.12Å; C198-W247 HydrophobicContact CB-CG 4.22Å; C198-W247 HydrophobicContact CB-CH2 4.18Å; C198-W247 HydrophobicContact CB-CZ2 3.74Å; C198-W247 HydrophobicContact CB-CZ3 4.35Å
199	P	92.8	Very high	92.3	Very high	33 Å²	33	34.4 Å²	34.4	21%	0.214	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-73.5	155.8	-173	30	-35.3	0	0	0	111.7	K197 T201 D210 W247	K197-P199 WeakPolarHBondContact O-CD 3.32Å; P199-T201 PolarHBondContact O-N 2.87Å; P199-D210 VanDerWaalsContact CA-OD1 3.25Å; P199-D210 WeakPolarHBondContact CA-OD1 3Å; P199-W247 PolarHBondContact O-NE1 3.17Å
200	F	92.5	Very high	92.4	Very high	121 Å²	121	37.4 Å²	37.4	53%	0.531	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-48.8	132.5	172.3	173.1	-89.6	0	0	0	111.6	L202 F208 D210	F200-L202 HydrophobicContact CE1-CD2 4.23Å; F200-L202 HydrophobicContact CE1-CG 4.13Å; F200-L202 HydrophobicContact CZ-CD2 3.81Å; F200-L202 HydrophobicContact CZ-CG 4.23Å; F200-F208 VanDerWaalsContact CA-O 3.31Å; F200-F208 WeakPolarHBondContact CA-O 3.16Å; F200-F208 WeakPolarHBondContact CD2-O 3.35Å; F200-D210 PolarHBondContact N-OD1 3.22Å
201	T	90.6	Very high	92.4	Very high	42 Å²	42	38 Å²	38	26%	0.258	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	152.5	178.6	-166.8	0	0	0	0	112.6	P199 F208 L239 W247	P199-T201 PolarHBondContact O-N 2.87Å; T201-F208 HydrophobicContact CG2-CB 4.01Å; T201-F208 HydrophobicContact CG2-CD2 4.19Å; T201-F208 HydrophobicContact CG2-CG 4.45Å; T201-F208 PolarHBondContact N-O 2.91Å; T201-F208 PolarHBondContact O-N 2.95Å; T201-L239 HydrophobicContact CG2-CD1 3.74Å; T201-W247 HydrophobicContact CG2-CG 4.26Å
202	L	90	Very high	92.2	Very high	96 Å²	96	39.9 Å²	39.9	50%	0.503	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.3	169.3	-64.1	178.9	0	0	0	108	F200 A206 I228	F200-L202 HydrophobicContact CE1-CD2 4.23Å; F200-L202 HydrophobicContact CE1-CG 4.13Å; F200-L202 HydrophobicContact CZ-CD2 3.81Å; F200-L202 HydrophobicContact CZ-CG 4.23Å; L202-A206 CarbonylContact C-O 3.56Å; L202-A206 WeakPolarHBondContact CA-O 3.49Å; L202-I228 HydrophobicContact CD2-CG2 4.11Å
203	M	87.9	Confident	91.8	Very high	77 Å²	77	38.5 Å²	38.5	38%	0.379	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	136.7	-179.8	-160.7	171.8	-165.8	0	0	110.3	L205 A206 F208 L239 P250	M203-L205 PolarHBondContact O-N 2.82Å; M203-A206 PolarHBondContact N-O 2.68Å; M203-A206 PolarHBondContact O-N 3.29Å; M203-A206 VanDerWaalsContact O-O 3.13Å; M203-F208 HydrophobicContact CB-CD2 4.48Å; M203-F208 HydrophobicContact CB-CE2 4.11Å; M203-L239 HydrophobicContact SD-CD2 4.05Å; M203-P250 HydrophobicContact CE-CB 4.14Å; M203-P250 HydrophobicContact CE-CG 3.76Å; M203-P250 HydrophobicContact SD-CB 3.89Å; M203-P250 HydrophobicContact SD-CG 4.14Å
204	N	90.5	Very high	91.1	Very high	62 Å²	62	45.5 Å²	45.5	33%	0.332	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	40.2	-180	-63.9	-17.9	0	0	0	113.8	A206 G252 R253 C254	N204-A206 PolarHBondContact O-N 2.87Å; N204-G252 PolarHBondContact ND2-O 3.24Å; N204-R253 HydrophobicContact CB-CB 3.76Å; N204-C254 PolarHBondContact O-N 2.99Å
205	L	92.4	Very high	90	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.026	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	26.1	-176.5	-53.8	172.5	0	0	0	113.9	M203 I228 A231 C254 E262 G265	M203-L205 PolarHBondContact O-N 2.82Å; L205-I228 HydrophobicContact CB-CD1 4.08Å; L205-I228 HydrophobicContact CB-CG1 4.18Å; L205-I228 HydrophobicContact CD2-CD1 3.66Å; L205-I228 HydrophobicContact CG-CD1 4.47Å; L205-I228 WeakPolarHBondContact O-CG1 3.42Å; L205-I228 PolarHBondContact O-N 3.28Å; L205-A231 HydrophobicContact CB-CB 4.36Å; L205-C254 HydrophobicContact CB-CB 3.93Å; L205-C254 WeakPolarHBondContact O-CB 3.31Å; L205-E262 HydrophobicContact CD1-CB 4.45Å; L205-E262 HydrophobicContact CD1-CG 4.33Å; L205-E262 HydrophobicContact CD2-CG 3.97Å; L205-G265 WeakPolarHBondContact CD2-O 3.42Å
206	A	93.6	Very high	88.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	143.6	172.4	0	0	0	0	0	110.9	L202 M203 N204 F208 A226 P237	L202-A206 CarbonylContact C-O 3.56Å; L202-A206 WeakPolarHBondContact CA-O 3.49Å; M203-A206 PolarHBondContact N-O 2.68Å; M203-A206 PolarHBondContact O-N 3.29Å; M203-A206 VanDerWaalsContact O-O 3.13Å; N204-A206 PolarHBondContact O-N 2.87Å; A206-F208 HydrophobicContact CB-CE2 3.8Å; A206-F208 HydrophobicContact CB-CZ 4.04Å; A206-F208 WeakPolarHBondContact O-CD2 3.29Å; A206-F208 WeakPolarHBondContact O-CE2 3.37Å; A206-A226 CarbonylContact C-O 3.55Å; A206-A226 WeakPolarHBondContact CA-O 3.21Å; A206-P237 HydrophobicContact CB-CB 3.53Å; A206-P237 HydrophobicContact CB-CG 3.72Å
207	S	93.8	Very high	87.3	Confident	33 Å²	33	52 Å²	52	23%	0.231	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.6	173.5	66.2	0	0	0	0	111.6	G225 A226	S207-G225 WeakPolarHBondContact O-CA 3.15Å; S207-A226 PolarHBondContact N-O 3.16Å; S207-A226 PolarHBondContact O-N 3.21Å; S207-A226 PolarHBondContact OG-O 3.04Å
208	F	93.9	Very high	85.8	Confident	5 Å²	5	55.4 Å²	55.4	2%	0.022	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.9	178.5	-61	-93.7	0	0	0	109.6	F200 T201 M203 A206 V223 G225 P237 L239 W247	F200-F208 VanDerWaalsContact CA-O 3.31Å; F200-F208 WeakPolarHBondContact CA-O 3.16Å; F200-F208 WeakPolarHBondContact CD2-O 3.35Å; T201-F208 HydrophobicContact CG2-CB 4.01Å; T201-F208 HydrophobicContact CG2-CD2 4.19Å; T201-F208 HydrophobicContact CG2-CG 4.45Å; T201-F208 PolarHBondContact N-O 2.91Å; T201-F208 PolarHBondContact O-N 2.95Å; M203-F208 HydrophobicContact CB-CD2 4.48Å; M203-F208 HydrophobicContact CB-CE2 4.11Å; A206-F208 HydrophobicContact CB-CE2 3.8Å; A206-F208 HydrophobicContact CB-CZ 4.04Å; A206-F208 WeakPolarHBondContact O-CD2 3.29Å; A206-F208 WeakPolarHBondContact O-CE2 3.37Å; F208-V223 HydrophobicContact CD1-CG1 4.3Å; F208-G225 VanDerWaalsContact CE1-N 3.31Å; F208-P237 HydrophobicContact CZ-CB 4.07Å; F208-L239 HydrophobicContact CB-CD1 4.07Å; F208-L239 HydrophobicContact CD1-CB 3.83Å; F208-L239 HydrophobicContact CD1-CD1 3.71Å; F208-L239 HydrophobicContact CD1-CG 3.81Å; F208-L239 HydrophobicContact CD2-CD1 3.45Å; F208-L239 VanDerWaalsContact CD2-CD1 3.45Å; F208-L239 HydrophobicContact CD2-CG 4.15Å; F208-L239 HydrophobicContact CE1-CB 3.8Å; F208-L239 HydrophobicContact CE1-CD1 3.93Å; F208-L239 HydrophobicContact CE1-CG 3.58Å; F208-L239 HydrophobicContact CE2-CD1 3.68Å; F208-L239 HydrophobicContact CE2-CG 3.95Å; F208-L239 HydrophobicContact CG-CB 4.44Å; F208-L239 HydrophobicContact CG-CD1 3.46Å; F208-L239 VanDerWaalsContact CG-CD1 3.46Å; F208-L239 HydrophobicContact CG-CG 4.09Å; F208-L239 HydrophobicContact CZ-CB 4.38Å; F208-L239 HydrophobicContact CZ-CD1 3.91Å; F208-L239 HydrophobicContact CZ-CG 3.65Å; F208-W247 HydrophobicContact CB-CH2 4.18Å; F208-W247 HydrophobicContact CB-CZ2 3.95Å
209	P	93.3	Very high	84.4	Confident	69 Å²	69	56.5 Å²	56.5	45%	0.448	31%	0.314	S	S	.	.			trans	-75.6	161.7	-176.6	31.6	-36.2	0	0	0	113	T211 V223 W247	P209-T211 PolarHBondContact O-N 3.15Å; P209-T211 PolarHBondContact O-OG1 2.02Å; P209-V223 HydrophobicContact CG-CG1 4.35Å; P209-W247 WeakPolarHBondContact O-CZ2 3.48Å
210	D	92.2	Very high	83.8	Confident	85 Å²	85	58.6 Å²	58.6	46%	0.455	32%	0.323	S	S	.	.			trans	-50.3	123.3	168.5	-83.5	-21.2	0	0	0	110.5	K197 C198 P199 F200	K197-D210 HydrophobicContact CD-CB 4.34Å; K197-D210 VanDerWaalsContact NZ-CG 3.26Å; K197-D210 IonicContact NZ-OD1 3.88Å; K197-D210 PolarHBondContact NZ-OD1 2.96Å; K197-D210 IonicContact NZ-OD2 3.17Å; K197-D210 PolarHBondContact NZ-OD2 3.1Å; C198-D210 WeakPolarHBondContact O-CA 3.49Å; P199-D210 VanDerWaalsContact CA-OD1 3.25Å; P199-D210 WeakPolarHBondContact CA-OD1 3Å; F200-D210 PolarHBondContact N-OD1 3.22Å
211	T	91.1	Very high	83.5	Confident	19 Å²	19	54 Å²	54	12%	0.117	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-130.3	131.5	-175	-58.6	0	0	0	0	111.1	K197 C198 P209 V221 V223 C241	K197-T211 CarbonylContact C-O 3.59Å; K197-T211 WeakPolarHBondContact CA-O 3.42Å; C198-T211 PolarHBondContact N-O 2.88Å; C198-T211 PolarHBondContact O-N 3.5Å; P209-T211 PolarHBondContact O-N 3.15Å; P209-T211 PolarHBondContact O-OG1 2.02Å; T211-V221 HydrophobicContact CG2-CB 4.37Å; T211-V221 HydrophobicContact CG2-CG1 3.88Å; T211-V223 HydrophobicContact CG2-CG2 3.68Å; T211-C241 HydrophobicContact CG2-CB 3.99Å; T211-C241 PolarHBondContact O-SG 2.8Å
212	V	89.9	Confident	83.5	Confident	41 Å²	41	57 Å²	57	25%	0.248	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-89.6	129.9	176	-175.4	0	0	0	0	109.6	A87 Y195	A87-V212 HydrophobicContact CB-CG2 3.97Å; Y195-V212 HydrophobicContact CD2-CG1 4.23Å; Y195-V212 HydrophobicContact CD2-CG2 4.47Å; Y195-V212 HydrophobicContact CE2-CG1 4.43Å; Y195-V212 HydrophobicContact CE2-CG2 3.87Å
213	P	86.6	Confident	83.7	Confident	11 Å²	11	53.1 Å²	53.1	7%	0.071	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-62.5	155.9	176.1	-18.2	29.8	0	0	0	112.3	K196 G242	K196-P213 WeakPolarHBondContact O-CD 3.37Å; P213-G242 WeakPolarHBondContact CB-O 3.06Å; P213-G242 WeakPolarHBondContact CG-O 3.32Å
214	R	81.2	Confident	83.9	Confident	147 Å²	147	57 Å²	57	56%	0.555	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-73.7	162.3	169.2	-80.9	171.9	-175	-102.8	1.3	110.5	D216 S219 V221	R214-D216 VanDerWaalsContact C-N 3.34Å; R214-S219 VanDerWaalsContact CB-OG 3.22Å; R214-S219 WeakPolarHBondContact CB-OG 3.33Å; R214-V221 HydrophobicContact CB-CG2 4.12Å; R214-V221 HydrophobicContact CG-CG2 3.72Å
215	V	71.3	Confident	84	Confident	20 Å²	20	54.3 Å²	54.3	12%	0.121	29%	0.294	C	S	.	.	S	Bend	trans	-71.7	-31.6	-172.6	-179.2	0	0	0	0	112.5	Q89 K90 P169 S217	Q89-V215 HydrophobicContact CB-CG2 3.35Å; Q89-V215 WeakPolarHBondContact O-CG2 3.27Å; K90-V215 VanDerWaalsContact CE-O 3.3Å; K90-V215 WeakPolarHBondContact CE-O 3.32Å; K90-V215 PolarHBondContact NZ-O 3.45Å; P169-V215 HydrophobicContact CB-CB 4.2Å; P169-V215 HydrophobicContact CB-CG1 3.83Å; P169-V215 HydrophobicContact CB-CG2 3.82Å; P169-V215 HydrophobicContact CG-CG1 4.41Å; V215-S217 PolarHBondContact O-N 2.86Å
216	D	70.2	Confident	84.1	Confident	90 Å²	90	56.7 Å²	56.7	48%	0.481	32%	0.315	S	S	.	.	S	Bend	trans	-71.1	118.6	-177.8	-7.8	-49.3	0	0	0	109.6	R214 S218 S219	R214-D216 VanDerWaalsContact C-N 3.34Å; D216-S218 PolarHBondContact O-N 2.8Å; D216-S219 WeakPolarHBondContact CB-OG 3.48Å; D216-S219 PolarHBondContact O-N 3.49Å; D216-S219 PolarHBondContact O-OG 3.27Å; D216-S219 VanDerWaalsContact O-OG 3.13Å; D216-S219 VanDerWaalsContact OD2-CB 3.27Å; D216-S219 WeakPolarHBondContact OD2-CB 3.07Å; D216-S219 PolarHBondContact OD2-OG 3.33Å
217	S	56.7	Low	84.2	Confident	94 Å²	94	58.5 Å²	58.5	66%	0.657	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-12.2	-173.2	-41.2	0	0	0	0	114.4	V215	V215-S217 PolarHBondContact O-N 2.86Å
218	S	60.7	Low	84.2	Confident	113 Å²	113	58.3 Å²	58.3	79%	0.79	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-5	178.1	62.3	0	0	0	0	114.3	D216	D216-S218 PolarHBondContact O-N 2.8Å
219	S	61.3	Low	84.1	Confident	23 Å²	23	64.6 Å²	64.6	16%	0.161	36%	0.357	C	S	.	.			trans	-95.2	125.7	-173.3	65.9	0	0	0	0	112.4	R214 D216	R214-S219 VanDerWaalsContact CB-OG 3.22Å; R214-S219 WeakPolarHBondContact CB-OG 3.33Å; D216-S219 WeakPolarHBondContact CB-OG 3.48Å; D216-S219 PolarHBondContact O-N 3.49Å; D216-S219 PolarHBondContact O-OG 3.27Å; D216-S219 VanDerWaalsContact O-OG 3.13Å; D216-S219 VanDerWaalsContact OD2-CB 3.27Å; D216-S219 WeakPolarHBondContact OD2-CB 3.07Å; D216-S219 PolarHBondContact OD2-OG 3.33Å
220	L	80.8	Confident	84.2	Confident	77 Å²	77	66.2 Å²	66.2	40%	0.403	36%	0.358	S	S	.	.			trans	-90.8	132.2	173.9	-64.6	-178.6	0	0	0	109.6	E222 F240 L248	L220-E222 PolarHBondContact O-N 2.98Å; L220-F240 HydrophobicContact CB-CB 4.14Å; L220-F240 HydrophobicContact CB-CD1 3.98Å; L220-F240 HydrophobicContact CB-CG 4.46Å; L220-F240 HydrophobicContact CD1-CB 4.15Å; L220-F240 HydrophobicContact CD1-CD1 4.39Å; L220-F240 HydrophobicContact CD1-CG 4.37Å; L220-L248 HydrophobicContact CD1-CD1 4.37Å; L220-L248 HydrophobicContact CD2-CD1 3.43Å; L220-L248 VanDerWaalsContact CD2-CD1 3.43Å
221	V	86.7	Confident	84.2	Confident	26 Å²	26	63 Å²	63	16%	0.158	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	107.6	172.1	-175.7	0	0	0	0	108.4	T211 R214 V223 F240 C241	T211-V221 HydrophobicContact CG2-CB 4.37Å; T211-V221 HydrophobicContact CG2-CG1 3.88Å; R214-V221 HydrophobicContact CB-CG2 4.12Å; R214-V221 HydrophobicContact CG-CG2 3.72Å; V221-V223 HydrophobicContact CG1-CG2 4.27Å; V221-V223 PolarHBondContact O-N 2.91Å; V221-F240 CarbonylContact O-C 3.42Å; V221-F240 WeakPolarHBondContact O-CA 3.48Å; V221-C241 HydrophobicContact CB-CB 4.2Å; V221-C241 PolarHBondContact N-O 3.32Å; V221-C241 PolarHBondContact O-N 3.23Å
222	E	90.3	Very high	84.3	Confident	104 Å²	104	66.6 Å²	66.6	49%	0.486	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	125.9	172	-174.5	-178	150.9	0	0	110	L220 K238 F240	L220-E222 PolarHBondContact O-N 2.98Å; E222-K238 HydrophobicContact CG-CD 4.41Å; E222-K238 VanDerWaalsContact OE1-CD 3.24Å; E222-K238 WeakPolarHBondContact OE1-CD 3.09Å; E222-K238 WeakPolarHBondContact OE1-CE 3.27Å; E222-K238 IonicContact OE1-NZ 3.52Å; E222-K238 PolarHBondContact OE1-NZ 3.06Å; E222-F240 HydrophobicContact CB-CD1 4Å; E222-F240 HydrophobicContact CB-CE1 3.7Å; E222-F240 HydrophobicContact CG-CD1 4.39Å; E222-F240 HydrophobicContact CG-CE1 3.8Å; E222-F240 HydrophobicContact CG-CZ 4.2Å
223	V	92.7	Very high	84.4	Confident	15 Å²	15	68.8 Å²	68.8	9%	0.091	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	117.3	177.5	-175.3	0	0	0	0	108.7	F208 P209 T211 V221 K238 L239 W247	F208-V223 HydrophobicContact CD1-CG1 4.3Å; P209-V223 HydrophobicContact CG-CG1 4.35Å; T211-V223 HydrophobicContact CG2-CG2 3.68Å; V221-V223 HydrophobicContact CG1-CG2 4.27Å; V221-V223 PolarHBondContact O-N 2.91Å; V223-K238 WeakPolarHBondContact O-CA 3.01Å; V223-L239 PolarHBondContact N-O 3.25Å; V223-L239 PolarHBondContact O-N 2.91Å; V223-W247 HydrophobicContact CB-CH2 3.83Å; V223-W247 HydrophobicContact CB-CZ3 3.77Å; V223-W247 HydrophobicContact CG1-CH2 3.97Å; V223-W247 HydrophobicContact CG1-CZ3 4.4Å; V223-W247 HydrophobicContact CG2-CH2 3.7Å; V223-W247 HydrophobicContact CG2-CZ3 3.64Å
224	R	93.6	Very high	84.4	Confident	158 Å²	158	76 Å²	76	60%	0.596	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	126.4	171.6	-175.7	178.4	179.6	-179.6	2.4	109.2	E233 T236	R224-E233 IonicContact CZ-OE2 2.64Å; R224-E233 IonicContact NH2-OE1 3.08Å; R224-E233 IonicContact NH2-OE2 2.76Å; R224-E233 PolarHBondContact NH2-OE2 2.96Å; R224-T236 HydrophobicContact CG-CG2 4.05Å
225	G	92.8	Very high	84.7	Confident	5 Å²	5	73.4 Å²	73.4	5%	0.052	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-77.9	154	173.4	0	0	0	0	0	111.7	S207 F208 P237	S207-G225 WeakPolarHBondContact O-CA 3.15Å; F208-G225 VanDerWaalsContact CE1-N 3.31Å; G225-P237 PolarHBondContact N-O 3.15Å; G225-P237 WeakPolarHBondContact O-CG 3.46Å
226	A	94.4	Very high	85.6	Confident	56 Å²	56	75.1 Å²	75.1	46%	0.463	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	130.9	169.3	0	0	0	0	0	109.1	A206 S207 I228	A206-A226 CarbonylContact C-O 3.55Å; A206-A226 WeakPolarHBondContact CA-O 3.21Å; S207-A226 PolarHBondContact N-O 3.16Å; S207-A226 PolarHBondContact O-N 3.21Å; S207-A226 PolarHBondContact OG-O 3.04Å; A226-I228 PolarHBondContact O-N 3.36Å
227	C	94.1	Very high	86.7	Confident	38 Å²	38	70.9 Å²	70.9	26%	0.257	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	138.8	175.3	-64.6	0	0	0	0	110.6	A231 C254	C227-A231 HydrophobicContact CB-CB 4.21Å; C227-C254 WeakPolarHBondContact CA-SG 3.16Å; C227-C254 HydrophobicContact CB-CB 3.73Å; C227-C254 WeakPolarHBondContact CB-SG 3.35Å; C227-C254 WeakPolarHBondContact SG-CB 3.38Å; C227-C254 CovalentContact SG-SG 2.03Å; C227-C254 PolarHBondContact SG-SG 2.86Å
228	I	93.8	Very high	88.4	Confident	28 Å²	28	69.3 Å²	69.3	14%	0.144	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-67.2	167	175	68.4	176.7	0	0	0	110.8	L202 L205 A226 H230 A231 G265	L202-I228 HydrophobicContact CD2-CG2 4.11Å; L205-I228 HydrophobicContact CB-CD1 4.08Å; L205-I228 HydrophobicContact CB-CG1 4.18Å; L205-I228 HydrophobicContact CD2-CD1 3.66Å; L205-I228 HydrophobicContact CG-CD1 4.47Å; L205-I228 WeakPolarHBondContact O-CG1 3.42Å; L205-I228 PolarHBondContact O-N 3.28Å; A226-I228 PolarHBondContact O-N 3.36Å; I228-H230 PolarHBondContact O-N 2.78Å; I228-A231 HydrophobicContact CG1-CB 3.87Å; I228-A231 WeakPolarHBondContact O-CB 3.41Å; I228-A231 PolarHBondContact O-N 3.11Å; I228-G265 WeakPolarHBondContact CD1-O 3.49Å
229	D	93.4	Very high	89.8	Confident	138 Å²	138	64 Å²	64	74%	0.738	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	138.5	178.6	-66.8	-30	0	0	0	111.9	A231	D229-A231 PolarHBondContact O-N 2.59Å
230	H	93.7	Very high	91.2	Very high	102 Å²	102	64.8 Å²	64.8	47%	0.472	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	23.2	-176	-47	-68.6	0	0	0	114.7	I228 S257 Y260 C267	I228-H230 PolarHBondContact O-N 2.78Å; H230-S257 WeakPolarHBondContact O-CB 3.32Å; H230-S257 PolarHBondContact O-N 2.89Å; H230-S257 PolarHBondContact O-OG 3.11Å; H230-Y260 HydrophobicContact CB-CD1 3.6Å; H230-Y260 HydrophobicContact CB-CD2 4.07Å; H230-Y260 HydrophobicContact CB-CE1 3.78Å; H230-Y260 HydrophobicContact CB-CE2 4.24Å; H230-Y260 HydrophobicContact CB-CG 3.79Å; H230-Y260 AromaticContact CD2-CE1 3.65Å; H230-Y260 AromaticContact CE1-CZ 3.89Å; H230-Y260 AromaticContact CG-CD1 3.85Å; H230-Y260 AromaticContact CG-CE1 3.46Å; H230-Y260 VanDerWaalsContact CG-CE1 3.46Å; H230-Y260 AromaticContact CG-CZ 3.66Å; H230-Y260 AromaticContact ND1-CE1 3.81Å; H230-Y260 AromaticContact ND1-CE2 3.95Å; H230-Y260 AromaticContact ND1-CZ 3.5Å; H230-C267 HydrophobicContact CB-CB 4.11Å
231	A	93.8	Very high	91.6	Very high	17 Å²	17	61.1 Å²	61.1	14%	0.14	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	148.2	166.3	0	0	0	0	0	111.3	L205 C227 I228 D229 C254 V255	L205-A231 HydrophobicContact CB-CB 4.36Å; C227-A231 HydrophobicContact CB-CB 4.21Å; I228-A231 HydrophobicContact CG1-CB 3.87Å; I228-A231 WeakPolarHBondContact O-CB 3.41Å; I228-A231 PolarHBondContact O-N 3.11Å; D229-A231 PolarHBondContact O-N 2.59Å; A231-C254 HydrophobicContact CB-CB 3.94Å; A231-V255 CarbonylContact C-O 3.5Å; A231-V255 VanDerWaalsContact CA-O 3.3Å; A231-V255 WeakPolarHBondContact CA-O 3.48Å
232	E	92.7	Very high	91.5	Very high	95 Å²	95	60.2 Å²	60.2	44%	0.444	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	144	179.4	-68.6	170.7	-159.9	0	0	110	R234 C254 V255 S257 A279	E232-R234 PolarHBondContact O-N 3.05Å; E232-C254 CarbonylContact O-C 3.48Å; E232-C254 VanDerWaalsContact O-CA 3.3Å; E232-C254 WeakPolarHBondContact O-CA 3.19Å; E232-V255 PolarHBondContact N-O 3.07Å; E232-V255 PolarHBondContact O-N 3.12Å; E232-S257 WeakPolarHBondContact OE1-CB 3.44Å; E232-A279 WeakPolarHBondContact OE2-CB 3Å
233	E	91.8	Very high	91.2	Very high	87 Å²	87	56.2 Å²	56.2	41%	0.407	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	114.3	177.6	-171.1	177.1	150.1	0	0	109.1	R224 T236	R224-E233 IonicContact CZ-OE2 2.64Å; R224-E233 IonicContact NH2-OE1 3.08Å; R224-E233 IonicContact NH2-OE2 2.76Å; R224-E233 PolarHBondContact NH2-OE2 2.96Å; E233-T236 WeakPolarHBondContact OE1-CA 3.15Å; E233-T236 VanDerWaalsContact OE1-CB 3.23Å; E233-T236 WeakPolarHBondContact OE1-CB 3.35Å; E233-T236 PolarHBondContact OE1-OG1 2.84Å
234	R	87.3	Confident	90.7	Very high	164 Å²	164	60 Å²	60	62%	0.619	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	-51.4	171	-178.4	177.1	-179.5	177.9	1.6	110.6	E232 R253 V255	E232-R234 PolarHBondContact O-N 3.05Å; R234-R253 PolarHBondContact N-O 3.19Å; R234-V255 HydrophobicContact CB-CG1 4.02Å; R234-V255 HydrophobicContact CB-CG2 4.16Å
235	D	87.6	Confident	90.3	Very high	92 Å²	92	52.4 Å²	52.4	49%	0.492	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	135.7	174.3	-62	-56.1	0	0	0	107	P237 R253	D235-P237 VanDerWaalsContact O-CD 3.23Å; D235-P237 WeakPolarHBondContact O-CD 3.36Å; D235-R253 PolarHBondContact N-O 3.36Å; D235-R253 CarbonylContact O-C 3.58Å; D235-R253 PolarHBondContact O-N 3.49Å; D235-R253 VanDerWaalsContact O-O 3.05Å
236	T	90.2	Very high	90.1	Very high	55 Å²	55	56.3 Å²	56.3	34%	0.337	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	112.3	-174.7	-54.4	0	0	0	0	111.8	R224 E233 K238	R224-T236 HydrophobicContact CG-CG2 4.05Å; E233-T236 WeakPolarHBondContact OE1-CA 3.15Å; E233-T236 VanDerWaalsContact OE1-CB 3.23Å; E233-T236 WeakPolarHBondContact OE1-CB 3.35Å; E233-T236 PolarHBondContact OE1-OG1 2.84Å; T236-K238 HydrophobicContact CG2-CG 4.19Å; T236-K238 PolarHBondContact O-N 3.43Å
237	P	92.5	Very high	89.8	Confident	1 Å²	1	56 Å²	56	1%	0.006	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	126.1	-178	30	-35.9	0	0	0	109.5	A206 F208 G225 D235 L251	A206-P237 HydrophobicContact CB-CB 3.53Å; A206-P237 HydrophobicContact CB-CG 3.72Å; F208-P237 HydrophobicContact CZ-CB 4.07Å; G225-P237 PolarHBondContact N-O 3.15Å; G225-P237 WeakPolarHBondContact O-CG 3.46Å; D235-P237 VanDerWaalsContact O-CD 3.23Å; D235-P237 WeakPolarHBondContact O-CD 3.36Å; P237-L251 CarbonylContact C-O 3.48Å; P237-L251 VanDerWaalsContact CA-O 3.29Å; P237-L251 WeakPolarHBondContact CA-O 3.09Å
238	K	91.7	Very high	89.2	Confident	61 Å²	61	57.7 Å²	57.7	27%	0.265	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	139.8	-178.8	-62.4	176.3	177	-158.2	0	110.1	E222 V223 T236 L251	E222-K238 HydrophobicContact CG-CD 4.41Å; E222-K238 VanDerWaalsContact OE1-CD 3.24Å; E222-K238 WeakPolarHBondContact OE1-CD 3.09Å; E222-K238 WeakPolarHBondContact OE1-CE 3.27Å; E222-K238 IonicContact OE1-NZ 3.52Å; E222-K238 PolarHBondContact OE1-NZ 3.06Å; V223-K238 WeakPolarHBondContact O-CA 3.01Å; T236-K238 HydrophobicContact CG2-CG 4.19Å; T236-K238 PolarHBondContact O-N 3.43Å; K238-L251 HydrophobicContact CB-CB 4.33Å; K238-L251 PolarHBondContact N-O 3.04Å; K238-L251 PolarHBondContact O-N 2.87Å
239	L	90.6	Very high	88.4	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	158.3	166.8	-74.5	176.9	0	0	0	109.3	T201 M203 F208 V223 W247 L248 P250	T201-L239 HydrophobicContact CG2-CD1 3.74Å; M203-L239 HydrophobicContact SD-CD2 4.05Å; F208-L239 HydrophobicContact CB-CD1 4.07Å; F208-L239 HydrophobicContact CD1-CB 3.83Å; F208-L239 HydrophobicContact CD1-CD1 3.71Å; F208-L239 HydrophobicContact CD1-CG 3.81Å; F208-L239 HydrophobicContact CD2-CD1 3.45Å; F208-L239 VanDerWaalsContact CD2-CD1 3.45Å; F208-L239 HydrophobicContact CD2-CG 4.15Å; F208-L239 HydrophobicContact CE1-CB 3.8Å; F208-L239 HydrophobicContact CE1-CD1 3.93Å; F208-L239 HydrophobicContact CE1-CG 3.58Å; F208-L239 HydrophobicContact CE2-CD1 3.68Å; F208-L239 HydrophobicContact CE2-CG 3.95Å; F208-L239 HydrophobicContact CG-CB 4.44Å; F208-L239 HydrophobicContact CG-CD1 3.46Å; F208-L239 VanDerWaalsContact CG-CD1 3.46Å; F208-L239 HydrophobicContact CG-CG 4.09Å; F208-L239 HydrophobicContact CZ-CB 4.38Å; F208-L239 HydrophobicContact CZ-CD1 3.91Å; F208-L239 HydrophobicContact CZ-CG 3.65Å; V223-L239 PolarHBondContact N-O 3.25Å; V223-L239 PolarHBondContact O-N 2.91Å; L239-W247 HydrophobicContact CB-CD2 4.12Å; L239-W247 HydrophobicContact CB-CE3 3.39Å; L239-W247 HydrophobicContact CB-CZ3 3.66Å; L239-W247 HydrophobicContact CD1-CB 4.28Å; L239-W247 HydrophobicContact CD1-CD2 3.82Å; L239-W247 HydrophobicContact CD1-CE3 3.98Å; L239-W247 HydrophobicContact CD1-CG 4Å; L239-W247 HydrophobicContact CG-CE3 4.28Å; L239-L248 VanDerWaalsContact CD2-O 3.31Å; L239-L248 WeakPolarHBondContact CD2-O 3.38Å; L239-P250 HydrophobicContact CD2-CB 3.78Å
240	F	90	Very high	87.8	Confident	41 Å²	41	56 Å²	56	18%	0.18	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	118.6	177.4	-66.7	-87.4	0	0	0	109.3	L220 V221 E222 G242 L248 L251	L220-F240 HydrophobicContact CB-CB 4.14Å; L220-F240 HydrophobicContact CB-CD1 3.98Å; L220-F240 HydrophobicContact CB-CG 4.46Å; L220-F240 HydrophobicContact CD1-CB 4.15Å; L220-F240 HydrophobicContact CD1-CD1 4.39Å; L220-F240 HydrophobicContact CD1-CG 4.37Å; V221-F240 CarbonylContact O-C 3.42Å; V221-F240 WeakPolarHBondContact O-CA 3.48Å; E222-F240 HydrophobicContact CB-CD1 4Å; E222-F240 HydrophobicContact CB-CE1 3.7Å; E222-F240 HydrophobicContact CG-CD1 4.39Å; E222-F240 HydrophobicContact CG-CE1 3.8Å; E222-F240 HydrophobicContact CG-CZ 4.2Å; F240-G242 PolarHBondContact O-N 2.78Å; F240-L248 HydrophobicContact CB-CB 4.24Å; F240-L248 PolarHBondContact N-O 2.98Å; F240-L248 PolarHBondContact O-N 3.4Å; F240-L251 HydrophobicContact CE2-CD1 3.79Å; F240-L251 HydrophobicContact CE2-CG 4.31Å; F240-L251 HydrophobicContact CZ-CD1 4.26Å
241	C	89.1	Confident	87.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	115.7	174.9	180	0	0	0	0	109.6	C198 T211 V221 W247	C198-C241 HydrophobicContact CB-CB 3.77Å; C198-C241 WeakPolarHBondContact CB-SG 3.43Å; C198-C241 WeakPolarHBondContact SG-CA 3.02Å; C198-C241 WeakPolarHBondContact SG-CB 3.3Å; C198-C241 CovalentContact SG-SG 2.02Å; C198-C241 PolarHBondContact SG-SG 3.35Å; T211-C241 HydrophobicContact CG2-CB 3.99Å; T211-C241 PolarHBondContact O-SG 2.8Å; V221-C241 HydrophobicContact CB-CB 4.2Å; V221-C241 PolarHBondContact N-O 3.32Å; V221-C241 PolarHBondContact O-N 3.23Å; C241-W247 HydrophobicContact CB-CE3 4.07Å; C241-W247 HydrophobicContact CB-CH2 4.41Å; C241-W247 HydrophobicContact CB-CZ3 3.8Å
242	G	86	Confident	86.9	Confident	6 Å²	6	55.7 Å²	55.7	6%	0.062	29%	0.289	C	S	.	.			trans	-82.5	163.6	179.1	0	0	0	0	0	113.4	P213 F240 D244 G245 D246	P213-G242 WeakPolarHBondContact CB-O 3.06Å; P213-G242 WeakPolarHBondContact CG-O 3.32Å; F240-G242 PolarHBondContact O-N 2.78Å; G242-D244 PolarHBondContact O-N 2.69Å; G242-D244 VanDerWaalsContact O-N 3.11Å; G242-G245 PolarHBondContact O-N 2.84Å; G242-D246 PolarHBondContact N-O 2.8Å
243	A	83	Confident	86.7	Confident	21 Å²	21	54 Å²	54	17%	0.174	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.6	-179.9	0	0	0	0	0	113.8	G245	A243-G245 VanDerWaalsContact C-N 3.28Å; A243-G245 PolarHBondContact O-N 3.47Å
244	D	83.1	Confident	86.8	Confident	93 Å²	93	49.9 Å²	49.9	50%	0.497	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	2.1	176.8	-70.8	-49.7	0	0	0	114.8	K196 G242 D246	K196-D244 WeakPolarHBondContact CD-O 3.27Å; K196-D244 IonicContact NZ-OD1 3.53Å; K196-D244 PolarHBondContact NZ-OD1 2.95Å; G242-D244 PolarHBondContact O-N 2.69Å; G242-D244 VanDerWaalsContact O-N 3.11Å; D244-D246 VanDerWaalsContact C-N 3.3Å
245	G	85.6	Confident	87.1	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	76.2	20.6	-178.3	0	0	0	0	0	113.4	K197 C198 G242 A243	K197-G245 VanDerWaalsContact O-O 3.13Å; C198-G245 WeakPolarHBondContact CA-O 3.15Å; G242-G245 PolarHBondContact O-N 2.84Å; A243-G245 VanDerWaalsContact C-N 3.28Å; A243-G245 PolarHBondContact O-N 3.47Å
246	D	87.4	Confident	87.5	Confident	86 Å²	86	38.1 Å²	38.1	46%	0.46	21%	0.209	S	C	.	.			trans	-103.9	140.9	175.9	-66.6	-30.7	0	0	0	111.2	C198 G242 D244	C198-D246 PolarHBondContact SG-O 2.9Å; G242-D246 PolarHBondContact N-O 2.8Å; D244-D246 VanDerWaalsContact C-N 3.3Å
247	W	87.9	Confident	87.7	Confident	50 Å²	50	36.1 Å²	36.1	19%	0.189	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	126.9	169.4	-71.4	115.8	0	0	0	110.5	C198 P199 T201 F208 P209 V223 L239 C241	C198-W247 HydrophobicContact CB-CD2 3.73Å; C198-W247 VanDerWaalsContact CB-CE2 3.49Å; C198-W247 HydrophobicContact CB-CE3 4.12Å; C198-W247 HydrophobicContact CB-CG 4.22Å; C198-W247 HydrophobicContact CB-CH2 4.18Å; C198-W247 HydrophobicContact CB-CZ2 3.74Å; C198-W247 HydrophobicContact CB-CZ3 4.35Å; P199-W247 PolarHBondContact O-NE1 3.17Å; T201-W247 HydrophobicContact CG2-CG 4.26Å; F208-W247 HydrophobicContact CB-CH2 4.18Å; F208-W247 HydrophobicContact CB-CZ2 3.95Å; P209-W247 WeakPolarHBondContact O-CZ2 3.48Å; V223-W247 HydrophobicContact CB-CH2 3.83Å; V223-W247 HydrophobicContact CB-CZ3 3.77Å; V223-W247 HydrophobicContact CG1-CH2 3.97Å; V223-W247 HydrophobicContact CG1-CZ3 4.4Å; V223-W247 HydrophobicContact CG2-CH2 3.7Å; V223-W247 HydrophobicContact CG2-CZ3 3.64Å; L239-W247 HydrophobicContact CB-CD2 4.12Å; L239-W247 HydrophobicContact CB-CE3 3.39Å; L239-W247 HydrophobicContact CB-CZ3 3.66Å; L239-W247 HydrophobicContact CD1-CB 4.28Å; L239-W247 HydrophobicContact CD1-CD2 3.82Å; L239-W247 HydrophobicContact CD1-CE3 3.98Å; L239-W247 HydrophobicContact CD1-CG 4Å; L239-W247 HydrophobicContact CG-CE3 4.28Å; C241-W247 HydrophobicContact CB-CE3 4.07Å; C241-W247 HydrophobicContact CB-CH2 4.41Å; C241-W247 HydrophobicContact CB-CZ3 3.8Å
248	L	83.1	Confident	87.8	Confident	74 Å²	74	38.7 Å²	38.7	39%	0.387	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	172.3	176.6	-51.9	-178.4	0	0	0	110.8	L220 L239 F240	L220-L248 HydrophobicContact CD1-CD1 4.37Å; L220-L248 HydrophobicContact CD2-CD1 3.43Å; L220-L248 VanDerWaalsContact CD2-CD1 3.43Å; L239-L248 VanDerWaalsContact CD2-O 3.31Å; L239-L248 WeakPolarHBondContact CD2-O 3.38Å; F240-L248 HydrophobicContact CB-CB 4.24Å; F240-L248 PolarHBondContact N-O 2.98Å; F240-L248 PolarHBondContact O-N 3.4Å
249	V	76.2	Confident	87.9	Confident	71 Å²	71	35.8 Å²	35.8	43%	0.43	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	2.5	103	-179.3	-169.4	0	0	0	0	115.6	L251	V249-L251 HydrophobicContact CG1-CD2 3.89Å; V249-L251 HydrophobicContact CG1-CG 4.23Å; V249-L251 PolarHBondContact O-N 2.99Å
250	P	80.8	Confident	88.1	Confident	58 Å²	58	38.4 Å²	38.4	38%	0.377	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	121.5	167.4	28.6	-33.5	0	0	0	110.6	M203 L239	M203-P250 HydrophobicContact CE-CB 4.14Å; M203-P250 HydrophobicContact CE-CG 3.76Å; M203-P250 HydrophobicContact SD-CB 3.89Å; M203-P250 HydrophobicContact SD-CG 4.14Å; L239-P250 HydrophobicContact CD2-CB 3.78Å
251	L	82.3	Confident	88.3	Confident	86 Å²	86	37.8 Å²	37.8	45%	0.45	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.9	169.3	-62	179.7	0	0	0	109.5	P237 K238 F240 V249	P237-L251 CarbonylContact C-O 3.48Å; P237-L251 VanDerWaalsContact CA-O 3.29Å; P237-L251 WeakPolarHBondContact CA-O 3.09Å; K238-L251 HydrophobicContact CB-CB 4.33Å; K238-L251 PolarHBondContact N-O 3.04Å; K238-L251 PolarHBondContact O-N 2.87Å; F240-L251 HydrophobicContact CE2-CD1 3.79Å; F240-L251 HydrophobicContact CE2-CG 4.31Å; F240-L251 HydrophobicContact CZ-CD1 4.26Å; V249-L251 HydrophobicContact CG1-CD2 3.89Å; V249-L251 HydrophobicContact CG1-CG 4.23Å; V249-L251 PolarHBondContact O-N 2.99Å
252	G	85.1	Confident	88.5	Confident	27 Å²	27	41.5 Å²	41.5	28%	0.278	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	65.8	174.8	-179.2	0	0	0	0	0	114.3	N204	N204-G252 PolarHBondContact ND2-O 3.24Å
253	R	89.8	Confident	88.7	Confident	61 Å²	61	44.8 Å²	44.8	23%	0.23	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	153.9	-179.8	66.6	177.4	-63.5	155.5	3.4	111.3	N204 R234 D235 V255 E262 N281	N204-R253 HydrophobicContact CB-CB 3.76Å; R234-R253 PolarHBondContact N-O 3.19Å; D235-R253 PolarHBondContact N-O 3.36Å; D235-R253 CarbonylContact O-C 3.58Å; D235-R253 PolarHBondContact O-N 3.49Å; D235-R253 VanDerWaalsContact O-O 3.05Å; R253-V255 HydrophobicContact CG-CG1 4.44Å; R253-E262 IonicContact NH2-OE2 3.18Å; R253-E262 PolarHBondContact NH2-OE2 3.05Å; R253-N281 VanDerWaalsContact CZ-OD1 3.24Å; R253-N281 PolarHBondContact NE-OD1 3.21Å; R253-N281 PolarHBondContact NH1-ND2 3.3Å; R253-N281 PolarHBondContact NH2-OD1 3.11Å
254	C	93.6	Very high	88.8	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	161	160.9	-51.7	0	0	0	0	109.6	N204 L205 C227 A231 E232	N204-C254 PolarHBondContact O-N 2.99Å; L205-C254 HydrophobicContact CB-CB 3.93Å; L205-C254 WeakPolarHBondContact O-CB 3.31Å; C227-C254 WeakPolarHBondContact CA-SG 3.16Å; C227-C254 HydrophobicContact CB-CB 3.73Å; C227-C254 WeakPolarHBondContact CB-SG 3.35Å; C227-C254 WeakPolarHBondContact SG-CB 3.38Å; C227-C254 CovalentContact SG-SG 2.03Å; C227-C254 PolarHBondContact SG-SG 2.86Å; A231-C254 HydrophobicContact CB-CB 3.94Å; E232-C254 CarbonylContact O-C 3.48Å; E232-C254 VanDerWaalsContact O-CA 3.3Å; E232-C254 WeakPolarHBondContact O-CA 3.19Å
255	V	94.5	Very high	88.9	Confident	7 Å²	7	48.7 Å²	48.7	4%	0.042	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	142.9	175.5	-62.2	0	0	0	0	109	A231 E232 R234 R253 S257 A279 N281	A231-V255 CarbonylContact C-O 3.5Å; A231-V255 VanDerWaalsContact CA-O 3.3Å; A231-V255 WeakPolarHBondContact CA-O 3.48Å; E232-V255 PolarHBondContact N-O 3.07Å; E232-V255 PolarHBondContact O-N 3.12Å; R234-V255 HydrophobicContact CB-CG1 4.02Å; R234-V255 HydrophobicContact CB-CG2 4.16Å; R253-V255 HydrophobicContact CG-CG1 4.44Å; V255-S257 PolarHBondContact O-N 3.47Å; V255-A279 HydrophobicContact CG2-CB 4.32Å; V255-N281 VanDerWaalsContact CG1-OD1 3.3Å; V255-N281 WeakPolarHBondContact CG1-OD1 3.48Å
256	C	94.9	Very high	89.1	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.014	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	137.7	177.2	-61.4	0	0	0	0	110.6	Y260 C267 K276 A279 G280	C256-Y260 VanDerWaalsContact CB-O 3.22Å; C256-Y260 WeakPolarHBondContact CB-O 3.3Å; C256-C267 WeakPolarHBondContact CA-SG 3.46Å; C256-C267 HydrophobicContact CB-CB 3.81Å; C256-C267 WeakPolarHBondContact CB-SG 3.24Å; C256-C267 WeakPolarHBondContact SG-CA 3.41Å; C256-C267 WeakPolarHBondContact SG-CB 3.4Å; C256-C267 CovalentContact SG-SG 2.04Å; C256-C267 PolarHBondContact SG-SG 3.37Å; C256-K276 PolarHBondContact O-NZ 3.09Å; C256-A279 WeakPolarHBondContact O-CA 3.32Å; C256-G280 PolarHBondContact O-N 3.03Å; C256-G280 VanDerWaalsContact O-N 3.16Å
257	S	95.1	Very high	89.5	Confident	13 Å²	13	48 Å²	48	9%	0.091	27%	0.268	C	S	.	.			trans	-64.7	177.4	-178.9	62.9	0	0	0	0	112	H230 E232 V255 G259 Y260 K276	H230-S257 WeakPolarHBondContact O-CB 3.32Å; H230-S257 PolarHBondContact O-N 2.89Å; H230-S257 PolarHBondContact O-OG 3.11Å; E232-S257 WeakPolarHBondContact OE1-CB 3.44Å; V255-S257 PolarHBondContact O-N 3.47Å; S257-G259 PolarHBondContact O-N 3.01Å; S257-Y260 PolarHBondContact O-N 3.15Å; S257-Y260 VanDerWaalsContact O-N 3.17Å; S257-Y260 VanDerWaalsContact OG-CD2 3.32Å; S257-Y260 WeakPolarHBondContact OG-CD2 3.42Å; S257-K276 PolarHBondContact O-NZ 3.43Å
258	V	93.7	Very high	89.8	Confident	55 Å²	55	48.8 Å²	48.8	33%	0.333	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	131.3	175.3	-176.6	0	0	0	0	109.6	Y260 K276 A279	V258-Y260 WeakPolarHBondContact O-CD2 3.41Å; V258-K276 WeakPolarHBondContact CG1-O 3.43Å; V258-A279 HydrophobicContact CG2-CB 4.47Å
259	G	93.9	Very high	90.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.7	-1.5	-176.8	0	0	0	0	0	115.9	S257 C270 K276 G297	S257-G259 PolarHBondContact O-N 3.01Å; G259-C270 VanDerWaalsContact C-SG 3.59Å; G259-C270 PolarHBondContact O-N 3.35Å; G259-C270 PolarHBondContact O-SG 3.44Å; G259-K276 PolarHBondContact N-O 3.4Å; G259-G297 WeakPolarHBondContact O-CA 3.33Å
260	Y	95.1	Very high	91.3	Very high	55 Å²	55	43 Å²	43	22%	0.216	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.9	-179.7	-67.3	-102.5	0	0	0	112	H230 C256 S257 V258 V268 A269 K276	H230-Y260 HydrophobicContact CB-CD1 3.6Å; H230-Y260 HydrophobicContact CB-CD2 4.07Å; H230-Y260 HydrophobicContact CB-CE1 3.78Å; H230-Y260 HydrophobicContact CB-CE2 4.24Å; H230-Y260 HydrophobicContact CB-CG 3.79Å; H230-Y260 AromaticContact CD2-CE1 3.65Å; H230-Y260 AromaticContact CE1-CZ 3.89Å; H230-Y260 AromaticContact CG-CD1 3.85Å; H230-Y260 AromaticContact CG-CE1 3.46Å; H230-Y260 VanDerWaalsContact CG-CE1 3.46Å; H230-Y260 AromaticContact CG-CZ 3.66Å; H230-Y260 AromaticContact ND1-CE1 3.81Å; H230-Y260 AromaticContact ND1-CE2 3.95Å; H230-Y260 AromaticContact ND1-CZ 3.5Å; C256-Y260 VanDerWaalsContact CB-O 3.22Å; C256-Y260 WeakPolarHBondContact CB-O 3.3Å; S257-Y260 PolarHBondContact O-N 3.15Å; S257-Y260 VanDerWaalsContact O-N 3.17Å; S257-Y260 VanDerWaalsContact OG-CD2 3.32Å; S257-Y260 WeakPolarHBondContact OG-CD2 3.42Å; V258-Y260 WeakPolarHBondContact O-CD2 3.41Å; Y260-V268 CarbonylContact C-O 3.51Å; Y260-V268 VanDerWaalsContact CA-O 3.24Å; Y260-V268 WeakPolarHBondContact CA-O 3.22Å; Y260-A269 HydrophobicContact CD1-CB 4.06Å; Y260-A269 HydrophobicContact CE1-CB 3.73Å; Y260-K276 WeakPolarHBondContact O-CD 3.4Å; Y260-K276 WeakPolarHBondContact O-CE 3.29Å; Y260-K276 PolarHBondContact O-NZ 3.5Å
261	E	93.9	Very high	91.9	Very high	29 Å²	29	47.2 Å²	47.2	14%	0.136	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	154.1	174.9	64.4	-177.9	158.2	0	0	112.8	I263 C267 V268 K283 C284	E261-I263 HydrophobicContact CG-CD1 4.1Å; E261-I263 HydrophobicContact CG-CG1 4.1Å; E261-I263 PolarHBondContact O-N 3.16Å; E261-C267 WeakPolarHBondContact O-CA 3.17Å; E261-V268 PolarHBondContact N-O 2.93Å; E261-V268 PolarHBondContact O-N 3.48Å; E261-K283 WeakPolarHBondContact OE2-CA 3.22Å; E261-K283 WeakPolarHBondContact OE2-CB 3.3Å; E261-C284 VanDerWaalsContact CB-SG 3.56Å; E261-C284 HydrophobicContact CG-CB 4.35Å; E261-C284 WeakPolarHBondContact CG-SG 3.46Å; E261-C284 PolarHBondContact OE2-N 3.32Å
262	E	93.1	Very high	92.5	Very high	78 Å²	78	46.5 Å²	46.5	36%	0.364	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	117.9	179.1	178.2	171.7	-174.8	0	0	110.3	L205 R253 S266	L205-E262 HydrophobicContact CD1-CB 4.45Å; L205-E262 HydrophobicContact CD1-CG 4.33Å; L205-E262 HydrophobicContact CD2-CG 3.97Å; R253-E262 IonicContact NH2-OE2 3.18Å; R253-E262 PolarHBondContact NH2-OE2 3.05Å; E262-S266 WeakPolarHBondContact CA-O 3.15Å
263	I	90.3	Very high	92.8	Very high	74 Å²	74	46.5 Å²	46.5	38%	0.379	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	120.8	174.3	-54.7	-178.7	0	0	0	107.5	E261 G265 S266 V268	E261-I263 HydrophobicContact CG-CD1 4.1Å; E261-I263 HydrophobicContact CG-CG1 4.1Å; E261-I263 PolarHBondContact O-N 3.16Å; I263-G265 VanDerWaalsContact C-N 3.25Å; I263-G265 PolarHBondContact O-N 2.98Å; I263-G265 VanDerWaalsContact O-N 3.15Å; I263-S266 PolarHBondContact N-O 3.42Å; I263-S266 PolarHBondContact O-N 2.04Å; I263-V268 HydrophobicContact CB-CG2 4.05Å; I263-V268 HydrophobicContact CD1-CB 4.03Å; I263-V268 HydrophobicContact CD1-CG1 4.36Å; I263-V268 HydrophobicContact CD1-CG2 4.28Å; I263-V268 HydrophobicContact CG1-CB 4.4Å; I263-V268 HydrophobicContact CG1-CG2 4.39Å
264	D	86.2	Confident	93	Very high	164 Å²	164	45.6 Å²	45.6	88%	0.877	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	41.4	177.6	-59.7	-29.7	0	0	0	114.5	S266	D264-S266 VanDerWaalsContact C-N 3.29Å; D264-S266 PolarHBondContact O-N 2.89Å
265	G	84.2	Confident	93.1	Very high	33 Å²	33	46 Å²	46	34%	0.34	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	12.7	178.7	0	0	0	0	0	114.8	L205 I228 I263	L205-G265 WeakPolarHBondContact CD2-O 3.42Å; I228-G265 WeakPolarHBondContact CD1-O 3.49Å; I263-G265 VanDerWaalsContact C-N 3.25Å; I263-G265 PolarHBondContact O-N 2.98Å; I263-G265 VanDerWaalsContact O-N 3.15Å
266	S	90.9	Very high	93	Very high	59 Å²	59	46.1 Å²	46.1	41%	0.413	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	154.5	174.1	-61.1	0	0	0	0	111.4	E262 I263 D264	E262-S266 WeakPolarHBondContact CA-O 3.15Å; I263-S266 PolarHBondContact N-O 3.42Å; I263-S266 PolarHBondContact O-N 2.04Å; D264-S266 VanDerWaalsContact C-N 3.29Å; D264-S266 PolarHBondContact O-N 2.89Å
267	C	94.3	Very high	92.8	Very high	13 Å²	13	47.2 Å²	47.2	9%	0.088	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	112	174.2	-68.4	0	0	0	0	110.5	H230 C256 E261	H230-C267 HydrophobicContact CB-CB 4.11Å; C256-C267 WeakPolarHBondContact CA-SG 3.46Å; C256-C267 HydrophobicContact CB-CB 3.81Å; C256-C267 WeakPolarHBondContact CB-SG 3.24Å; C256-C267 WeakPolarHBondContact SG-CA 3.41Å; C256-C267 WeakPolarHBondContact SG-CB 3.4Å; C256-C267 CovalentContact SG-SG 2.04Å; C256-C267 PolarHBondContact SG-SG 3.37Å; E261-C267 WeakPolarHBondContact O-CA 3.17Å
268	V	94.5	Very high	92.6	Very high	65 Å²	65	53.2 Å²	53.2	39%	0.394	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.4	-175.9	-177	0	0	0	0	109.9	Y260 E261 I263	Y260-V268 CarbonylContact C-O 3.51Å; Y260-V268 VanDerWaalsContact CA-O 3.24Å; Y260-V268 WeakPolarHBondContact CA-O 3.22Å; E261-V268 PolarHBondContact N-O 2.93Å; E261-V268 PolarHBondContact O-N 3.48Å; I263-V268 HydrophobicContact CB-CG2 4.05Å; I263-V268 HydrophobicContact CD1-CB 4.03Å; I263-V268 HydrophobicContact CD1-CG1 4.36Å; I263-V268 HydrophobicContact CD1-CG2 4.28Å; I263-V268 HydrophobicContact CG1-CB 4.4Å; I263-V268 HydrophobicContact CG1-CG2 4.39Å
269	A	95.2	Very high	92.4	Very high	23 Å²	23	52.4 Å²	52.4	19%	0.19	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	140.6	-179	0	0	0	0	0	111.6	Y260 R271 E296	Y260-A269 HydrophobicContact CD1-CB 4.06Å; Y260-A269 HydrophobicContact CE1-CB 3.73Å; A269-R271 PolarHBondContact O-N 3.42Å; A269-E296 HydrophobicContact CB-CB 4.14Å
270	C	95.1	Very high	92.1	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-58	127.9	174.1	-66.6	0	0	0	0	110.1	G259 F274 C284 E296 G297	G259-C270 VanDerWaalsContact C-SG 3.59Å; G259-C270 PolarHBondContact O-N 3.35Å; G259-C270 PolarHBondContact O-SG 3.44Å; C270-F274 HydrophobicContact CB-CB 4.41Å; C270-C284 WeakPolarHBondContact CA-SG 3.35Å; C270-C284 HydrophobicContact CB-CB 3.77Å; C270-C284 WeakPolarHBondContact CB-SG 3.45Å; C270-C284 WeakPolarHBondContact SG-CB 3.46Å; C270-C284 CovalentContact SG-SG 2.02Å; C270-C284 PolarHBondContact SG-SG 3.28Å; C270-E296 CarbonylContact O-C 3.17Å; C270-E296 WeakPolarHBondContact O-CA 3.01Å; C270-G297 PolarHBondContact O-N 3.01Å
271	R	94.6	Very high	91.4	Very high	147 Å²	147	54 Å²	54	56%	0.555	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-60.9	158.2	175.7	66.3	-177.1	176	-174.6	-5.2	112.6	A269 G273 F274	A269-R271 PolarHBondContact O-N 3.42Å; R271-G273 PolarHBondContact O-N 3.14Å; R271-F274 HydrophobicContact CG-CB 4.13Å; R271-F274 HydrophobicContact CG-CD2 3.5Å; R271-F274 VanDerWaalsContact CG-CD2 3.5Å; R271-F274 HydrophobicContact CG-CE2 4.18Å; R271-F274 HydrophobicContact CG-CG 3.92Å; R271-F274 VanDerWaalsContact NE-CD2 3.29Å; R271-F274 WeakPolarHBondContact O-CB 3.13Å; R271-F274 PolarHBondContact O-N 3.29Å
272	P	94.3	Very high	91	Very high	71 Å²	71	57.7 Å²	57.7	46%	0.461	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	140.6	176.6	-25.8	36.5	0	0	0	112.5	F274 E296	P272-F274 PolarHBondContact O-N 3.05Å; P272-E296 HydrophobicContact CG-CG 4.19Å
273	G	91.8	Very high	90.9	Very high	27 Å²	27	61.1 Å²	61.1	28%	0.278	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	-1.7	-172.3	0	0	0	0	0	115	R271 C287 S293	R271-G273 PolarHBondContact O-N 3.14Å; G273-C287 PolarHBondContact O-N 3.33Å; G273-S293 WeakPolarHBondContact CA-OG 3.25Å; G273-S293 PolarHBondContact N-O 2.98Å; G273-S293 PolarHBondContact N-OG 3.47Å; G273-S293 VanDerWaalsContact N-OG 3.11Å
274	F	94.6	Very high	91.1	Very high	43 Å²	43	58.2 Å²	58.2	19%	0.189	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	160.2	173.4	-68.3	-109.8	0	0	0	110.4	C270 R271 P272 C284 S285 K286 S293	C270-F274 HydrophobicContact CB-CB 4.41Å; R271-F274 HydrophobicContact CG-CB 4.13Å; R271-F274 HydrophobicContact CG-CD2 3.5Å; R271-F274 VanDerWaalsContact CG-CD2 3.5Å; R271-F274 HydrophobicContact CG-CE2 4.18Å; R271-F274 HydrophobicContact CG-CG 3.92Å; R271-F274 VanDerWaalsContact NE-CD2 3.29Å; R271-F274 WeakPolarHBondContact O-CB 3.13Å; R271-F274 PolarHBondContact O-N 3.29Å; P272-F274 PolarHBondContact O-N 3.05Å; F274-C284 HydrophobicContact CB-CB 4.07Å; F274-S285 CarbonylContact C-O 3.53Å; F274-S285 WeakPolarHBondContact CA-O 3.04Å; F274-S285 WeakPolarHBondContact CB-O 3.33Å; F274-S285 VanDerWaalsContact CD1-C 3.45Å; F274-K286 HydrophobicContact CD1-CB 4.23Å; F274-K286 HydrophobicContact CE1-CB 3.85Å; F274-K286 HydrophobicContact CZ-CB 4.08Å; F274-K286 HydrophobicContact CZ-CG 4.31Å; F274-S293 PolarHBondContact N-OG 2.88Å; F274-S293 PolarHBondContact O-OG 2.79Å
275	Y	93.9	Very high	91.5	Very high	9 Å²	9	53 Å²	53	4%	0.035	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	163.7	179.9	82.3	-66.9	0	0	0	111.6	A277 S285 A298 S299 C301 S315 T316	Y275-A277 HydrophobicContact CD2-CB 4.28Å; Y275-A277 HydrophobicContact CE2-CB 3.97Å; Y275-S285 VanDerWaalsContact CD1-O 3.29Å; Y275-S285 WeakPolarHBondContact CD1-O 3.06Å; Y275-S285 PolarHBondContact N-O 3.04Å; Y275-S285 PolarHBondContact O-N 3.49Å; Y275-A298 CarbonylContact C-O 3.59Å; Y275-A298 WeakPolarHBondContact CA-O 3.5Å; Y275-A298 VanDerWaalsContact CB-O 3.32Å; Y275-A298 WeakPolarHBondContact CB-O 3.32Å; Y275-S299 WeakPolarHBondContact CD2-O 3.44Å; Y275-C301 WeakPolarHBondContact CD1-SG 3.05Å; Y275-S315 PolarHBondContact OH-O 2.78Å; Y275-T316 WeakPolarHBondContact OH-CA 3.39Å; Y275-T316 WeakPolarHBondContact OH-CG2 2.89Å
276	K	93.8	Very high	92	Very high	9 Å²	9	59 Å²	59	4%	0.039	31%	0.313	C	S	.	.			trans	-144.7	110.7	171	-177.1	-169.1	-176.8	-165.7	0	109.9	C256 S257 V258 G259 Y260 Y278 G280 I282 A298 S299	C256-K276 PolarHBondContact O-NZ 3.09Å; S257-K276 PolarHBondContact O-NZ 3.43Å; V258-K276 WeakPolarHBondContact CG1-O 3.43Å; G259-K276 PolarHBondContact N-O 3.4Å; Y260-K276 WeakPolarHBondContact O-CD 3.4Å; Y260-K276 WeakPolarHBondContact O-CE 3.29Å; Y260-K276 PolarHBondContact O-NZ 3.5Å; K276-Y278 WeakPolarHBondContact CE-O 3.28Å; K276-Y278 WeakPolarHBondContact CG-O 3.37Å; K276-G280 WeakPolarHBondContact CE-O 3.43Å; K276-G280 PolarHBondContact NZ-O 2.89Å; K276-I282 WeakPolarHBondContact CE-O 3.39Å; K276-A298 PolarHBondContact N-O 2.94Å; K276-S299 WeakPolarHBondContact O-CA 3.33Å
277	A	90.1	Very high	92.1	Very high	24 Å²	24	57 Å²	57	20%	0.198	30%	0.299	C	S	.	.			trans	-82.5	-18.9	-172.6	0	0	0	0	0	116	Y275 S299 S315	Y275-A277 HydrophobicContact CD2-CB 4.28Å; Y275-A277 HydrophobicContact CE2-CB 3.97Å; A277-S299 WeakPolarHBondContact CA-O 3.31Å; A277-S299 WeakPolarHBondContact CB-O 3.16Å; A277-S299 PolarHBondContact N-O 3.44Å; A277-S315 WeakPolarHBondContact CB-OG 3.45Å
278	Y	90.4	Very high	92.1	Very high	139 Å²	139	57.1 Å²	57.1	55%	0.545	30%	0.3	S	S	.	.	S	Bend	trans	-133.8	140.7	-175.6	-52.9	-73.4	0	0	0	109.9	K276	K276-Y278 WeakPolarHBondContact CE-O 3.28Å; K276-Y278 WeakPolarHBondContact CG-O 3.37Å
279	A	89.8	Confident	92.1	Very high	39 Å²	39	58.2 Å²	58.2	32%	0.322	31%	0.309	S	S	.	.	S	Bend	trans	-62.4	143.2	170.8	0	0	0	0	0	110.1	E232 V255 C256 V258	E232-A279 WeakPolarHBondContact OE2-CB 3Å; V255-A279 HydrophobicContact CG2-CB 4.32Å; C256-A279 WeakPolarHBondContact O-CA 3.32Å; V258-A279 HydrophobicContact CG2-CB 4.47Å
280	G	87.1	Confident	92	Very high	9 Å²	9	60.8 Å²	60.8	9%	0.093	32%	0.317	C	S	.	.	S	Bend	trans	149.3	-172.5	-175.2	0	0	0	0	0	114.1	C256 K276 I282	C256-G280 PolarHBondContact O-N 3.03Å; C256-G280 VanDerWaalsContact O-N 3.16Å; K276-G280 WeakPolarHBondContact CE-O 3.43Å; K276-G280 PolarHBondContact NZ-O 2.89Å; G280-I282 PolarHBondContact O-N 2.87Å
281	N	81.8	Confident	92	Very high	78 Å²	78	61.3 Å²	61.3	42%	0.417	32%	0.32	S	S	.	.	S	Bend	trans	-86.2	10.3	-176	-59.1	-8.7	0	0	0	113.5	R253 V255	R253-N281 VanDerWaalsContact CZ-OD1 3.24Å; R253-N281 PolarHBondContact NE-OD1 3.21Å; R253-N281 PolarHBondContact NH1-ND2 3.3Å; R253-N281 PolarHBondContact NH2-OD1 3.11Å; V255-N281 VanDerWaalsContact CG1-OD1 3.3Å; V255-N281 WeakPolarHBondContact CG1-OD1 3.48Å
282	I	85.5	Confident	91.9	Very high	108 Å²	108	57.1 Å²	57.1	55%	0.554	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-82.5	132.9	-176	-45.4	171	0	0	0	108.1	K276 G280	K276-I282 WeakPolarHBondContact CE-O 3.39Å; G280-I282 PolarHBondContact O-N 2.87Å
283	K	91.3	Very high	91.9	Very high	150 Å²	150	54.3 Å²	54.3	65%	0.652	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-68.1	158.1	173.8	-67.5	-167.5	177.1	-169.9	0	111.5	E261 S285	E261-K283 WeakPolarHBondContact OE2-CA 3.22Å; E261-K283 WeakPolarHBondContact OE2-CB 3.3Å; K283-S285 PolarHBondContact O-N 3.05Å
284	C	94	Very high	91.6	Very high	13 Å²	13	61.8 Å²	61.8	9%	0.088	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-58.8	128.2	175.1	-65.6	0	0	0	0	109.7	E261 C270 F274	E261-C284 VanDerWaalsContact CB-SG 3.56Å; E261-C284 HydrophobicContact CG-CB 4.35Å; E261-C284 WeakPolarHBondContact CG-SG 3.46Å; E261-C284 PolarHBondContact OE2-N 3.32Å; C270-C284 WeakPolarHBondContact CA-SG 3.35Å; C270-C284 HydrophobicContact CB-CB 3.77Å; C270-C284 WeakPolarHBondContact CB-SG 3.45Å; C270-C284 WeakPolarHBondContact SG-CB 3.46Å; C270-C284 CovalentContact SG-SG 2.02Å; C270-C284 PolarHBondContact SG-SG 3.28Å; F274-C284 HydrophobicContact CB-CB 4.07Å
285	S	93.8	Very high	91.2	Very high	55 Å²	55	61.8 Å²	61.8	39%	0.385	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	147.1	-179.7	-66.3	0	0	0	0	109.9	F274 Y275 K283	F274-S285 CarbonylContact C-O 3.53Å; F274-S285 WeakPolarHBondContact CA-O 3.04Å; F274-S285 WeakPolarHBondContact CB-O 3.33Å; F274-S285 VanDerWaalsContact CD1-C 3.45Å; Y275-S285 VanDerWaalsContact CD1-O 3.29Å; Y275-S285 WeakPolarHBondContact CD1-O 3.06Å; Y275-S285 PolarHBondContact N-O 3.04Å; Y275-S285 PolarHBondContact O-N 3.49Å; K283-S285 PolarHBondContact O-N 3.05Å
286	K	94.4	Very high	91.1	Very high	157 Å²	157	68.2 Å²	68.2	68%	0.683	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.9	143.2	172.9	-172.1	178.1	177.7	-178.9	0	109.1	F274	F274-K286 HydrophobicContact CD1-CB 4.23Å; F274-K286 HydrophobicContact CE1-CB 3.85Å; F274-K286 HydrophobicContact CZ-CB 4.08Å; F274-K286 HydrophobicContact CZ-CG 4.31Å
287	C	94.4	Very high	91	Very high	17 Å²	17	68.9 Å²	68.9	12%	0.115	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-54.7	133.1	174.2	-75.7	0	0	0	0	111.3	G273 S293 C301	G273-C287 PolarHBondContact O-N 3.33Å; C287-S293 PolarHBondContact SG-OG 3.41Å; C287-S293 VanDerWaalsContact SG-OG 3.35Å; C287-C301 WeakPolarHBondContact CA-SG 3.37Å; C287-C301 HydrophobicContact CB-CB 3.74Å; C287-C301 WeakPolarHBondContact CB-SG 3.3Å; C287-C301 WeakPolarHBondContact SG-CB 3.38Å; C287-C301 CovalentContact SG-SG 2.03Å; C287-C301 PolarHBondContact SG-SG 3.16Å
288	P	94.2	Very high	91.2	Very high	16 Å²	16	68.5 Å²	68.5	10%	0.104	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-68.7	163.4	179.6	30.7	-36.6	0	0	0	110.7	S291 R309 M317	P288-S291 VanDerWaalsContact CD-OG 3.28Å; P288-S291 WeakPolarHBondContact CD-OG 3.46Å; P288-S291 WeakPolarHBondContact CG-OG 3.37Å; P288-S291 PolarHBondContact O-N 2.88Å; P288-S291 PolarHBondContact O-OG 2.99Å; P288-R309 VanDerWaalsContact CG-NH2 3.28Å; P288-M317 WeakPolarHBondContact CG-O 3.24Å
289	P	93.6	Very high	91.2	Very high	89 Å²	89	64.6 Å²	64.6	58%	0.578	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	145.5	-178.3	-27.6	33.9	0	0	0	113.9	S291 A318 C319	P289-S291 PolarHBondContact O-N 3.21Å; P289-A318 HydrophobicContact CB-CB 4.09Å; P289-A318 HydrophobicContact CG-CB 4.3Å; P289-C319 PolarHBondContact O-N 3.37Å
290	H	94.3	Very high	91.3	Very high	77 Å²	77	67 Å²	67	36%	0.356	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	30.2	-177.3	-51.7	-61.5	0	0	0	114.4	E304 F307 C319	H290-E304 IonicContact ND1-OE2 2.68Å; H290-E304 PolarHBondContact ND1-OE2 2.94Å; H290-E304 PolarHBondContact O-N 3.28Å; H290-F307 HydrophobicContact CB-CB 4.1Å; H290-F307 HydrophobicContact CB-CD1 3.68Å; H290-F307 HydrophobicContact CB-CD2 4.02Å; H290-F307 HydrophobicContact CB-CE1 4.03Å; H290-F307 HydrophobicContact CB-CE2 4.35Å; H290-F307 HydrophobicContact CB-CG 3.67Å; H290-F307 HydrophobicContact CB-CZ 4.35Å; H290-F307 AromaticContact CD2-CD1 3.81Å; H290-F307 AromaticContact CD2-CE1 3.41Å; H290-F307 VanDerWaalsContact CD2-CE1 3.41Å; H290-F307 WeakPolarHBondContact CD2-CE1 3.49Å; H290-F307 AromaticContact CD2-CZ 3.92Å; H290-F307 AromaticContact CE1-CE1 3.85Å; H290-F307 AromaticContact CE1-CZ 3.57Å; H290-F307 AromaticContact CG-CD1 3.62Å; H290-F307 AromaticContact CG-CE1 3.43Å; H290-F307 VanDerWaalsContact CG-CE1 3.43Å; H290-F307 AromaticContact CG-CG 3.99Å; H290-F307 AromaticContact CG-CZ 3.64Å; H290-F307 AromaticContact ND1-CE1 3.72Å; H290-F307 AromaticContact ND1-CE2 3.71Å; H290-F307 AromaticContact ND1-CZ 3.41Å; H290-F307 WeakPolarHBondContact ND1-CZ 3.12Å; H290-F307 AromaticContact NE2-CE1 3.7Å; H290-F307 AromaticContact NE2-CZ 3.9Å; H290-C319 HydrophobicContact CB-CB 4.1Å; H290-C319 WeakPolarHBondContact O-CB 3.44Å
291	S	94.7	Very high	91.6	Very high	11 Å²	11	66.6 Å²	66.6	8%	0.077	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	155.7	176.3	77.5	0	0	0	0	112.6	P288 P289 C301 R302	P288-S291 VanDerWaalsContact CD-OG 3.28Å; P288-S291 WeakPolarHBondContact CD-OG 3.46Å; P288-S291 WeakPolarHBondContact CG-OG 3.37Å; P288-S291 PolarHBondContact O-N 2.88Å; P288-S291 PolarHBondContact O-OG 2.99Å; P289-S291 PolarHBondContact O-N 3.21Å; S291-C301 VanDerWaalsContact OG-CB 3.28Å; S291-C301 WeakPolarHBondContact OG-CB 3.26Å; S291-R302 CarbonylContact C-O 3.52Å; S291-R302 WeakPolarHBondContact CA-O 3.49Å; S291-R302 VanDerWaalsContact CB-O 3.29Å; S291-R302 WeakPolarHBondContact CB-O 3.48Å
292	F	92.7	Very high	92.2	Very high	58 Å²	58	71.8 Å²	71.8	25%	0.254	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	159.7	-176.5	60.8	-97.2	0	0	0	113	Y294 C301 R302 E304	F292-Y294 HydrophobicContact CD2-CD1 4.43Å; F292-Y294 AromaticContact CD2-CD2 3.63Å; F292-Y294 HydrophobicContact CD2-CD2 3.63Å; F292-Y294 HydrophobicContact CD2-CE1 4.05Å; F292-Y294 AromaticContact CD2-CE2 3.22Å; F292-Y294 HydrophobicContact CD2-CE2 3.22Å; F292-Y294 HydrophobicContact CD2-CG 4.22Å; F292-Y294 AromaticContact CD2-CZ 3.41Å; F292-Y294 VanDerWaalsContact CD2-CZ 3.41Å; F292-Y294 AromaticContact CE2-CD2 3.52Å; F292-Y294 HydrophobicContact CE2-CD2 3.52Å; F292-Y294 HydrophobicContact CE2-CE1 4.5Å; F292-Y294 AromaticContact CE2-CE2 2.91Å; F292-Y294 HydrophobicContact CE2-CE2 2.91Å; F292-Y294 AromaticContact CE2-CZ 3.47Å; F292-Y294 VanDerWaalsContact CE2-CZ 3.47Å; F292-Y294 HydrophobicContact CG-CE2 4.28Å; F292-Y294 AromaticContact CZ-CE2 3.74Å; F292-Y294 HydrophobicContact CZ-CE2 3.74Å; F292-C301 CarbonylContact O-C 3.57Å; F292-C301 WeakPolarHBondContact O-CA 3.46Å; F292-R302 HydrophobicContact CE2-CB 4.05Å; F292-R302 HydrophobicContact CZ-CB 4.19Å; F292-R302 PolarHBondContact N-O 2.91Å; F292-R302 PolarHBondContact O-N 3.27Å; F292-E304 HydrophobicContact CD1-CG 4.02Å; F292-E304 HydrophobicContact CE1-CG 4.28Å
293	S	93.3	Very high	92.5	Very high	12 Å²	12	68.6 Å²	68.6	8%	0.084	35%	0.354	C	S	.	.			trans	-133.9	121.8	168.3	59.6	0	0	0	0	109.9	G273 F274 C287	G273-S293 WeakPolarHBondContact CA-OG 3.25Å; G273-S293 PolarHBondContact N-O 2.98Å; G273-S293 PolarHBondContact N-OG 3.47Å; G273-S293 VanDerWaalsContact N-OG 3.11Å; F274-S293 PolarHBondContact N-OG 2.88Å; F274-S293 PolarHBondContact O-OG 2.79Å; C287-S293 PolarHBondContact SG-OG 3.41Å; C287-S293 VanDerWaalsContact SG-OG 3.35Å
294	Y	85.7	Confident	92.6	Very high	184 Å²	184	65.2 Å²	65.2	72%	0.722	34%	0.34	S	S	*	.			trans	-90.5	-31.2	-177.1	-65.9	-61.6	0	0	0	113.8	F292	F292-Y294 HydrophobicContact CD2-CD1 4.43Å; F292-Y294 AromaticContact CD2-CD2 3.63Å; F292-Y294 HydrophobicContact CD2-CD2 3.63Å; F292-Y294 HydrophobicContact CD2-CE1 4.05Å; F292-Y294 AromaticContact CD2-CE2 3.22Å; F292-Y294 HydrophobicContact CD2-CE2 3.22Å; F292-Y294 HydrophobicContact CD2-CG 4.22Å; F292-Y294 AromaticContact CD2-CZ 3.41Å; F292-Y294 VanDerWaalsContact CD2-CZ 3.41Å; F292-Y294 AromaticContact CE2-CD2 3.52Å; F292-Y294 HydrophobicContact CE2-CD2 3.52Å; F292-Y294 HydrophobicContact CE2-CE1 4.5Å; F292-Y294 AromaticContact CE2-CE2 2.91Å; F292-Y294 HydrophobicContact CE2-CE2 2.91Å; F292-Y294 AromaticContact CE2-CZ 3.47Å; F292-Y294 VanDerWaalsContact CE2-CZ 3.47Å; F292-Y294 HydrophobicContact CG-CE2 4.28Å; F292-Y294 AromaticContact CZ-CE2 3.74Å; F292-Y294 HydrophobicContact CZ-CE2 3.74Å
295	G	87	Confident	92.4	Very high	44 Å²	44	74.6 Å²	74.6	45%	0.454	38%	0.38	S	S	.	.	S	Bend	trans	-98.9	161	-178.5	0	0	0	0	0	112.7
296	E	92	Very high	92.2	Very high	144 Å²	144	73.3 Å²	73.3	67%	0.673	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	153.8	168	-69.1	179.8	173.3	0	0	111	A269 C270 P272 A298	A269-E296 HydrophobicContact CB-CB 4.14Å; C270-E296 CarbonylContact O-C 3.17Å; C270-E296 WeakPolarHBondContact O-CA 3.01Å; P272-E296 HydrophobicContact CG-CG 4.19Å; E296-A298 PolarHBondContact O-N 3.04Å
297	G	91.8	Very high	92.1	Very high	22 Å²	22	67.5 Å²	67.5	23%	0.227	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	76	22.2	174.3	0	0	0	0	0	114.7	G259 C270 S299	G259-G297 WeakPolarHBondContact O-CA 3.33Å; C270-G297 PolarHBondContact O-N 3.01Å; G297-S299 PolarHBondContact O-N 3.22Å
298	A	93.6	Very high	92	Very high	17 Å²	17	68.9 Å²	68.9	14%	0.14	35%	0.354	C	S	.	.			trans	-65.3	126.9	-175.1	0	0	0	0	0	112.6	Y275 K276 E296	Y275-A298 CarbonylContact C-O 3.59Å; Y275-A298 WeakPolarHBondContact CA-O 3.5Å; Y275-A298 VanDerWaalsContact CB-O 3.32Å; Y275-A298 WeakPolarHBondContact CB-O 3.32Å; K276-A298 PolarHBondContact N-O 2.94Å; E296-A298 PolarHBondContact O-N 3.04Å
299	S	90.8	Very high	91.9	Very high	57 Å²	57	69.8 Å²	69.8	40%	0.399	36%	0.355	S	S	.	.	S	Bend	trans	-82.7	-27.6	173.2	57.9	0	0	0	0	112.9	Y275 K276 A277 G297	Y275-S299 WeakPolarHBondContact CD2-O 3.44Å; K276-S299 WeakPolarHBondContact O-CA 3.33Å; A277-S299 WeakPolarHBondContact CA-O 3.31Å; A277-S299 WeakPolarHBondContact CB-O 3.16Å; A277-S299 PolarHBondContact N-O 3.44Å; G297-S299 PolarHBondContact O-N 3.22Å
300	I	91.9	Very high	91.8	Very high	90 Å²	90	66.5 Å²	66.5	46%	0.462	34%	0.335	S	S	.	.	S	Bend	trans	-149.4	142.6	-178.4	-170.1	167.1	0	0	0	110.1
301	C	93.5	Very high	91.4	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-84.3	129.2	172.6	-58.2	0	0	0	0	110.5	Y275 C287 S291 F292 R309	Y275-C301 WeakPolarHBondContact CD1-SG 3.05Å; C287-C301 WeakPolarHBondContact CA-SG 3.37Å; C287-C301 HydrophobicContact CB-CB 3.74Å; C287-C301 WeakPolarHBondContact CB-SG 3.3Å; C287-C301 WeakPolarHBondContact SG-CB 3.38Å; C287-C301 CovalentContact SG-SG 2.03Å; C287-C301 PolarHBondContact SG-SG 3.16Å; S291-C301 VanDerWaalsContact OG-CB 3.28Å; S291-C301 WeakPolarHBondContact OG-CB 3.26Å; F292-C301 CarbonylContact O-C 3.57Å; F292-C301 WeakPolarHBondContact O-CA 3.46Å; C301-R309 PolarHBondContact O-NH1 3.4Å
302	R	93.1	Very high	91	Very high	187 Å²	187	81.5 Å²	81.5	71%	0.706	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	138	178.6	-65.8	-175.9	178.8	179.8	0	109.9	S291 F292	S291-R302 CarbonylContact C-O 3.52Å; S291-R302 WeakPolarHBondContact CA-O 3.49Å; S291-R302 VanDerWaalsContact CB-O 3.29Å; S291-R302 WeakPolarHBondContact CB-O 3.48Å; F292-R302 HydrophobicContact CE2-CB 4.05Å; F292-R302 HydrophobicContact CZ-CB 4.19Å; F292-R302 PolarHBondContact N-O 2.91Å; F292-R302 PolarHBondContact O-N 3.27Å
303	C	93.3	Very high	90.9	Very high	40 Å²	40	80 Å²	80	27%	0.27	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	146.5	178.2	-64.5	0	0	0	0	111.9	F307 C319	C303-F307 VanDerWaalsContact CB-O 3.27Å; C303-F307 WeakPolarHBondContact CB-O 3.46Å; C303-C319 WeakPolarHBondContact CA-SG 3.1Å; C303-C319 HydrophobicContact CB-CB 3.67Å; C303-C319 WeakPolarHBondContact CB-SG 3.43Å; C303-C319 WeakPolarHBondContact SG-CB 3.33Å; C303-C319 CovalentContact SG-SG 2.03Å; C303-C319 PolarHBondContact SG-SG 2.65Å
304	E	93.3	Very high	90.7	Very high	80 Å²	80	82.4 Å²	82.4	37%	0.374	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-65.1	158.1	168.6	-71.2	171	-168.1	0	0	111.4	H290 F292 G306 F307	H290-E304 IonicContact ND1-OE2 2.68Å; H290-E304 PolarHBondContact ND1-OE2 2.94Å; H290-E304 PolarHBondContact O-N 3.28Å; F292-E304 HydrophobicContact CD1-CG 4.02Å; F292-E304 HydrophobicContact CE1-CG 4.28Å; E304-G306 PolarHBondContact O-N 3.31Å; E304-F307 HydrophobicContact CB-CD2 4.2Å; E304-F307 PolarHBondContact O-N 3.19Å; E304-F307 VanDerWaalsContact O-N 3.07Å
305	K	90.2	Very high	90.6	Very high	210 Å²	210	74.3 Å²	74.3	91%	0.913	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	126.9	179.5	-172	178.8	179.7	-178.9	0	110.4
306	G	88.3	Confident	90.6	Very high	28 Å²	28	76.4 Å²	76.4	29%	0.289	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	1	-177.9	0	0	0	0	0	114.7	E304 F308	E304-G306 PolarHBondContact O-N 3.31Å; G306-F308 WeakPolarHBondContact O-CE2 3.4Å
307	F	92.8	Very high	90.6	Very high	34 Å²	34	72.7 Å²	72.7	15%	0.149	37%	0.369	C	S	.	.			trans	-118.7	149.2	172.1	-67.2	-96	0	0	0	110.9	H290 C303 E304 C319 T320 R321	H290-F307 HydrophobicContact CB-CB 4.1Å; H290-F307 HydrophobicContact CB-CD1 3.68Å; H290-F307 HydrophobicContact CB-CD2 4.02Å; H290-F307 HydrophobicContact CB-CE1 4.03Å; H290-F307 HydrophobicContact CB-CE2 4.35Å; H290-F307 HydrophobicContact CB-CG 3.67Å; H290-F307 HydrophobicContact CB-CZ 4.35Å; H290-F307 AromaticContact CD2-CD1 3.81Å; H290-F307 AromaticContact CD2-CE1 3.41Å; H290-F307 VanDerWaalsContact CD2-CE1 3.41Å; H290-F307 WeakPolarHBondContact CD2-CE1 3.49Å; H290-F307 AromaticContact CD2-CZ 3.92Å; H290-F307 AromaticContact CE1-CE1 3.85Å; H290-F307 AromaticContact CE1-CZ 3.57Å; H290-F307 AromaticContact CG-CD1 3.62Å; H290-F307 AromaticContact CG-CE1 3.43Å; H290-F307 VanDerWaalsContact CG-CE1 3.43Å; H290-F307 AromaticContact CG-CG 3.99Å; H290-F307 AromaticContact CG-CZ 3.64Å; H290-F307 AromaticContact ND1-CE1 3.72Å; H290-F307 AromaticContact ND1-CE2 3.71Å; H290-F307 AromaticContact ND1-CZ 3.41Å; H290-F307 WeakPolarHBondContact ND1-CZ 3.12Å; H290-F307 AromaticContact NE2-CE1 3.7Å; H290-F307 AromaticContact NE2-CZ 3.9Å; C303-F307 VanDerWaalsContact CB-O 3.27Å; C303-F307 WeakPolarHBondContact CB-O 3.46Å; E304-F307 HydrophobicContact CB-CD2 4.2Å; E304-F307 PolarHBondContact O-N 3.19Å; E304-F307 VanDerWaalsContact O-N 3.07Å; F307-C319 HydrophobicContact CB-CB 3.63Å; F307-C319 WeakPolarHBondContact CD1-O 3.3Å; F307-T320 CarbonylContact C-O 3.54Å; F307-T320 VanDerWaalsContact CA-O 3.3Å; F307-T320 WeakPolarHBondContact CA-O 3.44Å; F307-R321 HydrophobicContact CD1-CB 4.07Å; F307-R321 HydrophobicContact CE1-CB 4.2Å; F307-R321 HydrophobicContact CE1-CG 4.16Å
308	F	92.6	Very high	90.6	Very high	47 Å²	47	73 Å²	73	21%	0.206	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-144.1	164	-168.8	-48.8	-82.1	0	0	0	111.3	G306 C319 T320 V412 M415	G306-F308 WeakPolarHBondContact O-CE2 3.4Å; F308-C319 WeakPolarHBondContact O-CA 2.96Å; F308-T320 PolarHBondContact N-O 3.36Å; F308-T320 PolarHBondContact O-N 2.57Å; F308-T320 PolarHBondContact O-OG1 2.77Å; F308-V412 HydrophobicContact CB-CB 4.09Å; F308-V412 HydrophobicContact CB-CG1 4.12Å; F308-M415 HydrophobicContact CB-CB 4.28Å; F308-M415 HydrophobicContact CB-SD 4.05Å; F308-M415 HydrophobicContact CD1-CB 4.07Å; F308-M415 HydrophobicContact CG-CB 4.04Å
309	R	92	Very high	90.6	Very high	35 Å²	35	72.3 Å²	72.3	13%	0.132	36%	0.364	C	S	.	.			trans	-125.3	133.7	166.3	-72	-172.2	-171.6	100	0	108.1	P288 C301 D313 M317 C319	P288-R309 VanDerWaalsContact CG-NH2 3.28Å; C301-R309 PolarHBondContact O-NH1 3.4Å; R309-D313 HydrophobicContact CB-CB 4.19Å; R309-M317 PolarHBondContact NE-O 2.96Å; R309-M317 PolarHBondContact NH2-O 3.11Å; R309-M317 VanDerWaalsContact NH2-O 3.08Å; R309-C319 PolarHBondContact NH1-SG 3.43Å
310	A	90.5	Very high	90.8	Very high	19 Å²	19	70 Å²	70	16%	0.157	35%	0.347	C	S	.	.			trans	-69.4	159.1	172.2	0	0	0	0	0	110.1	K312 D313 G411 V412	A310-K312 PolarHBondContact O-N 3.14Å; A310-K312 VanDerWaalsContact O-N 3.15Å; A310-D313 PolarHBondContact N-OD2 3.25Å; A310-D313 WeakPolarHBondContact O-CB 3.43Å; A310-D313 PolarHBondContact O-N 2.77Å; A310-G411 WeakPolarHBondContact CB-O 3.34Å; A310-V412 HydrophobicContact CB-CG1 4.31Å
311	E	86.7	Confident	90.9	Very high	201 Å²	201	71 Å²	71	94%	0.939	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-30.8	-178	-170.7	178.8	-174.5	0	0	113.3
312	K	86.4	Confident	90.9	Very high	203 Å²	203	72.8 Å²	72.8	88%	0.883	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-6.5	178.3	-62.9	-178.9	-178.5	175.8	0	113.7	A310	A310-K312 PolarHBondContact O-N 3.14Å; A310-K312 VanDerWaalsContact O-N 3.15Å
313	D	89.6	Confident	90.9	Very high	26 Å²	26	64.6 Å²	64.6	14%	0.139	33%	0.328	C	S	.	.	S	Bend	trans	-77.5	133.5	-178.2	-67.3	-18.9	0	0	0	110.4	R309 A310 M317 R351	R309-D313 HydrophobicContact CB-CB 4.19Å; A310-D313 PolarHBondContact N-OD2 3.25Å; A310-D313 WeakPolarHBondContact O-CB 3.43Å; A310-D313 PolarHBondContact O-N 2.77Å; D313-M317 HydrophobicContact CB-SD 4.07Å; D313-R351 IonicContact OD1-CZ 2.68Å; D313-R351 IonicContact OD1-NH1 2.73Å; D313-R351 PolarHBondContact OD1-NH1 3.45Å; D313-R351 IonicContact OD1-NH2 3.74Å; D313-R351 PolarHBondContact OD1-NH2 3.4Å; D313-R351 IonicContact OD2-CZ 2.99Å; D313-R351 IonicContact OD2-NH1 3.38Å; D313-R351 PolarHBondContact OD2-NH1 3.5Å; D313-R351 IonicContact OD2-NH2 3.18Å; D313-R351 PolarHBondContact OD2-NH2 2.77Å
314	P	88.9	Confident	90.9	Very high	62 Å²	62	63.9 Å²	63.9	40%	0.403	32%	0.323	S	S	.	.			trans	-68.7	152.6	175	29.1	-33.3	0	0	0	110.7	T316 M317	P314-T316 PolarHBondContact O-N 3.01Å; P314-M317 HydrophobicContact CG-CB 4.14Å; P314-M317 WeakPolarHBondContact O-CB 3.39Å; P314-M317 PolarHBondContact O-N 2.68Å
315	S	85.4	Confident	90.9	Very high	14 Å²	14	61.7 Å²	61.7	10%	0.098	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-16.4	177.2	58.8	0	0	0	0	113.8	Y275 A277	Y275-S315 PolarHBondContact OH-O 2.78Å; A277-S315 WeakPolarHBondContact CB-OG 3.45Å
316	T	86.9	Confident	91.1	Very high	88 Å²	88	52 Å²	52	54%	0.54	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-16.6	173.1	55.4	0	0	0	0	114.4	Y275 P314	Y275-T316 WeakPolarHBondContact OH-CA 3.39Å; Y275-T316 WeakPolarHBondContact OH-CG2 2.89Å; P314-T316 PolarHBondContact O-N 3.01Å
317	M	90.6	Very high	91.3	Very high	66 Å²	66	56.3 Å²	56.3	33%	0.325	28%	0.282	S	S	.	.	S	Bend	trans	-74.6	144.8	177.2	-161.3	168.7	-169.2	0	0	111	P288 R309 D313 P314	P288-M317 WeakPolarHBondContact CG-O 3.24Å; R309-M317 PolarHBondContact NE-O 2.96Å; R309-M317 PolarHBondContact NH2-O 3.11Å; R309-M317 VanDerWaalsContact NH2-O 3.08Å; D313-M317 HydrophobicContact CB-SD 4.07Å; P314-M317 HydrophobicContact CG-CB 4.14Å; P314-M317 WeakPolarHBondContact O-CB 3.39Å; P314-M317 PolarHBondContact O-N 2.68Å
318	A	92.8	Very high	91	Very high	30 Å²	30	60 Å²	60	25%	0.248	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-60.3	150.4	170.3	0	0	0	0	0	110.7	P289	P289-A318 HydrophobicContact CB-CB 4.09Å; P289-A318 HydrophobicContact CG-CB 4.3Å
319	C	94.1	Very high	90.9	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.014	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-72	137.4	168.2	-56.7	0	0	0	0	108.7	P289 H290 C303 F307 F308 R309	P289-C319 PolarHBondContact O-N 3.37Å; H290-C319 HydrophobicContact CB-CB 4.1Å; H290-C319 WeakPolarHBondContact O-CB 3.44Å; C303-C319 WeakPolarHBondContact CA-SG 3.1Å; C303-C319 HydrophobicContact CB-CB 3.67Å; C303-C319 WeakPolarHBondContact CB-SG 3.43Å; C303-C319 WeakPolarHBondContact SG-CB 3.33Å; C303-C319 CovalentContact SG-SG 2.03Å; C303-C319 PolarHBondContact SG-SG 2.65Å; F307-C319 HydrophobicContact CB-CB 3.63Å; F307-C319 WeakPolarHBondContact CD1-O 3.3Å; F308-C319 WeakPolarHBondContact O-CA 2.96Å; R309-C319 PolarHBondContact NH1-SG 3.43Å
320	T	94.8	Very high	90.6	Very high	7 Å²	7	63.7 Å²	63.7	4%	0.043	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-121.3	168.6	-171.9	51.4	0	0	0	0	110.1	F307 F308 G349 R351	F307-T320 CarbonylContact C-O 3.54Å; F307-T320 VanDerWaalsContact CA-O 3.3Å; F307-T320 WeakPolarHBondContact CA-O 3.44Å; F308-T320 PolarHBondContact N-O 3.36Å; F308-T320 PolarHBondContact O-N 2.57Å; F308-T320 PolarHBondContact O-OG1 2.77Å; T320-G349 VanDerWaalsContact CB-O 3.25Å; T320-G349 WeakPolarHBondContact CB-O 3.18Å; T320-R351 HydrophobicContact CG2-CG 3.69Å; T320-R351 WeakPolarHBondContact OG1-CD 3.44Å; T320-R351 PolarHBondContact OG1-NH1 2.82Å
321	R	92.9	Very high	90.4	Very high	113 Å²	113	67.3 Å²	67.3	43%	0.426	34%	0.34	S	S	.	.			trans	-129	165.2	-178.4	66.2	178.3	-176.4	-174.9	0.2	111.3	F307 D347 G349 N410	F307-R321 HydrophobicContact CD1-CB 4.07Å; F307-R321 HydrophobicContact CE1-CB 4.2Å; F307-R321 HydrophobicContact CE1-CG 4.16Å; R321-D347 IonicContact CZ-OD2 3.45Å; R321-D347 IonicContact NE-OD2 3.4Å; R321-D347 PolarHBondContact NE-OD2 2.92Å; R321-D347 IonicContact NH2-OD2 2.75Å; R321-D347 PolarHBondContact NH2-OD2 3.44Å; R321-G349 PolarHBondContact N-O 3.37Å; R321-G349 VanDerWaalsContact O-CA 3.3Å; R321-G349 WeakPolarHBondContact O-CA 3.27Å; R321-N410 PolarHBondContact O-ND2 2.69Å
322	P	93.4	Very high	89.9	Confident	36 Å²	36	62.9 Å²	62.9	23%	0.234	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-59.8	149.7	171.1	-19.9	31	0	0	0	111.5	S416	P322-S416 VanDerWaalsContact CG-CB 3.41Å
323	P	94.2	Very high	89.4	Confident	16 Å²	16	56.7 Å²	56.7	10%	0.104	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-74.1	159	-179	33.8	-35.1	0	0	0	111.8	P345 D347 L354 S408 S413	P323-P345 HydrophobicContact CB-CG 4.26Å; P323-D347 CarbonylContact C-O 3.55Å; P323-D347 VanDerWaalsContact CA-O 3.26Å; P323-D347 WeakPolarHBondContact CA-O 3.07Å; P323-D347 WeakPolarHBondContact CB-O 3.42Å; P323-L354 HydrophobicContact CB-CD1 3.89Å; P323-L354 HydrophobicContact CG-CD1 3.9Å; P323-S408 VanDerWaalsContact CG-O 3.25Å; P323-S408 WeakPolarHBondContact CG-O 3.34Å; P323-S413 WeakPolarHBondContact CD-OG 3.25Å
324	S	93.2	Very high	88.5	Confident	24 Å²	24	60.5 Å²	60.5	17%	0.168	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-69.6	162.9	165.5	68.4	0	0	0	0	110.4	P345 S346 D347 S408	S324-P345 WeakPolarHBondContact O-CB 3.43Å; S324-P345 WeakPolarHBondContact OG-CB 3.06Å; S324-S346 PolarHBondContact OG-N 3.21Å; S324-S346 PolarHBondContact OG-OG 2.85Å; S324-D347 PolarHBondContact N-O 3.36Å; S324-D347 PolarHBondContact OG-N 3.1Å; S324-D347 PolarHBondContact OG-O 3.39Å; S324-S408 PolarHBondContact O-OG 2.68Å
325	P	92.8	Very high	87.1	Confident	34 Å²	34	63.5 Å²	63.5	22%	0.221	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-62.5	158	179.3	25.1	-34	0	0	0	113.5	P345 Q421	P325-P345 WeakPolarHBondContact O-CB 3.38Å; P325-Q421 HydrophobicContact CB-CB 4.18Å; P325-Q421 HydrophobicContact CG-CB 4.01Å
326	P	93.6	Very high	86.2	Confident	8 Å²	8	66.4 Å²	66.4	5%	0.052	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-58	155.9	172.5	-18.3	29.4	0	0	0	112.3	W342 Y356 I406 A423	P326-W342 HydrophobicContact CB-CB 4.4Å; P326-W342 HydrophobicContact CB-CG 4.19Å; P326-Y356 HydrophobicContact CB-CE1 4.47Å; P326-Y356 HydrophobicContact CG-CD1 4Å; P326-Y356 HydrophobicContact CG-CE1 4.14Å; P326-I406 HydrophobicContact CG-CB 4.43Å; P326-I406 HydrophobicContact CG-CG2 3.87Å; P326-A423 HydrophobicContact CB-CB 4.25Å; P326-A423 HydrophobicContact CG-CB 4.4Å
327	R	92	Very high	85.8	Confident	118 Å²	118	64.1 Å²	64.1	45%	0.445	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	153.7	-176.6	-63.1	-175.9	-64.5	165.2	2.7	111.2	S343 P344	R327-S343 PolarHBondContact N-O 2.58Å; R327-S343 WeakPolarHBondContact O-CA 3.22Å; R327-S343 WeakPolarHBondContact O-CB 2.89Å; R327-S343 PolarHBondContact O-N 3.41Å; R327-P344 PolarHBondContact NE-O 2.7Å; R327-P344 PolarHBondContact NH2-O 3.49Å
328	N	88.5	Confident	85.6	Confident	111 Å²	111	61 Å²	61	59%	0.594	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.3	57.3	170.5	-51.1	-29.6	0	0	0	113.9	M330	N328-M330 PolarHBondContact O-N 3.17Å
329	P	89.9	Confident	85.2	Confident	35 Å²	35	62.9 Å²	62.9	23%	0.227	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	129.7	173.3	31.9	-35.5	0	0	0	109.2	E341 I406 A423 I425	P329-E341 CarbonylContact C-O 3.58Å; P329-E341 WeakPolarHBondContact CA-O 3.48Å; P329-I406 HydrophobicContact CB-CD1 4.03Å; P329-A423 HydrophobicContact CG-CB 4.38Å; P329-I425 HydrophobicContact CB-CB 4.16Å; P329-I425 HydrophobicContact CB-CD1 4.17Å; P329-I425 HydrophobicContact CB-CG2 4.42Å; P329-I425 HydrophobicContact CG-CB 4.38Å; P329-I425 WeakPolarHBondContact O-CD1 3.21Å
330	M	85.6	Confident	85	Confident	125 Å²	125	62.8 Å²	62.8	62%	0.616	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	155.9	-178.9	-62.9	-65.6	-66.8	0	0	109	N328 E341	N328-M330 PolarHBondContact O-N 3.17Å; M330-E341 PolarHBondContact N-O 3.14Å; M330-E341 PolarHBondContact O-N 2.93Å
331	F	85.1	Confident	84.8	Confident	94 Å²	94	67.4 Å²	67.4	41%	0.412	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	148.5	172.7	72.8	-88.9	0	0	0	111.3	M333 L338 M339 L340 I425 V427	F331-M333 HydrophobicContact CD2-CB 4.46Å; F331-L338 HydrophobicContact CB-CD1 3.98Å; F331-L338 HydrophobicContact CD2-CD1 3.92Å; F331-L338 HydrophobicContact CG-CD1 4.33Å; F331-M339 CarbonylContact C-O 3.54Å; F331-M339 VanDerWaalsContact CA-O 3.29Å; F331-M339 WeakPolarHBondContact CA-O 3.27Å; F331-L340 HydrophobicContact CB-CD2 3.76Å; F331-I425 HydrophobicContact CB-CD1 4.17Å; F331-I425 HydrophobicContact CD1-CD1 3.69Å; F331-I425 HydrophobicContact CD1-CG1 4.15Å; F331-I425 HydrophobicContact CG-CD1 4.43Å; F331-V427 HydrophobicContact CB-CG2 4.12Å; F331-V427 HydrophobicContact CD1-CG2 3.87Å; F331-V427 HydrophobicContact CD2-CG1 3.98Å; F331-V427 HydrophobicContact CD2-CG2 4.12Å; F331-V427 HydrophobicContact CE1-CG2 4.29Å; F331-V427 HydrophobicContact CE2-CG1 3.98Å; F331-V427 HydrophobicContact CG-CG1 4.49Å; F331-V427 HydrophobicContact CG-CG2 3.78Å; F331-V427 HydrophobicContact CZ-CG1 4.46Å
332	N	77.9	Confident	84.8	Confident	108 Å²	108	62.4 Å²	62.4	58%	0.578	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.4	169.6	-173.4	4.8	0	0	0	108.7	M339	N332-M339 HydrophobicContact CB-CE 4.4Å; N332-M339 PolarHBondContact N-O 3.41Å; N332-M339 PolarHBondContact O-N 3.35Å
333	M	76	Confident	84.7	Confident	74 Å²	74	62.6 Å²	62.6	37%	0.365	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.2	-171.1	-169.1	173.2	71.2	0	0	110.8	F331 L338 F396 V427 T429	F331-M333 HydrophobicContact CD2-CB 4.46Å; M333-L338 HydrophobicContact CB-CD1 3.99Å; M333-L338 HydrophobicContact CG-CD1 4.2Å; M333-F396 HydrophobicContact CG-CE2 4.49Å; M333-F396 HydrophobicContact CG-CZ 4.11Å; M333-F396 HydrophobicContact SD-CE2 4.21Å; M333-F396 HydrophobicContact SD-CZ 4.39Å; M333-V427 HydrophobicContact SD-CG1 4.19Å; M333-T429 HydrophobicContact SD-CG2 3.9Å
334	N	70.4	Confident	84.5	Confident	105 Å²	105	65.2 Å²	65.2	56%	0.561	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	170	170.4	-166.2	14.1	0	0	0	109.3	T336 C337	N334-T336 PolarHBondContact O-N 3.11Å; N334-C337 PolarHBondContact N-O 2.86Å; N334-C337 PolarHBondContact O-N 2.91Å; N334-C337 VanDerWaalsContact O-N 3.13Å
335	D	59.7	Low	84.6	Confident	125 Å²	125	64.4 Å²	64.4	67%	0.668	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-21.7	-171.8	-62.8	-24	0	0	0	115.3
336	T	65.9	Low	84.5	Confident	75 Å²	75	66.9 Å²	66.9	46%	0.46	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.4	3.2	-178.9	63.3	0	0	0	0	114.2	N334 F514	N334-T336 PolarHBondContact O-N 3.11Å; T336-F514 HydrophobicContact CG2-CD2 4.21Å; T336-F514 HydrophobicContact CG2-CE2 4.08Å
337	C	77.5	Confident	84.4	Confident	41 Å²	41	68.7 Å²	68.7	28%	0.277	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	121.3	-165.3	-175.8	0	0	0	0	111.9	N334 T392	N334-C337 PolarHBondContact N-O 2.86Å; N334-C337 PolarHBondContact O-N 2.91Å; N334-C337 VanDerWaalsContact O-N 3.13Å; C337-T392 WeakPolarHBondContact SG-CG2 3.49Å
338	L	86.3	Confident	84.4	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	109.2	172.2	171.9	66.5	0	0	0	108.6	F331 M333 L340 V393 F396 F404 V427	F331-L338 HydrophobicContact CB-CD1 3.98Å; F331-L338 HydrophobicContact CD2-CD1 3.92Å; F331-L338 HydrophobicContact CG-CD1 4.33Å; M333-L338 HydrophobicContact CB-CD1 3.99Å; M333-L338 HydrophobicContact CG-CD1 4.2Å; L338-L340 HydrophobicContact CG-CD2 4.41Å; L338-V393 HydrophobicContact CB-CB 4.19Å; L338-V393 HydrophobicContact CD2-CB 4.38Å; L338-V393 HydrophobicContact CG-CB 4.47Å; L338-V393 PolarHBondContact N-O 3.4Å; L338-V393 PolarHBondContact O-N 3.15Å; L338-F396 HydrophobicContact CB-CD1 3.97Å; L338-F396 HydrophobicContact CB-CE1 3.8Å; L338-F404 HydrophobicContact CD2-CE2 3.74Å; L338-F404 HydrophobicContact CD2-CZ 3.87Å; L338-V427 HydrophobicContact CD1-CG1 3.83Å; L338-V427 HydrophobicContact CD1-CG2 4.34Å; L338-V427 HydrophobicContact CD2-CB 4.34Å; L338-V427 HydrophobicContact CD2-CG1 4.04Å; L338-V427 HydrophobicContact CD2-CG2 4.27Å
339	M	85.1	Confident	84.4	Confident	68 Å²	68	60.4 Å²	60.4	34%	0.335	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	120.6	177.3	-169.3	174	74.9	0	0	109.6	F331 N332	F331-M339 CarbonylContact C-O 3.54Å; F331-M339 VanDerWaalsContact CA-O 3.29Å; F331-M339 WeakPolarHBondContact CA-O 3.27Å; N332-M339 HydrophobicContact CB-CE 4.4Å; N332-M339 PolarHBondContact N-O 3.41Å; N332-M339 PolarHBondContact O-N 3.35Å
340	L	91.3	Very high	84.4	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	134.9	171.5	-59.9	176.2	0	0	0	109.1	F331 L338 W342 V358 T390 V391 V393 F404 I425	F331-L340 HydrophobicContact CB-CD2 3.76Å; L338-L340 HydrophobicContact CG-CD2 4.41Å; L340-W342 HydrophobicContact CB-CZ3 4.09Å; L340-V358 HydrophobicContact CD1-CG1 4.41Å; L340-T390 CarbonylContact O-C 3.51Å; L340-T390 VanDerWaalsContact O-CA 3.23Å; L340-T390 WeakPolarHBondContact O-CA 3.19Å; L340-V391 HydrophobicContact CB-CG1 3.97Å; L340-V391 HydrophobicContact CD1-CG1 4.03Å; L340-V391 HydrophobicContact CG-CG1 4.43Å; L340-V391 PolarHBondContact N-O 2.86Å; L340-V391 PolarHBondContact O-N 3.06Å; L340-V393 HydrophobicContact CD1-CG2 4.07Å; L340-V393 HydrophobicContact CG-CG2 4.38Å; L340-F404 HydrophobicContact CD1-CB 4Å; L340-F404 HydrophobicContact CD1-CD1 3.67Å; L340-F404 HydrophobicContact CD1-CD2 3.83Å; L340-F404 HydrophobicContact CD1-CE1 4.05Å; L340-F404 HydrophobicContact CD1-CE2 4.2Å; L340-F404 HydrophobicContact CD1-CG 3.55Å; L340-F404 HydrophobicContact CD1-CZ 4.3Å; L340-F404 HydrophobicContact CD2-CD2 4.17Å; L340-F404 HydrophobicContact CD2-CE2 4.43Å; L340-I425 HydrophobicContact CD2-CG2 4.29Å
341	E	89.8	Confident	84.7	Confident	103 Å²	103	56.7 Å²	56.7	48%	0.481	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	141.3	178.8	179.8	171	-171.8	0	0	110	P329 M330 A389 T390	P329-E341 CarbonylContact C-O 3.58Å; P329-E341 WeakPolarHBondContact CA-O 3.48Å; M330-E341 PolarHBondContact N-O 3.14Å; M330-E341 PolarHBondContact O-N 2.93Å; E341-A389 WeakPolarHBondContact CA-O 3.19Å; E341-T390 HydrophobicContact CB-CG2 4.17Å; E341-T390 HydrophobicContact CG-CG2 3.91Å
342	W	93.4	Very high	84.9	Confident	8 Å²	8	64.1 Å²	64.1	3%	0.03	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	165.7	176.2	55	91.1	0	0	0	111.5	P326 L340 Y356 V358 L386 A389 V391 I406	P326-W342 HydrophobicContact CB-CB 4.4Å; P326-W342 HydrophobicContact CB-CG 4.19Å; L340-W342 HydrophobicContact CB-CZ3 4.09Å; W342-Y356 AromaticContact CD1-CE1 3.97Å; W342-Y356 HydrophobicContact CZ2-CD2 4.19Å; W342-Y356 AromaticContact CZ2-CG 3.98Å; W342-Y356 HydrophobicContact CZ2-CG 3.98Å; W342-Y356 AromaticContact NE1-CD1 3.36Å; W342-Y356 AromaticContact NE1-CD2 3.68Å; W342-Y356 AromaticContact NE1-CE1 3.47Å; W342-Y356 AromaticContact NE1-CE2 3.81Å; W342-Y356 AromaticContact NE1-CG 3.45Å; W342-Y356 AromaticContact NE1-CZ 3.69Å; W342-V358 HydrophobicContact CH2-CG2 3.7Å; W342-V358 HydrophobicContact CZ2-CG2 4.4Å; W342-V358 HydrophobicContact CZ3-CG2 4.21Å; W342-L386 HydrophobicContact CH2-CD1 3.94Å; W342-L386 HydrophobicContact CZ2-CD1 4.24Å; W342-A389 HydrophobicContact CD2-CB 4.43Å; W342-A389 HydrophobicContact CG-CB 4.21Å; W342-A389 PolarHBondContact N-O 2.8Å; W342-A389 WeakPolarHBondContact O-CB 3.37Å; W342-V391 HydrophobicContact CH2-CB 4.33Å; W342-V391 HydrophobicContact CH2-CG1 4.03Å; W342-V391 HydrophobicContact CZ3-CG1 3.99Å; W342-I406 HydrophobicContact CD2-CD1 4.13Å; W342-I406 HydrophobicContact CD2-CG2 3.95Å; W342-I406 HydrophobicContact CE3-CD1 3.65Å; W342-I406 HydrophobicContact CE3-CG1 4.45Å; W342-I406 HydrophobicContact CE3-CG2 4.28Å; W342-I406 HydrophobicContact CG-CG2 4.44Å; W342-I406 HydrophobicContact CH2-CG2 4.33Å; W342-I406 HydrophobicContact CZ2-CG2 4.01Å; W342-I406 HydrophobicContact CZ3-CD1 4.11Å; W342-I406 HydrophobicContact CZ3-CG2 4.45Å
343	S	90.9	Very high	85.6	Confident	41 Å²	41	62.1 Å²	62.1	29%	0.287	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	149.6	172.6	-62.7	0	0	0	0	111.4	R327	R327-S343 PolarHBondContact N-O 2.58Å; R327-S343 WeakPolarHBondContact O-CA 3.22Å; R327-S343 WeakPolarHBondContact O-CB 2.89Å; R327-S343 PolarHBondContact O-N 3.41Å
344	P	90.5	Very high	86.4	Confident	70 Å²	70	59.9 Å²	59.9	46%	0.455	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-56.1	152.3	173.2	-25.7	34.5	0	0	0	113.1	R327	R327-P344 PolarHBondContact NE-O 2.7Å; R327-P344 PolarHBondContact NH2-O 3.49Å
345	P	93.8	Very high	87.6	Confident	7 Å²	7	56.8 Å²	56.8	5%	0.045	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-61.6	153.3	-179	28.6	-36.5	0	0	0	112	P323 S324 P325 D347 T348 L354	P323-P345 HydrophobicContact CB-CG 4.26Å; S324-P345 WeakPolarHBondContact O-CB 3.43Å; S324-P345 WeakPolarHBondContact OG-CB 3.06Å; P325-P345 WeakPolarHBondContact O-CB 3.38Å; P345-D347 VanDerWaalsContact C-N 3.27Å; P345-D347 PolarHBondContact O-N 3.16Å; P345-T348 HydrophobicContact CG-CG2 4.29Å; P345-L354 VanDerWaalsContact CD-CD2 3.49Å; P345-L354 HydrophobicContact CG-CD1 4.06Å; P345-L354 HydrophobicContact CG-CD2 3.77Å
346	S	91.7	Very high	89.2	Confident	87 Å²	87	51.2 Å²	51.2	61%	0.608	29%	0.287	S	S	*	.	S	Bend	trans	-65.7	-32.2	177.6	42.3	0	0	0	0	112.9	S324	S324-S346 PolarHBondContact OG-N 3.21Å; S324-S346 PolarHBondContact OG-OG 2.85Å
347	D	91.8	Very high	90.6	Very high	45 Å²	45	49 Å²	49	24%	0.241	27%	0.272	C	S	.	.			trans	-127.2	117.3	172.9	179.9	16.9	0	0	0	109.4	R321 P323 S324 P345 G349	R321-D347 IonicContact CZ-OD2 3.45Å; R321-D347 IonicContact NE-OD2 3.4Å; R321-D347 PolarHBondContact NE-OD2 2.92Å; R321-D347 IonicContact NH2-OD2 2.75Å; R321-D347 PolarHBondContact NH2-OD2 3.44Å; P323-D347 CarbonylContact C-O 3.55Å; P323-D347 VanDerWaalsContact CA-O 3.26Å; P323-D347 WeakPolarHBondContact CA-O 3.07Å; P323-D347 WeakPolarHBondContact CB-O 3.42Å; S324-D347 PolarHBondContact N-O 3.36Å; S324-D347 PolarHBondContact OG-N 3.1Å; S324-D347 PolarHBondContact OG-O 3.39Å; P345-D347 VanDerWaalsContact C-N 3.27Å; P345-D347 PolarHBondContact O-N 3.16Å; D347-G349 PolarHBondContact O-N 3.05Å; D347-G349 WeakPolarHBondContact OD1-CA 3.19Å; D347-G349 PolarHBondContact OD1-N 3.08Å
348	T	91.6	Very high	91.3	Very high	49 Å²	49	47.3 Å²	47.3	30%	0.301	26%	0.261	S	S	.	.			trans	-81.3	-1.3	175.7	68.5	0	0	0	0	112.6	P345 G350 R351 N410	P345-T348 HydrophobicContact CG-CG2 4.29Å; T348-G350 VanDerWaalsContact C-N 3.26Å; T348-G350 PolarHBondContact O-N 3.43Å; T348-R351 WeakPolarHBondContact CB-O 3.42Å; T348-R351 PolarHBondContact OG1-O 2.97Å; T348-N410 PolarHBondContact O-ND2 3.2Å; T348-N410 VanDerWaalsContact O-ND2 3.13Å
349	G	89.3	Confident	91.5	Very high	6 Å²	6	51.6 Å²	51.6	6%	0.062	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	18.2	-173.7	0	0	0	0	0	113.4	T320 R321 D347	T320-G349 VanDerWaalsContact CB-O 3.25Å; T320-G349 WeakPolarHBondContact CB-O 3.18Å; R321-G349 PolarHBondContact N-O 3.37Å; R321-G349 VanDerWaalsContact O-CA 3.3Å; R321-G349 WeakPolarHBondContact O-CA 3.27Å; D347-G349 PolarHBondContact O-N 3.05Å; D347-G349 WeakPolarHBondContact OD1-CA 3.19Å; D347-G349 PolarHBondContact OD1-N 3.08Å
350	G	89.7	Confident	91.8	Very high	62 Å²	62	48.7 Å²	48.7	64%	0.639	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	9.7	-180	0	0	0	0	0	114.8	T348	T348-G350 VanDerWaalsContact C-N 3.26Å; T348-G350 PolarHBondContact O-N 3.43Å
351	R	91.4	Very high	91.7	Very high	20 Å²	20	51.2 Å²	51.2	8%	0.075	28%	0.278	C	S	.	.			trans	-114.3	166.1	179.8	-49.5	-174.8	70.3	91.6	-2.6	112.8	D313 T320 T348 D353 N410	D313-R351 IonicContact OD1-CZ 2.68Å; D313-R351 IonicContact OD1-NH1 2.73Å; D313-R351 PolarHBondContact OD1-NH1 3.45Å; D313-R351 IonicContact OD1-NH2 3.74Å; D313-R351 PolarHBondContact OD1-NH2 3.4Å; D313-R351 IonicContact OD2-CZ 2.99Å; D313-R351 IonicContact OD2-NH1 3.38Å; D313-R351 PolarHBondContact OD2-NH1 3.5Å; D313-R351 IonicContact OD2-NH2 3.18Å; D313-R351 PolarHBondContact OD2-NH2 2.77Å; T320-R351 HydrophobicContact CG2-CG 3.69Å; T320-R351 WeakPolarHBondContact OG1-CD 3.44Å; T320-R351 PolarHBondContact OG1-NH1 2.82Å; T348-R351 WeakPolarHBondContact CB-O 3.42Å; T348-R351 PolarHBondContact OG1-O 2.97Å; R351-D353 WeakPolarHBondContact CB-OD1 2.98Å; R351-D353 WeakPolarHBondContact CD-OD1 3.41Å; R351-D353 IonicContact CZ-OD2 2.74Å; R351-D353 IonicContact NE-OD1 2.66Å; R351-D353 PolarHBondContact NE-OD1 3.27Å; R351-D353 IonicContact NE-OD2 3.54Å; R351-D353 PolarHBondContact NE-OD2 2.95Å; R351-D353 IonicContact NH2-OD2 2.74Å; R351-D353 PolarHBondContact NH2-OD2 2.95Å; R351-D353 VanDerWaalsContact NH2-OD2 3.17Å; R351-N410 HydrophobicContact CB-CB 4.41Å
352	R	89.4	Confident	91.4	Very high	250 Å²	250	50.5 Å²	50.5	94%	0.943	27%	0.271	S	S	*	.	S	Bend	trans	-118.6	-7	179.3	-61.5	-177	-177	-176.5	0.3	113.3	L354	R352-L354 PolarHBondContact O-N 2.8Å
353	D	92.6	Very high	90.8	Very high	66 Å²	66	51.2 Å²	51.2	35%	0.353	28%	0.277	S	S	.	.			trans	-81	42.5	175.3	59	-13.8	0	0	0	111.1	R351 G411	R351-D353 WeakPolarHBondContact CB-OD1 2.98Å; R351-D353 WeakPolarHBondContact CD-OD1 3.41Å; R351-D353 IonicContact CZ-OD2 2.74Å; R351-D353 IonicContact NE-OD1 2.66Å; R351-D353 PolarHBondContact NE-OD1 3.27Å; R351-D353 IonicContact NE-OD2 3.54Å; R351-D353 PolarHBondContact NE-OD2 2.95Å; R351-D353 IonicContact NH2-OD2 2.74Å; R351-D353 PolarHBondContact NH2-OD2 2.95Å; R351-D353 VanDerWaalsContact NH2-OD2 3.17Å; D353-G411 WeakPolarHBondContact OD2-CA 3.13Å; D353-G411 PolarHBondContact OD2-N 3.32Å; D353-G411 VanDerWaalsContact OD2-N 3.16Å
354	L	92.9	Very high	89.8	Confident	27 Å²	27	50.6 Å²	50.6	14%	0.141	28%	0.277	C	S	.	.			trans	-75.4	128.6	-176.6	-169.6	75.5	0	0	0	109.9	P323 P345 R352 Y356 L409	P323-L354 HydrophobicContact CB-CD1 3.89Å; P323-L354 HydrophobicContact CG-CD1 3.9Å; P345-L354 VanDerWaalsContact CD-CD2 3.49Å; P345-L354 HydrophobicContact CG-CD1 4.06Å; P345-L354 HydrophobicContact CG-CD2 3.77Å; R352-L354 PolarHBondContact O-N 2.8Å; L354-Y356 HydrophobicContact CD2-CE1 3.98Å; L354-Y356 HydrophobicContact CD2-CE2 4.34Å; L354-Y356 WeakPolarHBondContact CD2-OH 3.31Å; L354-Y356 HydrophobicContact CG-CE1 4.34Å; L354-L409 CarbonylContact C-O 3.59Å; L354-L409 WeakPolarHBondContact CA-O 3.4Å; L354-L409 WeakPolarHBondContact CD1-O 3.29Å
355	T	94.6	Very high	88.3	Confident	40 Å²	40	54 Å²	54	25%	0.245	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	162.3	172.6	57.8	0	0	0	0	110.3	L386 S408 L409	T355-L386 CarbonylContact C-O 3.48Å; T355-L386 VanDerWaalsContact CA-O 3.23Å; T355-L386 WeakPolarHBondContact CA-O 3.47Å; T355-S408 CarbonylContact O-C 3.58Å; T355-S408 WeakPolarHBondContact O-CA 3.39Å; T355-L409 PolarHBondContact N-O 2.73Å; T355-L409 PolarHBondContact O-N 3.25Å
356	Y	94.5	Very high	86.6	Confident	8 Å²	8	55 Å²	55	3%	0.031	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144	177.9	-49.4	-84.7	0	0	0	110.6	P326 W342 L354 G385 L386 A389 E407	P326-Y356 HydrophobicContact CB-CE1 4.47Å; P326-Y356 HydrophobicContact CG-CD1 4Å; P326-Y356 HydrophobicContact CG-CE1 4.14Å; W342-Y356 AromaticContact CD1-CE1 3.97Å; W342-Y356 HydrophobicContact CZ2-CD2 4.19Å; W342-Y356 AromaticContact CZ2-CG 3.98Å; W342-Y356 HydrophobicContact CZ2-CG 3.98Å; W342-Y356 AromaticContact NE1-CD1 3.36Å; W342-Y356 AromaticContact NE1-CD2 3.68Å; W342-Y356 AromaticContact NE1-CE1 3.47Å; W342-Y356 AromaticContact NE1-CE2 3.81Å; W342-Y356 AromaticContact NE1-CG 3.45Å; W342-Y356 AromaticContact NE1-CZ 3.69Å; L354-Y356 HydrophobicContact CD2-CE1 3.98Å; L354-Y356 HydrophobicContact CD2-CE2 4.34Å; L354-Y356 WeakPolarHBondContact CD2-OH 3.31Å; L354-Y356 HydrophobicContact CG-CE1 4.34Å; Y356-G385 PolarHBondContact O-N 3.41Å; Y356-L386 WeakPolarHBondContact CD2-O 3.28Å; Y356-L386 PolarHBondContact N-O 2.77Å; Y356-L386 WeakPolarHBondContact O-CB 3.23Å; Y356-L386 PolarHBondContact O-N 3.05Å; Y356-A389 HydrophobicContact CE2-CB 4.36Å; Y356-E407 WeakPolarHBondContact CA-O 3.19Å
357	N	93.9	Very high	84.8	Confident	28 Å²	28	57 Å²	57	15%	0.15	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	142.3	167.4	-62.7	-18.8	0	0	0	109.2	P383 L384 G385 I406 E407 L409	N357-P383 CarbonylContact C-O 3.55Å; N357-P383 VanDerWaalsContact CA-O 3.3Å; N357-P383 WeakPolarHBondContact CA-O 3.46Å; N357-L384 HydrophobicContact CB-CD2 3.78Å; N357-L384 WeakPolarHBondContact OD1-CA 3.29Å; N357-G385 PolarHBondContact OD1-N 3.03Å; N357-I406 WeakPolarHBondContact O-CA 3.21Å; N357-E407 HydrophobicContact CB-CG 3.61Å; N357-E407 WeakPolarHBondContact CB-OE1 3.31Å; N357-E407 PolarHBondContact N-O 2.78Å; N357-E407 PolarHBondContact ND2-OE1 3.4Å; N357-E407 PolarHBondContact O-N 2.7Å; N357-L409 WeakPolarHBondContact ND2-CD1 3.3Å
358	V	92.9	Very high	83.2	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.042	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	120.6	179.1	-177.5	0	0	0	0	108.8	L340 W342 F379 P383 L386 V391 F404 E405 I406	L340-V358 HydrophobicContact CD1-CG1 4.41Å; W342-V358 HydrophobicContact CH2-CG2 3.7Å; W342-V358 HydrophobicContact CZ2-CG2 4.4Å; W342-V358 HydrophobicContact CZ3-CG2 4.21Å; V358-F379 HydrophobicContact CG1-CE1 4.17Å; V358-P383 HydrophobicContact CB-CB 4.31Å; V358-P383 PolarHBondContact N-O 2.99Å; V358-P383 WeakPolarHBondContact O-CB 3.49Å; V358-L386 HydrophobicContact CG2-CD1 3.75Å; V358-V391 HydrophobicContact CG2-CG1 4.15Å; V358-F404 HydrophobicContact CG1-CB 4.26Å; V358-F404 HydrophobicContact CG1-CD1 3.97Å; V358-E405 WeakPolarHBondContact CA-O 3.16Å; V358-I406 HydrophobicContact CG1-CG1 4.48Å; V358-I406 HydrophobicContact CG2-CG1 4.25Å; V358-I406 HydrophobicContact CG2-CG2 4.27Å
359	Q	91.3	Very high	82.1	Confident	90 Å²	90	67.1 Å²	67.1	42%	0.421	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	130.1	174.7	-171.1	172.5	42.3	0	0	109.8	L372 F404 E405	Q359-L372 HydrophobicContact CG-CD2 3.81Å; Q359-L372 VanDerWaalsContact NE2-CD2 3.29Å; Q359-F404 CarbonylContact O-C 3.54Å; Q359-F404 WeakPolarHBondContact O-CA 3.36Å; Q359-E405 PolarHBondContact N-O 2.77Å; Q359-E405 PolarHBondContact O-N 2.6Å
360	C	90	Very high	81.5	Confident	8 Å²	8	69.5 Å²	69.5	5%	0.054	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	136.1	176.6	174.8	0	0	0	0	111.5	C373 L377 F379 F404	C360-C373 HydrophobicContact CB-CB 3.59Å; C360-C373 WeakPolarHBondContact CB-SG 3.49Å; C360-C373 PolarHBondContact O-N 2.93Å; C360-C373 VanDerWaalsContact O-N 3.16Å; C360-C373 PolarHBondContact O-SG 3.02Å; C360-C373 VanDerWaalsContact O-SG 3.34Å; C360-C373 WeakPolarHBondContact SG-CB 3.28Å; C360-C373 CovalentContact SG-SG 2.05Å; C360-C373 PolarHBondContact SG-SG 2.89Å; C360-L377 HydrophobicContact CB-CD1 4.25Å; C360-L377 WeakPolarHBondContact SG-CD1 3.43Å; C360-F379 HydrophobicContact CB-CZ 3.94Å; C360-F404 HydrophobicContact CB-CD1 3.91Å; C360-F404 HydrophobicContact CB-CE1 3.81Å
361	K	89	Confident	81.2	Confident	53 Å²	53	74.1 Å²	74.1	23%	0.23	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	127.6	169.9	-65.2	176.8	-173	168	0	109.3	C370 Q371 L372 C373 T403 E405	K361-C370 HydrophobicContact CB-CB 4.23Å; K361-Q371 CarbonylContact C-O 3.59Å; K361-Q371 VanDerWaalsContact CA-O 3.28Å; K361-Q371 WeakPolarHBondContact CA-O 3.35Å; K361-L372 HydrophobicContact CG-CD2 4.17Å; K361-C373 VanDerWaalsContact C-SG 3.59Å; K361-C373 PolarHBondContact N-SG 3.1Å; K361-T403 PolarHBondContact N-O 2.92Å; K361-T403 PolarHBondContact O-N 3.36Å; K361-E405 WeakPolarHBondContact CE-OE2 3.36Å; K361-E405 IonicContact NZ-OE1 2.7Å; K361-E405 PolarHBondContact NZ-OE1 2.82Å; K361-E405 IonicContact NZ-OE2 3.52Å; K361-E405 PolarHBondContact NZ-OE2 2.74Å
362	R	85.1	Confident	80.8	Confident	88 Å²	88	77.1 Å²	77.1	33%	0.332	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	118.3	171.1	-173.8	176.7	-179.4	170.9	-1.4	108.3	C370 Q371 C373 E376 Y402	R362-C370 CarbonylContact O-C 3.59Å; R362-C370 VanDerWaalsContact O-CA 3.28Å; R362-C370 WeakPolarHBondContact O-CA 3.29Å; R362-Q371 PolarHBondContact N-O 3.2Å; R362-Q371 PolarHBondContact O-N 2.87Å; R362-C373 PolarHBondContact N-SG 2.76Å; R362-E376 IonicContact CZ-OE2 3.77Å; R362-E376 IonicContact NH1-OE1 3.1Å; R362-E376 PolarHBondContact NH1-OE1 2.03Å; R362-E376 IonicContact NH1-OE2 2.63Å; R362-E376 PolarHBondContact NH1-OE2 2.75Å; R362-Y402 HydrophobicContact CB-CD1 4.19Å; R362-Y402 HydrophobicContact CB-CE1 4.15Å; R362-Y402 HydrophobicContact CG-CD1 4.35Å; R362-Y402 HydrophobicContact CG-CE1 4.1Å
363	C	79.6	Confident	80.4	Confident	23 Å²	23	66.2 Å²	66.2	16%	0.155	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.1	-174.7	-63.6	0	0	0	0	111.2	Q369 C370 N401	C363-Q369 WeakPolarHBondContact CA-O 3.2Å; C363-C370 HydrophobicContact CB-CB 4.16Å; C363-C370 WeakPolarHBondContact CB-SG 3.49Å; C363-C370 WeakPolarHBondContact SG-CB 3.22Å; C363-C370 CovalentContact SG-SG 2.04Å; C363-C370 PolarHBondContact SG-SG 3.06Å; C363-N401 PolarHBondContact N-O 2.88Å
364	G	69.6	Low	78.8	Confident	28 Å²	28	70.2 Å²	70.2	29%	0.289	39%	0.385	S	S	.	.			trans	-75.8	179.9	169.5	0	0	0	0	0	112.7	G366 Q369	G364-G366 PolarHBondContact O-N 3.29Å; G364-Q369 PolarHBondContact N-O 3.35Å
365	P	60.2	Low	77.3	Confident	143 Å²	143	76.2 Å²	76.2	93%	0.929	42%	0.417	S	S	*	.	S	Bend	trans	-66.4	-5.4	178.8	24.6	-32	0	0	0	114.6
366	G	56.8	Low	75.9	Confident	28 Å²	28	78.8 Å²	78.8	29%	0.289	43%	0.426	S	S	.	.	S	Bend	trans	-107.1	143.1	174.4	0	0	0	0	0	112.6	G364 N368 Q369	G364-G366 PolarHBondContact O-N 3.29Å; G366-N368 PolarHBondContact O-N 3.37Å; G366-Q369 PolarHBondContact O-N 3.13Å
367	P	54.9	Low	75.2	Confident	128 Å²	128	79.2 Å²	79.2	83%	0.831	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-11.3	-171.1	23	-32.8	0	0	0	116.2
368	N	57.8	Low	74.6	Confident	163 Å²	163	83 Å²	83	87%	0.872	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	10.2	-176.9	-80.2	-5.5	0	0	0	114.7	G366	G366-N368 PolarHBondContact O-N 3.37Å
369	Q	69.4	Low	74.4	Confident	144 Å²	144	84.2 Å²	84.2	67%	0.673	45%	0.446	S	S	*	.			trans	-112.5	69.2	176.6	-80.1	-178.5	-4.5	0	0	110.6	C363 G364 G366	C363-Q369 WeakPolarHBondContact CA-O 3.2Å; G364-Q369 PolarHBondContact N-O 3.35Å; G366-Q369 PolarHBondContact O-N 3.13Å
370	C	76.6	Confident	74	Confident	56 Å²	56	83.5 Å²	83.5	38%	0.378	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122	172.4	-61.7	0	0	0	0	109.8	K361 R362 C363	K361-C370 HydrophobicContact CB-CB 4.23Å; R362-C370 CarbonylContact O-C 3.59Å; R362-C370 VanDerWaalsContact O-CA 3.28Å; R362-C370 WeakPolarHBondContact O-CA 3.29Å; C363-C370 HydrophobicContact CB-CB 4.16Å; C363-C370 WeakPolarHBondContact CB-SG 3.49Å; C363-C370 WeakPolarHBondContact SG-CB 3.22Å; C363-C370 CovalentContact SG-SG 2.04Å; C363-C370 PolarHBondContact SG-SG 3.06Å
371	Q	82.3	Confident	73.9	Confident	158 Å²	158	86.8 Å²	86.8	74%	0.738	47%	0.466	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	151.4	175.8	-68.7	-179.3	-10.6	0	0	110.3	K361 R362	K361-Q371 CarbonylContact C-O 3.59Å; K361-Q371 VanDerWaalsContact CA-O 3.28Å; K361-Q371 WeakPolarHBondContact CA-O 3.35Å; R362-Q371 PolarHBondContact N-O 3.2Å; R362-Q371 PolarHBondContact O-N 2.87Å
372	L	83.9	Confident	73.9	Confident	84 Å²	84	93.4 Å²	93.4	44%	0.44	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	141.7	176.2	-71.2	170.9	0	0	0	110.7	Q359 K361 E374	Q359-L372 HydrophobicContact CG-CD2 3.81Å; Q359-L372 VanDerWaalsContact NE2-CD2 3.29Å; K361-L372 HydrophobicContact CG-CD2 4.17Å; L372-E374 VanDerWaalsContact C-N 3.26Å; L372-E374 HydrophobicContact CB-CG 3.91Å; L372-E374 PolarHBondContact O-N 3.39Å
373	C	80.6	Confident	74	Confident	20 Å²	20	90.9 Å²	90.9	14%	0.135	48%	0.484	C	S	.	.			trans	-80.1	70.6	177.6	-46	0	0	0	0	109.7	C360 K361 R362 D375 L377	C360-C373 HydrophobicContact CB-CB 3.59Å; C360-C373 WeakPolarHBondContact CB-SG 3.49Å; C360-C373 PolarHBondContact O-N 2.93Å; C360-C373 VanDerWaalsContact O-N 3.16Å; C360-C373 PolarHBondContact O-SG 3.02Å; C360-C373 VanDerWaalsContact O-SG 3.34Å; C360-C373 WeakPolarHBondContact SG-CB 3.28Å; C360-C373 CovalentContact SG-SG 2.05Å; C360-C373 PolarHBondContact SG-SG 2.89Å; K361-C373 VanDerWaalsContact C-SG 3.59Å; K361-C373 PolarHBondContact N-SG 3.1Å; R362-C373 PolarHBondContact N-SG 2.76Å; C373-D375 PolarHBondContact O-N 3.34Å; C373-L377 HydrophobicContact CB-CD1 4.08Å; C373-L377 HydrophobicContact CB-CG 4.48Å
374	E	58.2	Low	74.5	Confident	150 Å²	150	95.7 Å²	95.7	70%	0.701	51%	0.508	S	S	*	.			trans	-81.3	77.3	-174.3	-66.3	-173.7	171.9	0	0	111.9	L372	L372-E374 VanDerWaalsContact C-N 3.26Å; L372-E374 HydrophobicContact CB-CG 3.91Å; L372-E374 PolarHBondContact O-N 3.39Å
375	D	63.2	Low	75.5	Confident	154 Å²	154	96.3 Å²	96.3	82%	0.824	51%	0.514	S	S	*	.	S	Bend	trans	94	3.4	172.6	-54.2	-37.6	0	0	0	118.1	C373 L377	C373-D375 PolarHBondContact O-N 3.34Å; D375-L377 VanDerWaalsContact C-N 3.31Å
376	E	64.5	Low	77.1	Confident	94 Å²	94	89.9 Å²	89.9	44%	0.439	47%	0.472	S	S	.	.	S	Bend	trans	-69.2	-31.2	171.2	-68.6	-169.2	164.5	0	0	112.6	R362	R362-E376 IonicContact CZ-OE2 3.77Å; R362-E376 IonicContact NH1-OE1 3.1Å; R362-E376 PolarHBondContact NH1-OE1 2.03Å; R362-E376 IonicContact NH1-OE2 2.63Å; R362-E376 PolarHBondContact NH1-OE2 2.75Å
377	L	79.3	Confident	78.7	Confident	16 Å²	16	93.6 Å²	93.6	8%	0.084	49%	0.489	C	S	.	.	S	Bend	trans	-113.2	138.9	-170.4	-61.4	178.5	0	0	0	111.5	C360 C373 D375 F379 V393 F396 Y402 F404	C360-L377 HydrophobicContact CB-CD1 4.25Å; C360-L377 WeakPolarHBondContact SG-CD1 3.43Å; C373-L377 HydrophobicContact CB-CD1 4.08Å; C373-L377 HydrophobicContact CB-CG 4.48Å; D375-L377 VanDerWaalsContact C-N 3.31Å; L377-F379 HydrophobicContact CB-CE2 4.02Å; L377-F379 HydrophobicContact CB-CZ 4.48Å; L377-F379 HydrophobicContact CD1-CZ 4.48Å; L377-V393 HydrophobicContact CB-CG1 4.04Å; L377-V393 HydrophobicContact CD1-CG1 4.03Å; L377-V393 HydrophobicContact CD2-CG1 4.17Å; L377-V393 HydrophobicContact CG-CG1 4.33Å; L377-F396 HydrophobicContact CD2-CB 3.56Å; L377-Y402 HydrophobicContact CD1-CD1 3.87Å; L377-Y402 HydrophobicContact CD1-CE1 3.84Å; L377-Y402 HydrophobicContact CD2-CE1 4.2Å; L377-Y402 HydrophobicContact CG-CE1 4.24Å; L377-F404 HydrophobicContact CD1-CE1 4.34Å; L377-F404 HydrophobicContact CD1-CZ 4.37Å
378	R	82.3	Confident	80.4	Confident	108 Å²	108	92.6 Å²	92.6	41%	0.408	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	122.3	173	-178.2	-179.1	-173.5	-179	3.2	110.5	L380 V393 T394	R378-L380 HydrophobicContact CG-CG 4.42Å; R378-V393 CarbonylContact O-C 3.45Å; R378-V393 WeakPolarHBondContact O-CA 2.95Å; R378-T394 WeakPolarHBondContact CB-OG1 3.05Å; R378-T394 PolarHBondContact N-O 3.26Å; R378-T394 PolarHBondContact O-N 3.43Å
379	F	87.1	Confident	81.9	Confident	32 Å²	32	86 Å²	86	14%	0.14	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	131.4	174.8	-63.9	-96	0	0	0	110.8	V358 C360 L377 P381 P383 V391 T392 V393 F404	V358-F379 HydrophobicContact CG1-CE1 4.17Å; C360-F379 HydrophobicContact CB-CZ 3.94Å; L377-F379 HydrophobicContact CB-CE2 4.02Å; L377-F379 HydrophobicContact CB-CZ 4.48Å; L377-F379 HydrophobicContact CD1-CZ 4.48Å; F379-P381 CarbonylContact C-O 3.58Å; F379-P381 WeakPolarHBondContact CB-O 3.02Å; F379-P381 CarbonylContact O-C 3.55Å; F379-P383 HydrophobicContact CB-CB 4.12Å; F379-P383 HydrophobicContact CB-CG 4.24Å; F379-P383 HydrophobicContact CD1-CB 3.93Å; F379-P383 HydrophobicContact CD2-CB 4.15Å; F379-P383 HydrophobicContact CD2-CG 4.01Å; F379-P383 HydrophobicContact CE1-CB 4.39Å; F379-P383 HydrophobicContact CG-CB 3.8Å; F379-P383 HydrophobicContact CG-CG 4.06Å; F379-V391 HydrophobicContact CB-CG2 4.14Å; F379-V391 HydrophobicContact CD1-CG1 4.48Å; F379-V391 HydrophobicContact CD1-CG2 3.99Å; F379-T392 CarbonylContact C-O 3.58Å; F379-T392 WeakPolarHBondContact CA-O 3.17Å; F379-V393 HydrophobicContact CD1-CG2 3.73Å; F379-V393 HydrophobicContact CE1-CG1 4.34Å; F379-V393 HydrophobicContact CE1-CG2 3.64Å; F379-F404 HydrophobicContact CE1-CD1 4.27Å; F379-F404 AromaticContact CE1-CE1 3.92Å; F379-F404 HydrophobicContact CE1-CE1 3.92Å; F379-F404 HydrophobicContact CZ-CD1 4.48Å; F379-F404 AromaticContact CZ-CE1 3.99Å; F379-F404 HydrophobicContact CZ-CE1 3.99Å
380	L	83.9	Confident	83	Confident	76 Å²	76	81.7 Å²	81.7	40%	0.398	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	107.2	177.9	-68.8	170.9	0	0	0	108.7	R378 T392 T394	R378-L380 HydrophobicContact CG-CG 4.42Å; L380-T392 PolarHBondContact N-O 3.4Å; L380-T392 WeakPolarHBondContact O-CB 3.31Å; L380-T392 PolarHBondContact O-N 3.04Å; L380-T394 HydrophobicContact CD1-CG2 4.44Å
381	P	88	Confident	83.8	Confident	77 Å²	77	79 Å²	79	50%	0.5	41%	0.411	S	S	.	.	S	Bend	cis	-73.5	-177.6	-7.3	30.6	-31.4	0	0	0	113.1	F379 L386 V391	F379-P381 CarbonylContact C-O 3.58Å; F379-P381 WeakPolarHBondContact CB-O 3.02Å; F379-P381 CarbonylContact O-C 3.55Å; P381-L386 HydrophobicContact CB-CD2 4.42Å; P381-L386 HydrophobicContact CG-CD2 3.62Å; P381-V391 WeakPolarHBondContact O-CG2 2.83Å
382	R	88	Confident	84.1	Confident	191 Å²	191	73.3 Å²	73.3	72%	0.721	39%	0.387	S	S	*	.			trans	-53.7	145.1	-177.9	-72.3	-175.8	178.2	178.2	-1.5	112	L384 L386	R382-L384 PolarHBondContact O-N 3.09Å; R382-L384 VanDerWaalsContact O-N 3.14Å; R382-L386 WeakPolarHBondContact O-CD2 3.22Å; R382-L386 WeakPolarHBondContact O-CG 3.42Å
383	P	88	Confident	84.3	Confident	35 Å²	35	69.3 Å²	69.3	23%	0.227	37%	0.366	C	S	.	.	S	Bend	trans	-78.2	-0.8	-167.5	32.3	-34.1	0	0	0	114.6	N357 V358 F379	N357-P383 CarbonylContact C-O 3.55Å; N357-P383 VanDerWaalsContact CA-O 3.3Å; N357-P383 WeakPolarHBondContact CA-O 3.46Å; V358-P383 HydrophobicContact CB-CB 4.31Å; V358-P383 PolarHBondContact N-O 2.99Å; V358-P383 WeakPolarHBondContact O-CB 3.49Å; F379-P383 HydrophobicContact CB-CB 4.12Å; F379-P383 HydrophobicContact CB-CG 4.24Å; F379-P383 HydrophobicContact CD1-CB 3.93Å; F379-P383 HydrophobicContact CD2-CB 4.15Å; F379-P383 HydrophobicContact CD2-CG 4.01Å; F379-P383 HydrophobicContact CE1-CB 4.39Å; F379-P383 HydrophobicContact CG-CB 3.8Å; F379-P383 HydrophobicContact CG-CG 4.06Å
384	L	91.2	Very high	84.4	Confident	124 Å²	124	69.5 Å²	69.5	65%	0.649	37%	0.366	S	S	*	.	S	Bend	trans	-114.9	139.1	179.9	-60.8	176.1	0	0	0	110.2	N357 R382 L386	N357-L384 HydrophobicContact CB-CD2 3.78Å; N357-L384 WeakPolarHBondContact OD1-CA 3.29Å; R382-L384 PolarHBondContact O-N 3.09Å; R382-L384 VanDerWaalsContact O-N 3.14Å; L384-L386 VanDerWaalsContact C-N 3.32Å; L384-L386 PolarHBondContact O-N 3.02Å
385	G	90.1	Very high	85.3	Confident	41 Å²	41	65.3 Å²	65.3	42%	0.423	35%	0.348	S	S	.	.	S	Bend	trans	69.4	28.7	176.5	0	0	0	0	0	113.6	Y356 N357 T387	Y356-G385 PolarHBondContact O-N 3.41Å; N357-G385 PolarHBondContact OD1-N 3.03Å; G385-T387 PolarHBondContact O-N 3.4Å
386	L	92.3	Very high	86.1	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-64.4	128.3	178.2	-66.3	169.8	0	0	0	110.1	W342 T355 Y356 V358 P381 R382 L384 V391	W342-L386 HydrophobicContact CH2-CD1 3.94Å; W342-L386 HydrophobicContact CZ2-CD1 4.24Å; T355-L386 CarbonylContact C-O 3.48Å; T355-L386 VanDerWaalsContact CA-O 3.23Å; T355-L386 WeakPolarHBondContact CA-O 3.47Å; Y356-L386 WeakPolarHBondContact CD2-O 3.28Å; Y356-L386 PolarHBondContact N-O 2.77Å; Y356-L386 WeakPolarHBondContact O-CB 3.23Å; Y356-L386 PolarHBondContact O-N 3.05Å; V358-L386 HydrophobicContact CG2-CD1 3.75Å; P381-L386 HydrophobicContact CB-CD2 4.42Å; P381-L386 HydrophobicContact CG-CD2 3.62Å; R382-L386 WeakPolarHBondContact O-CD2 3.22Å; R382-L386 WeakPolarHBondContact O-CG 3.42Å; L384-L386 VanDerWaalsContact C-N 3.32Å; L384-L386 PolarHBondContact O-N 3.02Å; L386-V391 HydrophobicContact CD1-CB 4.07Å; L386-V391 HydrophobicContact CD1-CG2 4.37Å
387	T	91.1	Very high	86.4	Confident	107 Å²	107	57.3 Å²	57.3	66%	0.656	31%	0.31	S	S	*	.			trans	-92	-29.1	173.5	51.3	0	0	0	0	112.2	G385	G385-T387 PolarHBondContact O-N 3.4Å
388	N	90.1	Very high	85.9	Confident	107 Å²	107	59.9 Å²	59.9	57%	0.572	33%	0.33	S	S	*	.	S	Bend	trans	-87.4	147.6	175.3	-66.9	-11.9	0	0	0	110.3	T390	N388-T390 PolarHBondContact O-N 2.69Å
389	A	90.8	Very high	85.4	Confident	23 Å²	23	60 Å²	60	19%	0.19	34%	0.335	C	S	.	.	S	Bend	trans	-84.3	33.1	-180	0	0	0	0	0	112.9	E341 W342 Y356	E341-A389 WeakPolarHBondContact CA-O 3.19Å; W342-A389 HydrophobicContact CD2-CB 4.43Å; W342-A389 HydrophobicContact CG-CB 4.21Å; W342-A389 PolarHBondContact N-O 2.8Å; W342-A389 WeakPolarHBondContact O-CB 3.37Å; Y356-A389 HydrophobicContact CE2-CB 4.36Å
390	T	91.1	Very high	84.8	Confident	54 Å²	54	58.7 Å²	58.7	33%	0.331	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	139	-175.6	58.1	0	0	0	0	110.3	L340 E341 N388	L340-T390 CarbonylContact O-C 3.51Å; L340-T390 VanDerWaalsContact O-CA 3.23Å; L340-T390 WeakPolarHBondContact O-CA 3.19Å; E341-T390 HydrophobicContact CB-CG2 4.17Å; E341-T390 HydrophobicContact CG-CG2 3.91Å; N388-T390 PolarHBondContact O-N 2.69Å
391	V	93.1	Very high	84.8	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	139.1	168.8	69.2	0	0	0	0	110.6	L340 W342 V358 F379 P381 L386	L340-V391 HydrophobicContact CB-CG1 3.97Å; L340-V391 HydrophobicContact CD1-CG1 4.03Å; L340-V391 HydrophobicContact CG-CG1 4.43Å; L340-V391 PolarHBondContact N-O 2.86Å; L340-V391 PolarHBondContact O-N 3.06Å; W342-V391 HydrophobicContact CH2-CB 4.33Å; W342-V391 HydrophobicContact CH2-CG1 4.03Å; W342-V391 HydrophobicContact CZ3-CG1 3.99Å; V358-V391 HydrophobicContact CG2-CG1 4.15Å; F379-V391 HydrophobicContact CB-CG2 4.14Å; F379-V391 HydrophobicContact CD1-CG1 4.48Å; F379-V391 HydrophobicContact CD1-CG2 3.99Å; P381-V391 WeakPolarHBondContact O-CG2 2.83Å; L386-V391 HydrophobicContact CD1-CB 4.07Å; L386-V391 HydrophobicContact CD1-CG2 4.37Å
392	T	88.9	Confident	84.7	Confident	38 Å²	38	54.2 Å²	54.2	23%	0.233	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.7	175.6	-61.9	0	0	0	0	109.9	C337 F379 L380 T394	C337-T392 WeakPolarHBondContact SG-CG2 3.49Å; F379-T392 CarbonylContact C-O 3.58Å; F379-T392 WeakPolarHBondContact CA-O 3.17Å; L380-T392 PolarHBondContact N-O 3.4Å; L380-T392 WeakPolarHBondContact O-CB 3.31Å; L380-T392 PolarHBondContact O-N 3.04Å; T392-T394 HydrophobicContact CG2-CG2 4.21Å
393	V	89	Confident	84.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.4	179.5	-170.8	0	0	0	0	108.6	L338 L340 L377 R378 F379 F404	L338-V393 HydrophobicContact CB-CB 4.19Å; L338-V393 HydrophobicContact CD2-CB 4.38Å; L338-V393 HydrophobicContact CG-CB 4.47Å; L338-V393 PolarHBondContact N-O 3.4Å; L338-V393 PolarHBondContact O-N 3.15Å; L340-V393 HydrophobicContact CD1-CG2 4.07Å; L340-V393 HydrophobicContact CG-CG2 4.38Å; L377-V393 HydrophobicContact CB-CG1 4.04Å; L377-V393 HydrophobicContact CD1-CG1 4.03Å; L377-V393 HydrophobicContact CD2-CG1 4.17Å; L377-V393 HydrophobicContact CG-CG1 4.33Å; R378-V393 CarbonylContact O-C 3.45Å; R378-V393 WeakPolarHBondContact O-CA 2.95Å; F379-V393 HydrophobicContact CD1-CG2 3.73Å; F379-V393 HydrophobicContact CE1-CG1 4.34Å; F379-V393 HydrophobicContact CE1-CG2 3.64Å; V393-F404 HydrophobicContact CG1-CE1 4.44Å; V393-F404 HydrophobicContact CG1-CZ 4.33Å; V393-F404 HydrophobicContact CG2-CE1 4.14Å; V393-F404 HydrophobicContact CG2-CZ 4.31Å
394	T	83.1	Confident	85	Confident	24 Å²	24	44.2 Å²	44.2	15%	0.147	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	170.6	176.4	65.3	0	0	0	0	110.6	R378 L380 T392 F396	R378-T394 WeakPolarHBondContact CB-OG1 3.05Å; R378-T394 PolarHBondContact N-O 3.26Å; R378-T394 PolarHBondContact O-N 3.43Å; L380-T394 HydrophobicContact CD1-CG2 4.44Å; T392-T394 HydrophobicContact CG2-CG2 4.21Å; T394-F396 VanDerWaalsContact C-N 3.26Å; T394-F396 PolarHBondContact O-N 2.88Å
395	D	77.1	Confident	85.1	Confident	61 Å²	61	40.1 Å²	40.1	33%	0.326	24%	0.239	S	C	.	.	S	Bend	trans	65.6	23.4	178.7	-53.1	-53.2	0	0	0	114.4
396	F	78.4	Confident	85.3	Confident	37 Å²	37	38.2 Å²	38.2	16%	0.162	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-70.5	143	173.9	58.2	-93.3	0	0	0	112.5	M333 L338 L377 T394 Y402 T429	M333-F396 HydrophobicContact CG-CE2 4.49Å; M333-F396 HydrophobicContact CG-CZ 4.11Å; M333-F396 HydrophobicContact SD-CE2 4.21Å; M333-F396 HydrophobicContact SD-CZ 4.39Å; L338-F396 HydrophobicContact CB-CD1 3.97Å; L338-F396 HydrophobicContact CB-CE1 3.8Å; L377-F396 HydrophobicContact CD2-CB 3.56Å; T394-F396 VanDerWaalsContact C-N 3.26Å; T394-F396 PolarHBondContact O-N 2.88Å; F396-Y402 HydrophobicContact CB-CD2 4.49Å; F396-Y402 HydrophobicContact CB-CE2 3.9Å; F396-T429 HydrophobicContact CD2-CG2 3.5Å; F396-T429 VanDerWaalsContact CD2-CG2 3.5Å; F396-T429 HydrophobicContact CE2-CG2 3.86Å; F396-T429 HydrophobicContact CG-CG2 4.42Å
397	S	71.5	Confident	85.4	Confident	43 Å²	43	39.6 Å²	39.6	30%	0.301	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-73.2	139.9	176.6	-65.8	0	0	0	0	110.5	Y402 T429	S397-Y402 WeakPolarHBondContact CB-OH 3.44Å; S397-Y402 PolarHBondContact N-OH 2.75Å; S397-Y402 VanDerWaalsContact N-OH 3.15Å; S397-T429 WeakPolarHBondContact O-CB 2.95Å; S397-T429 PolarHBondContact O-OG1 2.73Å
398	S	68.8	Low	85.5	Confident	71 Å²	71	34.9 Å²	34.9	50%	0.497	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	145.2	161.5	61.3	0	0	0	0	110.1
399	H	71	Confident	85.7	Confident	110 Å²	110	30.6 Å²	30.6	51%	0.509	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.9	41.3	179.6	-48.3	79.7	0	0	0	114.4	T429 Q431	H399-T429 PolarHBondContact N-O 2.83Å; H399-T429 PolarHBondContact N-OG1 3.31Å; H399-Q431 PolarHBondContact CE1-O 3.38Å
400	A	75.6	Confident	85.8	Confident	5 Å²	5	30 Å²	30	4%	0.041	17%	0.167	C	C	.	.			trans	-131.8	144	177.6	0	0	0	0	0	111.9	Y402 T429	A400-Y402 HydrophobicContact CB-CD2 4.16Å; A400-Y402 HydrophobicContact CB-CE2 3.55Å; A400-T429 PolarHBondContact N-OG1 3.01Å; A400-T429 PolarHBondContact O-N 3.23Å; A400-T429 PolarHBondContact O-OG1 3.46Å
401	N	83.5	Confident	85.8	Confident	57 Å²	57	29 Å²	29	31%	0.305	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	111	172.9	-68	-17.6	0	0	0	109.7	C363 V427 S428	C363-N401 PolarHBondContact N-O 2.88Å; N401-V427 CarbonylContact C-O 3.59Å; N401-V427 WeakPolarHBondContact CA-O 3.38Å; N401-S428 WeakPolarHBondContact OD1-CB 3.44Å; N401-S428 PolarHBondContact OD1-OG 2.92Å
402	Y	86.9	Confident	85.8	Confident	1 Å²	1	29 Å²	29	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	125.9	176.6	-66.4	-77.4	0	0	0	110	R362 L377 F396 S397 A400 T426 V427	R362-Y402 HydrophobicContact CB-CD1 4.19Å; R362-Y402 HydrophobicContact CB-CE1 4.15Å; R362-Y402 HydrophobicContact CG-CD1 4.35Å; R362-Y402 HydrophobicContact CG-CE1 4.1Å; L377-Y402 HydrophobicContact CD1-CD1 3.87Å; L377-Y402 HydrophobicContact CD1-CE1 3.84Å; L377-Y402 HydrophobicContact CD2-CE1 4.2Å; L377-Y402 HydrophobicContact CG-CE1 4.24Å; F396-Y402 HydrophobicContact CB-CD2 4.49Å; F396-Y402 HydrophobicContact CB-CE2 3.9Å; S397-Y402 WeakPolarHBondContact CB-OH 3.44Å; S397-Y402 PolarHBondContact N-OH 2.75Å; S397-Y402 VanDerWaalsContact N-OH 3.15Å; A400-Y402 HydrophobicContact CB-CD2 4.16Å; A400-Y402 HydrophobicContact CB-CE2 3.55Å; Y402-T426 CarbonylContact O-C 3.51Å; Y402-T426 VanDerWaalsContact O-CA 3.31Å; Y402-T426 WeakPolarHBondContact O-CA 3.25Å; Y402-V427 PolarHBondContact N-O 2.99Å; Y402-V427 PolarHBondContact O-N 3.23Å
403	T	89.6	Confident	85.9	Confident	16 Å²	16	27.6 Å²	27.6	10%	0.098	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	123.4	173.1	-60.6	0	0	0	0	109.1	K361 I424 I425 T426	K361-T403 PolarHBondContact N-O 2.92Å; K361-T403 PolarHBondContact O-N 3.36Å; T403-I424 HydrophobicContact CG2-CG2 3.39Å; T403-I425 CarbonylContact C-O 3.55Å; T403-I425 WeakPolarHBondContact CA-O 3.42Å; T403-T426 PolarHBondContact OG1-OG1 2.89Å; T403-T426 VanDerWaalsContact OG1-OG1 3.08Å
404	F	91.9	Very high	85.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.1	178.1	-59.7	-87.1	0	0	0	109.8	L338 L340 V358 Q359 C360 L377 F379 V393 I424 I425 V427	L338-F404 HydrophobicContact CD2-CE2 3.74Å; L338-F404 HydrophobicContact CD2-CZ 3.87Å; L340-F404 HydrophobicContact CD1-CB 4Å; L340-F404 HydrophobicContact CD1-CD1 3.67Å; L340-F404 HydrophobicContact CD1-CD2 3.83Å; L340-F404 HydrophobicContact CD1-CE1 4.05Å; L340-F404 HydrophobicContact CD1-CE2 4.2Å; L340-F404 HydrophobicContact CD1-CG 3.55Å; L340-F404 HydrophobicContact CD1-CZ 4.3Å; L340-F404 HydrophobicContact CD2-CD2 4.17Å; L340-F404 HydrophobicContact CD2-CE2 4.43Å; V358-F404 HydrophobicContact CG1-CB 4.26Å; V358-F404 HydrophobicContact CG1-CD1 3.97Å; Q359-F404 CarbonylContact O-C 3.54Å; Q359-F404 WeakPolarHBondContact O-CA 3.36Å; C360-F404 HydrophobicContact CB-CD1 3.91Å; C360-F404 HydrophobicContact CB-CE1 3.81Å; L377-F404 HydrophobicContact CD1-CE1 4.34Å; L377-F404 HydrophobicContact CD1-CZ 4.37Å; F379-F404 HydrophobicContact CE1-CD1 4.27Å; F379-F404 AromaticContact CE1-CE1 3.92Å; F379-F404 HydrophobicContact CE1-CE1 3.92Å; F379-F404 HydrophobicContact CZ-CD1 4.48Å; F379-F404 AromaticContact CZ-CE1 3.99Å; F379-F404 HydrophobicContact CZ-CE1 3.99Å; V393-F404 HydrophobicContact CG1-CE1 4.44Å; V393-F404 HydrophobicContact CG1-CZ 4.33Å; V393-F404 HydrophobicContact CG2-CE1 4.14Å; V393-F404 HydrophobicContact CG2-CZ 4.31Å; F404-I424 WeakPolarHBondContact O-CA 3.26Å; F404-I425 HydrophobicContact CB-CG2 3.89Å; F404-I425 HydrophobicContact CD2-CG2 4.39Å; F404-I425 PolarHBondContact N-O 2.67Å; F404-I425 PolarHBondContact O-N 3.09Å; F404-V427 HydrophobicContact CD2-CG2 4.32Å; F404-V427 HydrophobicContact CE2-CG2 4.16Å
405	E	92.9	Very high	86.1	Confident	38 Å²	38	37.1 Å²	37.1	18%	0.178	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	119.3	172.3	-63.8	-178.6	176.5	0	0	108.4	V358 Q359 K361 V422 A423 I424	V358-E405 WeakPolarHBondContact CA-O 3.16Å; Q359-E405 PolarHBondContact N-O 2.77Å; Q359-E405 PolarHBondContact O-N 2.6Å; K361-E405 WeakPolarHBondContact CE-OE2 3.36Å; K361-E405 IonicContact NZ-OE1 2.7Å; K361-E405 PolarHBondContact NZ-OE1 2.82Å; K361-E405 IonicContact NZ-OE2 3.52Å; K361-E405 PolarHBondContact NZ-OE2 2.74Å; E405-V422 HydrophobicContact CB-CB 4.35Å; E405-V422 HydrophobicContact CB-CG2 4.29Å; E405-V422 HydrophobicContact CG-CG2 4.39Å; E405-A423 CarbonylContact C-O 3.53Å; E405-A423 WeakPolarHBondContact CA-O 3.44Å; E405-I424 HydrophobicContact CG-CG1 4.21Å
406	I	94.1	Very high	86.6	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	112.4	-175.8	-50.6	159.8	0	0	0	107.4	P326 P329 W342 N357 V358 V422 A423 I425	P326-I406 HydrophobicContact CG-CB 4.43Å; P326-I406 HydrophobicContact CG-CG2 3.87Å; P329-I406 HydrophobicContact CB-CD1 4.03Å; W342-I406 HydrophobicContact CD2-CD1 4.13Å; W342-I406 HydrophobicContact CD2-CG2 3.95Å; W342-I406 HydrophobicContact CE3-CD1 3.65Å; W342-I406 HydrophobicContact CE3-CG1 4.45Å; W342-I406 HydrophobicContact CE3-CG2 4.28Å; W342-I406 HydrophobicContact CG-CG2 4.44Å; W342-I406 HydrophobicContact CH2-CG2 4.33Å; W342-I406 HydrophobicContact CZ2-CG2 4.01Å; W342-I406 HydrophobicContact CZ3-CD1 4.11Å; W342-I406 HydrophobicContact CZ3-CG2 4.45Å; N357-I406 WeakPolarHBondContact O-CA 3.21Å; V358-I406 HydrophobicContact CG1-CG1 4.48Å; V358-I406 HydrophobicContact CG2-CG1 4.25Å; V358-I406 HydrophobicContact CG2-CG2 4.27Å; I406-V422 WeakPolarHBondContact O-CA 3.37Å; I406-A423 HydrophobicContact CB-CB 4.49Å; I406-A423 PolarHBondContact N-O 3.06Å; I406-A423 PolarHBondContact O-N 2.9Å; I406-I425 HydrophobicContact CD1-CG2 4.44Å
407	E	93.9	Very high	86.8	Confident	38 Å²	38	40.1 Å²	40.1	18%	0.178	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	146.6	173.1	62.6	173	179.5	0	0	110.9	Y356 N357 L409 R420 V422	Y356-E407 WeakPolarHBondContact CA-O 3.19Å; N357-E407 HydrophobicContact CB-CG 3.61Å; N357-E407 WeakPolarHBondContact CB-OE1 3.31Å; N357-E407 PolarHBondContact N-O 2.78Å; N357-E407 PolarHBondContact ND2-OE1 3.4Å; N357-E407 PolarHBondContact O-N 2.7Å; E407-L409 HydrophobicContact CG-CD1 4.44Å; E407-L409 HydrophobicContact CG-CD2 4.47Å; E407-L409 HydrophobicContact CG-CG 4.29Å; E407-R420 WeakPolarHBondContact OE2-CD 3.09Å; E407-R420 IonicContact OE2-NH1 3.29Å; E407-V422 HydrophobicContact CB-CG1 4.01Å
408	S	94.3	Very high	87.2	Confident	8 Å²	8	45 Å²	45	6%	0.056	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	134.8	170	51.4	0	0	0	0	109.8	P323 S324 T355	P323-S408 VanDerWaalsContact CG-O 3.25Å; P323-S408 WeakPolarHBondContact CG-O 3.34Å; S324-S408 PolarHBondContact O-OG 2.68Å; T355-S408 CarbonylContact O-C 3.58Å; T355-S408 WeakPolarHBondContact O-CA 3.39Å
409	L	93.8	Very high	87.7	Confident	17 Å²	17	47 Å²	47	9%	0.089	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	153.7	-175.3	-59.2	177.9	0	0	0	110.9	L354 T355 N357 E407	L354-L409 CarbonylContact C-O 3.59Å; L354-L409 WeakPolarHBondContact CA-O 3.4Å; L354-L409 WeakPolarHBondContact CD1-O 3.29Å; T355-L409 PolarHBondContact N-O 2.73Å; T355-L409 PolarHBondContact O-N 3.25Å; N357-L409 WeakPolarHBondContact ND2-CD1 3.3Å; E407-L409 HydrophobicContact CG-CD1 4.44Å; E407-L409 HydrophobicContact CG-CD2 4.47Å; E407-L409 HydrophobicContact CG-CG 4.29Å
410	N	93.1	Very high	88.2	Confident	9 Å²	9	46.7 Å²	46.7	5%	0.048	26%	0.255	C	S	.	.			trans	-142	177.1	170.8	71	10.7	0	0	0	109.8	R321 T348 R351 V412 S413	R321-N410 PolarHBondContact O-ND2 2.69Å; T348-N410 PolarHBondContact O-ND2 3.2Å; T348-N410 VanDerWaalsContact O-ND2 3.13Å; R351-N410 HydrophobicContact CB-CB 4.41Å; N410-V412 PolarHBondContact O-N 2.71Å; N410-V412 WeakPolarHBondContact OD1-CG2 3.14Å; N410-V412 PolarHBondContact OD1-N 2.77Å; N410-V412 VanDerWaalsContact OD1-N 3.16Å; N410-S413 PolarHBondContact N-OG 2.79Å; N410-S413 WeakPolarHBondContact O-CB 3.25Å; N410-S413 PolarHBondContact O-N 3.48Å; N410-S413 PolarHBondContact O-OG 2.82Å; N410-S413 PolarHBondContact OD1-N 2.76Å; N410-S413 PolarHBondContact OD1-OG 3.16Å
411	G	90.8	Very high	88.6	Confident	35 Å²	35	52.8 Å²	52.8	36%	0.361	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-9.5	-174.7	0	0	0	0	0	116.8	A310 D353	A310-G411 WeakPolarHBondContact CB-O 3.34Å; D353-G411 WeakPolarHBondContact OD2-CA 3.13Å; D353-G411 PolarHBondContact OD2-N 3.32Å; D353-G411 VanDerWaalsContact OD2-N 3.16Å
412	V	92.9	Very high	89.1	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	3	177.1	-61.7	0	0	0	0	113.5	F308 A310 N410 D414 M415	F308-V412 HydrophobicContact CB-CB 4.09Å; F308-V412 HydrophobicContact CB-CG1 4.12Å; A310-V412 HydrophobicContact CB-CG1 4.31Å; N410-V412 PolarHBondContact O-N 2.71Å; N410-V412 WeakPolarHBondContact OD1-CG2 3.14Å; N410-V412 PolarHBondContact OD1-N 2.77Å; N410-V412 VanDerWaalsContact OD1-N 3.16Å; V412-D414 VanDerWaalsContact C-N 3.27Å; V412-D414 PolarHBondContact O-N 2.87Å; V412-M415 WeakPolarHBondContact O-CB 3.34Å; V412-M415 PolarHBondContact O-N 3.5Å; V412-M415 VanDerWaalsContact O-N 3.09Å
413	S	91.6	Very high	89.3	Confident	8 Å²	8	53.1 Å²	53.1	6%	0.056	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-66.9	-26.4	-175.4	-64.4	0	0	0	0	113.5	P323 N410 M415 R420	P323-S413 WeakPolarHBondContact CD-OG 3.25Å; N410-S413 PolarHBondContact N-OG 2.79Å; N410-S413 WeakPolarHBondContact O-CB 3.25Å; N410-S413 PolarHBondContact O-N 3.48Å; N410-S413 PolarHBondContact O-OG 2.82Å; N410-S413 PolarHBondContact OD1-N 2.76Å; N410-S413 PolarHBondContact OD1-OG 3.16Å; S413-M415 VanDerWaalsContact C-N 3.31Å; S413-R420 PolarHBondContact O-NH2 2.81Å
414	D	89.5	Confident	89.3	Confident	133 Å²	133	56.9 Å²	56.9	71%	0.711	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-77.8	-15.3	175.1	-60.9	-33.9	0	0	0	113.2	V412 R420	V412-D414 VanDerWaalsContact C-N 3.27Å; V412-D414 PolarHBondContact O-N 2.87Å; D414-R420 IonicContact OD1-CZ 3.4Å; D414-R420 IonicContact OD1-NH1 3.05Å; D414-R420 IonicContact OD1-NH2 2.85Å; D414-R420 PolarHBondContact OD1-NH2 2.89Å
415	M	87.9	Confident	89.2	Confident	92 Å²	92	57.8 Å²	57.8	45%	0.453	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-89.5	-12.2	-178.1	-54.4	-172.3	80.5	0	0	113.1	F308 V412 S413	F308-M415 HydrophobicContact CB-CB 4.28Å; F308-M415 HydrophobicContact CB-SD 4.05Å; F308-M415 HydrophobicContact CD1-CB 4.07Å; F308-M415 HydrophobicContact CG-CB 4.04Å; V412-M415 WeakPolarHBondContact O-CB 3.34Å; V412-M415 PolarHBondContact O-N 3.5Å; V412-M415 VanDerWaalsContact O-N 3.09Å; S413-M415 VanDerWaalsContact C-N 3.31Å
416	S	86.3	Confident	88.9	Confident	25 Å²	25	59.5 Å²	59.5	18%	0.175	32%	0.324	C	S	.	.			trans	-84.4	132.8	178.3	173.1	0	0	0	0	111	P322 F418	P322-S416 VanDerWaalsContact CG-CB 3.41Å; S416-F418 VanDerWaalsContact C-N 3.31Å; S416-F418 PolarHBondContact OG-N 3.43Å
417	T	82.3	Confident	88.5	Confident	136 Å²	136	59.5 Å²	59.5	83%	0.834	32%	0.324	S	S	*	.			trans	-85	-4.9	172.8	54.5	0	0	0	0	113.2
418	F	80.1	Confident	87.8	Confident	146 Å²	146	60.2 Å²	60.2	64%	0.64	33%	0.333	S	S	*	.	S	Bend	trans	-77.8	142.8	176.1	-66	-77	0	0	0	111.5	S416	S416-F418 VanDerWaalsContact C-N 3.31Å; S416-F418 PolarHBondContact OG-N 3.43Å
419	P	80	Confident	86.8	Confident	112 Å²	112	60.1 Å²	60.1	73%	0.727	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-61.5	143.6	177.6	25.6	-33.6	0	0	0	111.5
420	R	82.1	Confident	85.2	Confident	104 Å²	104	64.7 Å²	64.7	39%	0.392	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-72.2	137	-178.4	-62.3	-172.3	178.1	-161.9	-8.7	110.7	E407 S413 D414	E407-R420 WeakPolarHBondContact OE2-CD 3.09Å; E407-R420 IonicContact OE2-NH1 3.29Å; S413-R420 PolarHBondContact O-NH2 2.81Å; D414-R420 IonicContact OD1-CZ 3.4Å; D414-R420 IonicContact OD1-NH1 3.05Å; D414-R420 IonicContact OD1-NH2 2.85Å; D414-R420 PolarHBondContact OD1-NH2 2.89Å
421	Q	84	Confident	83.2	Confident	133 Å²	133	71.3 Å²	71.3	62%	0.621	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-94.8	133.8	177.8	-64.9	176.2	45.9	0	0	108.8	P325	P325-Q421 HydrophobicContact CB-CB 4.18Å; P325-Q421 HydrophobicContact CG-CB 4.01Å
422	V	92.3	Very high	80.7	Confident	54 Å²	54	71.7 Å²	71.7	33%	0.327	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	148.2	-174.9	-55.8	0	0	0	0	111	E405 I406 E407 I424	E405-V422 HydrophobicContact CB-CB 4.35Å; E405-V422 HydrophobicContact CB-CG2 4.29Å; E405-V422 HydrophobicContact CG-CG2 4.39Å; I406-V422 WeakPolarHBondContact O-CA 3.37Å; E407-V422 HydrophobicContact CB-CG1 4.01Å; V422-I424 HydrophobicContact CG2-CD1 4.18Å; V422-I424 HydrophobicContact CG2-CG1 3.93Å
423	A	91.6	Very high	78.5	Confident	11 Å²	11	73.8 Å²	73.8	9%	0.091	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	137.7	165.3	0	0	0	0	0	109.1	P326 P329 E405 I406	P326-A423 HydrophobicContact CB-CB 4.25Å; P326-A423 HydrophobicContact CG-CB 4.4Å; P329-A423 HydrophobicContact CG-CB 4.38Å; E405-A423 CarbonylContact C-O 3.53Å; E405-A423 WeakPolarHBondContact CA-O 3.44Å; I406-A423 HydrophobicContact CB-CB 4.49Å; I406-A423 PolarHBondContact N-O 3.06Å; I406-A423 PolarHBondContact O-N 2.9Å
424	I	90.6	Very high	76.1	Confident	95 Å²	95	79 Å²	79	49%	0.487	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	135.8	-172.9	-51.6	-175.7	0	0	0	109.8	T403 F404 E405 V422	T403-I424 HydrophobicContact CG2-CG2 3.39Å; F404-I424 WeakPolarHBondContact O-CA 3.26Å; E405-I424 HydrophobicContact CG-CG1 4.21Å; V422-I424 HydrophobicContact CG2-CD1 4.18Å; V422-I424 HydrophobicContact CG2-CG1 3.93Å
425	I	89.4	Confident	74.1	Confident	19 Å²	19	73.4 Å²	73.4	10%	0.097	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	134.8	173	-168	169.3	0	0	0	111.2	P329 F331 L340 T403 F404 I406	P329-I425 HydrophobicContact CB-CB 4.16Å; P329-I425 HydrophobicContact CB-CD1 4.17Å; P329-I425 HydrophobicContact CB-CG2 4.42Å; P329-I425 HydrophobicContact CG-CB 4.38Å; P329-I425 WeakPolarHBondContact O-CD1 3.21Å; F331-I425 HydrophobicContact CB-CD1 4.17Å; F331-I425 HydrophobicContact CD1-CD1 3.69Å; F331-I425 HydrophobicContact CD1-CG1 4.15Å; F331-I425 HydrophobicContact CG-CD1 4.43Å; L340-I425 HydrophobicContact CD2-CG2 4.29Å; T403-I425 CarbonylContact C-O 3.55Å; T403-I425 WeakPolarHBondContact CA-O 3.42Å; F404-I425 HydrophobicContact CB-CG2 3.89Å; F404-I425 HydrophobicContact CD2-CG2 4.39Å; F404-I425 PolarHBondContact N-O 2.67Å; F404-I425 PolarHBondContact O-N 3.09Å; I406-I425 HydrophobicContact CD1-CG2 4.44Å
426	T	87.4	Confident	72.5	Confident	74 Å²	74	74.7 Å²	74.7	45%	0.454	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	133.9	-179.9	-54.6	0	0	0	0	110.6	Y402 T403	Y402-T426 CarbonylContact O-C 3.51Å; Y402-T426 VanDerWaalsContact O-CA 3.31Å; Y402-T426 WeakPolarHBondContact O-CA 3.25Å; T403-T426 PolarHBondContact OG1-OG1 2.89Å; T403-T426 VanDerWaalsContact OG1-OG1 3.08Å
427	V	84.9	Confident	71.2	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.006	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.1	-175	-175.7	0	0	0	0	110	F331 M333 L338 N401 Y402 F404	F331-V427 HydrophobicContact CB-CG2 4.12Å; F331-V427 HydrophobicContact CD1-CG2 3.87Å; F331-V427 HydrophobicContact CD2-CG1 3.98Å; F331-V427 HydrophobicContact CD2-CG2 4.12Å; F331-V427 HydrophobicContact CE1-CG2 4.29Å; F331-V427 HydrophobicContact CE2-CG1 3.98Å; F331-V427 HydrophobicContact CG-CG1 4.49Å; F331-V427 HydrophobicContact CG-CG2 3.78Å; F331-V427 HydrophobicContact CZ-CG1 4.46Å; M333-V427 HydrophobicContact SD-CG1 4.19Å; L338-V427 HydrophobicContact CD1-CG1 3.83Å; L338-V427 HydrophobicContact CD1-CG2 4.34Å; L338-V427 HydrophobicContact CD2-CB 4.34Å; L338-V427 HydrophobicContact CD2-CG1 4.04Å; L338-V427 HydrophobicContact CD2-CG2 4.27Å; N401-V427 CarbonylContact C-O 3.59Å; N401-V427 WeakPolarHBondContact CA-O 3.38Å; Y402-V427 PolarHBondContact N-O 2.99Å; Y402-V427 PolarHBondContact O-N 3.23Å; F404-V427 HydrophobicContact CD2-CG2 4.32Å; F404-V427 HydrophobicContact CE2-CG2 4.16Å
428	S	79.2	Confident	70.2	Confident	52 Å²	52	68.7 Å²	68.7	36%	0.364	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.7	179.1	-60.5	0	0	0	0	111.2	N401	N401-S428 WeakPolarHBondContact OD1-CB 3.44Å; N401-S428 PolarHBondContact OD1-OG 2.92Å
429	T	73.5	Confident	69.8	Low	6 Å²	6	65.1 Å²	65.1	4%	0.037	39%	0.391	C	S	.	.			trans	-109	68.2	-170	54.1	0	0	0	0	113	M333 F396 S397 H399 A400 Q431	M333-T429 HydrophobicContact SD-CG2 3.9Å; F396-T429 HydrophobicContact CD2-CG2 3.5Å; F396-T429 VanDerWaalsContact CD2-CG2 3.5Å; F396-T429 HydrophobicContact CE2-CG2 3.86Å; F396-T429 HydrophobicContact CG-CG2 4.42Å; S397-T429 WeakPolarHBondContact O-CB 2.95Å; S397-T429 PolarHBondContact O-OG1 2.73Å; H399-T429 PolarHBondContact N-O 2.83Å; H399-T429 PolarHBondContact N-OG1 3.31Å; A400-T429 PolarHBondContact N-OG1 3.01Å; A400-T429 PolarHBondContact O-N 3.23Å; A400-T429 PolarHBondContact O-OG1 3.46Å; T429-Q431 PolarHBondContact O-N 3.23Å
430	D	59.6	Low	69.9	Low	114 Å²	114	60 Å²	60	61%	0.61	36%	0.358	S	S	*	.			trans	-98.6	78.8	-167.2	-58.3	-24.2	0	0	0	114.6
431	Q	50.8	Low	70	Confident	147 Å²	147	61.7 Å²	61.7	69%	0.687	37%	0.368	S	S	*	.			trans	-144.9	130.3	162.1	-66.1	-166.9	-1.7	0	0	111.7	H399 T429	H399-Q431 PolarHBondContact CE1-O 3.38Å; T429-Q431 PolarHBondContact O-N 3.23Å
432	G	39.8	Very low	70.2	Confident	44 Å²	44	59.6 Å²	59.6	45%	0.454	36%	0.357	S	S	.	.			trans	-75.6	163.8	-168.3	0	0	0	0	0	116.5
433	G	45.1	Very low	70	Confident	43 Å²	43	60.7 Å²	60.7	44%	0.443	36%	0.361	S	S	.	.			cis	-162.2	177.4	-0.6	0	0	0	0	0	108.9
434	P	42.4	Very low	69.7	Low	119 Å²	119	65.7 Å²	65.7	77%	0.773	38%	0.377	S	S	*	.			trans	-94.6	149.1	-154.2	35.1	-33.3	0	0	0	115.2
435	S	47.4	Very low	69.5	Low	15 Å²	15	62.2 Å²	62.2	11%	0.105	36%	0.363	C	S	.	.			trans	-155	112	147.8	40.5	0	0	0	0	109.5	V437	S435-V437 PolarHBondContact O-N 3.43Å
436	L	54.6	Low	69.4	Low	118 Å²	118	62.5 Å²	62.5	62%	0.618	37%	0.367	S	S	*	.			trans	-66.5	127.3	172.4	-84.2	151.4	0	0	0	108.5	G438 P457	L436-G438 PolarHBondContact O-N 3.04Å; L436-P457 WeakPolarHBondContact O-CG 3.17Å
437	V	57.5	Low	69.3	Low	8 Å²	8	61 Å²	61	5%	0.048	36%	0.358	C	S	.	.			trans	-59.6	132.6	166.3	-177.8	0	0	0	0	108	S435 W454 Y467 V506 T508	S435-V437 PolarHBondContact O-N 3.43Å; V437-W454 HydrophobicContact CG1-CB 3.77Å; V437-W454 HydrophobicContact CG1-CD2 4.37Å; V437-W454 HydrophobicContact CG1-CG 3.54Å; V437-Y467 HydrophobicContact CG2-CD1 4.39Å; V437-V506 HydrophobicContact CG1-CB 4.27Å; V437-V506 HydrophobicContact CG1-CG1 4.16Å; V437-V506 HydrophobicContact CG2-CG1 4.2Å; V437-T508 HydrophobicContact CG2-CG2 3.44Å; V437-T508 VanDerWaalsContact CG2-CG2 3.44Å
438	G	62.5	Low	69.5	Low	28 Å²	28	65.4 Å²	65.4	29%	0.289	38%	0.382	S	S	.	.			trans	-60.6	176.9	174.6	0	0	0	0	0	112.4	L436 V440	L436-G438 PolarHBondContact O-N 3.04Å; G438-V440 PolarHBondContact O-N 3.07Å
439	A	70.9	Confident	70	Confident	70 Å²	70	63.4 Å²	63.4	58%	0.579	37%	0.368	S	S	*	.			trans	-56.5	125.3	-177.1	0	0	0	0	0	111.7	Y521	A439-Y521 WeakPolarHBondContact CA-OH 3.11Å
440	V	82.4	Confident	70.9	Confident	6 Å²	6	63.1 Å²	63.1	4%	0.036	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	133.8	175	-176.3	0	0	0	0	108.1	G438 L452 W454 V506 Y521 Y523	G438-V440 PolarHBondContact O-N 3.07Å; V440-L452 HydrophobicContact CG1-CB 4.27Å; V440-L452 HydrophobicContact CG1-CD1 4.4Å; V440-L452 HydrophobicContact CG1-CD2 4.3Å; V440-W454 HydrophobicContact CG1-CE3 4.37Å; V440-W454 HydrophobicContact CG2-CB 4.38Å; V440-V506 HydrophobicContact CG1-CG2 4.42Å; V440-V506 HydrophobicContact CG2-CB 4.17Å; V440-V506 HydrophobicContact CG2-CG2 3.67Å; V440-Y521 HydrophobicContact CB-CD2 3.58Å; V440-Y521 HydrophobicContact CB-CE2 3.73Å; V440-Y521 HydrophobicContact CB-CG 4.04Å; V440-Y521 HydrophobicContact CG2-CD2 3.79Å; V440-Y521 HydrophobicContact CG2-CE2 3.73Å; V440-Y523 HydrophobicContact CG1-CE2 4.43Å; V440-Y523 PolarHBondContact O-OH 2.66Å
441	K	83.4	Confident	72.4	Confident	138 Å²	138	57.9 Å²	57.9	60%	0.6	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	138.4	-178.7	-172.7	-177.6	177.1	-172.7	0	109.8	L452 S453	K441-L452 VanDerWaalsContact O-CA 3.32Å; K441-L452 WeakPolarHBondContact O-CA 3.49Å; K441-S453 PolarHBondContact N-O 3.32Å; K441-S453 PolarHBondContact O-N 3.49Å
442	K	88.8	Confident	74.4	Confident	89 Å²	89	51 Å²	51	39%	0.387	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	117.6	168.2	-175.5	-176.1	76.5	173	0	109.7	A445 I450 L452 Y523	K442-A445 HydrophobicContact CD-CB 4.23Å; K442-I450 HydrophobicContact CD-CG2 4.48Å; K442-I450 HydrophobicContact CG-CG2 4.11Å; K442-L452 HydrophobicContact CB-CD2 4.41Å; K442-Y523 HydrophobicContact CB-CD1 3.75Å; K442-Y523 HydrophobicContact CB-CD2 4.31Å; K442-Y523 HydrophobicContact CB-CE1 3.65Å; K442-Y523 HydrophobicContact CB-CE2 4.21Å; K442-Y523 HydrophobicContact CB-CG 4.09Å; K442-Y523 HydrophobicContact CD-CD1 3.9Å; K442-Y523 HydrophobicContact CD-CG 4.06Å; K442-Y523 HydrophobicContact CG-CD1 4.31Å; K442-Y523 HydrophobicContact CG-CG 4.36Å
443	D	88.6	Confident	76.7	Confident	78 Å²	78	50.2 Å²	50.2	42%	0.417	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-50.9	177.6	-64.3	-32.3	0	0	0	110.7	A451 S453	D443-A451 HydrophobicContact CB-CB 4.16Å; D443-A451 PolarHBondContact N-O 2.98Å; D443-S453 PolarHBondContact OD1-OG 3.33Å; D443-S453 VanDerWaalsContact OD2-CB 3.25Å; D443-S453 WeakPolarHBondContact OD2-CB 3.16Å; D443-S453 PolarHBondContact OD2-OG 3.43Å
444	W	85.6	Confident	78.8	Confident	115 Å²	115	48.8 Å²	48.8	44%	0.436	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	162.9	174.2	56.1	-98.4	0	0	0	110.7	S449 A451 I492	W444-S449 WeakPolarHBondContact CH2-OG 3.11Å; W444-S449 WeakPolarHBondContact CZ3-OG 3.12Å; W444-A451 HydrophobicContact CD2-CB 3.71Å; W444-A451 HydrophobicContact CE3-CB 4.4Å; W444-A451 HydrophobicContact CG-CB 4.01Å; W444-A451 HydrophobicContact CH2-CB 4.32Å; W444-A451 HydrophobicContact CZ2-CB 3.64Å; W444-A451 VanDerWaalsContact NE1-CB 3.34Å; W444-A451 PolarHBondContact O-N 3.09Å; W444-I492 HydrophobicContact CH2-CG2 3.78Å; W444-I492 HydrophobicContact CZ2-CD1 3.99Å; W444-I492 HydrophobicContact CZ2-CG1 4.14Å; W444-I492 HydrophobicContact CZ2-CG2 4.02Å
445	A	86.6	Confident	80.5	Confident	23 Å²	23	49.3 Å²	49.3	19%	0.19	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	141.7	173.4	0	0	0	0	0	110	K442 I450 T526	K442-A445 HydrophobicContact CD-CB 4.23Å; A445-I450 HydrophobicContact CB-CG1 4.04Å; A445-T526 HydrophobicContact CB-CG2 4.33Å; A445-T526 WeakPolarHBondContact O-CG2 3.5Å
446	S	85.6	Confident	81.5	Confident	25 Å²	25	53.6 Å²	53.6	18%	0.175	29%	0.286	C	S	.	.			trans	-117.4	179.5	172.2	77.3	0	0	0	0	109.8	N448 S449 T525 T526	S446-N448 PolarHBondContact O-N 3.41Å; S446-N448 VanDerWaalsContact O-N 3.16Å; S446-N448 PolarHBondContact OG-N 3.15Å; S446-N448 PolarHBondContact OG-OD1 2.64Å; S446-N448 VanDerWaalsContact OG-OD1 3.06Å; S446-S449 PolarHBondContact N-O 3.41Å; S446-S449 PolarHBondContact OG-N 3.02Å; S446-S449 PolarHBondContact OG-O 3.28Å; S446-S449 PolarHBondContact OG-OG 3.35Å; S446-T525 VanDerWaalsContact O-CB 3.3Å; S446-T525 WeakPolarHBondContact O-CB 3.34Å; S446-T526 WeakPolarHBondContact CA-OG1 3.02Å; S446-T526 PolarHBondContact O-N 3.44Å; S446-T526 VanDerWaalsContact O-N 3.15Å
447	P	85.4	Confident	81.9	Confident	41 Å²	41	49 Å²	49	27%	0.266	26%	0.264	S	S	.	.	S	Bend	trans	-61.5	-19.2	174.8	-24.6	35.6	0	0	0	114.1	K497 P498 T526 D528	P447-K497 CarbonylContact O-C 3.36Å; P447-P498 HydrophobicContact CB-CB 4.2Å; P447-P498 WeakPolarHBondContact O-CA 3.49Å; P447-P498 WeakPolarHBondContact O-CB 3.45Å; P447-P498 VanDerWaalsContact O-N 3.15Å; P447-T526 WeakPolarHBondContact CA-O 3.03Å; P447-T526 VanDerWaalsContact CD-OG1 3.29Å; P447-T526 WeakPolarHBondContact CD-OG1 3.46Å; P447-T526 VanDerWaalsContact N-OG1 3.12Å; P447-D528 WeakPolarHBondContact CG-OD1 3.49Å
448	N	89.3	Confident	81.8	Confident	94 Å²	94	57.1 Å²	57.1	50%	0.503	30%	0.301	S	S	.	.	S	Bend	trans	-135.8	6.6	-174.8	66.7	0.2	0	0	0	115.2	S446 S494 G495 L496	S446-N448 PolarHBondContact O-N 3.41Å; S446-N448 VanDerWaalsContact O-N 3.16Å; S446-N448 PolarHBondContact OG-N 3.15Å; S446-N448 PolarHBondContact OG-OD1 2.64Å; S446-N448 VanDerWaalsContact OG-OD1 3.06Å; N448-S494 CarbonylContact O-C 3.5Å; N448-G495 PolarHBondContact O-N 3.26Å; N448-L496 VanDerWaalsContact CA-O 3.31Å; N448-L496 WeakPolarHBondContact CA-O 3.23Å; N448-L496 PolarHBondContact O-N 2.81Å
449	S	89.5	Confident	81.6	Confident	11 Å²	11	64 Å²	64	8%	0.077	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	152.8	179.1	61.8	0	0	0	0	113.3	W444 S446 V493	W444-S449 WeakPolarHBondContact CH2-OG 3.11Å; W444-S449 WeakPolarHBondContact CZ3-OG 3.12Å; S446-S449 PolarHBondContact N-O 3.41Å; S446-S449 PolarHBondContact OG-N 3.02Å; S446-S449 PolarHBondContact OG-O 3.28Å; S446-S449 PolarHBondContact OG-OG 3.35Å; S449-V493 CarbonylContact C-O 3.48Å; S449-V493 WeakPolarHBondContact CA-O 3.41Å; S449-V493 VanDerWaalsContact CB-O 3.27Å; S449-V493 WeakPolarHBondContact CB-O 3.44Å
450	I	92.2	Very high	80.8	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	128.6	174.2	-64.3	175.8	0	0	0	108.7	K442 A445 L452 V493 L496 F504 T525	K442-I450 HydrophobicContact CD-CG2 4.48Å; K442-I450 HydrophobicContact CG-CG2 4.11Å; A445-I450 HydrophobicContact CB-CG1 4.04Å; I450-L452 HydrophobicContact CG2-CD2 3.76Å; I450-L452 HydrophobicContact CG2-CG 4.15Å; I450-V493 PolarHBondContact N-O 2.91Å; I450-V493 PolarHBondContact O-N 2.63Å; I450-L496 HydrophobicContact CB-CD1 4.02Å; I450-L496 HydrophobicContact CD1-CD1 3.92Å; I450-L496 HydrophobicContact CG1-CD1 3.77Å; I450-F504 HydrophobicContact CB-CZ 4.36Å; I450-F504 HydrophobicContact CD1-CE2 3.98Å; I450-F504 HydrophobicContact CD1-CZ 4.04Å; I450-T525 HydrophobicContact CD1-CG2 3.98Å; I450-T525 HydrophobicContact CG1-CG2 3.95Å
451	A	91.5	Very high	79.6	Confident	4 Å²	4	68.9 Å²	68.9	3%	0.033	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.3	172	0	0	0	0	0	111	D443 W444 V491 I492	D443-A451 HydrophobicContact CB-CB 4.16Å; D443-A451 PolarHBondContact N-O 2.98Å; W444-A451 HydrophobicContact CD2-CB 3.71Å; W444-A451 HydrophobicContact CE3-CB 4.4Å; W444-A451 HydrophobicContact CG-CB 4.01Å; W444-A451 HydrophobicContact CH2-CB 4.32Å; W444-A451 HydrophobicContact CZ2-CB 3.64Å; W444-A451 VanDerWaalsContact NE1-CB 3.34Å; W444-A451 PolarHBondContact O-N 3.09Å; A451-V491 WeakPolarHBondContact CA-O 3.26Å; A451-I492 HydrophobicContact CB-CG1 4.04Å
452	L	92.5	Very high	78.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	142	-177.4	-58.6	175.8	0	0	0	110.5	V440 K441 K442 I450 W454 V469 S490 V491 F504 Y523	V440-L452 HydrophobicContact CG1-CB 4.27Å; V440-L452 HydrophobicContact CG1-CD1 4.4Å; V440-L452 HydrophobicContact CG1-CD2 4.3Å; K441-L452 VanDerWaalsContact O-CA 3.32Å; K441-L452 WeakPolarHBondContact O-CA 3.49Å; K442-L452 HydrophobicContact CB-CD2 4.41Å; I450-L452 HydrophobicContact CG2-CD2 3.76Å; I450-L452 HydrophobicContact CG2-CG 4.15Å; L452-W454 HydrophobicContact CB-CZ3 4.21Å; L452-V469 HydrophobicContact CD1-CG1 4.34Å; L452-S490 CarbonylContact O-C 3.51Å; L452-S490 WeakPolarHBondContact O-CA 3.18Å; L452-S490 WeakPolarHBondContact O-CB 3.4Å; L452-V491 HydrophobicContact CB-CG1 4.31Å; L452-V491 PolarHBondContact N-O 2.81Å; L452-V491 PolarHBondContact O-N 2.96Å; L452-F504 HydrophobicContact CD1-CB 4.04Å; L452-F504 HydrophobicContact CD1-CD1 3.39Å; L452-F504 HydrophobicContact CD1-CD2 4.35Å; L452-F504 HydrophobicContact CD1-CE1 3.87Å; L452-F504 HydrophobicContact CD1-CG 3.67Å; L452-Y523 HydrophobicContact CD2-CD2 3.51Å; L452-Y523 HydrophobicContact CD2-CE2 3.4Å; L452-Y523 VanDerWaalsContact CD2-CE2 3.4Å
453	S	89.3	Confident	77.6	Confident	29 Å²	29	66 Å²	66	20%	0.203	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	153	169.3	62.8	0	0	0	0	110.6	K441 D443 P489	K441-S453 PolarHBondContact N-O 3.32Å; K441-S453 PolarHBondContact O-N 3.49Å; D443-S453 PolarHBondContact OD1-OG 3.33Å; D443-S453 VanDerWaalsContact OD2-CB 3.25Å; D443-S453 WeakPolarHBondContact OD2-CB 3.16Å; D443-S453 PolarHBondContact OD2-OG 3.43Å; S453-P489 WeakPolarHBondContact CA-O 3.5Å
454	W	89.1	Confident	76.9	Confident	13 Å²	13	63.9 Å²	63.9	5%	0.049	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	156.2	175.1	50.4	87.1	0	0	0	110	V437 V440 L452 Y467 V469 T486 P489 V491 V506	V437-W454 HydrophobicContact CG1-CB 3.77Å; V437-W454 HydrophobicContact CG1-CD2 4.37Å; V437-W454 HydrophobicContact CG1-CG 3.54Å; V440-W454 HydrophobicContact CG1-CE3 4.37Å; V440-W454 HydrophobicContact CG2-CB 4.38Å; L452-W454 HydrophobicContact CB-CZ3 4.21Å; W454-Y467 AromaticContact CD1-CE1 3.94Å; W454-Y467 AromaticContact CE2-CD1 3.86Å; W454-Y467 AromaticContact CE2-CG 3.93Å; W454-Y467 HydrophobicContact CZ2-CD1 4.09Å; W454-Y467 HydrophobicContact CZ2-CD2 4.17Å; W454-Y467 AromaticContact CZ2-CG 3.7Å; W454-Y467 HydrophobicContact CZ2-CG 3.7Å; W454-Y467 AromaticContact NE1-CD1 3.14Å; W454-Y467 AromaticContact NE1-CE1 3.23Å; W454-Y467 AromaticContact NE1-CG 3.58Å; W454-Y467 AromaticContact NE1-CZ 3.76Å; W454-V469 HydrophobicContact CH2-CG2 3.44Å; W454-V469 VanDerWaalsContact CH2-CG2 3.44Å; W454-V469 HydrophobicContact CZ2-CG2 4.3Å; W454-V469 HydrophobicContact CZ3-CG2 3.87Å; W454-T486 HydrophobicContact CH2-CG2 3.68Å; W454-T486 HydrophobicContact CZ2-CG2 3.73Å; W454-P489 PolarHBondContact N-O 2.69Å; W454-P489 WeakPolarHBondContact O-CB 3.33Å; W454-V491 HydrophobicContact CH2-CB 4.31Å; W454-V491 HydrophobicContact CH2-CG1 4.07Å; W454-V491 HydrophobicContact CZ3-CG1 4.04Å; W454-V506 HydrophobicContact CD2-CG1 4.03Å; W454-V506 HydrophobicContact CD2-CG2 4.39Å; W454-V506 HydrophobicContact CE3-CG1 4.32Å; W454-V506 HydrophobicContact CE3-CG2 3.96Å; W454-V506 HydrophobicContact CH2-CG1 4.14Å; W454-V506 HydrophobicContact CH2-CG2 4.47Å; W454-V506 HydrophobicContact CZ2-CG1 3.84Å; W454-V506 HydrophobicContact CZ3-CG1 4.37Å; W454-V506 HydrophobicContact CZ3-CG2 3.99Å
455	Q	77	Confident	76.6	Confident	129 Å²	129	62.4 Å²	62.4	60%	0.603	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-77.2	133.6	176.5	-166	169.9	-10.4	0	0	110
456	Q	69.1	Low	76.3	Confident	106 Å²	106	62.1 Å²	62.1	50%	0.495	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-66.3	134.6	172.6	-176.9	167.8	14.5	0	0	109.3	E458 I464 Y467	Q456-E458 PolarHBondContact O-N 3.4Å; Q456-I464 HydrophobicContact CG-CD1 4.16Å; Q456-Y467 WeakPolarHBondContact CG-OH 3.38Å
457	P	64.3	Low	76.3	Confident	22 Å²	22	61 Å²	61	14%	0.143	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-61.7	130.4	179.5	-19.2	30.9	0	0	0	111.1	L436 E459 T460	L436-P457 WeakPolarHBondContact O-CG 3.17Å; P457-E459 VanDerWaalsContact C-N 3.26Å; P457-E459 PolarHBondContact O-N 3.16Å; P457-T460 HydrophobicContact CB-CG2 4.11Å; P457-T460 HydrophobicContact CG-CG2 4.44Å
458	E	54.5	Low	76.4	Confident	177 Å²	177	59.5 Å²	59.5	83%	0.827	31%	0.314	S	S	*	.	S	Bend	trans	-71.8	-14.9	-174.3	-75.4	-178.9	170.4	0	0	113.9	Q456	Q456-E458 PolarHBondContact O-N 3.4Å
459	E	57.9	Low	76.3	Confident	173 Å²	173	55 Å²	55	81%	0.808	29%	0.29	S	S	*	.			trans	-126.2	103	172	-72.1	-176.6	165.7	0	0	110.2	P457	P457-E459 VanDerWaalsContact C-N 3.26Å; P457-E459 PolarHBondContact O-N 3.16Å
460	T	55	Low	76.1	Confident	50 Å²	50	56.4 Å²	56.4	31%	0.307	29%	0.294	S	S	.	.			trans	-119.7	116.2	167.8	50.9	0	0	0	0	109.4	P457 L462 I464	P457-T460 HydrophobicContact CB-CG2 4.11Å; P457-T460 HydrophobicContact CG-CG2 4.44Å; T460-L462 PolarHBondContact O-N 2.83Å; T460-I464 HydrophobicContact CG2-CD1 3.83Å; T460-I464 HydrophobicContact CG2-CG1 3.98Å
461	T	57	Low	75.9	Confident	128 Å²	128	57.9 Å²	57.9	79%	0.785	30%	0.3	S	S	*	.	S	Bend	trans	-70.5	-21.4	178	48.1	0	0	0	0	112.5
462	L	62.1	Low	75.7	Confident	65 Å²	65	58.5 Å²	58.5	34%	0.34	30%	0.302	S	S	.	.	S	Bend	trans	-127.9	142.6	176.2	-68.9	171.5	0	0	0	110	T460 I464 T510 A511	T460-L462 PolarHBondContact O-N 2.83Å; L462-I464 PolarHBondContact O-N 2.6Å; L462-T510 HydrophobicContact CB-CG2 4.42Å; L462-A511 HydrophobicContact CD1-CB 4.44Å
463	P	68.5	Low	75.4	Confident	102 Å²	102	60.1 Å²	60.1	66%	0.662	31%	0.309	S	S	*	.			trans	-61.6	132.7	179	23.5	-31.5	0	0	0	111.1	I465	P463-I465 PolarHBondContact O-N 2.95Å
464	I	72.1	Confident	75	Confident	33 Å²	33	63 Å²	63	17%	0.169	32%	0.318	C	S	.	.			trans	-69.3	124.4	175.9	-59.1	174.8	0	0	0	108.6	Q456 T460 L462 Y467 T508	Q456-I464 HydrophobicContact CG-CD1 4.16Å; T460-I464 HydrophobicContact CG2-CD1 3.83Å; T460-I464 HydrophobicContact CG2-CG1 3.98Å; L462-I464 PolarHBondContact O-N 2.6Å; I464-Y467 HydrophobicContact CD1-CE1 4.26Å; I464-Y467 VanDerWaalsContact CD1-OH 3.28Å; I464-Y467 WeakPolarHBondContact CD1-OH 3.45Å; I464-Y467 HydrophobicContact CG2-CD2 4.44Å; I464-Y467 HydrophobicContact CG2-CE1 4.31Å; I464-Y467 HydrophobicContact CG2-CE2 3.98Å; I464-T508 HydrophobicContact CD1-CG2 4.25Å
465	I	80.4	Confident	74.2	Confident	85 Å²	85	71.7 Å²	71.7	44%	0.436	36%	0.359	S	S	.	.			trans	-80.2	-53	179.2	-60.8	174.7	0	0	0	109.6	P463 R509	P463-I465 PolarHBondContact O-N 2.95Å; I465-R509 PolarHBondContact N-O 3.17Å
466	D	81.2	Confident	73.5	Confident	16 Å²	16	69.2 Å²	69.2	9%	0.086	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	172.5	175.1	57.7	4.7	0	0	0	111	T486 R487 R509	D466-T486 WeakPolarHBondContact CB-O 3.37Å; D466-R487 HydrophobicContact CB-CG 4.25Å; D466-R509 PolarHBondContact O-N 3.42Å; D466-R509 WeakPolarHBondContact OD1-CB 3.22Å; D466-R509 IonicContact OD1-CZ 3.25Å; D466-R509 VanDerWaalsContact OD1-CZ 3.25Å; D466-R509 IonicContact OD1-NE 2.71Å; D466-R509 PolarHBondContact OD1-NE 3.06Å; D466-R509 IonicContact OD1-NH2 3.03Å; D466-R509 PolarHBondContact OD1-NH2 3.46Å; D466-R509 IonicContact OD2-CZ 3.63Å; D466-R509 IonicContact OD2-NE 3.87Å; D466-R509 IonicContact OD2-NH2 2.7Å; D466-R509 PolarHBondContact OD2-NH2 3.27Å
467	Y	85.2	Confident	73	Confident	3 Å²	3	69.1 Å²	69.1	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	143.9	172.9	-58.6	-93.2	0	0	0	109.4	V437 W454 Q456 I464 R485 T486 P489 V506 R507 T508	V437-Y467 HydrophobicContact CG2-CD1 4.39Å; W454-Y467 AromaticContact CD1-CE1 3.94Å; W454-Y467 AromaticContact CE2-CD1 3.86Å; W454-Y467 AromaticContact CE2-CG 3.93Å; W454-Y467 HydrophobicContact CZ2-CD1 4.09Å; W454-Y467 HydrophobicContact CZ2-CD2 4.17Å; W454-Y467 AromaticContact CZ2-CG 3.7Å; W454-Y467 HydrophobicContact CZ2-CG 3.7Å; W454-Y467 AromaticContact NE1-CD1 3.14Å; W454-Y467 AromaticContact NE1-CE1 3.23Å; W454-Y467 AromaticContact NE1-CG 3.58Å; W454-Y467 AromaticContact NE1-CZ 3.76Å; Q456-Y467 WeakPolarHBondContact CG-OH 3.38Å; I464-Y467 HydrophobicContact CD1-CE1 4.26Å; I464-Y467 VanDerWaalsContact CD1-OH 3.28Å; I464-Y467 WeakPolarHBondContact CD1-OH 3.45Å; I464-Y467 HydrophobicContact CG2-CD2 4.44Å; I464-Y467 HydrophobicContact CG2-CE1 4.31Å; I464-Y467 HydrophobicContact CG2-CE2 3.98Å; Y467-R485 VanDerWaalsContact O-CA 3.25Å; Y467-R485 WeakPolarHBondContact O-CA 3.45Å; Y467-T486 PolarHBondContact N-O 2.92Å; Y467-T486 PolarHBondContact O-N 3.47Å; Y467-P489 HydrophobicContact CE2-CB 4.45Å; Y467-V506 HydrophobicContact CD1-CG1 4.37Å; Y467-R507 WeakPolarHBondContact CA-O 3.49Å; Y467-T508 HydrophobicContact CD1-CG2 3.78Å; Y467-T508 HydrophobicContact CE1-CG2 3.54Å
468	E	86.3	Confident	72.3	Confident	9 Å²	9	76 Å²	76	4%	0.042	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	122.9	172.6	-172.3	176.6	-104.1	0	0	109.8	R485 V506 R507 F514 Y517	E468-R485 HydrophobicContact CB-CG 4.3Å; E468-R485 HydrophobicContact CG-CG 4.17Å; E468-R485 IonicContact OE1-CZ 2.62Å; E468-R485 IonicContact OE1-NE 3.23Å; E468-R485 PolarHBondContact OE1-NE 3.46Å; E468-R485 IonicContact OE1-NH2 2.81Å; E468-R485 PolarHBondContact OE1-NH2 3.36Å; E468-V506 WeakPolarHBondContact O-CA 3.25Å; E468-R507 HydrophobicContact CB-CG 4.13Å; E468-R507 PolarHBondContact N-O 3.34Å; E468-R507 PolarHBondContact O-N 3.41Å; E468-R507 IonicContact OE2-CZ 2.85Å; E468-R507 IonicContact OE2-NE 2.98Å; E468-R507 PolarHBondContact OE2-NE 3.47Å; E468-R507 IonicContact OE2-NH2 2.79Å; E468-R507 PolarHBondContact OE2-NH2 3.13Å; E468-F514 HydrophobicContact CB-CE1 4.43Å; E468-Y517 PolarHBondContact OE2-OH 3.46Å
469	V	86.8	Confident	72.5	Confident	0 Å²	0	74 Å²	74	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	112.3	178.2	-175	0	0	0	0	108.4	L452 W454 S483 T484 V491 F504 V506	L452-V469 HydrophobicContact CD1-CG1 4.34Å; W454-V469 HydrophobicContact CH2-CG2 3.44Å; W454-V469 VanDerWaalsContact CH2-CG2 3.44Å; W454-V469 HydrophobicContact CZ2-CG2 4.3Å; W454-V469 HydrophobicContact CZ3-CG2 3.87Å; V469-S483 CarbonylContact O-C 3.58Å; V469-S483 WeakPolarHBondContact O-CA 2.83Å; V469-T484 PolarHBondContact N-O 2.97Å; V469-T484 PolarHBondContact O-N 2.79Å; V469-V491 HydrophobicContact CB-CG1 4.39Å; V469-V491 HydrophobicContact CG1-CG1 4.36Å; V469-V491 HydrophobicContact CG2-CG1 3.81Å; V469-F504 HydrophobicContact CG1-CD1 4.17Å; V469-V506 HydrophobicContact CB-CG2 4.44Å; V469-V506 HydrophobicContact CG1-CG2 4.17Å; V469-V506 HydrophobicContact CG2-CG1 4.19Å; V469-V506 HydrophobicContact CG2-CG2 3.96Å
470	K	86.4	Confident	72.5	Confident	40 Å²	40	69.6 Å²	69.6	17%	0.174	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	132.2	173.9	176.1	174.6	178.8	-179.8	0	109	Y481 F504 S505 Y517	K470-Y481 HydrophobicContact CD-CD2 4.04Å; K470-Y481 HydrophobicContact CD-CE2 4.27Å; K470-Y481 HydrophobicContact CD-CG 4.18Å; K470-Y481 HydrophobicContact CG-CD2 3.66Å; K470-Y481 HydrophobicContact CG-CE2 4.23Å; K470-Y481 HydrophobicContact CG-CG 3.99Å; K470-F504 CarbonylContact O-C 3.6Å; K470-F504 WeakPolarHBondContact O-CA 3.46Å; K470-S505 PolarHBondContact N-O 2.68Å; K470-S505 PolarHBondContact O-N 3.24Å; K470-Y517 HydrophobicContact CB-CD1 4.47Å; K470-Y517 HydrophobicContact CB-CE1 3.74Å; K470-Y517 HydrophobicContact CD-CE1 4.2Å; K470-Y517 HydrophobicContact CD-CE2 4.3Å
471	Y	88.3	Confident	73.7	Confident	31 Å²	31	71.3 Å²	71.3	12%	0.122	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	148.9	176.6	66.8	-82.5	0	0	0	113.8	S482 V493 L496 Y502 I503 F504	Y471-S482 WeakPolarHBondContact CD1-O 3.36Å; Y471-S482 PolarHBondContact N-O 3.09Å; Y471-S482 PolarHBondContact O-N 3.37Å; Y471-S482 VanDerWaalsContact O-O 3.13Å; Y471-S482 WeakPolarHBondContact OH-CB 2.96Å; Y471-V493 HydrophobicContact CD1-CG1 4.07Å; Y471-V493 HydrophobicContact CD2-CG1 4.06Å; Y471-V493 HydrophobicContact CE1-CG1 3.63Å; Y471-V493 HydrophobicContact CE2-CG1 3.62Å; Y471-V493 HydrophobicContact CG-CG1 4.27Å; Y471-L496 HydrophobicContact CD2-CD2 4.04Å; Y471-L496 HydrophobicContact CE2-CD2 3.71Å; Y471-Y502 HydrophobicContact CD2-CD1 4.25Å; Y471-I503 WeakPolarHBondContact CA-O 3.44Å; Y471-I503 WeakPolarHBondContact CB-O 3.48Å; Y471-F504 VanDerWaalsContact CB-CE1 3.42Å; Y471-F504 HydrophobicContact CD1-CE1 4.45Å; Y471-F504 HydrophobicContact CD2-CE1 4.34Å; Y471-F504 HydrophobicContact CG-CD1 4.19Å; Y471-F504 AromaticContact CG-CE1 3.85Å; Y471-F504 HydrophobicContact CG-CE1 3.85Å
472	Y	86.9	Confident	74.8	Confident	17 Å²	17	68.1 Å²	68.1	7%	0.067	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	156.6	179.4	55.4	-84.7	0	0	0	111.1	K474 E477 Y502 I503 K520	Y472-K474 PolarHBondContact O-N 3.3Å; Y472-E477 HydrophobicContact CD2-CB 4.27Å; Y472-E477 HydrophobicContact CD2-CG 4.47Å; Y472-E477 HydrophobicContact CE2-CB 3.74Å; Y472-E477 HydrophobicContact CE2-CG 3.59Å; Y472-E477 PolarHBondContact OH-OE1 2.9Å; Y472-Y502 CarbonylContact O-C 3.42Å; Y472-Y502 VanDerWaalsContact O-CA 3.32Å; Y472-Y502 WeakPolarHBondContact O-CA 3.22Å; Y472-I503 HydrophobicContact CD1-CB 4.44Å; Y472-I503 HydrophobicContact CD2-CB 4.35Å; Y472-I503 HydrophobicContact CD2-CD1 4.5Å; Y472-I503 HydrophobicContact CE1-CB 4.01Å; Y472-I503 HydrophobicContact CE1-CG2 3.84Å; Y472-I503 HydrophobicContact CE2-CB 3.93Å; Y472-I503 HydrophobicContact CE2-CD1 3.61Å; Y472-I503 HydrophobicContact CE2-CG1 4.22Å; Y472-I503 HydrophobicContact CE2-CG2 4.37Å; Y472-I503 PolarHBondContact N-O 3.31Å; Y472-I503 VanDerWaalsContact N-O 3.15Å; Y472-I503 PolarHBondContact O-N 2.87Å; Y472-K520 VanDerWaalsContact OH-CE 3.27Å; Y472-K520 WeakPolarHBondContact OH-CE 3.14Å; Y472-K520 PolarHBondContact OH-NZ 3.39Å
473	E	86.7	Confident	75.9	Confident	35 Å²	35	67.9 Å²	67.9	16%	0.164	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	131.7	174.4	-68.1	177.3	-164.6	0	0	109	E475 Q476 K497 T500 Y502	E473-E475 PolarHBondContact O-N 2.98Å; E473-E475 VanDerWaalsContact O-N 3.1Å; E473-Q476 HydrophobicContact CB-CB 4.33Å; E473-Q476 HydrophobicContact CB-CG 4.47Å; E473-Q476 PolarHBondContact O-N 2.84Å; E473-K497 WeakPolarHBondContact OE1-CD 3.36Å; E473-K497 WeakPolarHBondContact OE1-CE 3.13Å; E473-K497 IonicContact OE1-NZ 2.71Å; E473-K497 PolarHBondContact OE1-NZ 2.77Å; E473-K497 IonicContact OE2-NZ 2.83Å; E473-K497 PolarHBondContact OE2-NZ 2.92Å; E473-T500 HydrophobicContact CG-CG2 4.1Å; E473-Y502 HydrophobicContact CB-CE1 4.34Å; E473-Y502 HydrophobicContact CG-CD1 3.98Å; E473-Y502 HydrophobicContact CG-CE1 3.28Å; E473-Y502 HydrophobicContact CG-CE2 4.5Å; E473-Y502 PolarHBondContact OE1-OH 3.24Å; E473-Y502 VanDerWaalsContact OE1-OH 3.11Å
474	K	80.8	Confident	76.5	Confident	90 Å²	90	65.4 Å²	65.4	39%	0.391	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-55.3	-33	-175.7	-176.9	172.2	179.8	174.1	0	112.6	Y472 Q476 W501 I503 E522	Y472-K474 PolarHBondContact O-N 3.3Å; K474-Q476 VanDerWaalsContact C-N 3.34Å; K474-W501 HydrophobicContact CB-CB 3.96Å; K474-W501 HydrophobicContact CD-CB 4.27Å; K474-W501 PolarHBondContact N-O 2.69Å; K474-I503 HydrophobicContact CB-CD1 4.36Å; K474-I503 HydrophobicContact CB-CG1 4.31Å; K474-I503 HydrophobicContact CG-CD1 4.08Å; K474-I503 HydrophobicContact CG-CG1 4.39Å; K474-E522 WeakPolarHBondContact CE-OE1 3.36Å; K474-E522 IonicContact NZ-OE1 3.1Å; K474-E522 PolarHBondContact NZ-OE1 3.15Å; K474-E522 IonicContact NZ-OE2 3.71Å; K474-E522 PolarHBondContact NZ-OE2 3.4Å
475	E	71.8	Confident	77.1	Confident	194 Å²	194	70 Å²	70	91%	0.907	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-78.9	-11.2	179.1	-62.7	-177.4	177.1	0	0	114.1	E473	E473-E475 PolarHBondContact O-N 2.98Å; E473-E475 VanDerWaalsContact O-N 3.1Å
476	Q	62.5	Low	77.3	Confident	78 Å²	78	67.1 Å²	67.1	36%	0.364	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-119.1	31.5	-174.3	-64.6	-168.2	-9.7	0	0	114.1	E473 K474 Q478 L479	E473-Q476 HydrophobicContact CB-CB 4.33Å; E473-Q476 HydrophobicContact CB-CG 4.47Å; E473-Q476 PolarHBondContact O-N 2.84Å; K474-Q476 VanDerWaalsContact C-N 3.34Å; Q476-Q478 PolarHBondContact O-N 2.91Å; Q476-L479 PolarHBondContact O-N 3.19Å
477	E	57.6	Low	77.4	Confident	104 Å²	104	76.9 Å²	76.9	49%	0.486	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-26.5	-175.1	-174	159.4	-136.3	0	0	115	Y472 K520	Y472-E477 HydrophobicContact CD2-CB 4.27Å; Y472-E477 HydrophobicContact CD2-CG 4.47Å; Y472-E477 HydrophobicContact CE2-CB 3.74Å; Y472-E477 HydrophobicContact CE2-CG 3.59Å; Y472-E477 PolarHBondContact OH-OE1 2.9Å; E477-K520 IonicContact OE1-NZ 2.78Å; E477-K520 PolarHBondContact OE1-NZ 3.31Å
478	Q	51.1	Low	77.4	Confident	165 Å²	165	78.8 Å²	78.8	77%	0.771	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	-2.6	-172.9	-70.2	-99.1	-24.6	0	0	115.4	Q476	Q476-Q478 PolarHBondContact O-N 2.91Å
479	L	58.2	Low	77.4	Confident	137 Å²	137	80.8 Å²	80.8	72%	0.717	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-42.4	-167.5	-77.1	152.7	0	0	0	114.4	Q476	Q476-L479 PolarHBondContact O-N 3.19Å
480	S	58.3	Low	77.4	Confident	80 Å²	80	83.2 Å²	83.2	56%	0.559	42%	0.416	S	S	*	.			trans	-173.1	145.1	176	55.5	0	0	0	0	112
481	Y	78.8	Confident	77.7	Confident	86 Å²	86	82.1 Å²	82.1	34%	0.337	41%	0.412	S	S	.	.			trans	-116.8	154.9	169.3	69.2	-95	0	0	0	110.9	K470	K470-Y481 HydrophobicContact CD-CD2 4.04Å; K470-Y481 HydrophobicContact CD-CE2 4.27Å; K470-Y481 HydrophobicContact CD-CG 4.18Å; K470-Y481 HydrophobicContact CG-CD2 3.66Å; K470-Y481 HydrophobicContact CG-CE2 4.23Å; K470-Y481 HydrophobicContact CG-CG 3.99Å
482	S	81	Confident	77.8	Confident	61 Å²	61	85.5 Å²	85.5	43%	0.427	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	151.2	169.1	-65.9	0	0	0	0	109.9	Y471	Y471-S482 WeakPolarHBondContact CD1-O 3.36Å; Y471-S482 PolarHBondContact N-O 3.09Å; Y471-S482 PolarHBondContact O-N 3.37Å; Y471-S482 VanDerWaalsContact O-O 3.13Å; Y471-S482 WeakPolarHBondContact OH-CB 2.96Å
483	S	84.6	Confident	78	Confident	59 Å²	59	84.8 Å²	84.8	41%	0.413	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	136.6	177.4	63	0	0	0	0	111.7	V469	V469-S483 CarbonylContact O-C 3.58Å; V469-S483 WeakPolarHBondContact O-CA 2.83Å
484	T	82	Confident	78	Confident	50 Å²	50	87.2 Å²	87.2	31%	0.307	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.6	177	-58.3	0	0	0	0	109.5	V469 V491	V469-T484 PolarHBondContact N-O 2.97Å; V469-T484 PolarHBondContact O-N 2.79Å; T484-V491 HydrophobicContact CG2-CG2 4.11Å
485	R	84.9	Confident	78.2	Confident	129 Å²	129	86.4 Å²	86.4	49%	0.487	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	144.6	-180	-65.7	-176	-179	171.1	0.4	111.7	Y467 E468	Y467-R485 VanDerWaalsContact O-CA 3.25Å; Y467-R485 WeakPolarHBondContact O-CA 3.45Å; E468-R485 HydrophobicContact CB-CG 4.3Å; E468-R485 HydrophobicContact CG-CG 4.17Å; E468-R485 IonicContact OE1-CZ 2.62Å; E468-R485 IonicContact OE1-NE 3.23Å; E468-R485 PolarHBondContact OE1-NE 3.46Å; E468-R485 IonicContact OE1-NH2 2.81Å; E468-R485 PolarHBondContact OE1-NH2 3.36Å
486	T	83.7	Confident	79	Confident	25 Å²	25	77.6 Å²	77.6	15%	0.153	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	144.5	178.5	-179.8	0	0	0	0	110.4	W454 D466 Y467 A488 S490 V491	W454-T486 HydrophobicContact CH2-CG2 3.68Å; W454-T486 HydrophobicContact CZ2-CG2 3.73Å; D466-T486 WeakPolarHBondContact CB-O 3.37Å; Y467-T486 PolarHBondContact N-O 2.92Å; Y467-T486 PolarHBondContact O-N 3.47Å; T486-A488 WeakPolarHBondContact CG2-O 3.34Å; T486-A488 PolarHBondContact OG1-N 2.95Å; T486-A488 PolarHBondContact OG1-O 3.39Å; T486-S490 WeakPolarHBondContact CG2-O 3.46Å; T486-S490 PolarHBondContact OG1-O 3.32Å; T486-V491 HydrophobicContact CG2-CB 4.09Å
487	R	83.8	Confident	80.2	Confident	222 Å²	222	78.7 Å²	78.7	84%	0.838	43%	0.429	S	S	*	.	S	Bend	trans	-88	-19.5	172.2	-66.2	-176	-176.8	167.2	1	112.4	D466	D466-R487 HydrophobicContact CB-CG 4.25Å
488	A	84.8	Confident	81.5	Confident	43 Å²	43	77.2 Å²	77.2	36%	0.355	43%	0.428	S	S	.	.	S	Bend	trans	-88.1	154	175.3	0	0	0	0	0	109.8	T486 S490	T486-A488 WeakPolarHBondContact CG2-O 3.34Å; T486-A488 PolarHBondContact OG1-N 2.95Å; T486-A488 PolarHBondContact OG1-O 3.39Å; A488-S490 PolarHBondContact O-N 2.93Å
489	P	86.8	Confident	83.1	Confident	50 Å²	50	72 Å²	72	33%	0.325	41%	0.413	S	S	.	.	S	Bend	trans	-75.4	33.6	174.1	34.9	-37.3	0	0	0	112.5	S453 W454 Y467	S453-P489 WeakPolarHBondContact CA-O 3.5Å; W454-P489 PolarHBondContact N-O 2.69Å; W454-P489 WeakPolarHBondContact O-CB 3.33Å; Y467-P489 HydrophobicContact CE2-CB 4.45Å
490	S	86.7	Confident	84.5	Confident	52 Å²	52	67 Å²	67	36%	0.364	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	153.8	176.7	63.1	0	0	0	0	111.5	L452 T486 A488	L452-S490 CarbonylContact O-C 3.51Å; L452-S490 WeakPolarHBondContact O-CA 3.18Å; L452-S490 WeakPolarHBondContact O-CB 3.4Å; T486-S490 WeakPolarHBondContact CG2-O 3.46Å; T486-S490 PolarHBondContact OG1-O 3.32Å; A488-S490 PolarHBondContact O-N 2.93Å
491	V	92.3	Very high	86	Confident	16 Å²	16	68.7 Å²	68.7	10%	0.097	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	148	176.2	72.5	0	0	0	0	111.2	A451 L452 W454 V469 T484 T486 V493	A451-V491 WeakPolarHBondContact CA-O 3.26Å; L452-V491 HydrophobicContact CB-CG1 4.31Å; L452-V491 PolarHBondContact N-O 2.81Å; L452-V491 PolarHBondContact O-N 2.96Å; W454-V491 HydrophobicContact CH2-CB 4.31Å; W454-V491 HydrophobicContact CH2-CG1 4.07Å; W454-V491 HydrophobicContact CZ3-CG1 4.04Å; V469-V491 HydrophobicContact CB-CG1 4.39Å; V469-V491 HydrophobicContact CG1-CG1 4.36Å; V469-V491 HydrophobicContact CG2-CG1 3.81Å; T484-V491 HydrophobicContact CG2-CG2 4.11Å; T486-V491 HydrophobicContact CG2-CB 4.09Å; V491-V493 HydrophobicContact CG1-CG2 3.95Å
492	I	90.7	Very high	86.6	Confident	102 Å²	102	65.1 Å²	65.1	52%	0.523	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	114.2	166.9	-56.6	169.6	0	0	0	107.3	W444 A451	W444-I492 HydrophobicContact CH2-CG2 3.78Å; W444-I492 HydrophobicContact CZ2-CD1 3.99Å; W444-I492 HydrophobicContact CZ2-CG1 4.14Å; W444-I492 HydrophobicContact CZ2-CG2 4.02Å; A451-I492 HydrophobicContact CB-CG1 4.04Å
493	V	90.1	Very high	86.9	Confident	3 Å²	3	62.5 Å²	62.5	2%	0.018	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	109.1	176.2	-175.5	0	0	0	0	108.2	S449 I450 Y471 V491 L496 F504	S449-V493 CarbonylContact C-O 3.48Å; S449-V493 WeakPolarHBondContact CA-O 3.41Å; S449-V493 VanDerWaalsContact CB-O 3.27Å; S449-V493 WeakPolarHBondContact CB-O 3.44Å; I450-V493 PolarHBondContact N-O 2.91Å; I450-V493 PolarHBondContact O-N 2.63Å; Y471-V493 HydrophobicContact CD1-CG1 4.07Å; Y471-V493 HydrophobicContact CD2-CG1 4.06Å; Y471-V493 HydrophobicContact CE1-CG1 3.63Å; Y471-V493 HydrophobicContact CE2-CG1 3.62Å; Y471-V493 HydrophobicContact CG-CG1 4.27Å; V491-V493 HydrophobicContact CG1-CG2 3.95Å; V493-L496 HydrophobicContact CB-CD1 4.42Å; V493-L496 HydrophobicContact CG1-CD1 4.21Å; V493-L496 HydrophobicContact CG1-CD2 3.88Å; V493-L496 HydrophobicContact CG1-CG 4.2Å; V493-F504 HydrophobicContact CB-CE1 4.33Å; V493-F504 HydrophobicContact CG1-CE1 4.43Å; V493-F504 HydrophobicContact CG2-CE1 4.07Å
494	S	87.5	Confident	87.2	Confident	86 Å²	86	59.7 Å²	59.7	60%	0.601	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	162.2	-178.1	57.6	0	0	0	0	113.1	N448	N448-S494 CarbonylContact O-C 3.5Å
495	G	84.4	Confident	87.3	Confident	72 Å²	72	57.7 Å²	57.7	74%	0.742	32%	0.318	S	S	*	.	S	Bend	trans	81.5	21	180	0	0	0	0	0	113.6	N448	N448-G495 PolarHBondContact O-N 3.26Å
496	L	89	Confident	87.3	Confident	9 Å²	9	51.6 Å²	51.6	5%	0.047	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-78.5	155	175.5	-58.3	179.9	0	0	0	110.3	N448 I450 Y471 V493 Y502 F504 T525	N448-L496 VanDerWaalsContact CA-O 3.31Å; N448-L496 WeakPolarHBondContact CA-O 3.23Å; N448-L496 PolarHBondContact O-N 2.81Å; I450-L496 HydrophobicContact CB-CD1 4.02Å; I450-L496 HydrophobicContact CD1-CD1 3.92Å; I450-L496 HydrophobicContact CG1-CD1 3.77Å; Y471-L496 HydrophobicContact CD2-CD2 4.04Å; Y471-L496 HydrophobicContact CE2-CD2 3.71Å; V493-L496 HydrophobicContact CB-CD1 4.42Å; V493-L496 HydrophobicContact CG1-CD1 4.21Å; V493-L496 HydrophobicContact CG1-CD2 3.88Å; V493-L496 HydrophobicContact CG1-CG 4.2Å; L496-Y502 HydrophobicContact CB-CD2 4.5Å; L496-Y502 HydrophobicContact CB-CE2 3.82Å; L496-Y502 HydrophobicContact CD1-CD2 4.35Å; L496-Y502 HydrophobicContact CD1-CE2 4.47Å; L496-Y502 HydrophobicContact CD2-CD1 4.12Å; L496-Y502 HydrophobicContact CD2-CD2 4.38Å; L496-Y502 HydrophobicContact CD2-CE1 3.78Å; L496-Y502 HydrophobicContact CD2-CE2 4.05Å; L496-Y502 HydrophobicContact CD2-CG 4.42Å; L496-Y502 HydrophobicContact CG-CE2 4.33Å; L496-F504 HydrophobicContact CD1-CZ 4.28Å; L496-T525 HydrophobicContact CB-CG2 3.8Å; L496-T525 HydrophobicContact CD1-CG2 4.13Å
497	K	87	Confident	87.2	Confident	102 Å²	102	52.1 Å²	52.1	44%	0.443	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-74.7	144.3	175	-68.1	176.5	-172.4	155	0	110.7	P447 E473 T500 Y502 T525	P447-K497 CarbonylContact O-C 3.36Å; E473-K497 WeakPolarHBondContact OE1-CD 3.36Å; E473-K497 WeakPolarHBondContact OE1-CE 3.13Å; E473-K497 IonicContact OE1-NZ 2.71Å; E473-K497 PolarHBondContact OE1-NZ 2.77Å; E473-K497 IonicContact OE2-NZ 2.83Å; E473-K497 PolarHBondContact OE2-NZ 2.92Å; K497-T500 HydrophobicContact CB-CG2 4.38Å; K497-T500 VanDerWaalsContact CB-OG1 3.28Å; K497-T500 WeakPolarHBondContact CB-OG1 3.17Å; K497-Y502 PolarHBondContact N-OH 3.21Å; K497-Y502 VanDerWaalsContact N-OH 3.11Å; K497-T525 WeakPolarHBondContact O-CB 3.29Å; K497-T525 WeakPolarHBondContact O-CG2 3.27Å; K497-T525 PolarHBondContact O-OG1 2.85Å
498	P	86.6	Confident	87	Confident	72 Å²	72	41.7 Å²	41.7	47%	0.468	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	152.3	174.3	25.9	-32.6	0	0	0	112.2	P447 T500	P447-P498 HydrophobicContact CB-CB 4.2Å; P447-P498 WeakPolarHBondContact O-CA 3.49Å; P447-P498 WeakPolarHBondContact O-CB 3.45Å; P447-P498 VanDerWaalsContact O-N 3.15Å; P498-T500 PolarHBondContact O-N 3.4Å; P498-T500 PolarHBondContact O-OG1 2.75Å
499	A	84.6	Confident	86.7	Confident	55 Å²	55	42.8 Å²	42.8	46%	0.455	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	23.4	-179.3	0	0	0	0	0	116.1	Q524 T525	A499-Q524 PolarHBondContact O-NE2 3.35Å; A499-T525 WeakPolarHBondContact CA-O 3.1Å; A499-T525 PolarHBondContact N-OG1 2.93Å
500	T	87.9	Confident	85.8	Confident	32 Å²	32	41.1 Å²	41.1	20%	0.196	24%	0.239	C	C	.	.			trans	-109	138.4	-170.8	-58.3	0	0	0	0	111.6	E473 K497 P498 Y502 Q524 T525	E473-T500 HydrophobicContact CG-CG2 4.1Å; K497-T500 HydrophobicContact CB-CG2 4.38Å; K497-T500 VanDerWaalsContact CB-OG1 3.28Å; K497-T500 WeakPolarHBondContact CB-OG1 3.17Å; P498-T500 PolarHBondContact O-N 3.4Å; P498-T500 PolarHBondContact O-OG1 2.75Å; T500-Y502 HydrophobicContact CG2-CD2 4.24Å; T500-Y502 HydrophobicContact CG2-CE2 3.66Å; T500-Q524 WeakPolarHBondContact O-CA 3.31Å; T500-T525 PolarHBondContact N-OG1 3.27Å; T500-T525 PolarHBondContact O-N 2.98Å; T500-T525 PolarHBondContact O-OG1 3.3Å
501	W	89.2	Confident	84.5	Confident	116 Å²	116	42.6 Å²	42.6	44%	0.439	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	125.9	176.5	-75.8	92.9	0	0	0	111.6	K474 E522 Q524	K474-W501 HydrophobicContact CB-CB 3.96Å; K474-W501 HydrophobicContact CD-CB 4.27Å; K474-W501 PolarHBondContact N-O 2.69Å; W501-E522 HydrophobicContact CE3-CB 4.09Å; W501-E522 HydrophobicContact CZ3-CB 4.14Å; W501-Q524 HydrophobicContact CD2-CB 3.84Å; W501-Q524 HydrophobicContact CD2-CG 4.05Å; W501-Q524 HydrophobicContact CE3-CB 4.03Å; W501-Q524 HydrophobicContact CG-CB 4.35Å; W501-Q524 HydrophobicContact CG-CG 4.12Å; W501-Q524 HydrophobicContact CH2-CB 4.27Å; W501-Q524 HydrophobicContact CZ2-CB 4.08Å; W501-Q524 HydrophobicContact CZ2-CG 4.45Å; W501-Q524 HydrophobicContact CZ3-CB 4.24Å
502	Y	90.3	Very high	82.8	Confident	11 Å²	11	43.4 Å²	43.4	4%	0.043	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.9	175.6	-73.3	-90.7	0	0	0	110.8	Y471 Y472 E473 L496 K497 T500 F504 E522 Y523	Y471-Y502 HydrophobicContact CD2-CD1 4.25Å; Y472-Y502 CarbonylContact O-C 3.42Å; Y472-Y502 VanDerWaalsContact O-CA 3.32Å; Y472-Y502 WeakPolarHBondContact O-CA 3.22Å; E473-Y502 HydrophobicContact CB-CE1 4.34Å; E473-Y502 HydrophobicContact CG-CD1 3.98Å; E473-Y502 HydrophobicContact CG-CE1 3.28Å; E473-Y502 HydrophobicContact CG-CE2 4.5Å; E473-Y502 PolarHBondContact OE1-OH 3.24Å; E473-Y502 VanDerWaalsContact OE1-OH 3.11Å; L496-Y502 HydrophobicContact CB-CD2 4.5Å; L496-Y502 HydrophobicContact CB-CE2 3.82Å; L496-Y502 HydrophobicContact CD1-CD2 4.35Å; L496-Y502 HydrophobicContact CD1-CE2 4.47Å; L496-Y502 HydrophobicContact CD2-CD1 4.12Å; L496-Y502 HydrophobicContact CD2-CD2 4.38Å; L496-Y502 HydrophobicContact CD2-CE1 3.78Å; L496-Y502 HydrophobicContact CD2-CE2 4.05Å; L496-Y502 HydrophobicContact CD2-CG 4.42Å; L496-Y502 HydrophobicContact CG-CE2 4.33Å; K497-Y502 PolarHBondContact N-OH 3.21Å; K497-Y502 VanDerWaalsContact N-OH 3.11Å; T500-Y502 HydrophobicContact CG2-CD2 4.24Å; T500-Y502 HydrophobicContact CG2-CE2 3.66Å; Y502-F504 VanDerWaalsContact CB-CE2 3.41Å; Y502-F504 HydrophobicContact CG-CZ 4.44Å; Y502-E522 WeakPolarHBondContact O-CA 3.23Å; Y502-Y523 PolarHBondContact N-O 2.87Å; Y502-Y523 PolarHBondContact O-N 2.95Å
503	I	89	Confident	81.5	Confident	7 Å²	7	39.8 Å²	39.8	4%	0.036	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.8	170.1	-65.8	174.7	0	0	0	108.3	Y471 Y472 K474 K520 Y521 E522	Y471-I503 WeakPolarHBondContact CA-O 3.44Å; Y471-I503 WeakPolarHBondContact CB-O 3.48Å; Y472-I503 HydrophobicContact CD1-CB 4.44Å; Y472-I503 HydrophobicContact CD2-CB 4.35Å; Y472-I503 HydrophobicContact CD2-CD1 4.5Å; Y472-I503 HydrophobicContact CE1-CB 4.01Å; Y472-I503 HydrophobicContact CE1-CG2 3.84Å; Y472-I503 HydrophobicContact CE2-CB 3.93Å; Y472-I503 HydrophobicContact CE2-CD1 3.61Å; Y472-I503 HydrophobicContact CE2-CG1 4.22Å; Y472-I503 HydrophobicContact CE2-CG2 4.37Å; Y472-I503 PolarHBondContact N-O 3.31Å; Y472-I503 VanDerWaalsContact N-O 3.15Å; Y472-I503 PolarHBondContact O-N 2.87Å; K474-I503 HydrophobicContact CB-CD1 4.36Å; K474-I503 HydrophobicContact CB-CG1 4.31Å; K474-I503 HydrophobicContact CG-CD1 4.08Å; K474-I503 HydrophobicContact CG-CG1 4.39Å; I503-K520 HydrophobicContact CG2-CB 3.71Å; I503-K520 HydrophobicContact CG2-CD 4.11Å; I503-K520 HydrophobicContact CG2-CG 3.83Å; I503-Y521 CarbonylContact C-O 3.56Å; I503-Y521 WeakPolarHBondContact CA-O 3.1Å; I503-E522 HydrophobicContact CG1-CG 4.21Å
504	F	89.4	Confident	80.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	139.2	177.6	-63.1	-92.1	0	0	0	111.4	I450 L452 V469 K470 Y471 V493 L496 Y502 Y521 Y523	I450-F504 HydrophobicContact CB-CZ 4.36Å; I450-F504 HydrophobicContact CD1-CE2 3.98Å; I450-F504 HydrophobicContact CD1-CZ 4.04Å; L452-F504 HydrophobicContact CD1-CB 4.04Å; L452-F504 HydrophobicContact CD1-CD1 3.39Å; L452-F504 HydrophobicContact CD1-CD2 4.35Å; L452-F504 HydrophobicContact CD1-CE1 3.87Å; L452-F504 HydrophobicContact CD1-CG 3.67Å; V469-F504 HydrophobicContact CG1-CD1 4.17Å; K470-F504 CarbonylContact O-C 3.6Å; K470-F504 WeakPolarHBondContact O-CA 3.46Å; Y471-F504 VanDerWaalsContact CB-CE1 3.42Å; Y471-F504 HydrophobicContact CD1-CE1 4.45Å; Y471-F504 HydrophobicContact CD2-CE1 4.34Å; Y471-F504 HydrophobicContact CG-CD1 4.19Å; Y471-F504 AromaticContact CG-CE1 3.85Å; Y471-F504 HydrophobicContact CG-CE1 3.85Å; V493-F504 HydrophobicContact CB-CE1 4.33Å; V493-F504 HydrophobicContact CG1-CE1 4.43Å; V493-F504 HydrophobicContact CG2-CE1 4.07Å; L496-F504 HydrophobicContact CD1-CZ 4.28Å; Y502-F504 VanDerWaalsContact CB-CE2 3.41Å; Y502-F504 HydrophobicContact CG-CZ 4.44Å; F504-Y521 PolarHBondContact N-O 3.22Å; F504-Y521 PolarHBondContact O-N 2.74Å; F504-Y523 AromaticContact CD2-CD2 3.64Å; F504-Y523 HydrophobicContact CD2-CD2 3.64Å; F504-Y523 HydrophobicContact CD2-CE2 4.48Å; F504-Y523 HydrophobicContact CD2-CG 4.44Å; F504-Y523 HydrophobicContact CE2-CD2 4.08Å; F504-Y523 HydrophobicContact CG-CD2 4.41Å
505	S	85.3	Confident	79.5	Confident	8 Å²	8	39 Å²	39	6%	0.056	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	136	172	-60.2	0	0	0	0	110	K470	K470-S505 PolarHBondContact N-O 2.68Å; K470-S505 PolarHBondContact O-N 3.24Å
506	V	85.1	Confident	78.5	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139	-176	-172.6	0	0	0	0	109.8	V437 V440 W454 Y467 E468 V469 S518	V437-V506 HydrophobicContact CG1-CB 4.27Å; V437-V506 HydrophobicContact CG1-CG1 4.16Å; V437-V506 HydrophobicContact CG2-CG1 4.2Å; V440-V506 HydrophobicContact CG1-CG2 4.42Å; V440-V506 HydrophobicContact CG2-CB 4.17Å; V440-V506 HydrophobicContact CG2-CG2 3.67Å; W454-V506 HydrophobicContact CD2-CG1 4.03Å; W454-V506 HydrophobicContact CD2-CG2 4.39Å; W454-V506 HydrophobicContact CE3-CG1 4.32Å; W454-V506 HydrophobicContact CE3-CG2 3.96Å; W454-V506 HydrophobicContact CH2-CG1 4.14Å; W454-V506 HydrophobicContact CH2-CG2 4.47Å; W454-V506 HydrophobicContact CZ2-CG1 3.84Å; W454-V506 HydrophobicContact CZ3-CG1 4.37Å; W454-V506 HydrophobicContact CZ3-CG2 3.99Å; Y467-V506 HydrophobicContact CD1-CG1 4.37Å; E468-V506 WeakPolarHBondContact O-CA 3.25Å; V469-V506 HydrophobicContact CB-CG2 4.44Å; V469-V506 HydrophobicContact CG1-CG2 4.17Å; V469-V506 HydrophobicContact CG2-CG1 4.19Å; V469-V506 HydrophobicContact CG2-CG2 3.96Å; V506-S518 PolarHBondContact N-OG 3.13Å; V506-S518 WeakPolarHBondContact O-CB 3.3Å; V506-S518 PolarHBondContact O-N 3.35Å
507	R	81.6	Confident	77.8	Confident	37 Å²	37	41.5 Å²	41.5	14%	0.14	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	154.2	170.5	65.3	179.4	-179.4	176.4	-1.7	111.5	Y467 E468 F514 S515 Y517	Y467-R507 WeakPolarHBondContact CA-O 3.49Å; E468-R507 HydrophobicContact CB-CG 4.13Å; E468-R507 PolarHBondContact N-O 3.34Å; E468-R507 PolarHBondContact O-N 3.41Å; E468-R507 IonicContact OE2-CZ 2.85Å; E468-R507 IonicContact OE2-NE 2.98Å; E468-R507 PolarHBondContact OE2-NE 3.47Å; E468-R507 IonicContact OE2-NH2 2.79Å; E468-R507 PolarHBondContact OE2-NH2 3.13Å; R507-F514 HydrophobicContact CG-CD1 4.11Å; R507-F514 VanDerWaalsContact NE-CD1 3.29Å; R507-S515 WeakPolarHBondContact CB-OG 3.31Å; R507-Y517 HydrophobicContact CB-CD1 3.88Å; R507-Y517 HydrophobicContact CB-CE1 4.13Å; R507-Y517 HydrophobicContact CB-CG 4.36Å; R507-Y517 VanDerWaalsContact CD-CZ 3.47Å; R507-Y517 HydrophobicContact CG-CD1 3.9Å; R507-Y517 HydrophobicContact CG-CE1 3.61Å; R507-Y517 VanDerWaalsContact CZ-OH 3.29Å; R507-Y517 PolarHBondContact NE-OH 2.76Å; R507-Y517 PolarHBondContact NH2-OH 2.92Å
508	T	78.8	Confident	77.3	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	151.1	174	61.7	0	0	0	0	110.6	V437 I464 Y467 F514 S515	V437-T508 HydrophobicContact CG2-CG2 3.44Å; V437-T508 VanDerWaalsContact CG2-CG2 3.44Å; I464-T508 HydrophobicContact CD1-CG2 4.25Å; Y467-T508 HydrophobicContact CD1-CG2 3.78Å; Y467-T508 HydrophobicContact CE1-CG2 3.54Å; T508-F514 WeakPolarHBondContact O-CA 3.33Å; T508-S515 PolarHBondContact N-OG 2.7Å; T508-S515 PolarHBondContact O-N 3.4Å; T508-S515 WeakPolarHBondContact OG1-CB 3.38Å; T508-S515 PolarHBondContact OG1-OG 2.93Å
509	R	77.8	Confident	77	Confident	67 Å²	67	37.4 Å²	37.4	25%	0.253	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126.7	166.2	-176.3	168.8	60.2	154.5	3	110.1	I465 D466 F514	I465-R509 PolarHBondContact N-O 3.17Å; D466-R509 PolarHBondContact O-N 3.42Å; D466-R509 WeakPolarHBondContact OD1-CB 3.22Å; D466-R509 IonicContact OD1-CZ 3.25Å; D466-R509 VanDerWaalsContact OD1-CZ 3.25Å; D466-R509 IonicContact OD1-NE 2.71Å; D466-R509 PolarHBondContact OD1-NE 3.06Å; D466-R509 IonicContact OD1-NH2 3.03Å; D466-R509 PolarHBondContact OD1-NH2 3.46Å; D466-R509 IonicContact OD2-CZ 3.63Å; D466-R509 IonicContact OD2-NE 3.87Å; D466-R509 IonicContact OD2-NH2 2.7Å; D466-R509 PolarHBondContact OD2-NH2 3.27Å; R509-F514 HydrophobicContact CB-CD1 3.89Å; R509-F514 HydrophobicContact CB-CE1 3.85Å; R509-F514 HydrophobicContact CG-CD1 4.22Å; R509-F514 HydrophobicContact CG-CE1 4.08Å; R509-F514 HydrophobicContact CG-CZ 4.33Å
510	T	68.9	Low	76.9	Confident	15 Å²	15	40.5 Å²	40.5	9%	0.092	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	177.1	173.5	70.2	0	0	0	0	110	L462 G512 G513	L462-T510 HydrophobicContact CB-CG2 4.42Å; T510-G512 PolarHBondContact O-N 2.92Å; T510-G512 VanDerWaalsContact O-N 3.17Å; T510-G512 PolarHBondContact OG1-N 3.43Å; T510-G513 PolarHBondContact N-O 2.75Å; T510-G513 PolarHBondContact O-N 3.17Å; T510-G513 VanDerWaalsContact O-N 3.08Å
511	A	59	Low	76.8	Confident	83 Å²	83	41.6 Å²	41.6	69%	0.686	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-17.8	171.9	0	0	0	0	0	113.5	L462	L462-A511 HydrophobicContact CD1-CB 4.44Å
512	G	57	Low	76.8	Confident	33 Å²	33	40 Å²	40	34%	0.34	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	4.4	175	0	0	0	0	0	114.8	T510	T510-G512 PolarHBondContact O-N 2.92Å; T510-G512 VanDerWaalsContact O-N 3.17Å; T510-G512 PolarHBondContact OG1-N 3.43Å
513	G	62.6	Low	76.9	Confident	25 Å²	25	41 Å²	41	26%	0.258	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	111.3	-162	179.5	0	0	0	0	0	113.9	T510	T510-G513 PolarHBondContact N-O 2.75Å; T510-G513 PolarHBondContact O-N 3.17Å; T510-G513 VanDerWaalsContact O-N 3.08Å
514	F	66.4	Low	76.9	Confident	57 Å²	57	44.2 Å²	44.2	25%	0.25	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	142.5	-177.6	-73.4	-82	0	0	0	112	T336 E468 R507 T508 R509	T336-F514 HydrophobicContact CG2-CD2 4.21Å; T336-F514 HydrophobicContact CG2-CE2 4.08Å; E468-F514 HydrophobicContact CB-CE1 4.43Å; R507-F514 HydrophobicContact CG-CD1 4.11Å; R507-F514 VanDerWaalsContact NE-CD1 3.29Å; T508-F514 WeakPolarHBondContact O-CA 3.33Å; R509-F514 HydrophobicContact CB-CD1 3.89Å; R509-F514 HydrophobicContact CB-CE1 3.85Å; R509-F514 HydrophobicContact CG-CD1 4.22Å; R509-F514 HydrophobicContact CG-CE1 4.08Å; R509-F514 HydrophobicContact CG-CZ 4.33Å
515	S	69.1	Low	76.8	Confident	17 Å²	17	44.4 Å²	44.4	12%	0.119	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-72.9	167.3	168.1	76.5	0	0	0	0	111.8	R507 T508	R507-S515 WeakPolarHBondContact CB-OG 3.31Å; T508-S515 PolarHBondContact N-OG 2.7Å; T508-S515 PolarHBondContact O-N 3.4Å; T508-S515 WeakPolarHBondContact OG1-CB 3.38Å; T508-S515 PolarHBondContact OG1-OG 2.93Å
516	S	64.7	Low	76.6	Confident	80 Å²	80	47 Å²	47	56%	0.559	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-56.3	148.7	159.4	55.5	0	0	0	0	110.3
517	Y	73.1	Confident	75.9	Confident	52 Å²	52	49.1 Å²	49.1	20%	0.204	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-65.3	148.2	172.3	-79.2	-74.4	0	0	0	111.2	E468 K470 R507	E468-Y517 PolarHBondContact OE2-OH 3.46Å; K470-Y517 HydrophobicContact CB-CD1 4.47Å; K470-Y517 HydrophobicContact CB-CE1 3.74Å; K470-Y517 HydrophobicContact CD-CE1 4.2Å; K470-Y517 HydrophobicContact CD-CE2 4.3Å; R507-Y517 HydrophobicContact CB-CD1 3.88Å; R507-Y517 HydrophobicContact CB-CE1 4.13Å; R507-Y517 HydrophobicContact CB-CG 4.36Å; R507-Y517 VanDerWaalsContact CD-CZ 3.47Å; R507-Y517 HydrophobicContact CG-CD1 3.9Å; R507-Y517 HydrophobicContact CG-CE1 3.61Å; R507-Y517 VanDerWaalsContact CZ-OH 3.29Å; R507-Y517 PolarHBondContact NE-OH 2.76Å; R507-Y517 PolarHBondContact NH2-OH 2.92Å
518	S	78.1	Confident	74.7	Confident	6 Å²	6	54 Å²	54	4%	0.042	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-58.2	163.8	166.8	73.3	0	0	0	0	110.8	V506	V506-S518 PolarHBondContact N-OG 3.13Å; V506-S518 WeakPolarHBondContact O-CB 3.3Å; V506-S518 PolarHBondContact O-N 3.35Å
519	P	78.8	Confident	73.2	Confident	82 Å²	82	59.5 Å²	59.5	53%	0.532	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-48.8	153.1	164.4	-25.9	35.2	0	0	0	111.6	Y521	P519-Y521 HydrophobicContact CB-CE2 4.13Å; P519-Y521 WeakPolarHBondContact O-CD2 3.31Å; P519-Y521 WeakPolarHBondContact O-CE2 3.23Å; P519-Y521 PolarHBondContact O-N 2.99Å
520	K	83.6	Confident	71.4	Confident	121 Å²	121	61.8 Å²	61.8	53%	0.526	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-72.2	123.7	176.6	-71.1	178.8	-179.5	177.8	0	109.3	Y472 E477 I503	Y472-K520 VanDerWaalsContact OH-CE 3.27Å; Y472-K520 WeakPolarHBondContact OH-CE 3.14Å; Y472-K520 PolarHBondContact OH-NZ 3.39Å; E477-K520 IonicContact OE1-NZ 2.78Å; E477-K520 PolarHBondContact OE1-NZ 3.31Å; I503-K520 HydrophobicContact CG2-CB 3.71Å; I503-K520 HydrophobicContact CG2-CD 4.11Å; I503-K520 HydrophobicContact CG2-CG 3.83Å
521	Y	84.7	Confident	69.9	Low	54 Å²	54	68.8 Å²	68.8	21%	0.212	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.1	177.1	-67.5	-85.2	0	0	0	110.6	A439 V440 I503 F504 P519	A439-Y521 WeakPolarHBondContact CA-OH 3.11Å; V440-Y521 HydrophobicContact CB-CD2 3.58Å; V440-Y521 HydrophobicContact CB-CE2 3.73Å; V440-Y521 HydrophobicContact CB-CG 4.04Å; V440-Y521 HydrophobicContact CG2-CD2 3.79Å; V440-Y521 HydrophobicContact CG2-CE2 3.73Å; I503-Y521 CarbonylContact C-O 3.56Å; I503-Y521 WeakPolarHBondContact CA-O 3.1Å; F504-Y521 PolarHBondContact N-O 3.22Å; F504-Y521 PolarHBondContact O-N 2.74Å; P519-Y521 HydrophobicContact CB-CE2 4.13Å; P519-Y521 WeakPolarHBondContact O-CD2 3.31Å; P519-Y521 WeakPolarHBondContact O-CE2 3.23Å; P519-Y521 PolarHBondContact O-N 2.99Å
522	E	90	Very high	68.7	Low	83 Å²	83	72.1 Å²	72.1	39%	0.388	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.3	-176.4	-53.4	-168.5	159.5	0	0	111	K474 W501 Y502 I503	K474-E522 WeakPolarHBondContact CE-OE1 3.36Å; K474-E522 IonicContact NZ-OE1 3.1Å; K474-E522 PolarHBondContact NZ-OE1 3.15Å; K474-E522 IonicContact NZ-OE2 3.71Å; K474-E522 PolarHBondContact NZ-OE2 3.4Å; W501-E522 HydrophobicContact CE3-CB 4.09Å; W501-E522 HydrophobicContact CZ3-CB 4.14Å; Y502-E522 WeakPolarHBondContact O-CA 3.23Å; I503-E522 HydrophobicContact CG1-CG 4.21Å
523	Y	91.2	Very high	67.6	Low	33 Å²	33	74.9 Å²	74.9	13%	0.129	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.2	178.2	-57.1	-52.9	0	0	0	111.7	V440 K442 L452 Y502 F504	V440-Y523 HydrophobicContact CG1-CE2 4.43Å; V440-Y523 PolarHBondContact O-OH 2.66Å; K442-Y523 HydrophobicContact CB-CD1 3.75Å; K442-Y523 HydrophobicContact CB-CD2 4.31Å; K442-Y523 HydrophobicContact CB-CE1 3.65Å; K442-Y523 HydrophobicContact CB-CE2 4.21Å; K442-Y523 HydrophobicContact CB-CG 4.09Å; K442-Y523 HydrophobicContact CD-CD1 3.9Å; K442-Y523 HydrophobicContact CD-CG 4.06Å; K442-Y523 HydrophobicContact CG-CD1 4.31Å; K442-Y523 HydrophobicContact CG-CG 4.36Å; L452-Y523 HydrophobicContact CD2-CD2 3.51Å; L452-Y523 HydrophobicContact CD2-CE2 3.4Å; L452-Y523 VanDerWaalsContact CD2-CE2 3.4Å; Y502-Y523 PolarHBondContact N-O 2.87Å; Y502-Y523 PolarHBondContact O-N 2.95Å; F504-Y523 AromaticContact CD2-CD2 3.64Å; F504-Y523 HydrophobicContact CD2-CD2 3.64Å; F504-Y523 HydrophobicContact CD2-CE2 4.48Å; F504-Y523 HydrophobicContact CD2-CG 4.44Å; F504-Y523 HydrophobicContact CE2-CD2 4.08Å; F504-Y523 HydrophobicContact CG-CD2 4.41Å
524	Q	89.1	Confident	66	Low	73 Å²	73	79.1 Å²	79.1	34%	0.341	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	139.9	179.7	-158.6	-175.2	9.1	0	0	111.2	A499 T500 W501	A499-Q524 PolarHBondContact O-NE2 3.35Å; T500-Q524 WeakPolarHBondContact O-CA 3.31Å; W501-Q524 HydrophobicContact CD2-CB 3.84Å; W501-Q524 HydrophobicContact CD2-CG 4.05Å; W501-Q524 HydrophobicContact CE3-CB 4.03Å; W501-Q524 HydrophobicContact CG-CB 4.35Å; W501-Q524 HydrophobicContact CG-CG 4.12Å; W501-Q524 HydrophobicContact CH2-CB 4.27Å; W501-Q524 HydrophobicContact CZ2-CB 4.08Å; W501-Q524 HydrophobicContact CZ2-CG 4.45Å; W501-Q524 HydrophobicContact CZ3-CB 4.24Å
525	T	88.3	Confident	64.4	Low	4 Å²	4	83.5 Å²	83.5	3%	0.025	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-71.3	150.9	166.2	47.1	0	0	0	0	110.9	S446 I450 L496 K497 A499 T500	S446-T525 VanDerWaalsContact O-CB 3.3Å; S446-T525 WeakPolarHBondContact O-CB 3.34Å; I450-T525 HydrophobicContact CD1-CG2 3.98Å; I450-T525 HydrophobicContact CG1-CG2 3.95Å; L496-T525 HydrophobicContact CB-CG2 3.8Å; L496-T525 HydrophobicContact CD1-CG2 4.13Å; K497-T525 WeakPolarHBondContact O-CB 3.29Å; K497-T525 WeakPolarHBondContact O-CG2 3.27Å; K497-T525 PolarHBondContact O-OG1 2.85Å; A499-T525 WeakPolarHBondContact CA-O 3.1Å; A499-T525 PolarHBondContact N-OG1 2.93Å; T500-T525 PolarHBondContact N-OG1 3.27Å; T500-T525 PolarHBondContact O-N 2.98Å; T500-T525 PolarHBondContact O-OG1 3.3Å
526	T	81.8	Confident	62.5	Low	62 Å²	62	91.6 Å²	91.6	38%	0.38	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-73.9	151.6	-178.2	55.9	0	0	0	0	111.5	A445 S446 P447	A445-T526 HydrophobicContact CB-CG2 4.33Å; A445-T526 WeakPolarHBondContact O-CG2 3.5Å; S446-T526 WeakPolarHBondContact CA-OG1 3.02Å; S446-T526 PolarHBondContact O-N 3.44Å; S446-T526 VanDerWaalsContact O-N 3.15Å; P447-T526 WeakPolarHBondContact CA-O 3.03Å; P447-T526 VanDerWaalsContact CD-OG1 3.29Å; P447-T526 WeakPolarHBondContact CD-OG1 3.46Å; P447-T526 VanDerWaalsContact N-OG1 3.12Å
527	G	70.1	Confident	60.9	Low	45 Å²	45	91.7 Å²	91.7	46%	0.464	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-83.4	155.1	169.7	0	0	0	0	0	111.4	S529	G527-S529 PolarHBondContact O-N 3.08Å; G527-S529 VanDerWaalsContact O-N 3.11Å
528	D	55.3	Low	58.8	Low	141 Å²	141	98 Å²	98	75%	0.754	57%	0.571	S	S	*	*			trans	-71.6	102.2	174.7	-74.5	-25.2	0	0	0	109.7	P447	P447-D528 WeakPolarHBondContact CG-OD1 3.49Å
529	S	47.1	Very low	56.6	Low	117 Å²	117	103 Å²	103	82%	0.818	60%	0.601	S	S	*	*			trans	-125.8	112.9	169.2	62.5	0	0	0	0	109.8	G527	G527-S529 PolarHBondContact O-N 3.08Å; G527-S529 VanDerWaalsContact O-N 3.11Å
530	S	39.8	Very low	54.3	Low	114 Å²	114	105.6 Å²	105.6	80%	0.797	61%	0.609	S	S	*	*			trans	-112.7	120	-179.7	55.7	0	0	0	0	110.6
531	D	37.5	Very low	52.5	Low	162 Å²	162	105.8 Å²	105.8	87%	0.866	62%	0.62	S	S	*	*			trans	-136.4	128.1	159.9	-107.2	-25.4	0	0	0	110.8
532	I	35.2	Very low	50.5	Low	154 Å²	154	109.3 Å²	109.3	79%	0.79	64%	0.641	S	S	*	*			trans	79.3	86.5	164.1	-45.9	177.8	0	0	0	118.8
533	A	32.4	Very low	48.2	Very low	91 Å²	91	111.2 Å²	111.2	75%	0.752	66%	0.658	S	S	*	*				48	128.7	127.7	0	0	0	0	0	119.2
534	S	30.3	Very low	45.9	Very low	113 Å²	113	115.3 Å²	115.3	79%	0.79	69%	0.687	S	S	*	*				-167.8	143.7	60.1	55	0	0	0	0	113.3
535	D	31.4	Very low	43.8	Very low	149 Å²	149	115.8 Å²	115.8	80%	0.797	70%	0.704	S	S	*	*			trans	70.4	89	139.8	-140.3	28.8	0	0	0	120
536	Q	29.4	Very low	42	Very low	188 Å²	188	119.1 Å²	119.1	88%	0.879	73%	0.732	S	S	*	*				176.1	119.4	118.5	-98.8	-179.8	-8.9	0	0	111.9
537	G	32.4	Very low	40.5	Very low	81 Å²	81	121.1 Å²	121.1	84%	0.835	74%	0.744	S	S	*	*			trans	75.6	74.7	142.2	0	0	0	0	0	119.2
538	Q	27.7	Very low	39.5	Very low	186 Å²	186	120.8 Å²	120.8	87%	0.869	74%	0.74	S	S	*	*			trans	-158.2	132.7	158.5	-118.6	-173.3	5	0	0	105.9
539	V	32.1	Very low	39.4	Very low	111 Å²	111	115.8 Å²	115.8	67%	0.673	72%	0.721	S	S	*	*			cis	-170.1	140.3	49.4	168.4	0	0	0	0	106.6
540	L	30.4	Very low	39.9	Very low	136 Å²	136	117 Å²	117	71%	0.712	71%	0.712	S	S	*	*				-164.5	94.5	123.3	-155.8	59.5	0	0	0	112.4	I542	L540-I542 VanDerWaalsContact C-N 3.28Å; L540-I542 HydrophobicContact CD1-CD1 3.69Å; L540-I542 HydrophobicContact CD1-CG1 3.83Å; L540-I542 HydrophobicContact CD2-CB 4.49Å; L540-I542 HydrophobicContact CD2-CD1 4.06Å; L540-I542 HydrophobicContact CD2-CG1 4.27Å; L540-I542 HydrophobicContact CG-CB 4.23Å; L540-I542 HydrophobicContact CG-CD1 3.95Å; L540-I542 HydrophobicContact CG-CG1 3.78Å; L540-I542 PolarHBondContact O-N 3.46Å
541	V	46.2	Very low	41	Very low	125 Å²	125	114.8 Å²	114.8	76%	0.758	69%	0.694	S	S	*	*			trans	-67.4	81	157.7	176.5	0	0	0	0	108.4
542	I	43.8	Very low	42.2	Very low	127 Å²	127	112.4 Å²	112.4	65%	0.651	68%	0.681	S	S	*	*			trans	-147.9	39.3	163.2	-47.5	176.7	0	0	0	111.9	L540	L540-I542 VanDerWaalsContact C-N 3.28Å; L540-I542 HydrophobicContact CD1-CD1 3.69Å; L540-I542 HydrophobicContact CD1-CG1 3.83Å; L540-I542 HydrophobicContact CD2-CB 4.49Å; L540-I542 HydrophobicContact CD2-CD1 4.06Å; L540-I542 HydrophobicContact CD2-CG1 4.27Å; L540-I542 HydrophobicContact CG-CB 4.23Å; L540-I542 HydrophobicContact CG-CD1 3.95Å; L540-I542 HydrophobicContact CG-CG1 3.78Å; L540-I542 PolarHBondContact O-N 3.46Å
543	V	40.9	Very low	43.7	Very low	123 Å²	123	110.3 Å²	110.3	75%	0.745	67%	0.671	S	S	*	*	S	Bend	trans	-136.2	-20.6	168.1	-177.6	0	0	0	0	114.5
544	T	42.9	Very low	45.6	Very low	120 Å²	120	109.4 Å²	109.4	74%	0.736	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-9.8	-177.9	43.1	0	0	0	0	115.1
545	A	45.7	Very low	47.5	Very low	83 Å²	83	109.3 Å²	109.3	69%	0.686	64%	0.642	S	S	*	*	H	α-helix	trans	-79.7	-17.1	179.5	0	0	0	0	0	114.5	G549	A545-G549 PolarHBondContact O-N 3.43Å
546	A	49.3	Very low	49.3	Very low	74 Å²	74	106.1 Å²	106.1	61%	0.612	63%	0.625	S	S	*	*	H	α-helix	trans	-82.2	-31.8	-178.3	0	0	0	0	0	113.3	F550	A546-F550 WeakPolarHBondContact O-CB 3.02Å; A546-F550 PolarHBondContact O-N 2.95Å
547	V	49.8	Very low	51.2	Low	104 Å²	104	100.5 Å²	100.5	63%	0.63	60%	0.603	S	S	*	*	H	α-helix	trans	-84.4	-34.2	-178.3	-176.3	0	0	0	0	111.5	T551	V547-T551 WeakPolarHBondContact O-CB 3.23Å; V547-T551 VanDerWaalsContact O-CG2 3.31Å; V547-T551 WeakPolarHBondContact O-CG2 3.11Å; V547-T551 PolarHBondContact O-N 3.46Å; V547-T551 PolarHBondContact O-OG1 3.35Å
548	G	50.3	Low	53	Low	38 Å²	38	101 Å²	101	39%	0.392	59%	0.586	S	S	.	*	H	α-helix	trans	-69.3	-42.4	174.6	0	0	0	0	0	113.1	T551 L552	G548-T551 WeakPolarHBondContact CA-OG1 3.46Å; G548-T551 PolarHBondContact O-OG1 2.93Å; G548-T551 VanDerWaalsContact O-OG1 3.09Å; G548-L552 VanDerWaalsContact O-CB 3.25Å; G548-L552 WeakPolarHBondContact O-CB 3.49Å; G548-L552 PolarHBondContact O-N 2.96Å
549	G	53.6	Low	55	Low	35 Å²	35	98.2 Å²	98.2	36%	0.361	57%	0.571	S	S	.	*	H	α-helix	trans	-67.4	-39.4	177.6	0	0	0	0	0	113.1	A545 L553	A545-G549 PolarHBondContact O-N 3.43Å; G549-L553 VanDerWaalsContact O-CB 3.26Å; G549-L553 WeakPolarHBondContact O-CB 3.39Å; G549-L553 WeakPolarHBondContact O-CG 3.37Å; G549-L553 PolarHBondContact O-N 2.92Å
550	F	57.4	Low	56.6	Low	142 Å²	142	98.2 Å²	98.2	62%	0.623	57%	0.567	S	S	*	*	H	α-helix	trans	-73	-36.4	178.7	-156.5	-105.9	0	0	0	112.1	A546 I554	A546-F550 WeakPolarHBondContact O-CB 3.02Å; A546-F550 PolarHBondContact O-N 2.95Å; F550-I554 HydrophobicContact CD1-CD1 3.45Å; F550-I554 VanDerWaalsContact CD1-CD1 3.45Å; F550-I554 HydrophobicContact CD1-CG1 4.29Å; F550-I554 HydrophobicContact CE1-CD1 3.37Å; F550-I554 HydrophobicContact CE1-CG1 4.29Å; F550-I554 HydrophobicContact CG-CD1 4.38Å; F550-I554 HydrophobicContact CZ-CD1 4.23Å; F550-I554 VanDerWaalsContact O-CB 3.29Å; F550-I554 WeakPolarHBondContact O-CB 3.31Å; F550-I554 WeakPolarHBondContact O-CG1 3.49Å; F550-I554 PolarHBondContact O-N 3.21Å
551	T	61.4	Low	58.3	Low	69 Å²	69	96.4 Å²	96.4	42%	0.423	56%	0.558	S	S	.	*	H	α-helix	trans	-71	-37.9	173.1	49.1	0	0	0	0	112.2	V547 G548 I554 I555	V547-T551 WeakPolarHBondContact O-CB 3.23Å; V547-T551 VanDerWaalsContact O-CG2 3.31Å; V547-T551 WeakPolarHBondContact O-CG2 3.11Å; V547-T551 PolarHBondContact O-N 3.46Å; V547-T551 PolarHBondContact O-OG1 3.35Å; G548-T551 WeakPolarHBondContact CA-OG1 3.46Å; G548-T551 PolarHBondContact O-OG1 2.93Å; G548-T551 VanDerWaalsContact O-OG1 3.09Å; T551-I554 PolarHBondContact O-N 3.2Å; T551-I555 VanDerWaalsContact O-CB 3.29Å; T551-I555 WeakPolarHBondContact O-CB 3.34Å; T551-I555 WeakPolarHBondContact O-CD1 3.03Å; T551-I555 WeakPolarHBondContact O-CG1 3.22Å; T551-I555 PolarHBondContact O-N 3.09Å
552	L	62.8	Low	59.1	Low	112 Å²	112	95 Å²	95	59%	0.586	55%	0.545	S	S	*	.	H	α-helix	trans	-70.4	-35.1	175.5	-149	109.8	0	0	0	111.9	G548 L556	G548-L552 VanDerWaalsContact O-CB 3.25Å; G548-L552 WeakPolarHBondContact O-CB 3.49Å; G548-L552 PolarHBondContact O-N 2.96Å; L552-L556 HydrophobicContact CD2-CD1 3.82Å; L552-L556 HydrophobicContact CG-CD1 4.4Å; L552-L556 VanDerWaalsContact O-CB 3.22Å; L552-L556 WeakPolarHBondContact O-CB 3.42Å; L552-L556 PolarHBondContact O-N 2.87Å
553	L	67.8	Low	59.8	Low	110 Å²	110	90.9 Å²	90.9	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-70.9	-37.4	172.3	-83.8	164.8	0	0	0	112.4	G549 T557	G549-L553 VanDerWaalsContact O-CB 3.26Å; G549-L553 WeakPolarHBondContact O-CB 3.39Å; G549-L553 WeakPolarHBondContact O-CG 3.37Å; G549-L553 PolarHBondContact O-N 2.92Å; L553-T557 VanDerWaalsContact O-CB 3.27Å; L553-T557 WeakPolarHBondContact O-CB 3.37Å; L553-T557 VanDerWaalsContact O-CG2 3.23Å; L553-T557 WeakPolarHBondContact O-CG2 3.46Å; L553-T557 PolarHBondContact O-N 3.34Å; L553-T557 PolarHBondContact O-OG1 3.49Å
554	I	71.1	Confident	60.5	Low	71 Å²	71	86.5 Å²	86.5	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-67.3	-41.1	172.8	-74.7	173	0	0	0	110.5	F550 T551 T557 L558	F550-I554 HydrophobicContact CD1-CD1 3.45Å; F550-I554 VanDerWaalsContact CD1-CD1 3.45Å; F550-I554 HydrophobicContact CD1-CG1 4.29Å; F550-I554 HydrophobicContact CE1-CD1 3.37Å; F550-I554 HydrophobicContact CE1-CG1 4.29Å; F550-I554 HydrophobicContact CG-CD1 4.38Å; F550-I554 HydrophobicContact CZ-CD1 4.23Å; F550-I554 VanDerWaalsContact O-CB 3.29Å; F550-I554 WeakPolarHBondContact O-CB 3.31Å; F550-I554 WeakPolarHBondContact O-CG1 3.49Å; F550-I554 PolarHBondContact O-N 3.21Å; T551-I554 PolarHBondContact O-N 3.2Å; I554-T557 WeakPolarHBondContact CA-OG1 3.25Å; I554-T557 PolarHBondContact O-N 3.46Å; I554-T557 PolarHBondContact O-OG1 3.23Å; I554-L558 HydrophobicContact CG2-CD1 3.67Å; I554-L558 WeakPolarHBondContact O-CB 3.41Å; I554-L558 PolarHBondContact O-N 2.98Å
555	I	71.8	Confident	61	Low	112 Å²	112	89.3 Å²	89.3	57%	0.574	50%	0.502	S	S	*	.	H	α-helix	trans	-69.8	-39.1	176.4	-68	164.4	0	0	0	110.8	T551 F559	T551-I555 VanDerWaalsContact O-CB 3.29Å; T551-I555 WeakPolarHBondContact O-CB 3.34Å; T551-I555 WeakPolarHBondContact O-CD1 3.03Å; T551-I555 WeakPolarHBondContact O-CG1 3.22Å; T551-I555 PolarHBondContact O-N 3.09Å; I555-F559 WeakPolarHBondContact O-CA 3.47Å; I555-F559 WeakPolarHBondContact O-CB 3.27Å; I555-F559 PolarHBondContact O-N 2.69Å
556	L	67.8	Low	61.1	Low	82 Å²	82	88.2 Å²	88.2	43%	0.429	49%	0.489	S	S	.	.	H	α-helix	trans	-69.7	-36.6	174.5	-95.6	151.1	0	0	0	112.4	L552 L560	L552-L556 HydrophobicContact CD2-CD1 3.82Å; L552-L556 HydrophobicContact CG-CD1 4.4Å; L552-L556 VanDerWaalsContact O-CB 3.22Å; L552-L556 WeakPolarHBondContact O-CB 3.42Å; L552-L556 PolarHBondContact O-N 2.87Å; L556-L560 WeakPolarHBondContact O-CB 3.44Å; L556-L560 WeakPolarHBondContact O-CD1 3.2Å; L556-L560 WeakPolarHBondContact O-CG 3.29Å; L556-L560 PolarHBondContact O-N 3Å
557	T	70.1	Confident	61.2	Low	70 Å²	70	91.4 Å²	91.4	43%	0.429	49%	0.491	S	S	.	.	H	α-helix	trans	-75.6	-37	175.4	51.9	0	0	0	0	111.9	L553 I554 L560 L561	L553-T557 VanDerWaalsContact O-CB 3.27Å; L553-T557 WeakPolarHBondContact O-CB 3.37Å; L553-T557 VanDerWaalsContact O-CG2 3.23Å; L553-T557 WeakPolarHBondContact O-CG2 3.46Å; L553-T557 PolarHBondContact O-N 3.34Å; L553-T557 PolarHBondContact O-OG1 3.49Å; I554-T557 WeakPolarHBondContact CA-OG1 3.25Å; I554-T557 PolarHBondContact O-N 3.46Å; I554-T557 PolarHBondContact O-OG1 3.23Å; T557-L560 PolarHBondContact O-N 3.26Å; T557-L561 WeakPolarHBondContact O-CA 3.23Å; T557-L561 WeakPolarHBondContact O-CB 3.42Å; T557-L561 WeakPolarHBondContact O-CD1 3.46Å; T557-L561 WeakPolarHBondContact O-CG 3.42Å; T557-L561 PolarHBondContact O-N 3.18Å
558	L	70.4	Confident	61.1	Low	90 Å²	90	95.7 Å²	95.7	47%	0.471	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-39.2	168.6	-93.4	148.2	0	0	0	111.3	I554 L561 I562	I554-L558 HydrophobicContact CG2-CD1 3.67Å; I554-L558 WeakPolarHBondContact O-CB 3.41Å; I554-L558 PolarHBondContact O-N 2.98Å; L558-L561 PolarHBondContact O-N 2.92Å; L558-I562 HydrophobicContact CB-CD1 4.38Å; L558-I562 HydrophobicContact CD2-CD1 3.97Å; L558-I562 WeakPolarHBondContact O-CA 3.36Å; L558-I562 WeakPolarHBondContact O-CB 3.47Å; L558-I562 WeakPolarHBondContact O-CD1 3.35Å; L558-I562 WeakPolarHBondContact O-CG1 3.45Å; L558-I562 PolarHBondContact O-N 3.34Å
559	F	69.1	Low	61	Low	129 Å²	129	101.3 Å²	101.3	57%	0.566	51%	0.506	S	S	*	.	H	α-helix	trans	-68.1	-40	175.3	-174.2	-98.2	0	0	0	110.5	I555 I562 T563	I555-F559 WeakPolarHBondContact O-CA 3.47Å; I555-F559 WeakPolarHBondContact O-CB 3.27Å; I555-F559 PolarHBondContact O-N 2.69Å; F559-I562 PolarHBondContact O-N 3.19Å; F559-T563 HydrophobicContact CD1-CG2 4.07Å; F559-T563 HydrophobicContact CD2-CG2 4.1Å; F559-T563 HydrophobicContact CE1-CG2 3.79Å; F559-T563 HydrophobicContact CE2-CG2 3.83Å; F559-T563 HydrophobicContact CG-CG2 4.22Å; F559-T563 HydrophobicContact CZ-CG2 3.66Å; F559-T563 WeakPolarHBondContact O-CA 3.15Å; F559-T563 WeakPolarHBondContact O-CB 3.41Å; F559-T563 VanDerWaalsContact O-CG2 3.27Å; F559-T563 WeakPolarHBondContact O-CG2 3.27Å; F559-T563 PolarHBondContact O-N 2.63Å; F559-T563 PolarHBondContact O-OG1 3.42Å
560	L	65.6	Low	60.8	Low	111 Å²	111	106.1 Å²	106.1	58%	0.581	52%	0.518	S	S	*	.	H	α-helix	trans	-74.6	-26.7	173.9	-72.9	168.4	0	0	0	113	L556 T557 G564	L556-L560 WeakPolarHBondContact O-CB 3.44Å; L556-L560 WeakPolarHBondContact O-CD1 3.2Å; L556-L560 WeakPolarHBondContact O-CG 3.29Å; L556-L560 PolarHBondContact O-N 3Å; T557-L560 PolarHBondContact O-N 3.26Å; L560-G564 WeakPolarHBondContact O-CA 3.49Å; L560-G564 PolarHBondContact O-N 3.34Å
561	L	65.6	Low	60.3	Low	98 Å²	98	107.2 Å²	107.2	51%	0.513	52%	0.522	S	S	.	.	H	α-helix	trans	-80.3	-30.9	171.7	-74.9	168.5	0	0	0	111.5	T557 L558 R565	T557-L561 WeakPolarHBondContact O-CA 3.23Å; T557-L561 WeakPolarHBondContact O-CB 3.42Å; T557-L561 WeakPolarHBondContact O-CD1 3.46Å; T557-L561 WeakPolarHBondContact O-CG 3.42Å; T557-L561 PolarHBondContact O-N 3.18Å; L558-L561 PolarHBondContact O-N 2.92Å; L561-R565 WeakPolarHBondContact O-CA 3.37Å; L561-R565 WeakPolarHBondContact O-CB 3.27Å; L561-R565 WeakPolarHBondContact O-CG 3.44Å; L561-R565 PolarHBondContact O-N 2.78Å
562	I	63.9	Low	59.7	Low	96 Å²	96	106 Å²	106	49%	0.492	52%	0.519	S	S	.	.	H	α-helix	trans	-83.3	-40.9	176.6	-68.4	164.8	0	0	0	110.2	L558 F559 C566	L558-I562 HydrophobicContact CB-CD1 4.38Å; L558-I562 HydrophobicContact CD2-CD1 3.97Å; L558-I562 WeakPolarHBondContact O-CA 3.36Å; L558-I562 WeakPolarHBondContact O-CB 3.47Å; L558-I562 WeakPolarHBondContact O-CD1 3.35Å; L558-I562 WeakPolarHBondContact O-CG1 3.45Å; L558-I562 PolarHBondContact O-N 3.34Å; F559-I562 PolarHBondContact O-N 3.19Å; I562-C566 WeakPolarHBondContact O-CA 3.43Å; I562-C566 WeakPolarHBondContact O-CB 3.37Å; I562-C566 PolarHBondContact O-N 3.02Å; I562-C566 PolarHBondContact O-SG 3.38Å
563	T	57.8	Low	58.8	Low	39 Å²	39	105.5 Å²	105.5	24%	0.239	51%	0.512	C	S	.	.	H	α-helix	trans	-79.8	-28.9	172.5	61	0	0	0	0	112.2	F559 Q567	F559-T563 HydrophobicContact CD1-CG2 4.07Å; F559-T563 HydrophobicContact CD2-CG2 4.1Å; F559-T563 HydrophobicContact CE1-CG2 3.79Å; F559-T563 HydrophobicContact CE2-CG2 3.83Å; F559-T563 HydrophobicContact CG-CG2 4.22Å; F559-T563 HydrophobicContact CZ-CG2 3.66Å; F559-T563 WeakPolarHBondContact O-CA 3.15Å; F559-T563 WeakPolarHBondContact O-CB 3.41Å; F559-T563 VanDerWaalsContact O-CG2 3.27Å; F559-T563 WeakPolarHBondContact O-CG2 3.27Å; F559-T563 PolarHBondContact O-N 2.63Å; F559-T563 PolarHBondContact O-OG1 3.42Å; T563-Q567 WeakPolarHBondContact O-CA 3.39Å; T563-Q567 WeakPolarHBondContact O-CB 3.47Å; T563-Q567 WeakPolarHBondContact O-CG 3.29Å; T563-Q567 PolarHBondContact O-N 3.38Å
564	G	56.3	Low	57.6	Low	31 Å²	31	106.1 Å²	106.1	32%	0.32	51%	0.514	S	S	.	.	H	α-helix	trans	-77.1	-38	170.9	0	0	0	0	0	112.3	L560 W568	L560-G564 WeakPolarHBondContact O-CA 3.49Å; L560-G564 PolarHBondContact O-N 3.34Å; G564-W568 WeakPolarHBondContact O-CA 3.29Å; G564-W568 WeakPolarHBondContact O-CB 3.35Å; G564-W568 PolarHBondContact O-N 2.94Å
565	R	53.2	Low	56.2	Low	180 Å²	180	107.2 Å²	107.2	68%	0.679	52%	0.524	S	S	*	.	H	α-helix	trans	-72.7	-33	165.6	-75.3	-177.8	154.6	136.2	-4.1	111.7	L561 Y569	L561-R565 WeakPolarHBondContact O-CA 3.37Å; L561-R565 WeakPolarHBondContact O-CB 3.27Å; L561-R565 WeakPolarHBondContact O-CG 3.44Å; L561-R565 PolarHBondContact O-N 2.78Å; R565-Y569 VanDerWaalsContact O-CA 3.31Å; R565-Y569 WeakPolarHBondContact O-CA 3.48Å; R565-Y569 WeakPolarHBondContact O-CB 3.47Å; R565-Y569 PolarHBondContact O-N 3.27Å
566	C	48.5	Very low	54.7	Low	59 Å²	59	105 Å²	105	40%	0.399	52%	0.518	S	S	.	.	H	α-helix	trans	-74.8	-35.5	174.8	-73.7	0	0	0	0	111.1	I562 F570	I562-C566 WeakPolarHBondContact O-CA 3.43Å; I562-C566 WeakPolarHBondContact O-CB 3.37Å; I562-C566 PolarHBondContact O-N 3.02Å; I562-C566 PolarHBondContact O-SG 3.38Å; C566-F570 HydrophobicContact CB-CD2 4.26Å; C566-F570 WeakPolarHBondContact O-CA 3.43Å; C566-F570 WeakPolarHBondContact O-CB 3.26Å; C566-F570 VanDerWaalsContact O-CD2 3.24Å; C566-F570 WeakPolarHBondContact O-CD2 3.09Å; C566-F570 PolarHBondContact O-N 3.39Å
567	Q	50.1	Low	53.4	Low	141 Å²	141	106.2 Å²	106.2	66%	0.659	52%	0.522	S	S	*	.	H	α-helix	trans	-72.6	-36.7	172.2	-77.8	178.7	-18.1	0	0	111	T563 K571	T563-Q567 WeakPolarHBondContact O-CA 3.39Å; T563-Q567 WeakPolarHBondContact O-CB 3.47Å; T563-Q567 WeakPolarHBondContact O-CG 3.29Å; T563-Q567 PolarHBondContact O-N 3.38Å; Q567-K571 WeakPolarHBondContact O-CA 3.25Å; Q567-K571 WeakPolarHBondContact O-CB 3.44Å; Q567-K571 PolarHBondContact O-N 3.06Å
568	W	47.9	Very low	52	Low	194 Å²	194	108.5 Å²	108.5	74%	0.735	53%	0.531	S	S	*	.	H	α-helix	trans	-73.9	-34.8	174.6	-167	80.2	0	0	0	112.1	G564 A572	G564-W568 WeakPolarHBondContact O-CA 3.29Å; G564-W568 WeakPolarHBondContact O-CB 3.35Å; G564-W568 PolarHBondContact O-N 2.94Å; W568-A572 WeakPolarHBondContact O-CA 3.26Å; W568-A572 WeakPolarHBondContact O-CB 3.37Å; W568-A572 PolarHBondContact O-N 2.6Å
569	Y	48.9	Very low	50.6	Low	157 Å²	157	112.1 Å²	112.1	62%	0.616	54%	0.543	S	S	*	.	H	α-helix	trans	-80.8	-33.9	177.2	-157.6	-93.8	0	0	0	111.8	R565 K573	R565-Y569 VanDerWaalsContact O-CA 3.31Å; R565-Y569 WeakPolarHBondContact O-CA 3.48Å; R565-Y569 WeakPolarHBondContact O-CB 3.47Å; R565-Y569 PolarHBondContact O-N 3.27Å; Y569-K573 HydrophobicContact CE1-CD 4.3Å; Y569-K573 WeakPolarHBondContact O-CA 3.41Å; Y569-K573 WeakPolarHBondContact O-CB 3.47Å; Y569-K573 PolarHBondContact O-N 3.16Å
570	F	50	Low	49.2	Very low	136 Å²	136	114 Å²	114	60%	0.596	55%	0.547	S	S	*	.	H	α-helix	trans	-74.3	-34.4	168.4	-88	-90.2	0	0	0	111.6	C566 K573 M574	C566-F570 HydrophobicContact CB-CD2 4.26Å; C566-F570 WeakPolarHBondContact O-CA 3.43Å; C566-F570 WeakPolarHBondContact O-CB 3.26Å; C566-F570 VanDerWaalsContact O-CD2 3.24Å; C566-F570 WeakPolarHBondContact O-CD2 3.09Å; C566-F570 PolarHBondContact O-N 3.39Å; F570-K573 PolarHBondContact O-N 3.12Å; F570-M574 WeakPolarHBondContact O-CB 3.39Å; F570-M574 WeakPolarHBondContact O-CG 3.27Å; F570-M574 PolarHBondContact O-N 3.47Å
571	K	46.7	Very low	47.9	Very low	164 Å²	164	118.9 Å²	118.9	71%	0.713	56%	0.557	S	S	*	*	H	α-helix	trans	-76.2	-29	174.4	-160.2	172.7	-172.1	176.9	0	111.9	Q567 T575	Q567-K571 WeakPolarHBondContact O-CA 3.25Å; Q567-K571 WeakPolarHBondContact O-CB 3.44Å; Q567-K571 PolarHBondContact O-N 3.06Å; K571-T575 WeakPolarHBondContact O-CB 3.35Å; K571-T575 VanDerWaalsContact O-CG2 3.25Å; K571-T575 WeakPolarHBondContact O-CG2 3.24Å; K571-T575 PolarHBondContact O-N 3.4Å; K571-T575 PolarHBondContact O-OG1 3.29Å
572	A	48.3	Very low	46.6	Very low	44 Å²	44	119.7 Å²	119.7	36%	0.364	57%	0.566	S	S	.	*	H	α-helix	trans	-81.4	-23.9	170.2	0	0	0	0	0	113.3	W568 T575 S576	W568-A572 WeakPolarHBondContact O-CA 3.26Å; W568-A572 WeakPolarHBondContact O-CB 3.37Å; W568-A572 PolarHBondContact O-N 2.6Å; A572-T575 WeakPolarHBondContact CA-OG1 3.44Å; A572-T575 PolarHBondContact O-OG1 3.21Å; A572-S576 WeakPolarHBondContact O-CB 3.43Å; A572-S576 PolarHBondContact O-N 2.94Å
573	K	44	Very low	45.2	Very low	102 Å²	102	121 Å²	121	44%	0.443	58%	0.575	S	S	.	*	H	α-helix	trans	-91.3	-32.7	176.8	-166.2	174.2	-180	-175.3	0	113	Y569 F570 S576 E577	Y569-K573 HydrophobicContact CE1-CD 4.3Å; Y569-K573 WeakPolarHBondContact O-CA 3.41Å; Y569-K573 WeakPolarHBondContact O-CB 3.47Å; Y569-K573 PolarHBondContact O-N 3.16Å; F570-K573 PolarHBondContact O-N 3.12Å; K573-S576 CarbonylContact O-C 3.55Å; K573-S576 PolarHBondContact O-N 2.66Å; K573-E577 WeakPolarHBondContact O-CB 3.15Å; K573-E577 PolarHBondContact O-N 2.85Å
574	M	41.5	Very low	44.2	Very low	123 Å²	123	128.9 Å²	128.9	61%	0.606	60%	0.601	S	S	*	*	H	α-helix	trans	-72.6	-32	169.6	-74.5	-177.3	90.8	0	0	112.1	F570 S576 D578	F570-M574 WeakPolarHBondContact O-CB 3.39Å; F570-M574 WeakPolarHBondContact O-CG 3.27Å; F570-M574 PolarHBondContact O-N 3.47Å; M574-S576 PolarHBondContact O-N 2.78Å; M574-D578 WeakPolarHBondContact O-CB 3.26Å; M574-D578 PolarHBondContact O-N 3.5Å; M574-D578 VanDerWaalsContact O-N 3.14Å
575	T	42	Very low	43.5	Very low	94 Å²	94	135.6 Å²	135.6	58%	0.577	62%	0.624	S	S	*	*	H	α-helix	trans	-75.3	-13.6	169.8	50.7	0	0	0	0	113.5	K571 A572	K571-T575 WeakPolarHBondContact O-CB 3.35Å; K571-T575 VanDerWaalsContact O-CG2 3.25Å; K571-T575 WeakPolarHBondContact O-CG2 3.24Å; K571-T575 PolarHBondContact O-N 3.4Å; K571-T575 PolarHBondContact O-OG1 3.29Å; A572-T575 WeakPolarHBondContact CA-OG1 3.44Å; A572-T575 PolarHBondContact O-OG1 3.21Å
576	S	41.6	Very low	42.5	Very low	65 Å²	65	134.6 Å²	134.6	46%	0.455	63%	0.632	S	S	.	*	H	α-helix	trans	-94.2	-38	174.6	174.9	0	0	0	0	112.2	A572 K573 M574 K579 R580	A572-S576 WeakPolarHBondContact O-CB 3.43Å; A572-S576 PolarHBondContact O-N 2.94Å; K573-S576 CarbonylContact O-C 3.55Å; K573-S576 PolarHBondContact O-N 2.66Å; M574-S576 PolarHBondContact O-N 2.78Å; S576-K579 WeakPolarHBondContact O-CB 3.39Å; S576-K579 PolarHBondContact O-N 2.87Å; S576-R580 WeakPolarHBondContact O-CB 3.15Å; S576-R580 PolarHBondContact O-N 2.84Å
577	E	39.7	Very low	41.9	Very low	108 Å²	108	135.4 Å²	135.4	51%	0.505	65%	0.651	S	S	.	*	H	α-helix	trans	-79.2	-32.9	178.8	-82.2	-172.7	160.5	0	0	113.8	K573 K579 R580 R581	K573-E577 WeakPolarHBondContact O-CB 3.15Å; K573-E577 PolarHBondContact O-N 2.85Å; E577-K579 PolarHBondContact O-N 2.79Å; E577-R580 CarbonylContact O-C 3.56Å; E577-R580 PolarHBondContact O-N 2.86Å; E577-R581 PolarHBondContact O-N 2.83Å
578	D	41.4	Very low	41.1	Very low	118 Å²	118	136.1 Å²	136.1	63%	0.631	65%	0.654	S	S	*	*	H	α-helix	trans	-66.9	-24.3	168.5	-91	-17.1	0	0	0	111.9	M574 R580 T582	M574-D578 WeakPolarHBondContact O-CB 3.26Å; M574-D578 PolarHBondContact O-N 3.5Å; M574-D578 VanDerWaalsContact O-N 3.14Å; D578-R580 VanDerWaalsContact C-N 3.32Å; D578-T582 PolarHBondContact O-OG1 2.88Å
579	K	40.8	Very low	40.4	Very low	166 Å²	166	133 Å²	133	72%	0.722	66%	0.656	S	S	*	*	H	α-helix	trans	-79	-15.7	171.1	-128.7	178.6	-175.9	-179.4	0	113.4	S576 E577	S576-K579 WeakPolarHBondContact O-CB 3.39Å; S576-K579 PolarHBondContact O-N 2.87Å; E577-K579 PolarHBondContact O-N 2.79Å
580	R	40.2	Very low	39.7	Very low	169 Å²	169	131.2 Å²	131.2	64%	0.638	66%	0.664	S	S	*	*	H	α-helix	trans	-105	-15.4	-176.5	-149.4	176.2	-175	-175.9	0.5	112.7	S576 E577 D578	S576-R580 WeakPolarHBondContact O-CB 3.15Å; S576-R580 PolarHBondContact O-N 2.84Å; E577-R580 CarbonylContact O-C 3.56Å; E577-R580 PolarHBondContact O-N 2.86Å; D578-R580 VanDerWaalsContact C-N 3.32Å
581	R	37.5	Very low	38.9	Very low	213 Å²	213	133.8 Å²	133.8	80%	0.804	68%	0.675	S	S	*	*	H	α-helix	trans	-87.4	-22.5	176.5	-137.8	175	-173.3	171.5	1.2	113.1	E577 D583	E577-R581 PolarHBondContact O-N 2.83Å; R581-D583 VanDerWaalsContact C-N 3.31Å
582	T	37.7	Very low	38.4	Very low	114 Å²	114	132.3 Å²	132.3	70%	0.699	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-78.8	-14.1	167.1	40.9	0	0	0	0	113.3	D578 Y584	D578-T582 PolarHBondContact O-OG1 2.88Å; T582-Y584 VanDerWaalsContact C-N 3.33Å; T582-Y584 PolarHBondContact O-N 2.58Å
583	D	34.3	Very low	38.1	Very low	125 Å²	125	133.9 Å²	133.9	67%	0.668	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-86.7	2.8	-177.9	-154.5	29.1	0	0	0	113.7	R581	R581-D583 VanDerWaalsContact C-N 3.31Å
584	Y	37.5	Very low	38.1	Very low	203 Å²	203	134.9 Å²	134.9	80%	0.796	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-115.5	6	-177.1	-97.7	-86.4	0	0	0	114.8	T582	T582-Y584 VanDerWaalsContact C-N 3.33Å; T582-Y584 PolarHBondContact O-N 2.58Å
585	Q	40.7	Very low	38.8	Very low	173 Å²	173	137.9 Å²	137.9	81%	0.808	72%	0.721	S	S	*	*	S	Bend	trans	-119.2	1.3	-175.6	-109.5	-176.4	-8.5	0	0	117.3
586	N	32.4	Very low	40	Very low	158 Å²	158	136.6 Å²	136.6	85%	0.845	72%	0.72	S	S	*	*	S	Bend	trans	-136.4	104.8	164.7	-85.3	-23	0	0	0	109.4	H588	N586-H588 PolarHBondContact O-N 2.95Å; N586-H588 VanDerWaalsContact O-N 3.16Å
587	G	37.5	Very low	41.8	Very low	77 Å²	77	134.3 Å²	134.3	79%	0.794	70%	0.702	S	S	*	*			trans	-67.1	109.5	176.1	0	0	0	0	0	110.8
588	H	33.1	Very low	43.8	Very low	156 Å²	156	131.9 Å²	131.9	72%	0.722	69%	0.694	S	S	*	*			trans	-149.1	126	148.5	-112.1	77.8	0	0	0	109	N586	N586-H588 PolarHBondContact O-N 2.95Å; N586-H588 VanDerWaalsContact O-N 3.16Å
589	V	32.6	Very low	45.3	Very low	127 Å²	127	127.1 Å²	127.1	77%	0.77	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-73.3	126.4	-174.9	-163.7	0	0	0	0	108.7	F591	V589-F591 PolarHBondContact O-N 3.11Å
590	P	35.1	Very low	46.9	Very low	121 Å²	121	119.5 Å²	119.5	79%	0.786	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-82.7	116.7	-178.4	28.4	-27.2	0	0	0	110.8
591	F	31.7	Very low	48.3	Very low	189 Å²	189	115.5 Å²	115.5	83%	0.829	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-73.8	143.2	156.8	-77.9	-87.4	0	0	0	109.4	V589 G593	V589-F591 PolarHBondContact O-N 3.11Å; F591-G593 PolarHBondContact O-N 2.8Å
592	P	37	Very low	49.9	Very low	134 Å²	134	110.2 Å²	110.2	87%	0.87	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	116.5	-178.2	11.4	2	0	0	0	110.2
593	G	41.2	Very low	51.2	Low	77 Å²	77	106.9 Å²	106.9	79%	0.794	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	146.4	-18	155.7	0	0	0	0	0	118.9	F591	F591-G593 PolarHBondContact O-N 2.8Å
594	I	43.7	Very low	52.5	Low	123 Å²	123	110.7 Å²	110.7	63%	0.631	61%	0.607	S	S	*	*			trans	-136.9	113.4	-179.4	-58	173.8	0	0	0	108	A596 D740	I594-A596 PolarHBondContact O-N 3.09Å; I594-D740 WeakPolarHBondContact CG2-O 3.24Å
595	K	56.5	Low	54	Low	186 Å²	186	104.6 Å²	104.6	81%	0.809	59%	0.589	S	S	*	*			trans	-72.6	107.8	166.7	-79.3	-176.1	175.1	-175.1	0	106.6	M741	K595-M741 WeakPolarHBondContact O-CE 3.31Å
596	A	68.8	Low	55.2	Low	66 Å²	66	97.7 Å²	97.7	55%	0.545	56%	0.559	S	S	.	*			trans	-64.3	147.1	172.3	0	0	0	0	0	110.2	I594	I594-A596 PolarHBondContact O-N 3.09Å
597	Y	79.4	Confident	57	Low	17 Å²	17	91.3 Å²	91.3	7%	0.067	53%	0.526	C	S	.	.			trans	-61.3	142.5	172	166.3	-109.6	0	0	0	111.1	P600 I674 Q677 F678 M741 Y743 V771	Y597-P600 WeakPolarHBondContact OH-CD 3.23Å; Y597-I674 HydrophobicContact CE2-CG1 4.31Å; Y597-I674 HydrophobicContact CE2-CG2 4.2Å; Y597-I674 WeakPolarHBondContact OH-CG1 3.37Å; Y597-Q677 VanDerWaalsContact CD2-OE1 3.3Å; Y597-F678 HydrophobicContact CD2-CE1 4.03Å; Y597-F678 AromaticContact CD2-CZ 3.89Å; Y597-F678 HydrophobicContact CD2-CZ 3.89Å; Y597-F678 HydrophobicContact CE2-CZ 4.22Å; Y597-M741 VanDerWaalsContact CB-O 3.22Å; Y597-M741 WeakPolarHBondContact CB-O 3.14Å; Y597-M741 PolarHBondContact N-O 3.09Å; Y597-Y743 AromaticContact CD1-CD2 3.58Å; Y597-Y743 HydrophobicContact CD1-CD2 3.58Å; Y597-Y743 HydrophobicContact CD1-CE2 4.39Å; Y597-Y743 HydrophobicContact CD1-CG 4.5Å; Y597-Y743 AromaticContact CD2-CD2 3.91Å; Y597-Y743 HydrophobicContact CD2-CD2 3.91Å; Y597-Y743 HydrophobicContact CD2-CE2 4.44Å; Y597-Y743 AromaticContact CE1-CD2 3.42Å; Y597-Y743 HydrophobicContact CE1-CD2 3.42Å; Y597-Y743 VanDerWaalsContact CE1-CD2 3.42Å; Y597-Y743 AromaticContact CE1-CE2 3.8Å; Y597-Y743 HydrophobicContact CE1-CE2 3.8Å; Y597-Y743 AromaticContact CE2-CD2 3.82Å; Y597-Y743 HydrophobicContact CE2-CD2 3.82Å; Y597-Y743 AromaticContact CE2-CE2 3.91Å; Y597-Y743 HydrophobicContact CE2-CE2 3.91Å; Y597-Y743 AromaticContact CG-CD2 3.82Å; Y597-Y743 HydrophobicContact CG-CD2 3.82Å; Y597-Y743 AromaticContact CZ-CD2 3.6Å; Y597-Y743 AromaticContact CZ-CE2 3.58Å; Y597-V771 HydrophobicContact CD1-CG2 3.4Å; Y597-V771 HydrophobicContact CE1-CB 4.24Å; Y597-V771 HydrophobicContact CE1-CG2 3.06Å
598	V	80.1	Confident	58.8	Low	58 Å²	58	93 Å²	93	35%	0.352	51%	0.513	S	S	.	.			trans	-114.2	129.3	179.3	-178.2	0	0	0	0	109.4	P600 Y603 F613 Q677	V598-P600 VanDerWaalsContact O-CD 3.26Å; V598-P600 WeakPolarHBondContact O-CD 3.46Å; V598-Y603 HydrophobicContact CG1-CE2 4.21Å; V598-F613 HydrophobicContact CB-CZ 4.08Å; V598-F613 HydrophobicContact CG1-CZ 4.26Å; V598-Q677 PolarHBondContact O-NE2 2.87Å; V598-Q677 PolarHBondContact O-OE1 3.32Å
599	D	74.2	Confident	61	Low	17 Å²	17	85.6 Å²	85.6	9%	0.091	48%	0.478	C	S	.	.			trans	-68.4	122.6	178.4	-149.3	-46	0	0	0	108.9	D601 T602 R670 V771	D599-D601 PolarHBondContact O-N 3.13Å; D599-D601 VanDerWaalsContact O-N 3.15Å; D599-D601 VanDerWaalsContact OD1-CB 3.31Å; D599-D601 WeakPolarHBondContact OD1-CB 3.39Å; D599-D601 PolarHBondContact OD1-N 3.26Å; D599-T602 HydrophobicContact CB-CG2 4.06Å; D599-T602 WeakPolarHBondContact O-CB 3.13Å; D599-T602 PolarHBondContact O-N 3.39Å; D599-T602 PolarHBondContact O-OG1 3.37Å; D599-R670 IonicContact OD1-NH2 3.47Å; D599-R670 PolarHBondContact OD1-NH2 2.93Å; D599-V771 HydrophobicContact CB-CB 3.64Å; D599-V771 HydrophobicContact CB-CG1 4.44Å; D599-V771 HydrophobicContact CB-CG2 3.12Å; D599-V771 WeakPolarHBondContact OD2-CB 3.43Å; D599-V771 WeakPolarHBondContact OD2-CG2 3.04Å; D599-V771 PolarHBondContact OD2-N 2.69Å
600	P	73	Confident	63.4	Low	6 Å²	6	79.5 Å²	79.5	4%	0.039	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-58.7	-23.3	168.9	-23.2	35	0	0	0	112.9	Y597 V598 T602 Y603 A609 R670 I674	Y597-P600 WeakPolarHBondContact OH-CD 3.23Å; V598-P600 VanDerWaalsContact O-CD 3.26Å; V598-P600 WeakPolarHBondContact O-CD 3.46Å; P600-T602 PolarHBondContact O-N 2.74Å; P600-Y603 WeakPolarHBondContact O-CB 2.96Å; P600-Y603 PolarHBondContact O-N 3Å; P600-Y603 VanDerWaalsContact O-N 3.14Å; P600-A609 HydrophobicContact CB-CB 4.05Å; P600-R670 HydrophobicContact CB-CG 4.37Å; P600-I674 HydrophobicContact CG-CG1 3.75Å
601	D	70.4	Confident	65.5	Low	85 Å²	85	78.8 Å²	78.8	46%	0.455	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-70.9	-10.7	177.4	-63	-26.4	0	0	0	113.1	D599 Y603 R670	D599-D601 PolarHBondContact O-N 3.13Å; D599-D601 VanDerWaalsContact O-N 3.15Å; D599-D601 VanDerWaalsContact OD1-CB 3.31Å; D599-D601 WeakPolarHBondContact OD1-CB 3.39Å; D599-D601 PolarHBondContact OD1-N 3.26Å; D601-Y603 PolarHBondContact O-N 3.26Å; D601-R670 VanDerWaalsContact CG-NE 3.31Å; D601-R670 WeakPolarHBondContact OD1-CD 3.34Å; D601-R670 IonicContact OD1-CZ 3.05Å; D601-R670 IonicContact OD1-NE 3.69Å; D601-R670 PolarHBondContact OD1-NE 3.14Å; D601-R670 IonicContact OD1-NH2 3.78Å; D601-R670 IonicContact OD2-CZ 2.68Å; D601-R670 IonicContact OD2-NE 2.79Å; D601-R670 PolarHBondContact OD2-NE 2.98Å; D601-R670 VanDerWaalsContact OD2-NE 3.11Å; D601-R670 IonicContact OD2-NH2 2.9Å; D601-R670 PolarHBondContact OD2-NH2 3.07Å
602	T	71.9	Confident	68	Low	102 Å²	102	75.4 Å²	75.4	63%	0.626	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-72.1	-13.2	169.4	59.3	0	0	0	0	113	D599 P600	D599-T602 HydrophobicContact CB-CG2 4.06Å; D599-T602 WeakPolarHBondContact O-CB 3.13Å; D599-T602 PolarHBondContact O-N 3.39Å; D599-T602 PolarHBondContact O-OG1 3.37Å; P600-T602 PolarHBondContact O-N 2.74Å
603	Y	64.9	Low	70.3	Confident	45 Å²	45	70.9 Å²	70.9	18%	0.176	38%	0.381	C	S	.	.	S	Bend	trans	-92.6	133.2	176.4	-64.6	-105.8	0	0	0	110.4	V598 P600 D601 D605 Q608 A609 E612 F613	V598-Y603 HydrophobicContact CG1-CE2 4.21Å; P600-Y603 WeakPolarHBondContact O-CB 2.96Å; P600-Y603 PolarHBondContact O-N 3Å; P600-Y603 VanDerWaalsContact O-N 3.14Å; D601-Y603 PolarHBondContact O-N 3.26Å; Y603-D605 VanDerWaalsContact C-N 3.3Å; Y603-D605 PolarHBondContact O-N 3.45Å; Y603-Q608 HydrophobicContact CD1-CB 4.16Å; Y603-Q608 HydrophobicContact CD1-CG 3.94Å; Y603-Q608 HydrophobicContact CE1-CG 4.3Å; Y603-A609 HydrophobicContact CD1-CB 4.36Å; Y603-A609 HydrophobicContact CD2-CB 3.89Å; Y603-A609 HydrophobicContact CE2-CB 4.31Å; Y603-A609 HydrophobicContact CG-CB 3.93Å; Y603-E612 VanDerWaalsContact CE1-OE2 3.27Å; Y603-E612 WeakPolarHBondContact CE1-OE2 3.26Å; Y603-E612 VanDerWaalsContact CZ-OE2 3.27Å; Y603-E612 PolarHBondContact OH-OE1 2.84Å; Y603-E612 PolarHBondContact OH-OE2 2.74Å; Y603-F613 AromaticContact CE2-CE2 3.99Å; Y603-F613 HydrophobicContact CE2-CE2 3.99Å; Y603-F613 HydrophobicContact CE2-CZ 4.31Å; Y603-F613 WeakPolarHBondContact OH-CZ 3.41Å
604	E	61.8	Low	72.6	Confident	204 Å²	204	68.2 Å²	68.2	95%	0.953	35%	0.35	S	S	*	.	S	Bend	trans	-66.9	-30.5	175.9	-67.8	-173.4	165.9	0	0	112.7
605	D	68.8	Low	74.8	Confident	76 Å²	76	68.3 Å²	68.3	41%	0.406	35%	0.345	S	S	.	.	S	Bend	trans	-117.7	115.4	174.4	-177.9	1.1	0	0	0	111.2	Y603 T607 Q608	Y603-D605 VanDerWaalsContact C-N 3.3Å; Y603-D605 PolarHBondContact O-N 3.45Å; D605-T607 PolarHBondContact O-N 2.99Å; D605-T607 VanDerWaalsContact O-N 3.09Å; D605-T607 VanDerWaalsContact OD1-CB 3.25Å; D605-T607 WeakPolarHBondContact OD1-CB 3.37Å; D605-T607 PolarHBondContact OD1-N 3.38Å; D605-T607 PolarHBondContact OD1-OG1 2.94Å; D605-Q608 VanDerWaalsContact O-CB 3.26Å; D605-Q608 WeakPolarHBondContact O-CB 3.45Å; D605-Q608 PolarHBondContact O-N 3.18Å
606	P	65	Low	76.5	Confident	27 Å²	27	61.9 Å²	61.9	18%	0.175	32%	0.318	C	S	.	.	H	α-helix	trans	-58.8	-24.1	177	-28.2	38.5	0	0	0	114.1	Q608 A609 V610 R666	P606-Q608 PolarHBondContact O-N 3.49Å; P606-A609 PolarHBondContact O-N 3.47Å; P606-V610 VanDerWaalsContact O-CG2 3.28Å; P606-V610 WeakPolarHBondContact O-CG2 3.34Å; P606-V610 PolarHBondContact O-N 2.84Å; P606-V610 VanDerWaalsContact O-N 3.1Å; P606-R666 HydrophobicContact CG-CB 4.16Å; P606-R666 HydrophobicContact CG-CG 3.79Å
607	T	71.1	Confident	77.6	Confident	24 Å²	24	59.1 Å²	59.1	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-29.7	176.4	-38.2	0	0	0	0	111	D605 H611 R665	D605-T607 PolarHBondContact O-N 2.99Å; D605-T607 VanDerWaalsContact O-N 3.09Å; D605-T607 VanDerWaalsContact OD1-CB 3.25Å; D605-T607 WeakPolarHBondContact OD1-CB 3.37Å; D605-T607 PolarHBondContact OD1-N 3.38Å; D605-T607 PolarHBondContact OD1-OG1 2.94Å; T607-H611 PolarHBondContact O-CD2 3.45Å; T607-H611 PolarHBondContact O-N 3.44Å; T607-H611 VanDerWaalsContact O-N 3.08Å; T607-R665 PolarHBondContact OG1-NH2 3.11Å
608	Q	75.8	Confident	78.2	Confident	113 Å²	113	62.5 Å²	62.5	53%	0.528	31%	0.314	S	S	.	.	H	α-helix	trans	-70.7	-45.6	176.1	-170.2	176.4	-4.4	0	0	111.9	Y603 D605 P606 V610 H611 E612	Y603-Q608 HydrophobicContact CD1-CB 4.16Å; Y603-Q608 HydrophobicContact CD1-CG 3.94Å; Y603-Q608 HydrophobicContact CE1-CG 4.3Å; D605-Q608 VanDerWaalsContact O-CB 3.26Å; D605-Q608 WeakPolarHBondContact O-CB 3.45Å; D605-Q608 PolarHBondContact O-N 3.18Å; P606-Q608 PolarHBondContact O-N 3.49Å; Q608-V610 VanDerWaalsContact C-N 3.31Å; Q608-V610 PolarHBondContact O-N 3.02Å; Q608-H611 PolarHBondContact O-N 2.85Å; Q608-H611 VanDerWaalsContact O-N 3.14Å; Q608-E612 PolarHBondContact O-N 2.8Å
609	A	77.7	Confident	78.7	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.1	-41.4	175	0	0	0	0	0	111.6	P600 Y603 P606 H611 E612 F613	P600-A609 HydrophobicContact CB-CB 4.05Å; Y603-A609 HydrophobicContact CD1-CB 4.36Å; Y603-A609 HydrophobicContact CD2-CB 3.89Å; Y603-A609 HydrophobicContact CE2-CB 4.31Å; Y603-A609 HydrophobicContact CG-CB 3.93Å; P606-A609 PolarHBondContact O-N 3.47Å; A609-H611 PolarHBondContact O-N 3.44Å; A609-E612 PolarHBondContact O-N 2.68Å; A609-F613 HydrophobicContact CB-CD2 4.38Å; A609-F613 HydrophobicContact CB-CE2 4.39Å; A609-F613 WeakPolarHBondContact O-CD2 3.4Å; A609-F613 PolarHBondContact O-N 2.87Å
610	V	82.6	Confident	79.4	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-60.6	-44	174.4	174.4	0	0	0	0	111.2	P606 Q608 E612 T614 L669 S673 V689 T691	P606-V610 VanDerWaalsContact O-CG2 3.28Å; P606-V610 WeakPolarHBondContact O-CG2 3.34Å; P606-V610 PolarHBondContact O-N 2.84Å; P606-V610 VanDerWaalsContact O-N 3.1Å; Q608-V610 VanDerWaalsContact C-N 3.31Å; Q608-V610 PolarHBondContact O-N 3.02Å; V610-E612 VanDerWaalsContact C-N 3.26Å; V610-E612 PolarHBondContact O-N 2.02Å; V610-T614 HydrophobicContact CG1-CG2 4.28Å; V610-T614 WeakPolarHBondContact CG1-OG1 3.28Å; V610-T614 WeakPolarHBondContact O-CA 3.46Å; V610-T614 VanDerWaalsContact O-CB 3.3Å; V610-T614 WeakPolarHBondContact O-CB 3.5Å; V610-T614 PolarHBondContact O-N 2.79Å; V610-T614 PolarHBondContact O-OG1 2.76Å; V610-L669 HydrophobicContact CG2-CB 3.72Å; V610-L669 HydrophobicContact CG2-CD1 4.46Å; V610-L669 HydrophobicContact CG2-CD2 4.1Å; V610-L669 HydrophobicContact CG2-CG 4.29Å; V610-L669 WeakPolarHBondContact CG2-O 3.35Å; V610-S673 WeakPolarHBondContact CG2-OG 3.43Å; V610-S673 PolarHBondContact N-OG 2.78Å; V610-V689 HydrophobicContact CG1-CG2 3.77Å; V610-T691 HydrophobicContact CG1-CG2 4.1Å
611	H	80.8	Confident	80.3	Confident	106 Å²	106	68.8 Å²	68.8	49%	0.491	35%	0.351	S	S	.	.	H	α-helix	trans	-65.9	-27.9	178.7	-76.5	-42.1	0	0	0	113.7	T607 Q608 A609	T607-H611 PolarHBondContact O-CD2 3.45Å; T607-H611 PolarHBondContact O-N 3.44Å; T607-H611 VanDerWaalsContact O-N 3.08Å; Q608-H611 PolarHBondContact O-N 2.85Å; Q608-H611 VanDerWaalsContact O-N 3.14Å; A609-H611 PolarHBondContact O-N 3.44Å
612	E	82.6	Confident	81.3	Confident	117 Å²	117	65.8 Å²	65.8	55%	0.547	34%	0.335	S	S	.	.	H	α-helix	trans	-80.3	-45.2	178.9	-173.2	167.4	172	0	0	112.7	Y603 Q608 A609 V610	Y603-E612 VanDerWaalsContact CE1-OE2 3.27Å; Y603-E612 WeakPolarHBondContact CE1-OE2 3.26Å; Y603-E612 VanDerWaalsContact CZ-OE2 3.27Å; Y603-E612 PolarHBondContact OH-OE1 2.84Å; Y603-E612 PolarHBondContact OH-OE2 2.74Å; Q608-E612 PolarHBondContact O-N 2.8Å; A609-E612 PolarHBondContact O-N 2.68Å; V610-E612 VanDerWaalsContact C-N 3.26Å; V610-E612 PolarHBondContact O-N 2.02Å
613	F	86.3	Confident	82.3	Confident	40 Å²	40	66.8 Å²	66.8	18%	0.175	33%	0.327	C	S	.	.	H	α-helix	trans	-99.3	-10.8	-171.6	-55.9	-55.3	0	0	0	114.4	V598 Y603 A609 G676 Q677	V598-F613 HydrophobicContact CB-CZ 4.08Å; V598-F613 HydrophobicContact CG1-CZ 4.26Å; Y603-F613 AromaticContact CE2-CE2 3.99Å; Y603-F613 HydrophobicContact CE2-CE2 3.99Å; Y603-F613 HydrophobicContact CE2-CZ 4.31Å; Y603-F613 WeakPolarHBondContact OH-CZ 3.41Å; A609-F613 HydrophobicContact CB-CD2 4.38Å; A609-F613 HydrophobicContact CB-CE2 4.39Å; A609-F613 WeakPolarHBondContact O-CD2 3.4Å; A609-F613 PolarHBondContact O-N 2.87Å; F613-G676 CarbonylContact O-C 3.51Å; F613-G676 VanDerWaalsContact O-CA 3.29Å; F613-G676 WeakPolarHBondContact O-CA 3.41Å; F613-Q677 HydrophobicContact CB-CG 3.96Å; F613-Q677 HydrophobicContact CD1-CG 3.6Å; F613-Q677 HydrophobicContact CD2-CG 4.13Å; F613-Q677 HydrophobicContact CE1-CG 4.12Å; F613-Q677 HydrophobicContact CG-CG 3.61Å
614	T	89	Confident	83.6	Confident	21 Å²	21	68.7 Å²	68.7	13%	0.129	34%	0.339	C	S	.	.	S	Bend	trans	-126.4	162.8	-174.5	83.3	0	0	0	0	112.8	V610 A672 L686 V689	V610-T614 HydrophobicContact CG1-CG2 4.28Å; V610-T614 WeakPolarHBondContact CG1-OG1 3.28Å; V610-T614 WeakPolarHBondContact O-CA 3.46Å; V610-T614 VanDerWaalsContact O-CB 3.3Å; V610-T614 WeakPolarHBondContact O-CB 3.5Å; V610-T614 PolarHBondContact O-N 2.79Å; V610-T614 PolarHBondContact O-OG1 2.76Å; T614-A672 HydrophobicContact CG2-CB 4.47Å; T614-A672 WeakPolarHBondContact CG2-O 3.36Å; T614-L686 HydrophobicContact CG2-CD2 3.64Å; T614-V689 HydrophobicContact CG2-CG1 4.37Å; T614-V689 VanDerWaalsContact OG1-CG2 3.23Å; T614-V689 WeakPolarHBondContact OG1-CG2 3.47Å
615	K	90.7	Very high	84.8	Confident	124 Å²	124	62.8 Å²	62.8	54%	0.539	31%	0.311	S	S	.	.			trans	-103.1	123.8	177.6	-178.4	-179.8	179.9	176.7	0	110.7	I617 G688 V689	K615-I617 PolarHBondContact O-N 3.5Å; K615-G688 CarbonylContact O-C 3.56Å; K615-G688 WeakPolarHBondContact O-CA 3.48Å; K615-V689 PolarHBondContact O-N 3.36Å
616	E	92.5	Very high	85.7	Confident	52 Å²	52	67.1 Å²	67.1	24%	0.243	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-70.3	129.7	170.8	-170.2	71.5	-172.4	0	0	110.5	V689 T691 K692	E616-V689 CarbonylContact C-O 3.46Å; E616-V689 WeakPolarHBondContact CA-O 3.27Å; E616-T691 VanDerWaalsContact CD-OG1 3.32Å; E616-T691 PolarHBondContact OE1-N 2.64Å; E616-T691 PolarHBondContact OE1-OG1 3.31Å; E616-T691 PolarHBondContact OE2-N 3.23Å; E616-T691 PolarHBondContact OE2-OG1 3.12Å; E616-K692 HydrophobicContact CG-CD 4.07Å; E616-K692 HydrophobicContact CG-CG 4.45Å; E616-K692 WeakPolarHBondContact OE1-CG 3.44Å; E616-K692 PolarHBondContact OE1-N 2.99Å
617	I	92.3	Very high	86.7	Confident	7 Å²	7	69.7 Å²	69.7	4%	0.036	34%	0.337	C	S	.	.			trans	-106.4	135.7	177.6	-61	174.1	0	0	0	109.2	K615 R621 I622 L641 E687 V689 V690 V699	K615-I617 PolarHBondContact O-N 3.5Å; I617-R621 HydrophobicContact CG2-CB 4.48Å; I617-I622 HydrophobicContact CB-CD1 4.26Å; I617-I622 HydrophobicContact CG2-CD1 3.67Å; I617-I622 HydrophobicContact CG2-CG1 3.83Å; I617-L641 HydrophobicContact CD1-CD1 4.2Å; I617-L641 HydrophobicContact CD1-CD2 4.08Å; I617-L641 HydrophobicContact CG2-CD1 3.77Å; I617-E687 HydrophobicContact CD1-CB 4.41Å; I617-V689 PolarHBondContact N-O 3.4Å; I617-V690 HydrophobicContact CB-CG2 4.18Å; I617-V699 HydrophobicContact CD1-CB 4.05Å; I617-V699 HydrophobicContact CD1-CG1 4.48Å; I617-V699 HydrophobicContact CD1-CG2 4.11Å
618	D	90.5	Very high	87.2	Confident	89 Å²	89	72 Å²	72	48%	0.476	35%	0.348	S	S	.	.			trans	-68.2	125.4	170.3	-170.3	-54.6	0	0	0	110	S620 R621	D618-S620 VanDerWaalsContact CG-OG 3.3Å; D618-S620 PolarHBondContact O-N 3.16Å; D618-S620 VanDerWaalsContact O-N 3.11Å; D618-S620 VanDerWaalsContact OD1-CB 3.26Å; D618-S620 WeakPolarHBondContact OD1-CB 3.48Å; D618-S620 PolarHBondContact OD1-N 3.46Å; D618-S620 PolarHBondContact OD1-OG 3.18Å; D618-R621 HydrophobicContact CB-CG 4.24Å; D618-R621 WeakPolarHBondContact O-CB 3.44Å; D618-R621 PolarHBondContact O-N 2.76Å
619	P	90.2	Very high	87.1	Confident	56 Å²	56	68.1 Å²	68.1	36%	0.364	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-54.1	-32.7	-178.7	-24.4	32	0	0	0	113.9	R621 I622 V690 S693	P619-R621 PolarHBondContact O-N 3.39Å; P619-R621 VanDerWaalsContact O-N 3.11Å; P619-I622 PolarHBondContact O-N 3.32Å; P619-I622 VanDerWaalsContact O-N 3.09Å; P619-V690 HydrophobicContact CG-CG1 3.82Å; P619-S693 WeakPolarHBondContact CG-OG 3.44Å
620	S	89.7	Confident	86.8	Confident	96 Å²	96	72.1 Å²	72.1	67%	0.671	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-63.8	-16.4	179	66.7	0	0	0	0	113.7	D618	D618-S620 VanDerWaalsContact CG-OG 3.3Å; D618-S620 PolarHBondContact O-N 3.16Å; D618-S620 VanDerWaalsContact O-N 3.11Å; D618-S620 VanDerWaalsContact OD1-CB 3.26Å; D618-S620 WeakPolarHBondContact OD1-CB 3.48Å; D618-S620 PolarHBondContact OD1-N 3.46Å; D618-S620 PolarHBondContact OD1-OG 3.18Å
621	R	91.2	Very high	85.8	Confident	61 Å²	61	73.6 Å²	73.6	23%	0.23	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-91	-6.4	179.5	-65.2	179.6	53	-155.3	-31.1	113.2	I617 D618 P619 L641 R642	I617-R621 HydrophobicContact CG2-CB 4.48Å; D618-R621 HydrophobicContact CB-CG 4.24Å; D618-R621 WeakPolarHBondContact O-CB 3.44Å; D618-R621 PolarHBondContact O-N 2.76Å; P619-R621 PolarHBondContact O-N 3.39Å; P619-R621 VanDerWaalsContact O-N 3.11Å; R621-L641 HydrophobicContact CB-CD1 4.42Å; R621-R642 HydrophobicContact CB-CB 4.31Å; R621-R642 PolarHBondContact NE-O 2.84Å; R621-R642 PolarHBondContact NH2-O 3.21Å; R621-R642 PolarHBondContact O-N 3.46Å
622	I	92.9	Very high	84.8	Confident	22 Å²	22	76 Å²	76	11%	0.113	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.7	179.1	-62.9	163.7	0	0	0	108.6	I617 P619 I624 L641 I653 V690 V699	I617-I622 HydrophobicContact CB-CD1 4.26Å; I617-I622 HydrophobicContact CG2-CD1 3.67Å; I617-I622 HydrophobicContact CG2-CG1 3.83Å; P619-I622 PolarHBondContact O-N 3.32Å; P619-I622 VanDerWaalsContact O-N 3.09Å; I622-I624 HydrophobicContact CG2-CG1 4.33Å; I622-L641 HydrophobicContact CG1-CD1 3.8Å; I622-I653 HydrophobicContact CG2-CD1 3.42Å; I622-I653 VanDerWaalsContact CG2-CD1 3.42Å; I622-I653 HydrophobicContact CG2-CG1 4.29Å; I622-V690 HydrophobicContact CD1-CG2 3.49Å; I622-V690 VanDerWaalsContact CD1-CG2 3.49Å; I622-V699 HydrophobicContact CD1-CG2 3.73Å
623	R	92	Very high	83.9	Confident	123 Å²	123	71.1 Å²	71.1	46%	0.464	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	109.4	169.4	-171.8	179.2	73.8	-162.1	1.8	108.9	E625 G639 R640	R623-E625 IonicContact CZ-OE1 3.96Å; R623-E625 IonicContact NE-OE1 3.28Å; R623-E625 IonicContact NH2-OE1 3.6Å; R623-E625 PolarHBondContact NH2-OE1 3.17Å; R623-G639 CarbonylContact O-C 3.53Å; R623-G639 WeakPolarHBondContact O-CA 3.1Å; R623-R640 HydrophobicContact CB-CB 4.48Å; R623-R640 PolarHBondContact N-O 3.05Å; R623-R640 PolarHBondContact O-N 3.44Å
624	I	91.5	Very high	83.2	Confident	84 Å²	84	69.2 Å²	69.2	43%	0.431	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	132.9	173.5	-60.3	171	0	0	0	108.2	I622 C637 I653 M697	I622-I624 HydrophobicContact CG2-CG1 4.33Å; I624-C637 HydrophobicContact CG2-CB 3.62Å; I624-I653 HydrophobicContact CG1-CD1 3.77Å; I624-M697 HydrophobicContact CD1-SD 4.27Å
625	E	88.2	Confident	82.9	Confident	80 Å²	80	71.8 Å²	71.8	37%	0.374	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	-60	-176.1	-68.9	-177	162	0	0	112.5	R623 S638 R640	R623-E625 IonicContact CZ-OE1 3.96Å; R623-E625 IonicContact NE-OE1 3.28Å; R623-E625 IonicContact NH2-OE1 3.6Å; R623-E625 PolarHBondContact NH2-OE1 3.17Å; E625-S638 PolarHBondContact N-O 3.46Å; E625-R640 WeakPolarHBondContact OE1-CG 3.45Å; E625-R640 IonicContact OE1-NE 3.92Å; E625-R640 IonicContact OE2-NE 3.63Å
626	R	86.5	Confident	82.7	Confident	167 Å²	167	67.4 Å²	67.4	63%	0.63	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.1	155.4	179.9	79.3	-174.7	91.3	-179.8	3.9	111.4	I628 C637 S638	R626-I628 HydrophobicContact CG-CG2 3.98Å; R626-C637 CarbonylContact O-C 3.57Å; R626-C637 WeakPolarHBondContact O-CA 3.37Å; R626-C637 WeakPolarHBondContact O-CB 3.26Å; R626-S638 WeakPolarHBondContact CG-OG 2.98Å; R626-S638 PolarHBondContact N-O 3.48Å; R626-S638 PolarHBondContact O-N 2.94Å
627	V	86.3	Confident	82.5	Confident	82 Å²	82	65.2 Å²	65.2	50%	0.497	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130.7	169.1	-176.4	0	0	0	0	108.8	E635	V627-E635 HydrophobicContact CG1-CB 4.34Å
628	I	81.6	Confident	82.5	Confident	72 Å²	72	65.2 Å²	65.2	37%	0.369	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-15.2	179	60.3	176	0	0	0	112.8	R626 V636 A652 Y702	R626-I628 HydrophobicContact CG-CG2 3.98Å; I628-V636 HydrophobicContact CD1-CG1 3.83Å; I628-V636 HydrophobicContact CG1-CB 4.11Å; I628-V636 HydrophobicContact CG1-CG1 3.79Å; I628-V636 VanDerWaalsContact CG1-O 3.26Å; I628-V636 WeakPolarHBondContact CG1-O 3.47Å; I628-V636 PolarHBondContact N-O 3.25Å; I628-A652 HydrophobicContact CD1-CB 4.14Å; I628-Y702 HydrophobicContact CD1-CD2 4.2Å; I628-Y702 HydrophobicContact CD1-CE2 3.71Å; I628-Y702 HydrophobicContact CG2-CE2 4.32Å
629	G	74.8	Confident	82.7	Confident	31 Å²	31	61 Å²	61	32%	0.32	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.5	173.5	175.5	0	0	0	0	0	112.4	V636	G629-V636 PolarHBondContact N-O 2.87Å; G629-V636 VanDerWaalsContact N-O 3.15Å; G629-V636 PolarHBondContact O-N 2.65Å
630	A	70.7	Confident	82.9	Confident	84 Å²	84	62.7 Å²	62.7	69%	0.694	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	126.4	172.1	0	0	0	0	0	108.8
631	G	61.1	Low	83.2	Confident	31 Å²	31	58.2 Å²	58.2	32%	0.32	30%	0.297	S	S	.	.			trans	-110	-177.1	176.1	0	0	0	0	0	112.4	F633 G634	G631-F633 VanDerWaalsContact C-N 3.27Å; G631-F633 PolarHBondContact O-N 3.31Å; G631-G634 PolarHBondContact N-O 3.27Å; G631-G634 PolarHBondContact O-N 3.48Å
632	E	60.7	Low	83.2	Confident	158 Å²	158	62 Å²	62	74%	0.738	31%	0.312	S	S	*	.	S	Bend	trans	-55.3	-38.8	-177.8	-174.7	177.5	-178.2	0	0	113.5
633	F	63.8	Low	82.6	Confident	13 Å²	13	62.3 Å²	62.3	6%	0.057	31%	0.314	C	S	.	.	S	Bend	trans	-93.3	-17.7	-175.2	-57	-68.5	0	0	0	114.4	G631 L656 K657 D667 F668 E671	G631-F633 VanDerWaalsContact C-N 3.27Å; G631-F633 PolarHBondContact O-N 3.31Å; F633-L656 HydrophobicContact CB-CD1 3.93Å; F633-L656 HydrophobicContact CD1-CD1 4.49Å; F633-K657 PolarHBondContact O-N 3.47Å; F633-D667 HydrophobicContact CE1-CB 3.59Å; F633-D667 HydrophobicContact CZ-CB 3.7Å; F633-F668 HydrophobicContact CB-CD2 3.41Å; F633-F668 VanDerWaalsContact CB-CD2 3.41Å; F633-F668 HydrophobicContact CB-CE2 3.91Å; F633-F668 HydrophobicContact CB-CG 4.35Å; F633-F668 HydrophobicContact CD1-CB 4.06Å; F633-F668 HydrophobicContact CD1-CD2 4.35Å; F633-F668 AromaticContact CD2-CD2 3.8Å; F633-F668 HydrophobicContact CD2-CD2 3.8Å; F633-F668 HydrophobicContact CE1-CB 4.46Å; F633-F668 HydrophobicContact CG-CB 4.13Å; F633-F668 AromaticContact CG-CD2 3.59Å; F633-F668 HydrophobicContact CG-CD2 3.59Å; F633-F668 HydrophobicContact CG-CE2 4.48Å; F633-F668 HydrophobicContact CG-CG 4.35Å; F633-E671 WeakPolarHBondContact CE2-OE2 3.44Å
634	G	71.6	Confident	82	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.323	C	S	.	.	S	Bend	trans	158.1	-157.8	-175.1	0	0	0	0	0	114.5	G631 T655	G631-G634 PolarHBondContact N-O 3.27Å; G631-G634 PolarHBondContact O-N 3.48Å; G634-T655 VanDerWaalsContact CA-O 3.31Å; G634-T655 WeakPolarHBondContact CA-O 3.17Å
635	E	81.3	Confident	81.2	Confident	75 Å²	75	61.4 Å²	61.4	35%	0.35	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	143.3	-176.5	-65.9	174.6	176.9	0	0	110.8	V627 T655	V627-E635 HydrophobicContact CG1-CB 4.34Å; E635-T655 PolarHBondContact O-N 3.48Å; E635-T655 PolarHBondContact O-OG1 3.4Å; E635-T655 VanDerWaalsContact O-OG1 3.09Å
636	V	86.9	Confident	80.8	Confident	33 Å²	33	65.6 Å²	65.6	20%	0.2	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.9	168.2	-169.9	0	0	0	0	107.3	I628 G629 A652 I653 K654	I628-V636 HydrophobicContact CD1-CG1 3.83Å; I628-V636 HydrophobicContact CG1-CB 4.11Å; I628-V636 HydrophobicContact CG1-CG1 3.79Å; I628-V636 VanDerWaalsContact CG1-O 3.26Å; I628-V636 WeakPolarHBondContact CG1-O 3.47Å; I628-V636 PolarHBondContact N-O 3.25Å; G629-V636 PolarHBondContact N-O 2.87Å; G629-V636 VanDerWaalsContact N-O 3.15Å; G629-V636 PolarHBondContact O-N 2.65Å; V636-A652 HydrophobicContact CG1-CB 4.33Å; V636-I653 CarbonylContact C-O 3.48Å; V636-I653 WeakPolarHBondContact CA-O 3.49Å; V636-K654 HydrophobicContact CG2-CG 4.2Å
637	C	89.2	Confident	80.6	Confident	6 Å²	6	66.6 Å²	66.6	4%	0.041	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	143.8	-179.1	-54	0	0	0	0	111.1	I624 R626 A652 I653	I624-C637 HydrophobicContact CG2-CB 3.62Å; R626-C637 CarbonylContact O-C 3.57Å; R626-C637 WeakPolarHBondContact O-CA 3.37Å; R626-C637 WeakPolarHBondContact O-CB 3.26Å; C637-A652 CarbonylContact O-C 3.49Å; C637-A652 WeakPolarHBondContact O-CA 3.35Å; C637-I653 HydrophobicContact CB-CB 4.48Å; C637-I653 PolarHBondContact N-O 3.46Å; C637-I653 PolarHBondContact O-N 3.19Å
638	S	92.9	Very high	80.7	Confident	6 Å²	6	66.1 Å²	66.1	4%	0.042	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	150.7	161.8	83.1	0	0	0	0	109.8	E625 R626 V651	E625-S638 PolarHBondContact N-O 3.46Å; R626-S638 WeakPolarHBondContact CG-OG 2.98Å; R626-S638 PolarHBondContact N-O 3.48Å; R626-S638 PolarHBondContact O-N 2.94Å; S638-V651 CarbonylContact C-O 3.58Å; S638-V651 WeakPolarHBondContact CA-O 3.27Å
639	G	94.1	Very high	81.2	Confident	2 Å²	2	65.2 Å²	65.2	2%	0.021	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	-171.4	176.3	0	0	0	0	0	113.7	R623 V651	R623-G639 CarbonylContact O-C 3.53Å; R623-G639 WeakPolarHBondContact O-CA 3.1Å; G639-V651 PolarHBondContact N-O 3.27Å; G639-V651 PolarHBondContact O-N 3.5Å
640	R	94.4	Very high	82.1	Confident	90 Å²	90	65.4 Å²	65.4	34%	0.34	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.8	175.5	-61	-68.2	179.2	167.2	-0.7	110.5	R623 E625 I649	R623-R640 HydrophobicContact CB-CB 4.48Å; R623-R640 PolarHBondContact N-O 3.05Å; R623-R640 PolarHBondContact O-N 3.44Å; E625-R640 WeakPolarHBondContact OE1-CG 3.45Å; E625-R640 IonicContact OE1-NE 3.92Å; E625-R640 IonicContact OE2-NE 3.63Å; R640-I649 WeakPolarHBondContact CA-O 3.19Å
641	L	94.7	Very high	83.3	Confident	3 Å²	3	61.4 Å²	61.4	2%	0.016	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.9	173.1	178	63.3	0	0	0	109.9	I617 R621 I622 T643 I649 V651 E687 V699	I617-L641 HydrophobicContact CD1-CD1 4.2Å; I617-L641 HydrophobicContact CD1-CD2 4.08Å; I617-L641 HydrophobicContact CG2-CD1 3.77Å; R621-L641 HydrophobicContact CB-CD1 4.42Å; I622-L641 HydrophobicContact CG1-CD1 3.8Å; L641-T643 HydrophobicContact CD2-CG2 4.24Å; L641-T643 HydrophobicContact CG-CG2 4.19Å; L641-I649 HydrophobicContact CB-CG1 3.99Å; L641-I649 HydrophobicContact CD2-CD1 4.32Å; L641-I649 PolarHBondContact N-O 3.29Å; L641-I649 PolarHBondContact O-N 3.22Å; L641-I649 VanDerWaalsContact O-N 3.14Å; L641-V651 HydrophobicContact CB-CG1 3.65Å; L641-V651 HydrophobicContact CB-CG2 4.07Å; L641-V651 HydrophobicContact CD2-CG1 4.27Å; L641-E687 HydrophobicContact CD2-CB 3.79Å; L641-E687 HydrophobicContact CD2-CG 4.13Å; L641-V699 HydrophobicContact CD2-CG1 4.45Å
642	R	91.6	Very high	85	Confident	141 Å²	141	60.4 Å²	60.4	53%	0.532	31%	0.314	S	S	.	.			trans	-80.2	122.5	169.6	-74.1	177	175.1	-173.4	-4.1	109.1	R621 E648	R621-R642 HydrophobicContact CB-CB 4.31Å; R621-R642 PolarHBondContact NE-O 2.84Å; R621-R642 PolarHBondContact NH2-O 3.21Å; R621-R642 PolarHBondContact O-N 3.46Å; R642-E648 HydrophobicContact CG-CG 3.65Å; R642-E648 IonicContact CZ-OE1 2.85Å; R642-E648 VanDerWaalsContact CZ-OE1 3.26Å; R642-E648 IonicContact NE-OE1 3.57Å; R642-E648 PolarHBondContact NE-OE1 3.12Å; R642-E648 IonicContact NH2-OE1 2.86Å; R642-E648 PolarHBondContact NH2-OE1 3.14Å
643	T	81.3	Confident	86.5	Confident	27 Å²	27	52.9 Å²	52.9	17%	0.166	28%	0.279	C	S	.	.			trans	-110.1	140.2	173.5	46.1	0	0	0	0	110.8	L641 G645 K646	L641-T643 HydrophobicContact CD2-CG2 4.24Å; L641-T643 HydrophobicContact CG-CG2 4.19Å; T643-G645 PolarHBondContact O-N 2.81Å; T643-K646 PolarHBondContact O-N 2.96Å; T643-K646 WeakPolarHBondContact OG1-CB 3.42Å
644	P	78.7	Confident	87.8	Confident	99 Å²	99	53.9 Å²	53.9	64%	0.643	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	125.8	-174.8	-15.6	33.6	0	0	0	108.6	K646	P644-K646 VanDerWaalsContact C-N 3.31Å; P644-K646 PolarHBondContact O-N 3.4Å
645	G	74.6	Confident	88.6	Confident	89 Å²	89	54.6 Å²	54.6	92%	0.918	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	10.3	-179.6	0	0	0	0	0	115.8	T643	T643-G645 PolarHBondContact O-N 2.81Å
646	K	81	Confident	88.7	Confident	168 Å²	168	51.4 Å²	51.4	73%	0.73	27%	0.273	S	S	*	.	S	Bend	trans	-132.7	160.4	178.7	-77	-175.1	-177.4	-173.6	0	111.3	T643 P644	T643-K646 PolarHBondContact O-N 2.96Å; T643-K646 WeakPolarHBondContact OG1-CB 3.42Å; P644-K646 VanDerWaalsContact C-N 3.31Å; P644-K646 PolarHBondContact O-N 3.4Å
647	K	81.8	Confident	88.1	Confident	189 Å²	189	54.5 Å²	54.5	82%	0.822	28%	0.284	S	S	*	.			trans	-64.8	153.6	174.5	-73.1	-174.6	177	-179.5	0	110.8	I649	K647-I649 PolarHBondContact O-N 3.3Å
648	E	88.6	Confident	87.3	Confident	72 Å²	72	58.1 Å²	58.1	34%	0.336	32%	0.322	S	S	.	.			trans	-58.1	130.3	171.5	-76.6	-178	-173.5	0	0	110.5	R642	R642-E648 HydrophobicContact CG-CG 3.65Å; R642-E648 IonicContact CZ-OE1 2.85Å; R642-E648 VanDerWaalsContact CZ-OE1 3.26Å; R642-E648 IonicContact NE-OE1 3.57Å; R642-E648 PolarHBondContact NE-OE1 3.12Å; R642-E648 IonicContact NH2-OE1 2.86Å; R642-E648 PolarHBondContact NH2-OE1 3.14Å
649	I	92.6	Very high	86.2	Confident	53 Å²	53	61.8 Å²	61.8	27%	0.272	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	148	178	61.6	175.4	0	0	0	110.5	R640 L641 K647 V651 E687	R640-I649 WeakPolarHBondContact CA-O 3.19Å; L641-I649 HydrophobicContact CB-CG1 3.99Å; L641-I649 HydrophobicContact CD2-CD1 4.32Å; L641-I649 PolarHBondContact N-O 3.29Å; L641-I649 PolarHBondContact O-N 3.22Å; L641-I649 VanDerWaalsContact O-N 3.14Å; K647-I649 PolarHBondContact O-N 3.3Å; I649-V651 HydrophobicContact CD1-CG1 4.41Å; I649-V651 HydrophobicContact CG1-CG1 4.17Å; I649-E687 HydrophobicContact CD1-CG 4.48Å; I649-E687 WeakPolarHBondContact CD1-OE1 3.37Å
650	A	93.7	Very high	85.1	Confident	35 Å²	35	63.9 Å²	63.9	29%	0.289	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	134.5	173.8	0	0	0	0	0	110.1	Y702	A650-Y702 HydrophobicContact CB-CD1 4.38Å; A650-Y702 HydrophobicContact CB-CG 4.42Å; A650-Y702 PolarHBondContact O-N 2.89Å
651	V	95.9	Very high	84.1	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	152.5	-177.4	-66.5	0	0	0	0	111.5	S638 G639 L641 I649 I653 E687 V699 V700	S638-V651 CarbonylContact C-O 3.58Å; S638-V651 WeakPolarHBondContact CA-O 3.27Å; G639-V651 PolarHBondContact N-O 3.27Å; G639-V651 PolarHBondContact O-N 3.5Å; L641-V651 HydrophobicContact CB-CG1 3.65Å; L641-V651 HydrophobicContact CB-CG2 4.07Å; L641-V651 HydrophobicContact CD2-CG1 4.27Å; I649-V651 HydrophobicContact CD1-CG1 4.41Å; I649-V651 HydrophobicContact CG1-CG1 4.17Å; V651-I653 HydrophobicContact CG2-CD1 4.04Å; V651-I653 HydrophobicContact CG2-CG1 3.9Å; V651-E687 HydrophobicContact CG1-CG 4Å; V651-V699 HydrophobicContact CB-CG1 3.64Å; V651-V699 HydrophobicContact CG1-CG1 3.83Å; V651-V699 HydrophobicContact CG2-CG1 3.83Å; V651-V700 CarbonylContact C-O 3.59Å; V651-V700 VanDerWaalsContact CA-O 3.31Å; V651-V700 WeakPolarHBondContact CA-O 3.37Å; V651-V700 WeakPolarHBondContact CB-O 3.2Å
652	A	94.9	Very high	83.1	Confident	10 Å²	10	68.7 Å²	68.7	8%	0.083	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	135.8	162.9	0	0	0	0	0	109.1	I628 V636 C637 V699 V700 Y702	I628-A652 HydrophobicContact CD1-CB 4.14Å; V636-A652 HydrophobicContact CG1-CB 4.33Å; C637-A652 CarbonylContact O-C 3.49Å; C637-A652 WeakPolarHBondContact O-CA 3.35Å; A652-V699 WeakPolarHBondContact O-CA 3.43Å; A652-V700 HydrophobicContact CB-CG2 3.87Å; A652-V700 PolarHBondContact N-O 2.91Å; A652-V700 PolarHBondContact O-N 2.91Å; A652-Y702 HydrophobicContact CB-CD2 4.25Å
653	I	93.7	Very high	82.2	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	103.4	-169.7	-56.8	161.9	0	0	0	106.8	I622 I624 V636 C637 V651 T655 M697 I698 V699	I622-I653 HydrophobicContact CG2-CD1 3.42Å; I622-I653 VanDerWaalsContact CG2-CD1 3.42Å; I622-I653 HydrophobicContact CG2-CG1 4.29Å; I624-I653 HydrophobicContact CG1-CD1 3.77Å; V636-I653 CarbonylContact C-O 3.48Å; V636-I653 WeakPolarHBondContact CA-O 3.49Å; C637-I653 HydrophobicContact CB-CB 4.48Å; C637-I653 PolarHBondContact N-O 3.46Å; C637-I653 PolarHBondContact O-N 3.19Å; V651-I653 HydrophobicContact CG2-CD1 4.04Å; V651-I653 HydrophobicContact CG2-CG1 3.9Å; I653-T655 HydrophobicContact CG2-CG2 4.06Å; I653-M697 HydrophobicContact CG2-CB 4.06Å; I653-M697 HydrophobicContact CG2-CG 4.19Å; I653-M697 HydrophobicContact CG2-SD 3.77Å; I653-I698 CarbonylContact C-O 3.53Å; I653-I698 WeakPolarHBondContact CA-O 3.35Å; I653-V699 HydrophobicContact CG1-CG1 4.34Å
654	K	91.4	Very high	81.8	Confident	33 Å²	33	72.6 Å²	72.6	14%	0.143	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	126.5	172	-156.6	-179.1	-167.9	175.4	0	107.6	V636 F668 E671 M697 I698	V636-K654 HydrophobicContact CG2-CG 4.2Å; K654-F668 HydrophobicContact CB-CE2 4.25Å; K654-F668 HydrophobicContact CB-CZ 4.41Å; K654-F668 HydrophobicContact CD-CE2 3.86Å; K654-F668 HydrophobicContact CG-CE2 3.82Å; K654-F668 HydrophobicContact CG-CZ 4.44Å; K654-E671 IonicContact NZ-OE1 3.17Å; K654-E671 PolarHBondContact NZ-OE1 3.06Å; K654-E671 IonicContact NZ-OE2 2.69Å; K654-E671 PolarHBondContact NZ-OE2 3.46Å; K654-M697 CarbonylContact O-C 3.59Å; K654-M697 VanDerWaalsContact O-CA 3.25Å; K654-M697 WeakPolarHBondContact O-CA 3.48Å; K654-I698 HydrophobicContact CB-CB 4.21Å; K654-I698 PolarHBondContact N-O 2.97Å; K654-I698 PolarHBondContact O-N 2.9Å
655	T	88.3	Confident	82	Confident	16 Å²	16	70.1 Å²	70.1	10%	0.098	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	141.4	-178.6	63.1	0	0	0	0	110.5	G634 E635 I653 M697	G634-T655 VanDerWaalsContact CA-O 3.31Å; G634-T655 WeakPolarHBondContact CA-O 3.17Å; E635-T655 PolarHBondContact O-N 3.48Å; E635-T655 PolarHBondContact O-OG1 3.4Å; E635-T655 VanDerWaalsContact O-OG1 3.09Å; I653-T655 HydrophobicContact CG2-CG2 4.06Å; T655-M697 HydrophobicContact CG2-CG 4.09Å; T655-M697 HydrophobicContact CG2-SD 4.42Å
656	L	83.3	Confident	82.2	Confident	7 Å²	7	71 Å²	71	4%	0.037	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-89.1	119.5	174.7	-171.3	63.5	0	0	0	109.9	F633 Y660 R665 F668 V696	F633-L656 HydrophobicContact CB-CD1 3.93Å; F633-L656 HydrophobicContact CD1-CD1 4.49Å; L656-Y660 HydrophobicContact CD1-CD1 4.38Å; L656-Y660 HydrophobicContact CD2-CD1 3.42Å; L656-Y660 VanDerWaalsContact CD2-CD1 3.42Å; L656-Y660 HydrophobicContact CD2-CD2 4.26Å; L656-Y660 HydrophobicContact CD2-CE1 3.42Å; L656-Y660 VanDerWaalsContact CD2-CE1 3.42Å; L656-Y660 HydrophobicContact CD2-CE2 4.3Å; L656-Y660 HydrophobicContact CD2-CG 3.85Å; L656-Y660 HydrophobicContact CG-CD1 3.48Å; L656-Y660 VanDerWaalsContact CG-CD1 3.48Å; L656-Y660 HydrophobicContact CG-CE1 3.89Å; L656-Y660 HydrophobicContact CG-CG 4.04Å; L656-R665 HydrophobicContact CD2-CB 4.05Å; L656-R665 HydrophobicContact CD2-CG 4.06Å; L656-F668 HydrophobicContact CB-CD1 3.96Å; L656-F668 HydrophobicContact CB-CE1 3.81Å; L656-F668 HydrophobicContact CB-CE2 4.37Å; L656-F668 HydrophobicContact CB-CG 4.31Å; L656-F668 HydrophobicContact CB-CZ 4.01Å; L656-F668 HydrophobicContact CD1-CB 3.91Å; L656-F668 HydrophobicContact CD1-CD1 4.26Å; L656-F668 HydrophobicContact CD1-CD2 4.06Å; L656-F668 HydrophobicContact CD1-CG 3.84Å; L656-F668 HydrophobicContact CD2-CB 4.45Å; L656-F668 HydrophobicContact CD2-CD1 4.08Å; L656-F668 HydrophobicContact CD2-CG 4.38Å; L656-F668 HydrophobicContact CG-CD1 4.32Å; L656-F668 HydrophobicContact CG-CG 4.39Å; L656-V696 HydrophobicContact CB-CB 4.06Å; L656-V696 HydrophobicContact CD2-CB 4.3Å; L656-V696 PolarHBondContact N-O 2.69Å
657	K	74.1	Confident	82	Confident	99 Å²	99	65.7 Å²	65.7	43%	0.43	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-59.2	140.7	-177.2	-82.1	170.1	173.7	168.7	0	112.8	F633 Y660	F633-K657 PolarHBondContact O-N 3.47Å; K657-Y660 WeakPolarHBondContact O-CD1 3.36Å
658	G	72.4	Confident	82.1	Confident	81 Å²	81	56.7 Å²	56.7	84%	0.835	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	141.9	173.6	0	0	0	0	0	112.6
659	G	68.7	Low	82	Confident	84 Å²	84	53.4 Å²	53.4	87%	0.866	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.2	14.3	-178.6	0	0	0	0	0	115.2
660	Y	71.1	Confident	81.6	Confident	45 Å²	45	52.1 Å²	52.1	18%	0.176	29%	0.286	C	S	.	.			trans	-59	149.1	174.9	59.8	-106.4	0	0	0	112.7	L656 K657 R665	L656-Y660 HydrophobicContact CD1-CD1 4.38Å; L656-Y660 HydrophobicContact CD2-CD1 3.42Å; L656-Y660 VanDerWaalsContact CD2-CD1 3.42Å; L656-Y660 HydrophobicContact CD2-CD2 4.26Å; L656-Y660 HydrophobicContact CD2-CE1 3.42Å; L656-Y660 VanDerWaalsContact CD2-CE1 3.42Å; L656-Y660 HydrophobicContact CD2-CE2 4.3Å; L656-Y660 HydrophobicContact CD2-CG 3.85Å; L656-Y660 HydrophobicContact CG-CD1 3.48Å; L656-Y660 VanDerWaalsContact CG-CD1 3.48Å; L656-Y660 HydrophobicContact CG-CE1 3.89Å; L656-Y660 HydrophobicContact CG-CG 4.04Å; K657-Y660 WeakPolarHBondContact O-CD1 3.36Å; Y660-R665 HydrophobicContact CD2-CB 3.66Å; Y660-R665 HydrophobicContact CD2-CG 4.47Å; Y660-R665 HydrophobicContact CE2-CB 3.52Å; Y660-R665 HydrophobicContact CE2-CG 3.87Å
661	V	72.8	Confident	81.2	Confident	88 Å²	88	51.1 Å²	51.1	53%	0.533	28%	0.275	S	S	.	.			trans	-79.5	151.3	166.1	-64.3	0	0	0	0	110	R663 Q664 R665	V661-R663 HydrophobicContact CG2-CB 4.24Å; V661-R663 PolarHBondContact O-N 2.52Å; V661-Q664 HydrophobicContact CG2-CB 4.16Å; V661-Q664 HydrophobicContact CG2-CG 3.67Å; V661-Q664 VanDerWaalsContact N-OE1 3.11Å; V661-Q664 WeakPolarHBondContact O-CB 3.49Å; V661-Q664 PolarHBondContact O-N 3.3Å; V661-R665 PolarHBondContact O-N 3.02Å
662	E	75.4	Confident	80.9	Confident	107 Å²	107	51.1 Å²	51.1	50%	0.5	28%	0.275	S	S	.	.	H	α-helix	trans	-54	-32.2	-179	-77.9	-57	134.3	0	0	113.2	Q664 R665 R666	E662-Q664 PolarHBondContact O-N 3.37Å; E662-R665 PolarHBondContact O-N 3.07Å; E662-R665 IonicContact OE2-NH1 3.96Å; E662-R666 WeakPolarHBondContact O-CG 3.08Å; E662-R666 PolarHBondContact O-N 3.36Å
663	R	71.3	Confident	80.5	Confident	171 Å²	171	50.7 Å²	50.7	65%	0.645	27%	0.272	S	S	*	.	H	α-helix	trans	-59.3	-46.3	173.4	-175.7	177	177	174.3	0.9	112.6	V661 R665 R666 D667	V661-R663 HydrophobicContact CG2-CB 4.24Å; V661-R663 PolarHBondContact O-N 2.52Å; R663-R665 VanDerWaalsContact C-N 3.31Å; R663-R665 PolarHBondContact O-N 3.17Å; R663-R666 PolarHBondContact O-N 3.03Å; R663-D667 PolarHBondContact O-N 3.36Å
664	Q	73.3	Confident	80.2	Confident	79 Å²	79	50.7 Å²	50.7	37%	0.369	27%	0.272	S	S	.	.	H	α-helix	trans	-65.2	-36	178.1	-71.4	172.8	-45.3	0	0	111.8	V661 E662 F668	V661-Q664 HydrophobicContact CG2-CB 4.16Å; V661-Q664 HydrophobicContact CG2-CG 3.67Å; V661-Q664 VanDerWaalsContact N-OE1 3.11Å; V661-Q664 WeakPolarHBondContact O-CB 3.49Å; V661-Q664 PolarHBondContact O-N 3.3Å; E662-Q664 PolarHBondContact O-N 3.37Å; Q664-F668 VanDerWaalsContact O-CB 3.22Å; Q664-F668 WeakPolarHBondContact O-CB 3.44Å; Q664-F668 PolarHBondContact O-N 2.65Å
665	R	82.5	Confident	80.1	Confident	46 Å²	46	49.5 Å²	49.5	17%	0.174	27%	0.267	C	S	.	.	H	α-helix	trans	-63	-45	172.7	-176.8	-178.1	173.2	-92.3	-6.5	111.6	T607 L656 Y660 V661 E662 R663 F668 L669	T607-R665 PolarHBondContact OG1-NH2 3.11Å; L656-R665 HydrophobicContact CD2-CB 4.05Å; L656-R665 HydrophobicContact CD2-CG 4.06Å; Y660-R665 HydrophobicContact CD2-CB 3.66Å; Y660-R665 HydrophobicContact CD2-CG 4.47Å; Y660-R665 HydrophobicContact CE2-CB 3.52Å; Y660-R665 HydrophobicContact CE2-CG 3.87Å; V661-R665 PolarHBondContact O-N 3.02Å; E662-R665 PolarHBondContact O-N 3.07Å; E662-R665 IonicContact OE2-NH1 3.96Å; R663-R665 VanDerWaalsContact C-N 3.31Å; R663-R665 PolarHBondContact O-N 3.17Å; R665-F668 PolarHBondContact O-N 3.25Å; R665-L669 HydrophobicContact CG-CD1 4.14Å; R665-L669 HydrophobicContact CG-CG 4.47Å; R665-L669 WeakPolarHBondContact O-CB 3.49Å; R665-L669 WeakPolarHBondContact O-CG 3.4Å; R665-L669 PolarHBondContact O-N 2.89Å
666	R	79.1	Confident	80.1	Confident	107 Å²	107	50 Å²	50	40%	0.404	28%	0.275	S	S	.	.	H	α-helix	trans	-62.3	-48.7	177.7	-68.8	-165.3	-60.7	-89.3	3.2	111.2	P606 E662 R663 F668 L669 R670	P606-R666 HydrophobicContact CG-CB 4.16Å; P606-R666 HydrophobicContact CG-CG 3.79Å; E662-R666 WeakPolarHBondContact O-CG 3.08Å; E662-R666 PolarHBondContact O-N 3.36Å; R663-R666 PolarHBondContact O-N 3.03Å; R666-F668 VanDerWaalsContact C-N 3.29Å; R666-F668 PolarHBondContact O-N 3.2Å; R666-L669 PolarHBondContact O-N 3.23Å; R666-R670 WeakPolarHBondContact O-CB 3.48Å; R666-R670 PolarHBondContact O-N 2.88Å
667	D	78.3	Confident	80.5	Confident	58 Å²	58	51.1 Å²	51.1	31%	0.31	28%	0.28	S	S	.	.	H	α-helix	trans	-60.8	-39.9	179.3	-63.7	-19.8	0	0	0	111	F633 R663 R670 E671	F633-D667 HydrophobicContact CE1-CB 3.59Å; F633-D667 HydrophobicContact CZ-CB 3.7Å; R663-D667 PolarHBondContact O-N 3.36Å; D667-R670 WeakPolarHBondContact O-CB 3.35Å; D667-R670 PolarHBondContact O-N 2.8Å; D667-E671 PolarHBondContact O-N 2.78Å; D667-E671 VanDerWaalsContact O-N 3.16Å
668	F	83.9	Confident	81.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-49.8	174.6	-173.4	-105.6	0	0	0	113	F633 K654 L656 Q664 R665 R666 R670 E671 A672 V696 I698	F633-F668 HydrophobicContact CB-CD2 3.41Å; F633-F668 VanDerWaalsContact CB-CD2 3.41Å; F633-F668 HydrophobicContact CB-CE2 3.91Å; F633-F668 HydrophobicContact CB-CG 4.35Å; F633-F668 HydrophobicContact CD1-CB 4.06Å; F633-F668 HydrophobicContact CD1-CD2 4.35Å; F633-F668 AromaticContact CD2-CD2 3.8Å; F633-F668 HydrophobicContact CD2-CD2 3.8Å; F633-F668 HydrophobicContact CE1-CB 4.46Å; F633-F668 HydrophobicContact CG-CB 4.13Å; F633-F668 AromaticContact CG-CD2 3.59Å; F633-F668 HydrophobicContact CG-CD2 3.59Å; F633-F668 HydrophobicContact CG-CE2 4.48Å; F633-F668 HydrophobicContact CG-CG 4.35Å; K654-F668 HydrophobicContact CB-CE2 4.25Å; K654-F668 HydrophobicContact CB-CZ 4.41Å; K654-F668 HydrophobicContact CD-CE2 3.86Å; K654-F668 HydrophobicContact CG-CE2 3.82Å; K654-F668 HydrophobicContact CG-CZ 4.44Å; L656-F668 HydrophobicContact CB-CD1 3.96Å; L656-F668 HydrophobicContact CB-CE1 3.81Å; L656-F668 HydrophobicContact CB-CE2 4.37Å; L656-F668 HydrophobicContact CB-CG 4.31Å; L656-F668 HydrophobicContact CB-CZ 4.01Å; L656-F668 HydrophobicContact CD1-CB 3.91Å; L656-F668 HydrophobicContact CD1-CD1 4.26Å; L656-F668 HydrophobicContact CD1-CD2 4.06Å; L656-F668 HydrophobicContact CD1-CG 3.84Å; L656-F668 HydrophobicContact CD2-CB 4.45Å; L656-F668 HydrophobicContact CD2-CD1 4.08Å; L656-F668 HydrophobicContact CD2-CG 4.38Å; L656-F668 HydrophobicContact CG-CD1 4.32Å; L656-F668 HydrophobicContact CG-CG 4.39Å; Q664-F668 VanDerWaalsContact O-CB 3.22Å; Q664-F668 WeakPolarHBondContact O-CB 3.44Å; Q664-F668 PolarHBondContact O-N 2.65Å; R665-F668 PolarHBondContact O-N 3.25Å; R666-F668 VanDerWaalsContact C-N 3.29Å; R666-F668 PolarHBondContact O-N 3.2Å; F668-R670 VanDerWaalsContact C-N 3.3Å; F668-R670 PolarHBondContact O-N 3.4Å; F668-E671 WeakPolarHBondContact O-CB 3.42Å; F668-E671 PolarHBondContact O-N 3.33Å; F668-A672 PolarHBondContact O-N 2.69Å; F668-V696 HydrophobicContact CD1-CG1 4.17Å; F668-V696 HydrophobicContact CE1-CB 4.4Å; F668-V696 HydrophobicContact CE1-CG1 3.88Å; F668-I698 HydrophobicContact CD1-CD1 4.08Å; F668-I698 HydrophobicContact CD1-CG1 4.27Å; F668-I698 HydrophobicContact CD2-CD1 4.01Å; F668-I698 HydrophobicContact CE1-CD1 3.84Å; F668-I698 HydrophobicContact CE1-CG1 3.64Å; F668-I698 HydrophobicContact CE2-CD1 3.81Å; F668-I698 HydrophobicContact CE2-CG1 4.24Å; F668-I698 HydrophobicContact CG-CD1 4.17Å; F668-I698 HydrophobicContact CZ-CB 4.36Å; F668-I698 HydrophobicContact CZ-CD1 3.72Å; F668-I698 HydrophobicContact CZ-CG1 3.64Å; F668-I698 WeakPolarHBondContact O-CD1 3.34Å
669	L	85.9	Confident	82.2	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-68.8	-30.5	179	-72.3	-176.2	0	0	0	112.8	V610 R665 R666 A672 S673 T691 V696	V610-L669 HydrophobicContact CG2-CB 3.72Å; V610-L669 HydrophobicContact CG2-CD1 4.46Å; V610-L669 HydrophobicContact CG2-CD2 4.1Å; V610-L669 HydrophobicContact CG2-CG 4.29Å; V610-L669 WeakPolarHBondContact CG2-O 3.35Å; R665-L669 HydrophobicContact CG-CD1 4.14Å; R665-L669 HydrophobicContact CG-CG 4.47Å; R665-L669 WeakPolarHBondContact O-CB 3.49Å; R665-L669 WeakPolarHBondContact O-CG 3.4Å; R665-L669 PolarHBondContact O-N 2.89Å; R666-L669 PolarHBondContact O-N 3.23Å; L669-A672 PolarHBondContact O-N 2.97Å; L669-S673 PolarHBondContact O-N 3.06Å; L669-S673 PolarHBondContact O-OG 3.06Å; L669-T691 HydrophobicContact CD2-CG2 3.89Å; L669-V696 HydrophobicContact CD2-CG1 4.03Å
670	R	83.6	Confident	83.4	Confident	26 Å²	26	47.2 Å²	47.2	10%	0.098	22%	0.223	C	C	.	.	H	α-helix	trans	-61.7	-47.1	174.3	-175.7	178	-173.2	-73.3	-9.9	110.8	D599 P600 D601 R666 D667 F668 A672 S673 I674 S769	D599-R670 IonicContact OD1-NH2 3.47Å; D599-R670 PolarHBondContact OD1-NH2 2.93Å; P600-R670 HydrophobicContact CB-CG 4.37Å; D601-R670 VanDerWaalsContact CG-NE 3.31Å; D601-R670 WeakPolarHBondContact OD1-CD 3.34Å; D601-R670 IonicContact OD1-CZ 3.05Å; D601-R670 IonicContact OD1-NE 3.69Å; D601-R670 PolarHBondContact OD1-NE 3.14Å; D601-R670 IonicContact OD1-NH2 3.78Å; D601-R670 IonicContact OD2-CZ 2.68Å; D601-R670 IonicContact OD2-NE 2.79Å; D601-R670 PolarHBondContact OD2-NE 2.98Å; D601-R670 VanDerWaalsContact OD2-NE 3.11Å; D601-R670 IonicContact OD2-NH2 2.9Å; D601-R670 PolarHBondContact OD2-NH2 3.07Å; R666-R670 WeakPolarHBondContact O-CB 3.48Å; R666-R670 PolarHBondContact O-N 2.88Å; D667-R670 WeakPolarHBondContact O-CB 3.35Å; D667-R670 PolarHBondContact O-N 2.8Å; F668-R670 VanDerWaalsContact C-N 3.3Å; F668-R670 PolarHBondContact O-N 3.4Å; R670-A672 VanDerWaalsContact C-N 3.28Å; R670-A672 PolarHBondContact O-N 2.93Å; R670-S673 WeakPolarHBondContact O-CB 3.43Å; R670-S673 PolarHBondContact O-N 3.2Å; R670-S673 VanDerWaalsContact O-N 3.09Å; R670-I674 HydrophobicContact CG-CD1 4.29Å; R670-I674 WeakPolarHBondContact O-CG1 3.13Å; R670-I674 PolarHBondContact O-N 3.46Å; R670-S769 PolarHBondContact NH1-O 2.83Å; R670-S769 PolarHBondContact NH2-O 3.35Å
671	E	85.1	Confident	84.6	Confident	15 Å²	15	49 Å²	49	7%	0.07	24%	0.24	C	C	.	.	H	α-helix	trans	-54.5	-45.5	175.3	-164.4	-172	153.5	0	0	111.5	F633 K654 D667 F668 S673 I674 M675	F633-E671 WeakPolarHBondContact CE2-OE2 3.44Å; K654-E671 IonicContact NZ-OE1 3.17Å; K654-E671 PolarHBondContact NZ-OE1 3.06Å; K654-E671 IonicContact NZ-OE2 2.69Å; K654-E671 PolarHBondContact NZ-OE2 3.46Å; D667-E671 PolarHBondContact O-N 2.78Å; D667-E671 VanDerWaalsContact O-N 3.16Å; F668-E671 WeakPolarHBondContact O-CB 3.42Å; F668-E671 PolarHBondContact O-N 3.33Å; E671-S673 PolarHBondContact O-N 2.61Å; E671-I674 PolarHBondContact O-N 3.36Å; E671-M675 HydrophobicContact CG-CE 3.95Å; E671-M675 WeakPolarHBondContact O-CE 3.34Å; E671-M675 WeakPolarHBondContact O-CG 3.26Å; E671-M675 PolarHBondContact O-N 3.22Å
672	A	89	Confident	85.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-41.8	176.7	0	0	0	0	0	113	T614 F668 L669 R670 I674 M675 G676 L686 V689 I698	T614-A672 HydrophobicContact CG2-CB 4.47Å; T614-A672 WeakPolarHBondContact CG2-O 3.36Å; F668-A672 PolarHBondContact O-N 2.69Å; L669-A672 PolarHBondContact O-N 2.97Å; R670-A672 VanDerWaalsContact C-N 3.28Å; R670-A672 PolarHBondContact O-N 2.93Å; A672-I674 VanDerWaalsContact C-N 3.27Å; A672-I674 PolarHBondContact O-N 2.91Å; A672-M675 PolarHBondContact O-N 2.87Å; A672-G676 PolarHBondContact O-N 2.71Å; A672-L686 WeakPolarHBondContact O-CD2 3.47Å; A672-V689 HydrophobicContact CB-CG1 3.71Å; A672-I698 HydrophobicContact CB-CD1 3.8Å; A672-I698 HydrophobicContact CB-CG1 3.87Å; A672-I698 HydrophobicContact CB-CG2 4.37Å
673	S	87.4	Confident	86.8	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-31.2	-179.9	-55.1	0	0	0	0	112.4	V610 L669 R670 E671 Q677	V610-S673 WeakPolarHBondContact CG2-OG 3.43Å; V610-S673 PolarHBondContact N-OG 2.78Å; L669-S673 PolarHBondContact O-N 3.06Å; L669-S673 PolarHBondContact O-OG 3.06Å; R670-S673 WeakPolarHBondContact O-CB 3.43Å; R670-S673 PolarHBondContact O-N 3.2Å; R670-S673 VanDerWaalsContact O-N 3.09Å; E671-S673 PolarHBondContact O-N 2.61Å; S673-Q677 WeakPolarHBondContact O-CG 3.47Å; S673-Q677 PolarHBondContact O-NE2 2.73Å
674	I	86.4	Confident	87.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-72.9	-51.6	174.6	-65.4	178.8	0	0	0	110.1	Y597 P600 R670 E671 A672 G676 Q677 F678 Y743 F766 S769	Y597-I674 HydrophobicContact CE2-CG1 4.31Å; Y597-I674 HydrophobicContact CE2-CG2 4.2Å; Y597-I674 WeakPolarHBondContact OH-CG1 3.37Å; P600-I674 HydrophobicContact CG-CG1 3.75Å; R670-I674 HydrophobicContact CG-CD1 4.29Å; R670-I674 WeakPolarHBondContact O-CG1 3.13Å; R670-I674 PolarHBondContact O-N 3.46Å; E671-I674 PolarHBondContact O-N 3.36Å; A672-I674 VanDerWaalsContact C-N 3.27Å; A672-I674 PolarHBondContact O-N 2.91Å; I674-G676 PolarHBondContact O-N 2.87Å; I674-Q677 PolarHBondContact O-N 3.24Å; I674-Q677 VanDerWaalsContact O-N 3.09Å; I674-F678 HydrophobicContact CG2-CD2 4.49Å; I674-F678 HydrophobicContact CG2-CE2 3.58Å; I674-F678 HydrophobicContact CG2-CZ 4.1Å; I674-Y743 HydrophobicContact CG2-CE2 3.7Å; I674-Y743 WeakPolarHBondContact CG2-OH 3.46Å; I674-F766 HydrophobicContact CG2-CB 3.99Å; I674-F766 HydrophobicContact CG2-CD1 4.49Å; I674-F766 HydrophobicContact CG2-CG 4.13Å; I674-S769 WeakPolarHBondContact CD1-OG 3.35Å
675	M	89.6	Confident	88.9	Confident	7 Å²	7	33.1 Å²	33.1	3%	0.034	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-35.7	178.4	-70.6	-175	-71.4	0	0	112.6	E671 A672 Q677 F678 I684 L686 I698 V700 F766	E671-M675 HydrophobicContact CG-CE 3.95Å; E671-M675 WeakPolarHBondContact O-CE 3.34Å; E671-M675 WeakPolarHBondContact O-CG 3.26Å; E671-M675 PolarHBondContact O-N 3.22Å; A672-M675 PolarHBondContact O-N 2.87Å; M675-Q677 PolarHBondContact O-N 3.26Å; M675-F678 PolarHBondContact O-N 2.79Å; M675-I684 HydrophobicContact SD-CG2 4.25Å; M675-L686 HydrophobicContact CB-CB 4.06Å; M675-L686 HydrophobicContact CB-CD2 4.44Å; M675-L686 HydrophobicContact CE-CD1 4.43Å; M675-I698 HydrophobicContact CE-CD1 4.43Å; M675-I698 HydrophobicContact CE-CG2 3.63Å; M675-V700 HydrophobicContact CE-CG1 4.38Å; M675-V700 HydrophobicContact SD-CG1 4.11Å; M675-F766 HydrophobicContact CG-CD2 3.37Å; M675-F766 HydrophobicContact CG-CE2 3.64Å; M675-F766 HydrophobicContact SD-CD2 4.17Å; M675-F766 HydrophobicContact SD-CE2 4.44Å
676	G	89.6	Confident	89.4	Confident	26 Å²	26	32 Å²	32	27%	0.268	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.8	179.2	0	0	0	0	0	115	F613 A672 I674	F613-G676 CarbonylContact O-C 3.51Å; F613-G676 VanDerWaalsContact O-CA 3.29Å; F613-G676 WeakPolarHBondContact O-CA 3.41Å; A672-G676 PolarHBondContact O-N 2.71Å; I674-G676 PolarHBondContact O-N 2.87Å
677	Q	90.2	Very high	90.1	Very high	31 Å²	31	28.4 Å²	28.4	15%	0.145	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-11.3	179	-65.7	-179.4	60.4	0	0	113.5	Y597 V598 F613 S673 I674 M675	Y597-Q677 VanDerWaalsContact CD2-OE1 3.3Å; V598-Q677 PolarHBondContact O-NE2 2.87Å; V598-Q677 PolarHBondContact O-OE1 3.32Å; F613-Q677 HydrophobicContact CB-CG 3.96Å; F613-Q677 HydrophobicContact CD1-CG 3.6Å; F613-Q677 HydrophobicContact CD2-CG 4.13Å; F613-Q677 HydrophobicContact CE1-CG 4.12Å; F613-Q677 HydrophobicContact CG-CG 3.61Å; S673-Q677 WeakPolarHBondContact O-CG 3.47Å; S673-Q677 PolarHBondContact O-NE2 2.73Å; I674-Q677 PolarHBondContact O-N 3.24Å; I674-Q677 VanDerWaalsContact O-N 3.09Å; M675-Q677 PolarHBondContact O-N 3.26Å
678	F	91.4	Very high	90.9	Very high	10 Å²	10	25.7 Å²	25.7	4%	0.044	14%	0.135	C	C	.	.			trans	-108.9	136	-172.7	-56.7	-39.2	0	0	0	112.4	Y597 I674 M675 I683 Y737 L738 M741 Y743 F766	Y597-F678 HydrophobicContact CD2-CE1 4.03Å; Y597-F678 AromaticContact CD2-CZ 3.89Å; Y597-F678 HydrophobicContact CD2-CZ 3.89Å; Y597-F678 HydrophobicContact CE2-CZ 4.22Å; I674-F678 HydrophobicContact CG2-CD2 4.49Å; I674-F678 HydrophobicContact CG2-CE2 3.58Å; I674-F678 HydrophobicContact CG2-CZ 4.1Å; M675-F678 PolarHBondContact O-N 2.79Å; F678-I683 HydrophobicContact CB-CG2 3.99Å; F678-I683 HydrophobicContact CD2-CG2 4.44Å; F678-Y737 HydrophobicContact CB-CE1 3.94Å; F678-Y737 AromaticContact CD1-CE1 3.97Å; F678-Y737 HydrophobicContact CD1-CE1 3.97Å; F678-Y737 HydrophobicContact CG-CE1 4.24Å; F678-L738 HydrophobicContact CD1-CD2 4.01Å; F678-L738 HydrophobicContact CD2-CD2 3.83Å; F678-L738 HydrophobicContact CE1-CD2 3.89Å; F678-L738 HydrophobicContact CE2-CD2 3.68Å; F678-L738 HydrophobicContact CG-CD2 4.01Å; F678-L738 HydrophobicContact CZ-CD2 3.74Å; F678-M741 HydrophobicContact CD1-CE 4.5Å; F678-Y743 HydrophobicContact CE1-CG 4.4Å; F678-Y743 HydrophobicContact CE2-CD1 4.34Å; F678-Y743 HydrophobicContact CE2-CD2 4.38Å; F678-Y743 HydrophobicContact CE2-CE1 4.22Å; F678-Y743 HydrophobicContact CE2-CE2 4.27Å; F678-Y743 HydrophobicContact CE2-CG 4.38Å; F678-Y743 AromaticContact CZ-CD1 3.99Å; F678-Y743 HydrophobicContact CZ-CD1 3.99Å; F678-Y743 AromaticContact CZ-CD2 3.61Å; F678-Y743 HydrophobicContact CZ-CD2 3.61Å; F678-Y743 HydrophobicContact CZ-CE1 4.25Å; F678-Y743 AromaticContact CZ-CE2 3.9Å; F678-Y743 HydrophobicContact CZ-CE2 3.9Å; F678-Y743 AromaticContact CZ-CG 3.62Å; F678-Y743 HydrophobicContact CZ-CG 3.62Å; F678-F766 HydrophobicContact CD2-CE1 4.4Å; F678-F766 HydrophobicContact CD2-CZ 4.15Å; F678-F766 HydrophobicContact CE2-CD1 4.49Å; F678-F766 HydrophobicContact CE2-CE1 4.15Å; F678-F766 HydrophobicContact CE2-CZ 4.34Å
679	D	91.2	Very high	91.4	Very high	128 Å²	128	25.7 Å²	25.7	68%	0.684	14%	0.135	S	C	*	.			trans	-141.4	96.1	173.7	-172.5	18.7	0	0	0	110	Y737	D679-Y737 PolarHBondContact N-OH 3.44Å; D679-Y737 VanDerWaalsContact N-OH 3.07Å
680	H	95.3	Very high	91.7	Very high	44 Å²	44	25.6 Å²	25.6	20%	0.204	14%	0.135	C	C	.	.			trans	-152.6	142.3	-179.9	-175.5	-91.5	0	0	0	110.5	N682 I683 Y737	H680-N682 PolarHBondContact ND1-N 2.72Å; H680-N682 VanDerWaalsContact ND1-N 3.13Å; H680-N682 PolarHBondContact O-N 3.1Å; H680-N682 VanDerWaalsContact O-N 3.09Å; H680-I683 HydrophobicContact CB-CB 4.24Å; H680-I683 HydrophobicContact CB-CG1 3.91Å; H680-I683 PolarHBondContact O-N 3.15Å; H680-I683 VanDerWaalsContact O-O 3.14Å; H680-Y737 HydrophobicContact CB-CD1 3.7Å; H680-Y737 HydrophobicContact CB-CD2 4.09Å; H680-Y737 HydrophobicContact CB-CE1 3.96Å; H680-Y737 HydrophobicContact CB-CE2 4.33Å; H680-Y737 HydrophobicContact CB-CG 3.76Å; H680-Y737 AromaticContact CD2-CD2 3.94Å; H680-Y737 AromaticContact CD2-CG 3.9Å; H680-Y737 AromaticContact CG-CG 3.84Å
681	P	95.6	Very high	92	Very high	84 Å²	84	25.6 Å²	25.6	55%	0.545	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-25	-176.6	21.5	-35.6	0	0	0	115.1	K762	P681-K762 WeakPolarHBondContact O-CE 3.24Å; P681-K762 PolarHBondContact O-NZ 2.8Å
682	N	97.6	Very high	92	Very high	15 Å²	15	32.8 Å²	32.8	8%	0.08	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	16.5	177.9	-60.7	105.3	0	0	0	114.2	H680 G730 C761 K762 V763	H680-N682 PolarHBondContact ND1-N 2.72Å; H680-N682 VanDerWaalsContact ND1-N 3.13Å; H680-N682 PolarHBondContact O-N 3.1Å; H680-N682 VanDerWaalsContact O-N 3.09Å; N682-G730 WeakPolarHBondContact CB-O 3.11Å; N682-G730 VanDerWaalsContact ND2-CA 3.34Å; N682-G730 WeakPolarHBondContact ND2-CA 3.43Å; N682-G730 PolarHBondContact ND2-O 3.12Å; N682-C761 PolarHBondContact ND2-O 2.82Å; N682-K762 CarbonylContact O-C 3.58Å; N682-K762 VanDerWaalsContact O-CA 3.31Å; N682-K762 WeakPolarHBondContact O-CA 3.41Å; N682-V763 PolarHBondContact O-N 2.86Å
683	I	96.2	Very high	91.7	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.015	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-117.3	140.3	169.8	-60.7	-58.9	0	0	0	107.9	F678 H680 R685 Y737 L738 V763 F766	F678-I683 HydrophobicContact CB-CG2 3.99Å; F678-I683 HydrophobicContact CD2-CG2 4.44Å; H680-I683 HydrophobicContact CB-CB 4.24Å; H680-I683 HydrophobicContact CB-CG1 3.91Å; H680-I683 PolarHBondContact O-N 3.15Å; H680-I683 VanDerWaalsContact O-O 3.14Å; I683-R685 PolarHBondContact O-N 2.83Å; I683-Y737 HydrophobicContact CG1-CD1 4.01Å; I683-L738 HydrophobicContact CD1-CD1 3.85Å; I683-L738 HydrophobicContact CD1-CD2 4.18Å; I683-L738 HydrophobicContact CD1-CG 3.83Å; I683-V763 HydrophobicContact CD1-CB 3.73Å; I683-V763 HydrophobicContact CD1-CG2 4.06Å; I683-F766 HydrophobicContact CG2-CZ 3.93Å
684	I	95.1	Very high	91.4	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.026	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-62	126	178	-166.7	68	0	0	0	110.2	M675 V700 E701 M703 L754 V763 F766	M675-I684 HydrophobicContact SD-CG2 4.25Å; I684-V700 HydrophobicContact CG1-CB 4.26Å; I684-V700 HydrophobicContact CG1-CG2 4.4Å; I684-E701 HydrophobicContact CD1-CG 3.45Å; I684-E701 VanDerWaalsContact CD1-CG 3.45Å; I684-E701 HydrophobicContact CG1-CG 4.35Å; I684-M703 HydrophobicContact CD1-CG 3.69Å; I684-M703 HydrophobicContact CD1-SD 4.1Å; I684-L754 HydrophobicContact CD1-CD1 3.96Å; I684-L754 HydrophobicContact CG1-CD1 4.4Å; I684-V763 PolarHBondContact N-O 2.6Å; I684-F766 HydrophobicContact CG2-CE2 3.94Å
685	R	93.4	Very high	91.4	Very high	87 Å²	87	47.9 Å²	47.9	33%	0.328	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-90.8	128.1	-174.1	-172	172.7	54.8	74.8	10.3	111.8	I683 E687 V700 E701	I683-R685 PolarHBondContact O-N 2.83Å; R685-E687 IonicContact CZ-OE1 4Å; R685-E687 IonicContact CZ-OE2 2.93Å; R685-E687 IonicContact NH1-OE1 3.97Å; R685-E687 PolarHBondContact NH1-OE1 2.87Å; R685-E687 IonicContact NH1-OE2 3.4Å; R685-E687 PolarHBondContact NH1-OE2 3.09Å; R685-E687 IonicContact NH2-OE1 3.35Å; R685-E687 PolarHBondContact NH2-OE1 3.11Å; R685-V700 WeakPolarHBondContact O-CA 3.08Å; R685-V700 WeakPolarHBondContact O-CB 3.42Å; R685-E701 HydrophobicContact CB-CG 4.38Å; R685-E701 WeakPolarHBondContact CB-OE1 3.31Å; R685-E701 PolarHBondContact N-OE1 3.33Å; R685-E701 PolarHBondContact O-N 2.8Å
686	L	94.4	Very high	91.4	Very high	24 Å²	24	47.9 Å²	47.9	13%	0.126	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	124.2	169	-175.7	70.3	0	0	0	110.6	T614 A672 M675 I698 V699 V700	T614-L686 HydrophobicContact CG2-CD2 3.64Å; A672-L686 WeakPolarHBondContact O-CD2 3.47Å; M675-L686 HydrophobicContact CB-CB 4.06Å; M675-L686 HydrophobicContact CB-CD2 4.44Å; M675-L686 HydrophobicContact CE-CD1 4.43Å; L686-I698 HydrophobicContact CD1-CG2 3.47Å; L686-I698 VanDerWaalsContact CD1-CG2 3.47Å; L686-V699 WeakPolarHBondContact CD1-O 3.28Å; L686-V700 HydrophobicContact CD1-CG1 4.03Å
687	E	93.9	Very high	91.5	Very high	30 Å²	30	47.2 Å²	47.2	14%	0.14	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	-33.5	171	-64.2	-69.5	-179.1	0	0	112	I617 L641 I649 V651 R685 V699	I617-E687 HydrophobicContact CD1-CB 4.41Å; L641-E687 HydrophobicContact CD2-CB 3.79Å; L641-E687 HydrophobicContact CD2-CG 4.13Å; I649-E687 HydrophobicContact CD1-CG 4.48Å; I649-E687 WeakPolarHBondContact CD1-OE1 3.37Å; V651-E687 HydrophobicContact CG1-CG 4Å; R685-E687 IonicContact CZ-OE1 4Å; R685-E687 IonicContact CZ-OE2 2.93Å; R685-E687 IonicContact NH1-OE1 3.97Å; R685-E687 PolarHBondContact NH1-OE1 2.87Å; R685-E687 IonicContact NH1-OE2 3.4Å; R685-E687 PolarHBondContact NH1-OE2 3.09Å; R685-E687 IonicContact NH2-OE1 3.35Å; R685-E687 PolarHBondContact NH2-OE1 3.11Å; E687-V699 WeakPolarHBondContact CA-O 3.34Å; E687-V699 HydrophobicContact CB-CB 4.29Å; E687-V699 HydrophobicContact CB-CG1 4.05Å; E687-V699 WeakPolarHBondContact CB-O 3.41Å; E687-V699 HydrophobicContact CG-CG1 4.44Å; E687-V699 PolarHBondContact N-O 3.22Å
688	G	93.3	Very high	91.7	Very high	1 Å²	1	45.8 Å²	45.8	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.7	-170.9	177	0	0	0	0	0	112.7	K615 V699	K615-G688 CarbonylContact O-C 3.56Å; K615-G688 WeakPolarHBondContact O-CA 3.48Å; G688-V699 PolarHBondContact N-O 2.81Å; G688-V699 PolarHBondContact O-N 3.03Å
689	V	94.4	Very high	91.8	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	158.9	-176.3	-62.5	0	0	0	0	110.8	V610 T614 K615 E616 I617 A672 T691 M697	V610-V689 HydrophobicContact CG1-CG2 3.77Å; T614-V689 HydrophobicContact CG2-CG1 4.37Å; T614-V689 VanDerWaalsContact OG1-CG2 3.23Å; T614-V689 WeakPolarHBondContact OG1-CG2 3.47Å; K615-V689 PolarHBondContact O-N 3.36Å; E616-V689 CarbonylContact C-O 3.46Å; E616-V689 WeakPolarHBondContact CA-O 3.27Å; I617-V689 PolarHBondContact N-O 3.4Å; A672-V689 HydrophobicContact CB-CG1 3.71Å; V689-T691 HydrophobicContact CB-CG2 4.12Å; V689-T691 HydrophobicContact CG2-CG2 3.82Å; V689-M697 CarbonylContact C-O 3.55Å; V689-M697 VanDerWaalsContact CA-O 3.26Å; V689-M697 WeakPolarHBondContact CA-O 3.13Å
690	V	93.1	Very high	92	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	107.1	167.1	-178.9	0	0	0	0	107.2	I617 P619 I622 S693 V696 M697	I617-V690 HydrophobicContact CB-CG2 4.18Å; P619-V690 HydrophobicContact CG-CG1 3.82Å; I622-V690 HydrophobicContact CD1-CG2 3.49Å; I622-V690 VanDerWaalsContact CD1-CG2 3.49Å; V690-S693 WeakPolarHBondContact CG1-OG 3.47Å; V690-V696 CarbonylContact O-C 3.59Å; V690-V696 VanDerWaalsContact O-CA 3.23Å; V690-V696 WeakPolarHBondContact O-CA 3.19Å; V690-V696 VanDerWaalsContact O-CG1 3.31Å; V690-V696 WeakPolarHBondContact O-CG1 3.27Å; V690-M697 HydrophobicContact CB-CB 3.99Å; V690-M697 HydrophobicContact CB-CE 3.83Å; V690-M697 HydrophobicContact CB-CG 4.37Å; V690-M697 HydrophobicContact CG1-CE 3.8Å; V690-M697 HydrophobicContact CG2-CB 4.24Å; V690-M697 HydrophobicContact CG2-CE 3.82Å; V690-M697 PolarHBondContact N-O 3.02Å; V690-M697 PolarHBondContact O-N 2.8Å
691	T	90.2	Very high	91.9	Very high	25 Å²	25	39.4 Å²	39.4	15%	0.153	19%	0.191	C	C	.	.			trans	-116.3	-22.4	-176.9	63.6	0	0	0	0	112.7	V610 E616 L669 V689 V696	V610-T691 HydrophobicContact CG1-CG2 4.1Å; E616-T691 VanDerWaalsContact CD-OG1 3.32Å; E616-T691 PolarHBondContact OE1-N 2.64Å; E616-T691 PolarHBondContact OE1-OG1 3.31Å; E616-T691 PolarHBondContact OE2-N 3.23Å; E616-T691 PolarHBondContact OE2-OG1 3.12Å; L669-T691 HydrophobicContact CD2-CG2 3.89Å; V689-T691 HydrophobicContact CB-CG2 4.12Å; V689-T691 HydrophobicContact CG2-CG2 3.82Å; T691-V696 HydrophobicContact CG2-CG1 4.41Å
692	K	85.4	Confident	91.9	Very high	167 Å²	167	38.4 Å²	38.4	73%	0.726	18%	0.177	S	C	*	.	S	Bend	trans	-82.8	-6.5	-177.1	-66	177.6	-176.8	179	0	114.8	E616	E616-K692 HydrophobicContact CG-CD 4.07Å; E616-K692 HydrophobicContact CG-CG 4.45Å; E616-K692 WeakPolarHBondContact OE1-CG 3.44Å; E616-K692 PolarHBondContact OE1-N 2.99Å
693	S	83.1	Confident	91.8	Very high	38 Å²	38	38.3 Å²	38.3	27%	0.266	18%	0.176	S	C	.	.	S	Bend	trans	-134.8	167.9	177.5	64.8	0	0	0	0	111.5	P619 V690 P695	P619-S693 WeakPolarHBondContact CG-OG 3.44Å; V690-S693 WeakPolarHBondContact CG1-OG 3.47Å; S693-P695 CarbonylContact O-C 3.52Å
694	R	80.2	Confident	91.7	Very high	217 Å²	217	42.3 Å²	42.3	82%	0.819	20%	0.195	S	C	*	.	S	Bend	trans	-105.5	138.1	171.7	-69	-173.8	175.3	-176.4	-2.7	110.6
695	P	86.6	Confident	91.6	Very high	62 Å²	62	44.8 Å²	44.8	40%	0.403	21%	0.208	S	C	.	.	S	Bend	cis	-71.8	156.3	-2.3	31.5	-35.2	0	0	0	112.7	S693 M697	S693-P695 CarbonylContact O-C 3.52Å; P695-M697 HydrophobicContact CG-CG 4.31Å; P695-M697 HydrophobicContact CG-SD 4.42Å
696	V	89.5	Confident	91.6	Very high	8 Å²	8	42.1 Å²	42.1	5%	0.048	21%	0.208	C	C	.	.			trans	-73.6	135.3	170.5	-177.4	0	0	0	0	107.6	L656 F668 L669 V690 T691	L656-V696 HydrophobicContact CB-CB 4.06Å; L656-V696 HydrophobicContact CD2-CB 4.3Å; L656-V696 PolarHBondContact N-O 2.69Å; F668-V696 HydrophobicContact CD1-CG1 4.17Å; F668-V696 HydrophobicContact CE1-CB 4.4Å; F668-V696 HydrophobicContact CE1-CG1 3.88Å; L669-V696 HydrophobicContact CD2-CG1 4.03Å; V690-V696 CarbonylContact O-C 3.59Å; V690-V696 VanDerWaalsContact O-CA 3.23Å; V690-V696 WeakPolarHBondContact O-CA 3.19Å; V690-V696 VanDerWaalsContact O-CG1 3.31Å; V690-V696 WeakPolarHBondContact O-CG1 3.27Å; T691-V696 HydrophobicContact CG2-CG1 4.41Å
697	M	92.6	Very high	91.6	Very high	11 Å²	11	42.4 Å²	42.4	5%	0.054	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	145.3	-172.9	-52.8	-177.7	-98.5	0	0	112.7	I624 I653 K654 T655 V689 V690 P695	I624-M697 HydrophobicContact CD1-SD 4.27Å; I653-M697 HydrophobicContact CG2-CB 4.06Å; I653-M697 HydrophobicContact CG2-CG 4.19Å; I653-M697 HydrophobicContact CG2-SD 3.77Å; K654-M697 CarbonylContact O-C 3.59Å; K654-M697 VanDerWaalsContact O-CA 3.25Å; K654-M697 WeakPolarHBondContact O-CA 3.48Å; T655-M697 HydrophobicContact CG2-CG 4.09Å; T655-M697 HydrophobicContact CG2-SD 4.42Å; V689-M697 CarbonylContact C-O 3.55Å; V689-M697 VanDerWaalsContact CA-O 3.26Å; V689-M697 WeakPolarHBondContact CA-O 3.13Å; V690-M697 HydrophobicContact CB-CB 3.99Å; V690-M697 HydrophobicContact CB-CE 3.83Å; V690-M697 HydrophobicContact CB-CG 4.37Å; V690-M697 HydrophobicContact CG1-CE 3.8Å; V690-M697 HydrophobicContact CG2-CB 4.24Å; V690-M697 HydrophobicContact CG2-CE 3.82Å; V690-M697 PolarHBondContact N-O 3.02Å; V690-M697 PolarHBondContact O-N 2.8Å; P695-M697 HydrophobicContact CG-CG 4.31Å; P695-M697 HydrophobicContact CG-SD 4.42Å
698	I	92.9	Very high	91.7	Very high	2 Å²	2	41 Å²	41	1%	0.01	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.4	165.1	-59.1	172.2	0	0	0	106.5	I653 K654 F668 A672 M675 L686 V700	I653-I698 CarbonylContact C-O 3.53Å; I653-I698 WeakPolarHBondContact CA-O 3.35Å; K654-I698 HydrophobicContact CB-CB 4.21Å; K654-I698 PolarHBondContact N-O 2.97Å; K654-I698 PolarHBondContact O-N 2.9Å; F668-I698 HydrophobicContact CD1-CD1 4.08Å; F668-I698 HydrophobicContact CD1-CG1 4.27Å; F668-I698 HydrophobicContact CD2-CD1 4.01Å; F668-I698 HydrophobicContact CE1-CD1 3.84Å; F668-I698 HydrophobicContact CE1-CG1 3.64Å; F668-I698 HydrophobicContact CE2-CD1 3.81Å; F668-I698 HydrophobicContact CE2-CG1 4.24Å; F668-I698 HydrophobicContact CG-CD1 4.17Å; F668-I698 HydrophobicContact CZ-CB 4.36Å; F668-I698 HydrophobicContact CZ-CD1 3.72Å; F668-I698 HydrophobicContact CZ-CG1 3.64Å; F668-I698 WeakPolarHBondContact O-CD1 3.34Å; A672-I698 HydrophobicContact CB-CD1 3.8Å; A672-I698 HydrophobicContact CB-CG1 3.87Å; A672-I698 HydrophobicContact CB-CG2 4.37Å; M675-I698 HydrophobicContact CE-CD1 4.43Å; M675-I698 HydrophobicContact CE-CG2 3.63Å; L686-I698 HydrophobicContact CD1-CG2 3.47Å; L686-I698 VanDerWaalsContact CD1-CG2 3.47Å; I698-V700 HydrophobicContact CG2-CG1 4.06Å
699	V	94.6	Very high	91.8	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	116.3	-177.7	-171.2	0	0	0	0	108.2	I617 I622 L641 V651 A652 I653 L686 E687 G688	I617-V699 HydrophobicContact CD1-CB 4.05Å; I617-V699 HydrophobicContact CD1-CG1 4.48Å; I617-V699 HydrophobicContact CD1-CG2 4.11Å; I622-V699 HydrophobicContact CD1-CG2 3.73Å; L641-V699 HydrophobicContact CD2-CG1 4.45Å; V651-V699 HydrophobicContact CB-CG1 3.64Å; V651-V699 HydrophobicContact CG1-CG1 3.83Å; V651-V699 HydrophobicContact CG2-CG1 3.83Å; A652-V699 WeakPolarHBondContact O-CA 3.43Å; I653-V699 HydrophobicContact CG1-CG1 4.34Å; L686-V699 WeakPolarHBondContact CD1-O 3.28Å; E687-V699 WeakPolarHBondContact CA-O 3.34Å; E687-V699 HydrophobicContact CB-CB 4.29Å; E687-V699 HydrophobicContact CB-CG1 4.05Å; E687-V699 WeakPolarHBondContact CB-O 3.41Å; E687-V699 HydrophobicContact CG-CG1 4.44Å; E687-V699 PolarHBondContact N-O 3.22Å; G688-V699 PolarHBondContact N-O 2.81Å; G688-V699 PolarHBondContact O-N 3.03Å
700	V	94.8	Very high	91.7	Very high	23 Å²	23	43.9 Å²	43.9	14%	0.139	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	166.8	177.6	-58.6	0	0	0	0	110.1	V651 A652 M675 I684 R685 L686 I698	V651-V700 CarbonylContact C-O 3.59Å; V651-V700 VanDerWaalsContact CA-O 3.31Å; V651-V700 WeakPolarHBondContact CA-O 3.37Å; V651-V700 WeakPolarHBondContact CB-O 3.2Å; A652-V700 HydrophobicContact CB-CG2 3.87Å; A652-V700 PolarHBondContact N-O 2.91Å; A652-V700 PolarHBondContact O-N 2.91Å; M675-V700 HydrophobicContact CE-CG1 4.38Å; M675-V700 HydrophobicContact SD-CG1 4.11Å; I684-V700 HydrophobicContact CG1-CB 4.26Å; I684-V700 HydrophobicContact CG1-CG2 4.4Å; R685-V700 WeakPolarHBondContact O-CA 3.08Å; R685-V700 WeakPolarHBondContact O-CB 3.42Å; L686-V700 HydrophobicContact CD1-CG1 4.03Å; I698-V700 HydrophobicContact CG2-CG1 4.06Å
701	E	94.1	Very high	91.8	Very high	25 Å²	25	44.3 Å²	44.3	12%	0.117	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	146.6	172.8	68.5	-173.2	133.5	0	0	112	I684 R685 M703 K762	I684-E701 HydrophobicContact CD1-CG 3.45Å; I684-E701 VanDerWaalsContact CD1-CG 3.45Å; I684-E701 HydrophobicContact CG1-CG 4.35Å; R685-E701 HydrophobicContact CB-CG 4.38Å; R685-E701 WeakPolarHBondContact CB-OE1 3.31Å; R685-E701 PolarHBondContact N-OE1 3.33Å; R685-E701 PolarHBondContact O-N 2.8Å; E701-M703 HydrophobicContact CG-SD 4.27Å; E701-K762 VanDerWaalsContact OE1-CD 3.29Å; E701-K762 WeakPolarHBondContact OE1-CD 3.19Å; E701-K762 WeakPolarHBondContact OE1-CE 3.35Å; E701-K762 IonicContact OE1-NZ 3.6Å; E701-K762 PolarHBondContact OE1-NZ 3.4Å; E701-K762 IonicContact OE2-NZ 3.88Å; E701-K762 PolarHBondContact OE2-NZ 2.81Å
702	Y	94.8	Very high	92	Very high	62 Å²	62	43.1 Å²	43.1	24%	0.243	22%	0.218	C	C	.	.			trans	-84.1	135.2	177.8	-173.6	-106.8	0	0	0	111.2	I628 A650 A652 E704	I628-Y702 HydrophobicContact CD1-CD2 4.2Å; I628-Y702 HydrophobicContact CD1-CE2 3.71Å; I628-Y702 HydrophobicContact CG2-CE2 4.32Å; A650-Y702 HydrophobicContact CB-CD1 4.38Å; A650-Y702 HydrophobicContact CB-CG 4.42Å; A650-Y702 PolarHBondContact O-N 2.89Å; A652-Y702 HydrophobicContact CB-CD2 4.25Å; Y702-E704 HydrophobicContact CD1-CG 4.05Å; Y702-E704 HydrophobicContact CE1-CB 4.3Å; Y702-E704 HydrophobicContact CE1-CG 3.93Å
703	M	95.1	Very high	92.2	Very high	13 Å²	13	41.9 Å²	41.9	6%	0.064	21%	0.209	C	C	.	.			trans	-116	106.3	-179.6	-60.6	-65.2	-72.9	0	0	108.7	I684 E701 N705 G706 L754 V755 N756 K762	I684-M703 HydrophobicContact CD1-CG 3.69Å; I684-M703 HydrophobicContact CD1-SD 4.1Å; E701-M703 HydrophobicContact CG-SD 4.27Å; M703-N705 VanDerWaalsContact C-N 3.28Å; M703-N705 PolarHBondContact O-N 3.42Å; M703-G706 PolarHBondContact O-N 3.09Å; M703-L754 HydrophobicContact CB-CB 3.82Å; M703-L754 HydrophobicContact CB-CD1 4.39Å; M703-L754 VanDerWaalsContact CE-C 3.49Å; M703-L754 HydrophobicContact CE-CB 3.91Å; M703-L754 VanDerWaalsContact CE-O 3.23Å; M703-L754 WeakPolarHBondContact CE-O 3.46Å; M703-L754 HydrophobicContact CG-CB 3.65Å; M703-L754 HydrophobicContact CG-CD1 3.96Å; M703-L754 HydrophobicContact CG-CG 4.43Å; M703-V755 CarbonylContact C-O 3.54Å; M703-N756 HydrophobicContact CE-CB 3.84Å; M703-N756 HydrophobicContact SD-CB 4.02Å; M703-K762 HydrophobicContact CE-CB 3.93Å; M703-K762 HydrophobicContact CE-CD 3.83Å; M703-K762 HydrophobicContact CE-CG 3.65Å; M703-K762 HydrophobicContact SD-CD 3.92Å; M703-K762 HydrophobicContact SD-CG 4.41Å
704	E	93.4	Very high	92.5	Very high	87 Å²	87	47 Å²	47	41%	0.407	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.2	-164.1	-63.2	84.4	174.5	0	0	114.7	Y702 N756 S757	Y702-E704 HydrophobicContact CD1-CG 4.05Å; Y702-E704 HydrophobicContact CE1-CB 4.3Å; Y702-E704 HydrophobicContact CE1-CG 3.93Å; E704-N756 WeakPolarHBondContact OE2-CA 3.34Å; E704-N756 WeakPolarHBondContact OE2-CB 3.33Å; E704-S757 PolarHBondContact OE2-N 2.94Å; E704-S757 PolarHBondContact OE2-OG 2.85Å
705	N	93.9	Very high	92.9	Very high	57 Å²	57	39.5 Å²	39.5	31%	0.305	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	4.9	-173.8	-69	-33.5	0	0	0	113.1	M703 F711 V755 N756	M703-N705 VanDerWaalsContact C-N 3.28Å; M703-N705 PolarHBondContact O-N 3.42Å; N705-F711 HydrophobicContact CB-CD2 3.58Å; N705-F711 HydrophobicContact CB-CE2 3.75Å; N705-F711 HydrophobicContact CB-CG 4.24Å; N705-V755 HydrophobicContact CB-CB 3.96Å; N705-V755 HydrophobicContact CB-CG1 4.17Å; N705-V755 WeakPolarHBondContact CB-O 3.42Å; N705-V755 PolarHBondContact N-O 2.95Å; N705-N756 PolarHBondContact ND2-O 3.35Å
706	G	93.1	Very high	92.7	Very high	32 Å²	32	41.7 Å²	41.7	33%	0.33	21%	0.211	S	C	.	.			trans	67.6	-147.8	177.7	0	0	0	0	0	113.2	M703 L754 V755	M703-G706 PolarHBondContact O-N 3.09Å; G706-L754 CarbonylContact O-C 3.32Å; G706-L754 WeakPolarHBondContact O-CA 3.31Å; G706-V755 PolarHBondContact O-N 2.85Å
707	S	94.6	Very high	92	Very high	29 Å²	29	44 Å²	44	20%	0.203	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-77.6	145.1	-179.3	65.6	0	0	0	0	112.4	D709 S710 F711 R751 I753	S707-D709 VanDerWaalsContact C-N 3.35Å; S707-D709 VanDerWaalsContact CB-OD1 3.24Å; S707-D709 WeakPolarHBondContact CB-OD1 3.47Å; S707-D709 PolarHBondContact O-N 2.79Å; S707-D709 PolarHBondContact OG-OD1 2.94Å; S707-S710 PolarHBondContact O-N 3.01Å; S707-S710 PolarHBondContact OG-OG 2.78Å; S707-F711 VanDerWaalsContact O-CB 3.3Å; S707-F711 WeakPolarHBondContact O-CB 3.19Å; S707-F711 PolarHBondContact O-N 2.81Å; S707-R751 WeakPolarHBondContact CB-O 3.2Å; S707-I753 CarbonylContact C-O 3.52Å; S707-I753 WeakPolarHBondContact CA-O 3.38Å
708	L	97.2	Very high	91.6	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63.4	-38.3	-173.4	178.8	62.9	0	0	0	112.4	S710 F711 L712 M727 I731 A750 I753 V755 V818	L708-S710 PolarHBondContact O-N 3.01Å; L708-F711 HydrophobicContact CD1-CD1 4.41Å; L708-F711 PolarHBondContact O-N 2.79Å; L708-L712 HydrophobicContact CD1-CD1 3.89Å; L708-L712 HydrophobicContact CD1-CD2 4.32Å; L708-L712 HydrophobicContact CD1-CG 3.83Å; L708-L712 HydrophobicContact CD2-CD1 4.49Å; L708-L712 HydrophobicContact CG-CD1 3.74Å; L708-L712 HydrophobicContact CG-CG 4.18Å; L708-L712 WeakPolarHBondContact O-CB 3.35Å; L708-L712 WeakPolarHBondContact O-CD1 3.21Å; L708-L712 WeakPolarHBondContact O-CG 3.35Å; L708-L712 PolarHBondContact O-N 2.84Å; L708-M727 HydrophobicContact CD1-SD 3.98Å; L708-I731 HydrophobicContact CD2-CD1 3.69Å; L708-A750 WeakPolarHBondContact CB-O 3.29Å; L708-A750 PolarHBondContact N-O 2.79Å; L708-I753 HydrophobicContact CB-CB 3.88Å; L708-I753 HydrophobicContact CB-CG2 4.1Å; L708-I753 HydrophobicContact CD2-CB 4.01Å; L708-I753 HydrophobicContact CD2-CG1 4.43Å; L708-I753 HydrophobicContact CD2-CG2 3.88Å; L708-I753 PolarHBondContact N-O 2.84Å; L708-V755 HydrophobicContact CB-CG2 3.82Å; L708-V755 HydrophobicContact CD1-CG2 3.58Å; L708-V755 HydrophobicContact CG-CG2 4.29Å; L708-V818 HydrophobicContact CD2-CG2 3.81Å
709	D	94.1	Very high	91.4	Very high	24 Å²	24	51.2 Å²	51.2	13%	0.128	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-44	179	74.6	-53.6	0	0	0	112.6	S707 R713 A750 R751	S707-D709 VanDerWaalsContact C-N 3.35Å; S707-D709 VanDerWaalsContact CB-OD1 3.24Å; S707-D709 WeakPolarHBondContact CB-OD1 3.47Å; S707-D709 PolarHBondContact O-N 2.79Å; S707-D709 PolarHBondContact OG-OD1 2.94Å; D709-R713 WeakPolarHBondContact O-CG 3.33Å; D709-R713 PolarHBondContact O-N 3.01Å; D709-R713 PolarHBondContact O-NE 3.48Å; D709-R713 IonicContact OD2-CZ 3.11Å; D709-R713 IonicContact OD2-NH2 3.85Å; D709-R713 PolarHBondContact OD2-NH2 2.82Å; D709-A750 HydrophobicContact CB-CB 3.94Å; D709-R751 WeakPolarHBondContact OD1-CA 3.45Å
710	S	92.4	Very high	91.1	Very high	40 Å²	40	54.8 Å²	54.8	28%	0.28	29%	0.291	S	S	.	.	H	α-helix	trans	-74.5	-37.9	179.6	-66	0	0	0	0	110.4	S707 L708 Q714	S707-S710 PolarHBondContact O-N 3.01Å; S707-S710 PolarHBondContact OG-OG 2.78Å; L708-S710 PolarHBondContact O-N 3.01Å; S710-Q714 VanDerWaalsContact O-CG 3.27Å; S710-Q714 WeakPolarHBondContact O-CG 3.39Å; S710-Q714 PolarHBondContact O-N 2.94Å
711	F	95.4	Very high	90.7	Very high	9 Å²	9	55.8 Å²	55.8	4%	0.039	30%	0.297	C	S	.	.	H	α-helix	trans	-61.9	-45.3	175.6	179.2	-108.6	0	0	0	112.3	N705 S707 L708 Q714 H715 F719 M727 V755 L759	N705-F711 HydrophobicContact CB-CD2 3.58Å; N705-F711 HydrophobicContact CB-CE2 3.75Å; N705-F711 HydrophobicContact CB-CG 4.24Å; S707-F711 VanDerWaalsContact O-CB 3.3Å; S707-F711 WeakPolarHBondContact O-CB 3.19Å; S707-F711 PolarHBondContact O-N 2.81Å; L708-F711 HydrophobicContact CD1-CD1 4.41Å; L708-F711 PolarHBondContact O-N 2.79Å; F711-Q714 PolarHBondContact O-N 3.1Å; F711-H715 AromaticContact CD2-CE1 3.8Å; F711-H715 AromaticContact CD2-ND1 3.78Å; F711-H715 AromaticContact CE2-CE1 3.54Å; F711-H715 AromaticContact CE2-ND1 3.73Å; F711-H715 PolarHBondContact O-N 3.13Å; F711-H715 PolarHBondContact O-ND1 2.77Å; F711-F719 HydrophobicContact CD1-CE2 4.46Å; F711-F719 HydrophobicContact CD1-CZ 4.45Å; F711-F719 HydrophobicContact CE1-CE1 4.4Å; F711-F719 AromaticContact CE1-CE2 3.81Å; F711-F719 HydrophobicContact CE1-CE2 3.81Å; F711-F719 AromaticContact CE1-CZ 3.44Å; F711-F719 HydrophobicContact CE1-CZ 3.44Å; F711-F719 VanDerWaalsContact CE1-CZ 3.44Å; F711-F719 HydrophobicContact CZ-CE1 4.38Å; F711-F719 HydrophobicContact CZ-CE2 4.29Å; F711-F719 AromaticContact CZ-CZ 3.54Å; F711-F719 HydrophobicContact CZ-CZ 3.54Å; F711-M727 HydrophobicContact CE1-CE 3.98Å; F711-V755 HydrophobicContact CD1-CB 4.48Å; F711-V755 HydrophobicContact CD1-CG1 4.21Å; F711-V755 HydrophobicContact CD1-CG2 4.27Å; F711-V755 HydrophobicContact CE1-CG1 4.14Å; F711-L759 HydrophobicContact CE1-CD2 3.79Å; F711-L759 HydrophobicContact CZ-CD2 3.48Å; F711-L759 VanDerWaalsContact CZ-CD2 3.48Å
712	L	93.6	Very high	90.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-46.7	178.6	-73.6	166.6	0	0	0	112	L708 Q714 H715 D716 F719 L724 M727 V818 Y821	L708-L712 HydrophobicContact CD1-CD1 3.89Å; L708-L712 HydrophobicContact CD1-CD2 4.32Å; L708-L712 HydrophobicContact CD1-CG 3.83Å; L708-L712 HydrophobicContact CD2-CD1 4.49Å; L708-L712 HydrophobicContact CG-CD1 3.74Å; L708-L712 HydrophobicContact CG-CG 4.18Å; L708-L712 WeakPolarHBondContact O-CB 3.35Å; L708-L712 WeakPolarHBondContact O-CD1 3.21Å; L708-L712 WeakPolarHBondContact O-CG 3.35Å; L708-L712 PolarHBondContact O-N 2.84Å; L712-Q714 PolarHBondContact O-N 2.86Å; L712-H715 CarbonylContact O-C 3.55Å; L712-H715 VanDerWaalsContact O-C 3.25Å; L712-H715 PolarHBondContact O-N 2.79Å; L712-D716 PolarHBondContact O-N 2.92Å; L712-D716 VanDerWaalsContact O-N 3.16Å; L712-F719 HydrophobicContact CD2-CD2 4.4Å; L712-F719 HydrophobicContact CD2-CE2 4.47Å; L712-L724 HydrophobicContact CD2-CD2 4.04Å; L712-M727 HydrophobicContact CD2-SD 4.48Å; L712-V818 HydrophobicContact CD1-CB 4.37Å; L712-V818 HydrophobicContact CD1-CG2 4.09Å; L712-Y821 CarbonylContact C-O 3.47Å; L712-Y821 HydrophobicContact CD2-CD1 4.32Å
713	R	90.3	Very high	90.4	Very high	140 Å²	140	58.4 Å²	58.4	53%	0.528	31%	0.313	S	S	.	.	H	α-helix	trans	-60.9	-32.8	178.9	-75.3	-177.1	-74.9	163.8	-7.3	113.2	D709 H715 Y821	D709-R713 WeakPolarHBondContact O-CG 3.33Å; D709-R713 PolarHBondContact O-N 3.01Å; D709-R713 PolarHBondContact O-NE 3.48Å; D709-R713 IonicContact OD2-CZ 3.11Å; D709-R713 IonicContact OD2-NH2 3.85Å; D709-R713 PolarHBondContact OD2-NH2 2.82Å; R713-H715 VanDerWaalsContact C-N 3.26Å; R713-H715 PolarHBondContact O-N 2.95Å; R713-Y821 WeakPolarHBondContact CA-O 3.34Å; R713-Y821 WeakPolarHBondContact CG-O 3.4Å; R713-Y821 PolarHBondContact N-O 2.85Å
714	Q	90.1	Very high	90.4	Very high	146 Å²	146	57.9 Å²	57.9	68%	0.682	31%	0.311	S	S	*	.	H	α-helix	trans	-75.2	-15.4	176.4	-71.5	172.6	25.6	0	0	113.3	S710 F711 L712	S710-Q714 VanDerWaalsContact O-CG 3.27Å; S710-Q714 WeakPolarHBondContact O-CG 3.39Å; S710-Q714 PolarHBondContact O-N 2.94Å; F711-Q714 PolarHBondContact O-N 3.1Å; L712-Q714 PolarHBondContact O-N 2.86Å
715	H	87.1	Confident	90.4	Very high	59 Å²	59	53.8 Å²	53.8	27%	0.273	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.2	34.5	-175	-63.4	86.3	0	0	0	111.1	F711 L712 R713 G717 H718 F719 Y821	F711-H715 AromaticContact CD2-CE1 3.8Å; F711-H715 AromaticContact CD2-ND1 3.78Å; F711-H715 AromaticContact CE2-CE1 3.54Å; F711-H715 AromaticContact CE2-ND1 3.73Å; F711-H715 PolarHBondContact O-N 3.13Å; F711-H715 PolarHBondContact O-ND1 2.77Å; L712-H715 CarbonylContact O-C 3.55Å; L712-H715 VanDerWaalsContact O-C 3.25Å; L712-H715 PolarHBondContact O-N 2.79Å; R713-H715 VanDerWaalsContact C-N 3.26Å; R713-H715 PolarHBondContact O-N 2.95Å; H715-G717 PolarHBondContact O-N 3.31Å; H715-H718 HydrophobicContact CB-CB 4.17Å; H715-H718 WeakPolarHBondContact O-CB 3.29Å; H715-H718 PolarHBondContact O-N 3.25Å; H715-F719 HydrophobicContact CB-CD2 4.4Å; H715-F719 HydrophobicContact CB-CE2 3.52Å; H715-F719 HydrophobicContact CB-CZ 3.82Å; H715-Y821 WeakPolarHBondContact O-CE1 3.04Å
716	D	83.7	Confident	90.5	Very high	108 Å²	108	52.7 Å²	52.7	58%	0.578	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	126	-177.9	-175.2	27.7	0	0	0	111.5	L712 H718 Y821	L712-D716 PolarHBondContact O-N 2.92Å; L712-D716 VanDerWaalsContact O-N 3.16Å; D716-H718 PolarHBondContact O-CD2 3.32Å; D716-H718 PolarHBondContact O-N 3.07Å; D716-Y821 VanDerWaalsContact OD1-CB 3.24Å; D716-Y821 WeakPolarHBondContact OD1-CB 3.06Å; D716-Y821 VanDerWaalsContact OD1-CG 3.26Å
717	G	74.9	Confident	90.7	Very high	56 Å²	56	51.3 Å²	51.3	58%	0.577	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	3.5	-176.3	0	0	0	0	0	116.7	H715	H715-G717 PolarHBondContact O-N 3.31Å
718	H	83	Confident	90.9	Very high	138 Å²	138	50 Å²	50	64%	0.639	27%	0.269	S	S	*	.			trans	-85.6	-14	-175.2	-71	-158	0	0	0	114.5	H715 D716	H715-H718 HydrophobicContact CB-CB 4.17Å; H715-H718 WeakPolarHBondContact O-CB 3.29Å; H715-H718 PolarHBondContact O-N 3.25Å; D716-H718 PolarHBondContact O-CD2 3.32Å; D716-H718 PolarHBondContact O-N 3.07Å
719	F	88.8	Confident	90.9	Very high	27 Å²	27	53.8 Å²	53.8	12%	0.118	28%	0.284	C	S	.	.	S	Bend	trans	-101.4	142.6	-178	-60.6	-61.9	0	0	0	112.2	F711 L712 H715 Q723 L724 M727 L759 Y821	F711-F719 HydrophobicContact CD1-CE2 4.46Å; F711-F719 HydrophobicContact CD1-CZ 4.45Å; F711-F719 HydrophobicContact CE1-CE1 4.4Å; F711-F719 AromaticContact CE1-CE2 3.81Å; F711-F719 HydrophobicContact CE1-CE2 3.81Å; F711-F719 AromaticContact CE1-CZ 3.44Å; F711-F719 HydrophobicContact CE1-CZ 3.44Å; F711-F719 VanDerWaalsContact CE1-CZ 3.44Å; F711-F719 HydrophobicContact CZ-CE1 4.38Å; F711-F719 HydrophobicContact CZ-CE2 4.29Å; F711-F719 AromaticContact CZ-CZ 3.54Å; F711-F719 HydrophobicContact CZ-CZ 3.54Å; L712-F719 HydrophobicContact CD2-CD2 4.4Å; L712-F719 HydrophobicContact CD2-CE2 4.47Å; H715-F719 HydrophobicContact CB-CD2 4.4Å; H715-F719 HydrophobicContact CB-CE2 3.52Å; H715-F719 HydrophobicContact CB-CZ 3.82Å; F719-Q723 HydrophobicContact CB-CB 4.38Å; F719-L724 HydrophobicContact CB-CD2 3.82Å; F719-L724 HydrophobicContact CB-CG 4.08Å; F719-L724 HydrophobicContact CD2-CD2 4.11Å; F719-L724 HydrophobicContact CG-CD2 4.27Å; F719-M727 HydrophobicContact CD1-CE 4.39Å; F719-M727 HydrophobicContact CD2-CE 4.4Å; F719-M727 HydrophobicContact CE1-CE 4.29Å; F719-M727 HydrophobicContact CE2-CE 4.3Å; F719-M727 HydrophobicContact CG-CE 4.47Å; F719-M727 HydrophobicContact CZ-CE 4.27Å; F719-L759 HydrophobicContact CD1-CD1 4.5Å; F719-L759 HydrophobicContact CE1-CD1 4.13Å; F719-L759 HydrophobicContact CE1-CD2 4.24Å; F719-L759 HydrophobicContact CZ-CD2 4.49Å; F719-Y821 HydrophobicContact CB-CE1 4.42Å; F719-Y821 AromaticContact CD2-CE1 3.88Å; F719-Y821 HydrophobicContact CD2-CE1 3.88Å; F719-Y821 PolarHBondContact O-OH 3.3Å
720	T	89.4	Confident	91.1	Very high	75 Å²	75	52.9 Å²	52.9	46%	0.46	28%	0.28	S	S	.	.			trans	-70.3	151.2	166.7	60.2	0	0	0	0	110.4	I722 Q723 L724	T720-I722 PolarHBondContact O-N 3.06Å; T720-I722 VanDerWaalsContact O-N 3.15Å; T720-I722 VanDerWaalsContact OG1-CG2 3.28Å; T720-I722 WeakPolarHBondContact OG1-CG2 3.3Å; T720-Q723 WeakPolarHBondContact O-CB 3.37Å; T720-Q723 PolarHBondContact O-N 3.44Å; T720-Q723 VanDerWaalsContact OG1-CG 3.29Å; T720-Q723 WeakPolarHBondContact OG1-CG 3.29Å; T720-Q723 PolarHBondContact OG1-N 3.47Å; T720-Q723 PolarHBondContact OG1-OE1 3.42Å; T720-L724 PolarHBondContact O-N 3.29Å; T720-L724 VanDerWaalsContact O-N 3.17Å
721	V	86.9	Confident	91.4	Very high	45 Å²	45	51 Å²	51	27%	0.273	27%	0.267	S	S	.	.	H	α-helix	trans	-52.3	-39.6	176.1	175.6	0	0	0	0	111.6	Q723 L724 V725 P851 L854 L889	V721-Q723 VanDerWaalsContact C-N 3.32Å; V721-Q723 PolarHBondContact O-N 3.27Å; V721-L724 WeakPolarHBondContact O-CB 3.47Å; V721-L724 PolarHBondContact O-N 3.11Å; V721-V725 HydrophobicContact CG1-CG2 4.32Å; V721-V725 VanDerWaalsContact O-CG2 3.3Å; V721-V725 WeakPolarHBondContact O-CG2 3.41Å; V721-V725 PolarHBondContact O-N 3.47Å; V721-P851 HydrophobicContact CG1-CG 3.5Å; V721-L854 HydrophobicContact CG1-CD1 4.41Å; V721-L889 HydrophobicContact CG1-CB 4.46Å; V721-L889 HydrophobicContact CG1-CD1 4.26Å; V721-L889 HydrophobicContact CG1-CD2 4.39Å
722	I	89.5	Confident	91.5	Very high	63 Å²	63	50.5 Å²	50.5	32%	0.323	27%	0.265	S	S	.	.	H	α-helix	trans	-65.4	-33.2	179.3	-169.6	63.4	0	0	0	112.9	T720 V725 G726 I883 P886 L889	T720-I722 PolarHBondContact O-N 3.06Å; T720-I722 VanDerWaalsContact O-N 3.15Å; T720-I722 VanDerWaalsContact OG1-CG2 3.28Å; T720-I722 WeakPolarHBondContact OG1-CG2 3.3Å; I722-V725 PolarHBondContact O-N 2.89Å; I722-G726 PolarHBondContact O-N 3.09Å; I722-I883 HydrophobicContact CD1-CB 4.39Å; I722-I883 HydrophobicContact CD1-CG1 4.11Å; I722-P886 HydrophobicContact CD1-CG 4.5Å; I722-L889 HydrophobicContact CD1-CD1 4.06Å
723	Q	92.4	Very high	91.7	Very high	78 Å²	78	51 Å²	51	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-68.3	-41.3	173.7	-73.3	167	-55.5	0	0	111	F719 T720 V721 G726 M727	F719-Q723 HydrophobicContact CB-CB 4.38Å; T720-Q723 WeakPolarHBondContact O-CB 3.37Å; T720-Q723 PolarHBondContact O-N 3.44Å; T720-Q723 VanDerWaalsContact OG1-CG 3.29Å; T720-Q723 WeakPolarHBondContact OG1-CG 3.29Å; T720-Q723 PolarHBondContact OG1-N 3.47Å; T720-Q723 PolarHBondContact OG1-OE1 3.42Å; V721-Q723 VanDerWaalsContact C-N 3.32Å; V721-Q723 PolarHBondContact O-N 3.27Å; Q723-G726 WeakPolarHBondContact O-CA 3.43Å; Q723-G726 PolarHBondContact O-N 3.11Å; Q723-G726 VanDerWaalsContact O-N 3.13Å; Q723-M727 PolarHBondContact O-N 3.45Å
724	L	94.6	Very high	92.1	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-43.4	173.9	-60.7	179.1	0	0	0	111.2	L712 F719 T720 V721 G726 M727 L728 V818 M819 Y821	L712-L724 HydrophobicContact CD2-CD2 4.04Å; F719-L724 HydrophobicContact CB-CD2 3.82Å; F719-L724 HydrophobicContact CB-CG 4.08Å; F719-L724 HydrophobicContact CD2-CD2 4.11Å; F719-L724 HydrophobicContact CG-CD2 4.27Å; T720-L724 PolarHBondContact O-N 3.29Å; T720-L724 VanDerWaalsContact O-N 3.17Å; V721-L724 WeakPolarHBondContact O-CB 3.47Å; V721-L724 PolarHBondContact O-N 3.11Å; L724-G726 VanDerWaalsContact C-N 3.27Å; L724-G726 PolarHBondContact O-N 2.97Å; L724-M727 HydrophobicContact CD2-SD 4.37Å; L724-M727 WeakPolarHBondContact O-CB 3.35Å; L724-M727 PolarHBondContact O-N 2.96Å; L724-M727 VanDerWaalsContact O-N 3.15Å; L724-L728 WeakPolarHBondContact O-CG 3.31Å; L724-L728 PolarHBondContact O-N 2.68Å; L724-V818 HydrophobicContact CB-CG1 4.01Å; L724-V818 HydrophobicContact CD2-CG1 3.96Å; L724-V818 HydrophobicContact CG-CG1 4.47Å; L724-M819 HydrophobicContact CB-SD 4.18Å; L724-M819 HydrophobicContact CD1-CE 4.36Å; L724-M819 HydrophobicContact CD1-SD 4.03Å; L724-Y821 HydrophobicContact CD1-CE2 4.17Å
725	V	94.6	Very high	92.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.8	-38.7	172.7	174.7	0	0	0	0	111.2	V721 I722 L728 R729 L854 L879 I883 L889	V721-V725 HydrophobicContact CG1-CG2 4.32Å; V721-V725 VanDerWaalsContact O-CG2 3.3Å; V721-V725 WeakPolarHBondContact O-CG2 3.41Å; V721-V725 PolarHBondContact O-N 3.47Å; I722-V725 PolarHBondContact O-N 2.89Å; V725-L728 PolarHBondContact O-N 3.1Å; V725-R729 VanDerWaalsContact O-CB 3.26Å; V725-R729 WeakPolarHBondContact O-CB 3.41Å; V725-R729 PolarHBondContact O-N 3.22Å; V725-L854 HydrophobicContact CG2-CD1 3.67Å; V725-L854 HydrophobicContact CG2-CD2 4.13Å; V725-L854 HydrophobicContact CG2-CG 4.45Å; V725-L879 HydrophobicContact CG1-CD2 4.28Å; V725-I883 HydrophobicContact CG1-CD1 4.12Å; V725-I883 HydrophobicContact CG1-CG1 3.64Å; V725-L889 HydrophobicContact CG2-CD1 4.26Å; V725-L889 HydrophobicContact CG2-CD2 4.21Å
726	G	95.4	Very high	92.9	Very high	35 Å²	35	37.5 Å²	37.5	36%	0.361	21%	0.211	S	C	.	.	H	α-helix	trans	-59.9	-44	173.4	0	0	0	0	0	113.1	I722 Q723 L724 R729 G730	I722-G726 PolarHBondContact O-N 3.09Å; Q723-G726 WeakPolarHBondContact O-CA 3.43Å; Q723-G726 PolarHBondContact O-N 3.11Å; Q723-G726 VanDerWaalsContact O-N 3.13Å; L724-G726 VanDerWaalsContact C-N 3.27Å; L724-G726 PolarHBondContact O-N 2.97Å; G726-R729 PolarHBondContact O-N 3Å; G726-G730 PolarHBondContact O-N 3.14Å
727	M	97.9	Very high	93.5	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.015	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-49.2	174.1	-66	178.8	-173.3	0	0	111.2	L708 F711 L712 F719 Q723 L724 R729 G730 I731 L759 C761	L708-M727 HydrophobicContact CD1-SD 3.98Å; F711-M727 HydrophobicContact CE1-CE 3.98Å; L712-M727 HydrophobicContact CD2-SD 4.48Å; F719-M727 HydrophobicContact CD1-CE 4.39Å; F719-M727 HydrophobicContact CD2-CE 4.4Å; F719-M727 HydrophobicContact CE1-CE 4.29Å; F719-M727 HydrophobicContact CE2-CE 4.3Å; F719-M727 HydrophobicContact CG-CE 4.47Å; F719-M727 HydrophobicContact CZ-CE 4.27Å; Q723-M727 PolarHBondContact O-N 3.45Å; L724-M727 HydrophobicContact CD2-SD 4.37Å; L724-M727 WeakPolarHBondContact O-CB 3.35Å; L724-M727 PolarHBondContact O-N 2.96Å; L724-M727 VanDerWaalsContact O-N 3.15Å; M727-R729 VanDerWaalsContact C-N 3.33Å; M727-R729 PolarHBondContact O-N 3.42Å; M727-G730 PolarHBondContact O-N 3Å; M727-G730 VanDerWaalsContact O-N 3.15Å; M727-I731 WeakPolarHBondContact O-CG1 3.41Å; M727-I731 PolarHBondContact O-N 2.98Å; M727-L759 HydrophobicContact CE-CB 4.11Å; M727-L759 HydrophobicContact CE-CD1 4.22Å; M727-L759 HydrophobicContact CE-CD2 4.08Å; M727-L759 HydrophobicContact CE-CG 4.37Å; M727-C761 VanDerWaalsContact CB-SG 3.58Å
728	L	98.3	Very high	94.3	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.1	-41.8	178.1	-69.6	178.6	0	0	0	112.8	L724 V725 G730 I731 A732 Y811 M815 V818 L879	L724-L728 WeakPolarHBondContact O-CG 3.31Å; L724-L728 PolarHBondContact O-N 2.68Å; V725-L728 PolarHBondContact O-N 3.1Å; L728-G730 VanDerWaalsContact C-N 3.34Å; L728-I731 PolarHBondContact O-N 3.14Å; L728-A732 WeakPolarHBondContact O-CB 3.19Å; L728-A732 PolarHBondContact O-N 3.38Å; L728-Y811 PolarHBondContact O-OH 3.07Å; L728-M815 HydrophobicContact CD1-CB 4.44Å; L728-M815 HydrophobicContact CD1-CE 4.42Å; L728-M815 HydrophobicContact CD1-CG 4.23Å; L728-M815 HydrophobicContact CD2-CB 4.26Å; L728-M815 HydrophobicContact CD2-CG 3.93Å; L728-V818 HydrophobicContact CD1-CG1 4.46Å; L728-V818 HydrophobicContact CD2-CB 3.78Å; L728-V818 HydrophobicContact CD2-CG1 4.04Å; L728-V818 HydrophobicContact CD2-CG2 3.68Å; L728-V818 HydrophobicContact CG-CB 4.31Å; L728-V818 HydrophobicContact CG-CG1 4.04Å; L728-L879 HydrophobicContact CB-CD1 4.3Å
729	R	97.8	Very high	94.8	Very high	80 Å²	80	27.1 Å²	27.1	30%	0.302	15%	0.146	S	C	.	.	H	α-helix	trans	-64.6	-39.6	177.2	-174.1	-88.3	-175	-148.2	-5.7	111.4	V725 G726 M727 A732 A733 L879 D880 I883	V725-R729 VanDerWaalsContact O-CB 3.26Å; V725-R729 WeakPolarHBondContact O-CB 3.41Å; V725-R729 PolarHBondContact O-N 3.22Å; G726-R729 PolarHBondContact O-N 3Å; M727-R729 VanDerWaalsContact C-N 3.33Å; M727-R729 PolarHBondContact O-N 3.42Å; R729-A732 PolarHBondContact O-N 2.66Å; R729-A733 WeakPolarHBondContact O-CB 3.44Å; R729-A733 PolarHBondContact O-N 3.03Å; R729-L879 HydrophobicContact CB-CB 4.07Å; R729-L879 HydrophobicContact CB-CD1 4.21Å; R729-L879 HydrophobicContact CG-CB 4.13Å; R729-D880 IonicContact CZ-OD1 3.81Å; R729-D880 IonicContact NE-OD1 3.26Å; R729-D880 PolarHBondContact NE-OD1 3.37Å; R729-D880 IonicContact NH2-OD1 4Å; R729-D880 PolarHBondContact NH2-OD1 3.49Å; R729-D880 IonicContact NH2-OD2 3.46Å; R729-D880 PolarHBondContact NH2-OD2 2.9Å; R729-I883 HydrophobicContact CB-CD1 3.92Å; R729-I883 HydrophobicContact CG-CD1 3.88Å
730	G	97.1	Very high	94.8	Very high	5 Å²	5	29.6 Å²	29.6	5%	0.052	16%	0.161	C	C	.	.	H	α-helix	trans	-59.8	-49	173.4	0	0	0	0	0	112.1	N682 G726 M727 L728 A732 A733 G734	N682-G730 WeakPolarHBondContact CB-O 3.11Å; N682-G730 VanDerWaalsContact ND2-CA 3.34Å; N682-G730 WeakPolarHBondContact ND2-CA 3.43Å; N682-G730 PolarHBondContact ND2-O 3.12Å; G726-G730 PolarHBondContact O-N 3.14Å; M727-G730 PolarHBondContact O-N 3Å; M727-G730 VanDerWaalsContact O-N 3.15Å; L728-G730 VanDerWaalsContact C-N 3.34Å; G730-A732 PolarHBondContact O-N 3.35Å; G730-A733 PolarHBondContact O-N 3.33Å; G730-G734 PolarHBondContact O-N 3.49Å; G730-G734 VanDerWaalsContact O-N 3.09Å
731	I	98.5	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-46.5	177.9	-60.6	162.6	0	0	0	110.7	L708 M727 L728 A733 G734 M735 L748 I753 C761 V763 Y811 V814	L708-I731 HydrophobicContact CD2-CD1 3.69Å; M727-I731 WeakPolarHBondContact O-CG1 3.41Å; M727-I731 PolarHBondContact O-N 2.98Å; L728-I731 PolarHBondContact O-N 3.14Å; I731-A733 VanDerWaalsContact C-N 3.32Å; I731-A733 PolarHBondContact O-N 2.81Å; I731-G734 PolarHBondContact O-N 3.35Å; I731-M735 PolarHBondContact O-N 2.98Å; I731-L748 HydrophobicContact CG2-CD1 4.45Å; I731-I753 HydrophobicContact CD1-CG1 4.14Å; I731-I753 HydrophobicContact CD1-CG2 4.02Å; I731-I753 HydrophobicContact CG1-CD1 4.32Å; I731-I753 HydrophobicContact CG1-CG1 4.28Å; I731-I753 HydrophobicContact CG1-CG2 3.9Å; I731-I753 HydrophobicContact CG2-CD1 4.01Å; I731-C761 HydrophobicContact CD1-CB 4.29Å; I731-C761 HydrophobicContact CG1-CB 3.75Å; I731-V763 HydrophobicContact CG2-CG2 4.38Å; I731-Y811 HydrophobicContact CB-CE2 4.08Å; I731-Y811 HydrophobicContact CG2-CD2 3.96Å; I731-Y811 HydrophobicContact CG2-CE2 3.81Å; I731-V814 HydrophobicContact CD1-CG1 3.97Å
732	A	98.4	Very high	94.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.9	-39	177.6	0	0	0	0	0	112.5	L728 R729 G730 M735 K736 Y811 I875 V876 L879	L728-A732 WeakPolarHBondContact O-CB 3.19Å; L728-A732 PolarHBondContact O-N 3.38Å; R729-A732 PolarHBondContact O-N 2.66Å; G730-A732 PolarHBondContact O-N 3.35Å; A732-M735 PolarHBondContact O-N 3.19Å; A732-K736 WeakPolarHBondContact O-CB 3.43Å; A732-K736 PolarHBondContact O-N 3.09Å; A732-Y811 HydrophobicContact CB-CE2 3.9Å; A732-I875 HydrophobicContact CB-CG2 3.85Å; A732-V876 HydrophobicContact CB-CG2 3.69Å; A732-L879 HydrophobicContact CB-CD1 4.09Å
733	A	98.2	Very high	94.4	Very high	9 Å²	9	23.6 Å²	23.6	7%	0.074	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-40.2	176.9	0	0	0	0	0	112	R729 G730 I731 Y737 V876	R729-A733 WeakPolarHBondContact O-CB 3.44Å; R729-A733 PolarHBondContact O-N 3.03Å; G730-A733 PolarHBondContact O-N 3.33Å; I731-A733 VanDerWaalsContact C-N 3.32Å; I731-A733 PolarHBondContact O-N 2.81Å; A733-Y737 PolarHBondContact O-N 2.97Å; A733-Y737 VanDerWaalsContact O-N 3.12Å; A733-V876 HydrophobicContact CB-CG2 4.46Å
734	G	97.2	Very high	94.2	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.2	-47.5	172.2	0	0	0	0	0	112.1	G730 I731 K736 Y737 L738	G730-G734 PolarHBondContact O-N 3.49Å; G730-G734 VanDerWaalsContact O-N 3.09Å; I731-G734 PolarHBondContact O-N 3.35Å; G734-K736 PolarHBondContact O-N 3.2Å; G734-Y737 WeakPolarHBondContact O-CB 3.38Å; G734-Y737 PolarHBondContact O-N 2.77Å; G734-L738 PolarHBondContact O-N 3.22Å
735	M	97.5	Very high	94	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-68.5	-33.3	179.4	-68.9	-53.6	-58.3	0	0	113.8	I731 A732 Y737 L738 S739 H745 L748 V763 D807 F872	I731-M735 PolarHBondContact O-N 2.98Å; A732-M735 PolarHBondContact O-N 3.19Å; M735-Y737 VanDerWaalsContact C-N 3.34Å; M735-L738 HydrophobicContact CE-CD1 4.46Å; M735-L738 PolarHBondContact O-N 3.12Å; M735-L738 HydrophobicContact SD-CD1 3.91Å; M735-S739 WeakPolarHBondContact O-CB 3.45Å; M735-S739 PolarHBondContact O-N 3.39Å; M735-H745 HydrophobicContact CE-CB 3.81Å; M735-H745 HydrophobicContact SD-CB 4.33Å; M735-L748 HydrophobicContact CE-CD2 4.11Å; M735-L748 HydrophobicContact CG-CD1 4.19Å; M735-L748 HydrophobicContact CG-CD2 3.81Å; M735-L748 HydrophobicContact SD-CD1 3.79Å; M735-L748 HydrophobicContact SD-CD2 3.98Å; M735-L748 HydrophobicContact SD-CG 4.43Å; M735-V763 HydrophobicContact CG-CG2 4.34Å; M735-V763 HydrophobicContact SD-CG1 4.06Å; M735-V763 HydrophobicContact SD-CG2 4.17Å; M735-D807 HydrophobicContact CE-CB 3.79Å; M735-D807 WeakPolarHBondContact CE-OD2 3.45Å; M735-F872 HydrophobicContact CB-CD1 3.5Å; M735-F872 HydrophobicContact CB-CD2 4.05Å; M735-F872 HydrophobicContact CB-CE1 3.31Å; M735-F872 HydrophobicContact CB-CE2 3.87Å; M735-F872 HydrophobicContact CB-CG 3.88Å; M735-F872 HydrophobicContact CB-CZ 3.5Å; M735-F872 HydrophobicContact CE-CE2 4.1Å; M735-F872 HydrophobicContact CE-CZ 3.98Å; M735-F872 HydrophobicContact CG-CE1 3.92Å; M735-F872 HydrophobicContact CG-CZ 3.99Å
736	K	97	Very high	93.6	Very high	62 Å²	62	20.7 Å²	20.7	27%	0.27	12%	0.118	S	C	.	.	H	α-helix	trans	-58	-48.8	169.1	-176.4	-169	173.7	-67.6	0	110.5	A732 G734 L738 S739 D740 F872 V873 V876	A732-K736 WeakPolarHBondContact O-CB 3.43Å; A732-K736 PolarHBondContact O-N 3.09Å; G734-K736 PolarHBondContact O-N 3.2Å; K736-L738 PolarHBondContact O-N 3.13Å; K736-S739 PolarHBondContact O-N 3.27Å; K736-D740 IonicContact NZ-OD2 2.73Å; K736-D740 PolarHBondContact NZ-OD2 2.94Å; K736-D740 WeakPolarHBondContact O-CB 3.31Å; K736-D740 PolarHBondContact O-N 3.45Å; K736-F872 HydrophobicContact CB-CB 3.8Å; K736-F872 HydrophobicContact CG-CB 4.37Å; K736-V873 HydrophobicContact CD-CB 4.3Å; K736-V876 HydrophobicContact CB-CG2 4.29Å; K736-V876 HydrophobicContact CD-CG2 4.34Å
737	Y	95.7	Very high	93.2	Very high	48 Å²	48	19.9 Å²	19.9	19%	0.188	11%	0.105	C	C	.	.	H	α-helix	trans	-59.6	-45.9	178.4	172	-96.6	0	0	0	111.9	F678 D679 H680 I683 A733 G734 M735 S739 D740 M741	F678-Y737 HydrophobicContact CB-CE1 3.94Å; F678-Y737 AromaticContact CD1-CE1 3.97Å; F678-Y737 HydrophobicContact CD1-CE1 3.97Å; F678-Y737 HydrophobicContact CG-CE1 4.24Å; D679-Y737 PolarHBondContact N-OH 3.44Å; D679-Y737 VanDerWaalsContact N-OH 3.07Å; H680-Y737 HydrophobicContact CB-CD1 3.7Å; H680-Y737 HydrophobicContact CB-CD2 4.09Å; H680-Y737 HydrophobicContact CB-CE1 3.96Å; H680-Y737 HydrophobicContact CB-CE2 4.33Å; H680-Y737 HydrophobicContact CB-CG 3.76Å; H680-Y737 AromaticContact CD2-CD2 3.94Å; H680-Y737 AromaticContact CD2-CG 3.9Å; H680-Y737 AromaticContact CG-CG 3.84Å; I683-Y737 HydrophobicContact CG1-CD1 4.01Å; A733-Y737 PolarHBondContact O-N 2.97Å; A733-Y737 VanDerWaalsContact O-N 3.12Å; G734-Y737 WeakPolarHBondContact O-CB 3.38Å; G734-Y737 PolarHBondContact O-N 2.77Å; M735-Y737 VanDerWaalsContact C-N 3.34Å; Y737-S739 PolarHBondContact O-N 3.11Å; Y737-D740 PolarHBondContact O-N 2.82Å; Y737-M741 HydrophobicContact CD1-CG 4.49Å; Y737-M741 HydrophobicContact CE1-CG 4.11Å; Y737-M741 HydrophobicContact CE2-CG 4.17Å; Y737-M741 HydrophobicContact CE2-SD 4.37Å; Y737-M741 VanDerWaalsContact O-CG 3.26Å; Y737-M741 WeakPolarHBondContact O-CG 3.48Å; Y737-M741 PolarHBondContact O-N 3.02Å
738	L	92.8	Very high	93.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-44	176	-67.8	178.9	0	0	0	112.1	F678 I683 G734 M735 K736 D740 M741 G742 Y743 V763 F766	F678-L738 HydrophobicContact CD1-CD2 4.01Å; F678-L738 HydrophobicContact CD2-CD2 3.83Å; F678-L738 HydrophobicContact CE1-CD2 3.89Å; F678-L738 HydrophobicContact CE2-CD2 3.68Å; F678-L738 HydrophobicContact CG-CD2 4.01Å; F678-L738 HydrophobicContact CZ-CD2 3.74Å; I683-L738 HydrophobicContact CD1-CD1 3.85Å; I683-L738 HydrophobicContact CD1-CD2 4.18Å; I683-L738 HydrophobicContact CD1-CG 3.83Å; G734-L738 PolarHBondContact O-N 3.22Å; M735-L738 HydrophobicContact CE-CD1 4.46Å; M735-L738 PolarHBondContact O-N 3.12Å; M735-L738 HydrophobicContact SD-CD1 3.91Å; K736-L738 PolarHBondContact O-N 3.13Å; L738-D740 PolarHBondContact O-N 3.13Å; L738-M741 CarbonylContact O-C 3.58Å; L738-M741 WeakPolarHBondContact O-CB 3.47Å; L738-M741 PolarHBondContact O-N 2.9Å; L738-G742 PolarHBondContact O-N 3.29Å; L738-Y743 CarbonylContact C-O 3.59Å; L738-Y743 HydrophobicContact CB-CD1 4.11Å; L738-Y743 HydrophobicContact CD1-CD1 4.07Å; L738-Y743 HydrophobicContact CD1-CE1 4.36Å; L738-Y743 HydrophobicContact CD2-CD1 3.83Å; L738-Y743 HydrophobicContact CD2-CE1 4.41Å; L738-Y743 HydrophobicContact CD2-CG 4.4Å; L738-Y743 HydrophobicContact CG-CD1 4.21Å; L738-Y743 WeakPolarHBondContact O-CB 3.24Å; L738-Y743 PolarHBondContact O-N 3.48Å; L738-V763 HydrophobicContact CD1-CG1 4.45Å; L738-F766 HydrophobicContact CD1-CE1 4.09Å; L738-F766 HydrophobicContact CD2-CE1 4.49Å
739	S	91.9	Very high	93	Very high	35 Å²	35	19.7 Å²	19.7	25%	0.245	10%	0.104	C	C	.	.	H	α-helix	trans	-63.3	-39.9	176.9	-175.7	0	0	0	0	112.5	M735 K736 Y737 M741 G742 S804	M735-S739 WeakPolarHBondContact O-CB 3.45Å; M735-S739 PolarHBondContact O-N 3.39Å; K736-S739 PolarHBondContact O-N 3.27Å; Y737-S739 PolarHBondContact O-N 3.11Å; S739-M741 PolarHBondContact O-N 3.36Å; S739-G742 PolarHBondContact O-N 3.1Å; S739-S804 WeakPolarHBondContact OG-CB 3.35Å; S739-S804 PolarHBondContact OG-OG 2.93Å
740	D	90.1	Very high	92.9	Very high	80 Å²	80	15.9 Å²	15.9	43%	0.428	9%	0.09	S	C	.	.	H	α-helix	trans	-65.9	-29.8	176.9	-69.4	-16.5	0	0	0	111.3	I594 K736 Y737 L738 G742	I594-D740 WeakPolarHBondContact CG2-O 3.24Å; K736-D740 IonicContact NZ-OD2 2.73Å; K736-D740 PolarHBondContact NZ-OD2 2.94Å; K736-D740 WeakPolarHBondContact O-CB 3.31Å; K736-D740 PolarHBondContact O-N 3.45Å; Y737-D740 PolarHBondContact O-N 2.82Å; L738-D740 PolarHBondContact O-N 3.13Å; D740-G742 PolarHBondContact O-N 3.17Å
741	M	86.8	Confident	92.8	Very high	21 Å²	21	19.3 Å²	19.3	10%	0.103	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-2.4	173.2	-67.1	-72.5	-63.6	0	0	113.2	K595 Y597 F678 Y737 L738 S739	K595-M741 WeakPolarHBondContact O-CE 3.31Å; Y597-M741 VanDerWaalsContact CB-O 3.22Å; Y597-M741 WeakPolarHBondContact CB-O 3.14Å; Y597-M741 PolarHBondContact N-O 3.09Å; F678-M741 HydrophobicContact CD1-CE 4.5Å; Y737-M741 HydrophobicContact CD1-CG 4.49Å; Y737-M741 HydrophobicContact CE1-CG 4.11Å; Y737-M741 HydrophobicContact CE2-CG 4.17Å; Y737-M741 HydrophobicContact CE2-SD 4.37Å; Y737-M741 VanDerWaalsContact O-CG 3.26Å; Y737-M741 WeakPolarHBondContact O-CG 3.48Å; Y737-M741 PolarHBondContact O-N 3.02Å; L738-M741 CarbonylContact O-C 3.58Å; L738-M741 WeakPolarHBondContact O-CB 3.47Å; L738-M741 PolarHBondContact O-N 2.9Å; S739-M741 PolarHBondContact O-N 3.36Å
742	G	83.3	Confident	92.6	Very high	34 Å²	34	19.9 Å²	19.9	35%	0.351	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	22.7	-175.8	0	0	0	0	0	114.1	L738 S739 D740	L738-G742 PolarHBondContact O-N 3.29Å; S739-G742 PolarHBondContact O-N 3.1Å; D740-G742 PolarHBondContact O-N 3.17Å
743	Y	86.4	Confident	92.5	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.008	10%	0.104	C	C	.	.			trans	-106.1	132.5	-175.5	-175.2	-93.2	0	0	0	112.6	Y597 I674 F678 L738 F766 S769	Y597-Y743 AromaticContact CD1-CD2 3.58Å; Y597-Y743 HydrophobicContact CD1-CD2 3.58Å; Y597-Y743 HydrophobicContact CD1-CE2 4.39Å; Y597-Y743 HydrophobicContact CD1-CG 4.5Å; Y597-Y743 AromaticContact CD2-CD2 3.91Å; Y597-Y743 HydrophobicContact CD2-CD2 3.91Å; Y597-Y743 HydrophobicContact CD2-CE2 4.44Å; Y597-Y743 AromaticContact CE1-CD2 3.42Å; Y597-Y743 HydrophobicContact CE1-CD2 3.42Å; Y597-Y743 VanDerWaalsContact CE1-CD2 3.42Å; Y597-Y743 AromaticContact CE1-CE2 3.8Å; Y597-Y743 HydrophobicContact CE1-CE2 3.8Å; Y597-Y743 AromaticContact CE2-CD2 3.82Å; Y597-Y743 HydrophobicContact CE2-CD2 3.82Å; Y597-Y743 AromaticContact CE2-CE2 3.91Å; Y597-Y743 HydrophobicContact CE2-CE2 3.91Å; Y597-Y743 AromaticContact CG-CD2 3.82Å; Y597-Y743 HydrophobicContact CG-CD2 3.82Å; Y597-Y743 AromaticContact CZ-CD2 3.6Å; Y597-Y743 AromaticContact CZ-CE2 3.58Å; I674-Y743 HydrophobicContact CG2-CE2 3.7Å; I674-Y743 WeakPolarHBondContact CG2-OH 3.46Å; F678-Y743 HydrophobicContact CE1-CG 4.4Å; F678-Y743 HydrophobicContact CE2-CD1 4.34Å; F678-Y743 HydrophobicContact CE2-CD2 4.38Å; F678-Y743 HydrophobicContact CE2-CE1 4.22Å; F678-Y743 HydrophobicContact CE2-CE2 4.27Å; F678-Y743 HydrophobicContact CE2-CG 4.38Å; F678-Y743 AromaticContact CZ-CD1 3.99Å; F678-Y743 HydrophobicContact CZ-CD1 3.99Å; F678-Y743 AromaticContact CZ-CD2 3.61Å; F678-Y743 HydrophobicContact CZ-CD2 3.61Å; F678-Y743 HydrophobicContact CZ-CE1 4.25Å; F678-Y743 AromaticContact CZ-CE2 3.9Å; F678-Y743 HydrophobicContact CZ-CE2 3.9Å; F678-Y743 AromaticContact CZ-CG 3.62Å; F678-Y743 HydrophobicContact CZ-CG 3.62Å; L738-Y743 CarbonylContact C-O 3.59Å; L738-Y743 HydrophobicContact CB-CD1 4.11Å; L738-Y743 HydrophobicContact CD1-CD1 4.07Å; L738-Y743 HydrophobicContact CD1-CE1 4.36Å; L738-Y743 HydrophobicContact CD2-CD1 3.83Å; L738-Y743 HydrophobicContact CD2-CE1 4.41Å; L738-Y743 HydrophobicContact CD2-CG 4.4Å; L738-Y743 HydrophobicContact CG-CD1 4.21Å; L738-Y743 WeakPolarHBondContact O-CB 3.24Å; L738-Y743 PolarHBondContact O-N 3.48Å; Y743-F766 AromaticContact CE1-CD1 3.7Å; Y743-F766 HydrophobicContact CE1-CD1 3.7Å; Y743-F766 AromaticContact CE1-CE1 3.97Å; Y743-F766 HydrophobicContact CE1-CE1 3.97Å; Y743-F766 AromaticContact CZ-CD1 3.8Å; Y743-F766 WeakPolarHBondContact OH-CB 3.46Å; Y743-F766 WeakPolarHBondContact OH-CD1 3.35Å; Y743-S769 VanDerWaalsContact CZ-CB 3.49Å; Y743-S769 WeakPolarHBondContact OH-CB 3.37Å; Y743-S769 PolarHBondContact OH-OG 3Å
744	V	88.3	Confident	92.5	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.006	11%	0.111	C	C	.	.			trans	-109.4	123.5	176.7	-173.9	0	0	0	0	109.9	R746 L772 F802 D807	V744-R746 HydrophobicContact CB-CG 4.39Å; V744-R746 HydrophobicContact CG1-CG 3.8Å; V744-L772 HydrophobicContact CG2-CD1 3.49Å; V744-L772 VanDerWaalsContact CG2-CD1 3.49Å; V744-L772 HydrophobicContact CG2-CD2 4.43Å; V744-L772 HydrophobicContact CG2-CG 3.95Å; V744-F802 HydrophobicContact CG1-CB 4.13Å; V744-D807 WeakPolarHBondContact CA-OD2 3.38Å; V744-D807 WeakPolarHBondContact CG1-OD2 3.41Å
745	H	90.1	Very high	92.4	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	11%	0.111	C	C	.	.			trans	-73.8	-42.8	-175.3	-167.1	-72.6	0	0	0	113	M735 D747 L748 V763 S764 D765 F766 D807	M735-H745 HydrophobicContact CE-CB 3.81Å; M735-H745 HydrophobicContact SD-CB 4.33Å; H745-D747 PolarHBondContact CE1-O 2.87Å; H745-D747 VanDerWaalsContact ND1-C 3.26Å; H745-D747 PolarHBondContact ND1-N 3.39Å; H745-D747 PolarHBondContact ND1-O 3.07Å; H745-D747 PolarHBondContact O-N 3.08Å; H745-L748 PolarHBondContact ND1-N 3Å; H745-V763 VanDerWaalsContact CD2-CG1 3.4Å; H745-V763 WeakPolarHBondContact CD2-CG1 3.48Å; H745-V763 VanDerWaalsContact NE2-CG1 3.34Å; H745-V763 WeakPolarHBondContact NE2-CG1 3.24Å; H745-S764 PolarHBondContact CE1-O 2.83Å; H745-S764 PolarHBondContact NE2-O 2.93Å; H745-D765 PolarHBondContact CE1-O 2.94Å; H745-D765 VanDerWaalsContact CE1-O 3.27Å; H745-F766 AromaticContact CD2-CE1 3.85Å; H745-D807 PolarHBondContact N-OD2 3.47Å
746	R	87.1	Confident	92.3	Very high	18 Å²	18	22.5 Å²	22.5	7%	0.068	12%	0.117	C	C	.	.	S	Bend	trans	68.7	-19.7	176.6	-48.2	171.3	-171.3	-158	-11.9	116.8	V744 L768 R770 Y780 F802 D807	V744-R746 HydrophobicContact CB-CG 4.39Å; V744-R746 HydrophobicContact CG1-CG 3.8Å; R746-L768 WeakPolarHBondContact CD-O 3.44Å; R746-R770 VanDerWaalsContact NH2-C 3.28Å; R746-R770 PolarHBondContact NH2-O 2.92Å; R746-Y780 WeakPolarHBondContact CD-OH 3.33Å; R746-Y780 PolarHBondContact NE-OH 3.31Å; R746-Y780 PolarHBondContact NH1-OH 2.97Å; R746-Y780 PolarHBondContact NH2-OH 2.82Å; R746-F802 HydrophobicContact CB-CD1 4.04Å; R746-F802 HydrophobicContact CB-CE1 4.26Å; R746-F802 HydrophobicContact CG-CB 4.34Å; R746-F802 HydrophobicContact CG-CD1 4.01Å; R746-F802 HydrophobicContact CG-CG 4.23Å; R746-D807 PolarHBondContact N-OD1 2.95Å
747	D	87.9	Confident	92.1	Very high	17 Å²	17	22.8 Å²	22.8	9%	0.091	13%	0.127	C	C	.	.			trans	-130.1	49.3	174.3	-165.5	22.4	0	0	0	112.7	H745 A749 R751 N752 L768 P788	H745-D747 PolarHBondContact CE1-O 2.87Å; H745-D747 VanDerWaalsContact ND1-C 3.26Å; H745-D747 PolarHBondContact ND1-N 3.39Å; H745-D747 PolarHBondContact ND1-O 3.07Å; H745-D747 PolarHBondContact O-N 3.08Å; D747-A749 PolarHBondContact O-N 3.15Å; D747-R751 IonicContact OD1-CZ 3.26Å; D747-R751 IonicContact OD1-NH2 2.92Å; D747-R751 PolarHBondContact OD1-NH2 2.87Å; D747-R751 IonicContact OD2-NH2 2.8Å; D747-R751 PolarHBondContact OD2-NH2 2.69Å; D747-N752 VanDerWaalsContact CG-ND2 3.27Å; D747-N752 PolarHBondContact O-ND2 3.02Å; D747-N752 PolarHBondContact OD2-ND2 3.1Å; D747-L768 HydrophobicContact CB-CD1 3.99Å; D747-P788 VanDerWaalsContact OD1-CG 3.27Å; D747-P788 WeakPolarHBondContact OD1-CG 3.26Å
748	L	95.3	Very high	92	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.			trans	-76.6	115.3	176.8	-176	67.6	0	0	0	109.9	I731 M735 H745 I753 V763 S810 Y811 V814	I731-L748 HydrophobicContact CG2-CD1 4.45Å; M735-L748 HydrophobicContact CE-CD2 4.11Å; M735-L748 HydrophobicContact CG-CD1 4.19Å; M735-L748 HydrophobicContact CG-CD2 3.81Å; M735-L748 HydrophobicContact SD-CD1 3.79Å; M735-L748 HydrophobicContact SD-CD2 3.98Å; M735-L748 HydrophobicContact SD-CG 4.43Å; H745-L748 PolarHBondContact ND1-N 3Å; L748-I753 HydrophobicContact CD1-CD1 3.86Å; L748-V763 HydrophobicContact CD1-CG1 4.17Å; L748-S810 WeakPolarHBondContact O-CB 3.48Å; L748-Y811 HydrophobicContact CD2-CD2 4.3Å; L748-V814 HydrophobicContact CG-CG2 4.16Å
749	A	95.3	Very high	92	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.			trans	-154.7	158.1	178.8	0	0	0	0	0	109.9	D747 R751 N752 W791	D747-A749 PolarHBondContact O-N 3.15Å; A749-R751 HydrophobicContact CB-CG 3.95Å; A749-R751 PolarHBondContact O-N 2.91Å; A749-R751 VanDerWaalsContact O-N 3.15Å; A749-N752 PolarHBondContact O-N 2.87Å; A749-W791 HydrophobicContact CB-CD2 4.19Å; A749-W791 HydrophobicContact CB-CG 4.02Å
750	A	96.7	Very high	92.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-57.3	-33	-179.3	0	0	0	0	0	113.3	L708 D709 N752 I753 E817	L708-A750 WeakPolarHBondContact CB-O 3.29Å; L708-A750 PolarHBondContact N-O 2.79Å; D709-A750 HydrophobicContact CB-CB 3.94Å; A750-N752 PolarHBondContact O-N 3.3Å; A750-I753 PolarHBondContact O-N 2.81Å; A750-I753 VanDerWaalsContact O-N 3.12Å; A750-E817 HydrophobicContact CB-CB 4.03Å; A750-E817 HydrophobicContact CB-CG 4.48Å; A750-E817 WeakPolarHBondContact CB-OE2 3.38Å; A750-E817 PolarHBondContact N-OE2 3.38Å
751	R	93.4	Very high	92.6	Very high	77 Å²	77	26.1 Å²	26.1	29%	0.291	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-61.1	-24	174.1	64.3	175	-173.9	-77.9	-6	114.7	S707 D709 D747 A749	S707-R751 WeakPolarHBondContact CB-O 3.2Å; D709-R751 WeakPolarHBondContact OD1-CA 3.45Å; D747-R751 IonicContact OD1-CZ 3.26Å; D747-R751 IonicContact OD1-NH2 2.92Å; D747-R751 PolarHBondContact OD1-NH2 2.87Å; D747-R751 IonicContact OD2-NH2 2.8Å; D747-R751 PolarHBondContact OD2-NH2 2.69Å; A749-R751 HydrophobicContact CB-CG 3.95Å; A749-R751 PolarHBondContact O-N 2.91Å; A749-R751 VanDerWaalsContact O-N 3.15Å
752	N	94.5	Very high	93.1	Very high	11 Å²	11	26 Å²	26	6%	0.059	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-100.5	6.2	-179.5	-66.8	-10.8	0	0	0	111.8	D747 A749 A750 S764 D765	D747-N752 VanDerWaalsContact CG-ND2 3.27Å; D747-N752 PolarHBondContact O-ND2 3.02Å; D747-N752 PolarHBondContact OD2-ND2 3.1Å; A749-N752 PolarHBondContact O-N 2.87Å; A750-N752 PolarHBondContact O-N 3.3Å; N752-S764 CarbonylContact O-C 3.53Å; N752-S764 WeakPolarHBondContact O-CA 3.39Å; N752-S764 PolarHBondContact O-N 2.64Å; N752-S764 PolarHBondContact O-OG 2.76Å; N752-D765 HydrophobicContact CB-CB 4.24Å
753	I	97.8	Very high	93.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	128.6	170.8	-54	-54.9	0	0	0	108.5	S707 L708 I731 L748 A750 C761 K762 V763	S707-I753 CarbonylContact C-O 3.52Å; S707-I753 WeakPolarHBondContact CA-O 3.38Å; L708-I753 HydrophobicContact CB-CB 3.88Å; L708-I753 HydrophobicContact CB-CG2 4.1Å; L708-I753 HydrophobicContact CD2-CB 4.01Å; L708-I753 HydrophobicContact CD2-CG1 4.43Å; L708-I753 HydrophobicContact CD2-CG2 3.88Å; L708-I753 PolarHBondContact N-O 2.84Å; I731-I753 HydrophobicContact CD1-CG1 4.14Å; I731-I753 HydrophobicContact CD1-CG2 4.02Å; I731-I753 HydrophobicContact CG1-CD1 4.32Å; I731-I753 HydrophobicContact CG1-CG1 4.28Å; I731-I753 HydrophobicContact CG1-CG2 3.9Å; I731-I753 HydrophobicContact CG2-CD1 4.01Å; L748-I753 HydrophobicContact CD1-CD1 3.86Å; A750-I753 PolarHBondContact O-N 2.81Å; A750-I753 VanDerWaalsContact O-N 3.12Å; I753-C761 HydrophobicContact CG2-CB 3.71Å; I753-K762 WeakPolarHBondContact CA-O 3.44Å; I753-V763 HydrophobicContact CD1-CB 4.15Å; I753-V763 HydrophobicContact CD1-CG1 4.2Å; I753-V763 HydrophobicContact CD1-CG2 3.89Å
754	L	96.5	Very high	94	Very high	41 Å²	41	24.9 Å²	24.9	22%	0.215	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	146.8	176.1	-62.8	174.1	0	0	0	111.1	I684 M703 G706 C761 K762	I684-L754 HydrophobicContact CD1-CD1 3.96Å; I684-L754 HydrophobicContact CG1-CD1 4.4Å; M703-L754 HydrophobicContact CB-CB 3.82Å; M703-L754 HydrophobicContact CB-CD1 4.39Å; M703-L754 VanDerWaalsContact CE-C 3.49Å; M703-L754 HydrophobicContact CE-CB 3.91Å; M703-L754 VanDerWaalsContact CE-O 3.23Å; M703-L754 WeakPolarHBondContact CE-O 3.46Å; M703-L754 HydrophobicContact CG-CB 3.65Å; M703-L754 HydrophobicContact CG-CD1 3.96Å; M703-L754 HydrophobicContact CG-CG 4.43Å; G706-L754 CarbonylContact O-C 3.32Å; G706-L754 WeakPolarHBondContact O-CA 3.31Å; L754-C761 CarbonylContact O-C 3.5Å; L754-C761 WeakPolarHBondContact O-CA 3.14Å; L754-K762 PolarHBondContact N-O 3.48Å; L754-K762 PolarHBondContact O-N 2.78Å
755	V	96.9	Very high	93.6	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.7	-176.6	-169.9	0	0	0	0	110.2	M703 N705 G706 L708 F711	M703-V755 CarbonylContact C-O 3.54Å; N705-V755 HydrophobicContact CB-CB 3.96Å; N705-V755 HydrophobicContact CB-CG1 4.17Å; N705-V755 WeakPolarHBondContact CB-O 3.42Å; N705-V755 PolarHBondContact N-O 2.95Å; G706-V755 PolarHBondContact O-N 2.85Å; L708-V755 HydrophobicContact CB-CG2 3.82Å; L708-V755 HydrophobicContact CD1-CG2 3.58Å; L708-V755 HydrophobicContact CG-CG2 4.29Å; F711-V755 HydrophobicContact CD1-CB 4.48Å; F711-V755 HydrophobicContact CD1-CG1 4.21Å; F711-V755 HydrophobicContact CD1-CG2 4.27Å; F711-V755 HydrophobicContact CE1-CG1 4.14Å
756	N	94.4	Very high	93	Very high	25 Å²	25	28.1 Å²	28.1	13%	0.134	15%	0.15	C	C	.	.			trans	-94.8	174.3	174.1	77.3	5.3	0	0	0	112	M703 E704 N705 N758 L759 V760	M703-N756 HydrophobicContact CE-CB 3.84Å; M703-N756 HydrophobicContact SD-CB 4.02Å; E704-N756 WeakPolarHBondContact OE2-CA 3.34Å; E704-N756 WeakPolarHBondContact OE2-CB 3.33Å; N705-N756 PolarHBondContact ND2-O 3.35Å; N756-N758 PolarHBondContact O-N 3.45Å; N756-N758 WeakPolarHBondContact OD1-CA 3.36Å; N756-N758 PolarHBondContact OD1-N 3.12Å; N756-L759 PolarHBondContact O-N 2.79Å; N756-L759 PolarHBondContact OD1-N 3.45Å; N756-V760 PolarHBondContact N-O 3.24Å; N756-V760 VanDerWaalsContact N-O 3.15Å; N756-V760 WeakPolarHBondContact OD1-CB 3.31Å; N756-V760 PolarHBondContact OD1-N 2.86Å
757	S	92.3	Very high	91.5	Very high	68 Å²	68	29 Å²	29	48%	0.476	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-22.6	178.5	50.6	0	0	0	0	115.2	E704	E704-S757 PolarHBondContact OE2-N 2.94Å; E704-S757 PolarHBondContact OE2-OG 2.85Å
758	N	93.4	Very high	89.6	Confident	129 Å²	129	32.7 Å²	32.7	69%	0.69	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.5	16.4	177.6	-62.6	-48.2	0	0	0	113.1	N756 V760	N756-N758 PolarHBondContact O-N 3.45Å; N756-N758 WeakPolarHBondContact OD1-CA 3.36Å; N756-N758 PolarHBondContact OD1-N 3.12Å; N758-V760 HydrophobicContact CB-CG2 4.28Å; N758-V760 PolarHBondContact O-N 3.2Å
759	L	93.6	Very high	87.5	Confident	50 Å²	50	32.7 Å²	32.7	26%	0.262	18%	0.184	S	C	.	.			trans	61.9	17.4	-176.4	-51.3	179.2	0	0	0	114.5	F711 F719 M727 N756 C761	F711-L759 HydrophobicContact CE1-CD2 3.79Å; F711-L759 HydrophobicContact CZ-CD2 3.48Å; F711-L759 VanDerWaalsContact CZ-CD2 3.48Å; F719-L759 HydrophobicContact CD1-CD1 4.5Å; F719-L759 HydrophobicContact CE1-CD1 4.13Å; F719-L759 HydrophobicContact CE1-CD2 4.24Å; F719-L759 HydrophobicContact CZ-CD2 4.49Å; M727-L759 HydrophobicContact CE-CB 4.11Å; M727-L759 HydrophobicContact CE-CD1 4.22Å; M727-L759 HydrophobicContact CE-CD2 4.08Å; M727-L759 HydrophobicContact CE-CG 4.37Å; N756-L759 PolarHBondContact O-N 2.79Å; N756-L759 PolarHBondContact OD1-N 3.45Å; L759-C761 PolarHBondContact O-N 3.43Å
760	V	96.3	Very high	85.4	Confident	53 Å²	53	39.8 Å²	39.8	32%	0.321	21%	0.211	S	C	.	.			trans	-75.7	120.9	174.6	-177.6	0	0	0	0	108.7	N756 N758	N756-V760 PolarHBondContact N-O 3.24Å; N756-V760 VanDerWaalsContact N-O 3.15Å; N756-V760 WeakPolarHBondContact OD1-CB 3.31Å; N756-V760 PolarHBondContact OD1-N 2.86Å; N758-V760 HydrophobicContact CB-CG2 4.28Å; N758-V760 PolarHBondContact O-N 3.2Å
761	C	97.8	Very high	82.5	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.007	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	133.9	175.7	-67.3	0	0	0	0	110.8	N682 M727 I731 I753 L754 L759	N682-C761 PolarHBondContact ND2-O 2.82Å; M727-C761 VanDerWaalsContact CB-SG 3.58Å; I731-C761 HydrophobicContact CD1-CB 4.29Å; I731-C761 HydrophobicContact CG1-CB 3.75Å; I753-C761 HydrophobicContact CG2-CB 3.71Å; L754-C761 CarbonylContact O-C 3.5Å; L754-C761 WeakPolarHBondContact O-CA 3.14Å; L759-C761 PolarHBondContact O-N 3.43Å
762	K	97.5	Very high	79.8	Confident	18 Å²	18	40 Å²	40	8%	0.078	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	132.2	176.6	-58.8	-166.4	177.6	-146.6	0	111.3	P681 N682 E701 M703 I753 L754	P681-K762 WeakPolarHBondContact O-CE 3.24Å; P681-K762 PolarHBondContact O-NZ 2.8Å; N682-K762 CarbonylContact O-C 3.58Å; N682-K762 VanDerWaalsContact O-CA 3.31Å; N682-K762 WeakPolarHBondContact O-CA 3.41Å; E701-K762 VanDerWaalsContact OE1-CD 3.29Å; E701-K762 WeakPolarHBondContact OE1-CD 3.19Å; E701-K762 WeakPolarHBondContact OE1-CE 3.35Å; E701-K762 IonicContact OE1-NZ 3.6Å; E701-K762 PolarHBondContact OE1-NZ 3.4Å; E701-K762 IonicContact OE2-NZ 3.88Å; E701-K762 PolarHBondContact OE2-NZ 2.81Å; M703-K762 HydrophobicContact CE-CB 3.93Å; M703-K762 HydrophobicContact CE-CD 3.83Å; M703-K762 HydrophobicContact CE-CG 3.65Å; M703-K762 HydrophobicContact SD-CD 3.92Å; M703-K762 HydrophobicContact SD-CG 4.41Å; I753-K762 WeakPolarHBondContact CA-O 3.44Å; L754-K762 PolarHBondContact N-O 3.48Å; L754-K762 PolarHBondContact O-N 2.78Å
763	V	96.8	Very high	76.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	135.5	174.4	-171.8	0	0	0	0	109.2	N682 I683 I684 I731 M735 L738 H745 L748 I753	N682-V763 PolarHBondContact O-N 2.86Å; I683-V763 HydrophobicContact CD1-CB 3.73Å; I683-V763 HydrophobicContact CD1-CG2 4.06Å; I684-V763 PolarHBondContact N-O 2.6Å; I731-V763 HydrophobicContact CG2-CG2 4.38Å; M735-V763 HydrophobicContact CG-CG2 4.34Å; M735-V763 HydrophobicContact SD-CG1 4.06Å; M735-V763 HydrophobicContact SD-CG2 4.17Å; L738-V763 HydrophobicContact CD1-CG1 4.45Å; H745-V763 VanDerWaalsContact CD2-CG1 3.4Å; H745-V763 WeakPolarHBondContact CD2-CG1 3.48Å; H745-V763 VanDerWaalsContact NE2-CG1 3.34Å; H745-V763 WeakPolarHBondContact NE2-CG1 3.24Å; L748-V763 HydrophobicContact CD1-CG1 4.17Å; I753-V763 HydrophobicContact CD1-CB 4.15Å; I753-V763 HydrophobicContact CD1-CG1 4.2Å; I753-V763 HydrophobicContact CD1-CG2 3.89Å
764	S	92.1	Very high	73.8	Confident	13 Å²	13	54.7 Å²	54.7	9%	0.091	29%	0.292	C	S	.	.			trans	-144.3	179.2	-177.3	73.8	0	0	0	0	111.4	H745 N752	H745-S764 PolarHBondContact CE1-O 2.83Å; H745-S764 PolarHBondContact NE2-O 2.93Å; N752-S764 CarbonylContact O-C 3.53Å; N752-S764 WeakPolarHBondContact O-CA 3.39Å; N752-S764 PolarHBondContact O-N 2.64Å; N752-S764 PolarHBondContact O-OG 2.76Å
765	D	80.5	Confident	70.9	Confident	69 Å²	69	56.7 Å²	56.7	37%	0.369	30%	0.302	S	S	.	.			trans	62.5	87.3	179.4	-159.8	-4.5	0	0	0	115	H745 N752 G767	H745-D765 PolarHBondContact CE1-O 2.94Å; H745-D765 VanDerWaalsContact CE1-O 3.27Å; N752-D765 HydrophobicContact CB-CB 4.24Å; D765-G767 PolarHBondContact OD1-N 3.14Å
766	F	76.1	Confident	68.2	Low	1 Å²	1	63.3 Å²	63.3	0%	0.004	35%	0.345	C	S	.	.			trans	-98.4	16.3	-177.9	-59	-70.8	0	0	0	113.2	I674 M675 F678 I683 I684 L738 Y743 H745 L768 S769	I674-F766 HydrophobicContact CG2-CB 3.99Å; I674-F766 HydrophobicContact CG2-CD1 4.49Å; I674-F766 HydrophobicContact CG2-CG 4.13Å; M675-F766 HydrophobicContact CG-CD2 3.37Å; M675-F766 HydrophobicContact CG-CE2 3.64Å; M675-F766 HydrophobicContact SD-CD2 4.17Å; M675-F766 HydrophobicContact SD-CE2 4.44Å; F678-F766 HydrophobicContact CD2-CE1 4.4Å; F678-F766 HydrophobicContact CD2-CZ 4.15Å; F678-F766 HydrophobicContact CE2-CD1 4.49Å; F678-F766 HydrophobicContact CE2-CE1 4.15Å; F678-F766 HydrophobicContact CE2-CZ 4.34Å; I683-F766 HydrophobicContact CG2-CZ 3.93Å; I684-F766 HydrophobicContact CG2-CE2 3.94Å; L738-F766 HydrophobicContact CD1-CE1 4.09Å; L738-F766 HydrophobicContact CD2-CE1 4.49Å; Y743-F766 AromaticContact CE1-CD1 3.7Å; Y743-F766 HydrophobicContact CE1-CD1 3.7Å; Y743-F766 AromaticContact CE1-CE1 3.97Å; Y743-F766 HydrophobicContact CE1-CE1 3.97Å; Y743-F766 AromaticContact CZ-CD1 3.8Å; Y743-F766 WeakPolarHBondContact OH-CB 3.46Å; Y743-F766 WeakPolarHBondContact OH-CD1 3.35Å; H745-F766 AromaticContact CD2-CE1 3.85Å; F766-L768 VanDerWaalsContact C-N 3.27Å; F766-L768 PolarHBondContact O-N 2.75Å; F766-L768 VanDerWaalsContact O-N 3.15Å; F766-S769 WeakPolarHBondContact O-CB 3.45Å; F766-S769 PolarHBondContact O-N 3.35Å; F766-S769 PolarHBondContact O-OG 2.82Å
767	G	56.1	Low	65.6	Low	36 Å²	36	68.2 Å²	68.2	37%	0.371	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15	-170.1	0	0	0	0	0	116.9	D765	D765-G767 PolarHBondContact OD1-N 3.14Å
768	L	47.4	Very low	62.8	Low	94 Å²	94	66.9 Å²	66.9	49%	0.492	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	5	-176.7	-64.7	175.5	0	0	0	114.7	R746 D747 F766	R746-L768 WeakPolarHBondContact CD-O 3.44Å; D747-L768 HydrophobicContact CB-CD1 3.99Å; F766-L768 VanDerWaalsContact C-N 3.27Å; F766-L768 PolarHBondContact O-N 2.75Å; F766-L768 VanDerWaalsContact O-N 3.15Å
769	S	51.3	Low	60.2	Low	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.337	C	S	.	.			trans	-83.8	152	-169.2	60.4	0	0	0	0	115.2	R670 I674 Y743 F766	R670-S769 PolarHBondContact NH1-O 2.83Å; R670-S769 PolarHBondContact NH2-O 3.35Å; I674-S769 WeakPolarHBondContact CD1-OG 3.35Å; Y743-S769 VanDerWaalsContact CZ-CB 3.49Å; Y743-S769 WeakPolarHBondContact OH-CB 3.37Å; Y743-S769 PolarHBondContact OH-OG 3Å; F766-S769 WeakPolarHBondContact O-CB 3.45Å; F766-S769 PolarHBondContact O-N 3.35Å; F766-S769 PolarHBondContact O-OG 2.82Å
770	R	51	Low	57.8	Low	149 Å²	149	61.8 Å²	61.8	56%	0.562	33%	0.334	S	S	*	.			trans	-154	161.7	168	-51.6	-173.3	173.8	-177.2	-5.7	110.6	R746	R746-R770 VanDerWaalsContact NH2-C 3.28Å; R746-R770 PolarHBondContact NH2-O 2.92Å
771	V	36.6	Very low	55.2	Low	40 Å²	40	64.2 Å²	64.2	24%	0.242	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-65.1	152.6	-177.1	161.2	0	0	0	0	115.4	Y597 D599	Y597-V771 HydrophobicContact CD1-CG2 3.4Å; Y597-V771 HydrophobicContact CE1-CB 4.24Å; Y597-V771 HydrophobicContact CE1-CG2 3.06Å; D599-V771 HydrophobicContact CB-CB 3.64Å; D599-V771 HydrophobicContact CB-CG1 4.44Å; D599-V771 HydrophobicContact CB-CG2 3.12Å; D599-V771 WeakPolarHBondContact OD2-CB 3.43Å; D599-V771 WeakPolarHBondContact OD2-CG2 3.04Å; D599-V771 PolarHBondContact OD2-N 2.69Å
772	L	36.1	Very low	52.6	Low	42 Å²	42	65.7 Å²	65.7	22%	0.22	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-93.2	126.9	159.7	-73	167	0	0	0	109.4	V744 Y780	V744-L772 HydrophobicContact CG2-CD1 3.49Å; V744-L772 VanDerWaalsContact CG2-CD1 3.49Å; V744-L772 HydrophobicContact CG2-CD2 4.43Å; V744-L772 HydrophobicContact CG2-CG 3.95Å; L772-Y780 HydrophobicContact CD2-CD1 3.65Å; L772-Y780 HydrophobicContact CD2-CE1 4.13Å
773	E	31.6	Very low	49.6	Very low	176 Å²	176	72.1 Å²	72.1	82%	0.822	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-73.7	151.3	164.1	-73.2	178.7	173.4	0	0	110.1	D775	E773-D775 VanDerWaalsContact C-N 3.34Å; E773-D775 PolarHBondContact O-N 2.94Å
774	D	35.5	Very low	46.9	Very low	144 Å²	144	75 Å²	75	77%	0.77	43%	0.429	S	S	*	.	S	Bend	trans	-54.9	71.2	-165.4	-68.3	-52.2	0	0	0	116.8
775	D	36.3	Very low	44.7	Very low	82 Å²	82	77.1 Å²	77.1	44%	0.439	45%	0.452	S	S	.	.			trans	-148.7	115.2	161.6	-177	3.2	0	0	0	110.8	E773 E777 A778	E773-D775 VanDerWaalsContact C-N 3.34Å; E773-D775 PolarHBondContact O-N 2.94Å; D775-E777 PolarHBondContact O-N 2.63Å; D775-E777 PolarHBondContact OD1-N 3.06Å; D775-A778 HydrophobicContact CB-CB 3.69Å; D775-A778 PolarHBondContact O-N 2.79Å; D775-A778 VanDerWaalsContact O-N 3.09Å
776	P	39.6	Very low	43.4	Very low	139 Å²	139	83.6 Å²	83.6	90%	0.903	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-14.6	177.6	-13.2	21.2	0	0	0	114.6
777	E	39.3	Very low	42.9	Very low	128 Å²	128	85 Å²	85	60%	0.598	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-7.1	176.7	-70.3	-155.9	123.2	0	0	114.8	D775 A779 R866	D775-E777 PolarHBondContact O-N 2.63Å; D775-E777 PolarHBondContact OD1-N 3.06Å; E777-A779 PolarHBondContact O-N 3.02Å; E777-R866 VanDerWaalsContact O-CZ 3.3Å; E777-R866 PolarHBondContact O-NH1 3.27Å; E777-R866 PolarHBondContact O-NH2 2.78Å
778	A	33.7	Very low	44.2	Very low	41 Å²	41	84.4 Å²	84.4	34%	0.339	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-81.1	120	-174.5	0	0	0	0	0	112.7	D775	D775-A778 HydrophobicContact CB-CB 3.69Å; D775-A778 PolarHBondContact O-N 2.79Å; D775-A778 VanDerWaalsContact O-N 3.09Å
779	A	40.2	Very low	45.9	Very low	23 Å²	23	81.1 Å²	81.1	19%	0.19	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-90.1	128.6	162.8	0	0	0	0	0	110	E777 K801	E777-A779 PolarHBondContact O-N 3.02Å; A779-K801 HydrophobicContact CB-CB 3.7Å; A779-K801 HydrophobicContact CB-CD 3.69Å; A779-K801 HydrophobicContact CB-CG 3.65Å
780	Y	43.3	Very low	47.8	Very low	48 Å²	48	81.7 Å²	81.7	19%	0.188	46%	0.459	C	S	.	.	B	Isolated β-bridge	trans	-96.7	155.2	-177.6	71.8	-83.5	0	0	0	111.8	R746 L772 T782 K801 F802	R746-Y780 WeakPolarHBondContact CD-OH 3.33Å; R746-Y780 PolarHBondContact NE-OH 3.31Å; R746-Y780 PolarHBondContact NH1-OH 2.97Å; R746-Y780 PolarHBondContact NH2-OH 2.82Å; L772-Y780 HydrophobicContact CD2-CD1 3.65Å; L772-Y780 HydrophobicContact CD2-CE1 4.13Å; Y780-T782 HydrophobicContact CD2-CG2 4.01Å; Y780-T782 HydrophobicContact CE2-CG2 3.43Å; Y780-T782 VanDerWaalsContact CE2-CG2 3.43Å; Y780-K801 VanDerWaalsContact O-CA 3.25Å; Y780-K801 WeakPolarHBondContact O-CA 3.34Å; Y780-F802 WeakPolarHBondContact CD1-O 3.07Å; Y780-F802 HydrophobicContact CE1-CB 3.74Å; Y780-F802 HydrophobicContact CE1-CD2 4.45Å; Y780-F802 WeakPolarHBondContact CE1-O 3.28Å; Y780-F802 HydrophobicContact CE2-CD2 4.17Å; Y780-F802 AromaticContact CZ-CD2 3.66Å; Y780-F802 WeakPolarHBondContact OH-CB 3.3Å; Y780-F802 WeakPolarHBondContact OH-CD2 3.07Å; Y780-F802 WeakPolarHBondContact OH-CG 2.99Å
781	T	41	Very low	49.9	Very low	104 Å²	104	76.3 Å²	76.3	64%	0.638	44%	0.439	S	S	*	.			trans	-110.6	137.4	-174.6	-44.3	0	0	0	0	110.7	Y799 R800	T781-Y799 WeakPolarHBondContact CG2-O 3.31Å; T781-R800 HydrophobicContact CG2-CB 4.37Å
782	T	43.8	Very low	52.4	Low	33 Å²	33	74.6 Å²	74.6	20%	0.202	43%	0.428	C	S	.	.			trans	-112.9	146.5	179.1	63.3	0	0	0	0	114.3	Y780	Y780-T782 HydrophobicContact CD2-CG2 4.01Å; Y780-T782 HydrophobicContact CE2-CG2 3.43Å; Y780-T782 VanDerWaalsContact CE2-CG2 3.43Å
783	T	34.3	Very low	55.1	Low	152 Å²	152	72.6 Å²	72.6	93%	0.933	42%	0.418	S	S	*	.			trans	-105.5	99.1	171.4	49.3	0	0	0	0	111.4
784	G	38.7	Very low	58	Low	62 Å²	62	64.7 Å²	64.7	64%	0.639	38%	0.382	S	S	*	.	S	Bend	trans	94.9	148.6	170.7	0	0	0	0	0	116.7
785	G	46.3	Very low	60.6	Low	56 Å²	56	59 Å²	59	58%	0.577	35%	0.35	S	S	*	.			trans	128.1	147.4	179.8	0	0	0	0	0	113.9	R800	G785-R800 PolarHBondContact O-NH1 2.8Å; G785-R800 PolarHBondContact O-NH2 3.12Å; G785-R800 VanDerWaalsContact O-NH2 3.16Å
786	K	53.8	Low	63	Low	205 Å²	205	55 Å²	55	89%	0.891	33%	0.33	S	S	*	.			trans	-71.8	131.8	172.7	-72	-175.2	-179.6	179.8	0	109.2
787	I	66.1	Low	65	Low	30 Å²	30	49.8 Å²	49.8	15%	0.154	29%	0.294	C	S	.	.			trans	-108.8	136.6	178.6	-69.1	-176.1	0	0	0	109.7	I789 T792 R800 F802	I787-I789 VanDerWaalsContact C-N 3.27Å; I787-I789 HydrophobicContact CB-CD1 4.24Å; I787-I789 HydrophobicContact CG2-CD1 4.04Å; I787-I789 PolarHBondContact O-N 2.72Å; I787-T792 HydrophobicContact CG2-CG2 3.68Å; I787-T792 WeakPolarHBondContact CG2-OG1 3.45Å; I787-R800 VanDerWaalsContact CD1-NE 3.29Å; I787-F802 HydrophobicContact CD1-CZ 4.04Å
788	P	82	Confident	66.9	Low	24 Å²	24	46.2 Å²	46.2	16%	0.156	29%	0.286	C	S	.	.			trans	-75.6	75.9	174.7	34.7	-38.1	0	0	0	110.7	D747 R790 W791 T792	D747-P788 VanDerWaalsContact OD1-CG 3.27Å; D747-P788 WeakPolarHBondContact OD1-CG 3.26Å; P788-R790 VanDerWaalsContact C-N 3.27Å; P788-R790 PolarHBondContact O-N 2.91Å; P788-W791 HydrophobicContact CB-CE3 4.07Å; P788-W791 PolarHBondContact O-N 2.66Å; P788-T792 PolarHBondContact O-N 2.92Å; P788-T792 PolarHBondContact O-OG1 2.83Å
789	I	83.6	Confident	69	Low	26 Å²	26	51.5 Å²	51.5	13%	0.133	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-43.5	-45.4	-168.1	-63.2	-59.2	0	0	0	114.2	I787 W791 T792 I797 N831 V834 I835	I787-I789 VanDerWaalsContact C-N 3.27Å; I787-I789 HydrophobicContact CB-CD1 4.24Å; I787-I789 HydrophobicContact CG2-CD1 4.04Å; I787-I789 PolarHBondContact O-N 2.72Å; I789-W791 VanDerWaalsContact C-N 3.28Å; I789-W791 PolarHBondContact O-N 2.73Å; I789-T792 PolarHBondContact O-N 3.37Å; I789-I797 HydrophobicContact CD1-CG1 4.4Å; I789-I797 HydrophobicContact CD1-CG2 4.49Å; I789-I797 HydrophobicContact CG2-CD1 4.31Å; I789-N831 HydrophobicContact CB-CB 4.27Å; I789-N831 HydrophobicContact CG1-CB 4.24Å; I789-N831 HydrophobicContact CG2-CB 4.2Å; I789-V834 HydrophobicContact CG2-CG1 4.36Å; I789-I835 HydrophobicContact CD1-CD1 4.22Å; I789-I835 HydrophobicContact CG2-CD1 4.01Å; I789-I835 HydrophobicContact CG2-CG1 3.63Å
790	R	90.6	Very high	70.6	Confident	11 Å²	11	53.8 Å²	53.8	4%	0.042	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-68.3	-21.9	-173.6	-63.1	166.1	-172.5	-93.5	-4	115.1	P788 P825 Y826 W827 M829 N831 V834	P788-R790 VanDerWaalsContact C-N 3.27Å; P788-R790 PolarHBondContact O-N 2.91Å; R790-P825 HydrophobicContact CB-CB 4.31Å; R790-P825 WeakPolarHBondContact CD-O 3.36Å; R790-P825 PolarHBondContact NH1-O 3.13Å; R790-Y826 HydrophobicContact CB-CD2 4.24Å; R790-Y826 HydrophobicContact CG-CD2 4.4Å; R790-W827 PolarHBondContact NH1-O 2.05Å; R790-M829 PolarHBondContact NH1-O 3.47Å; R790-M829 PolarHBondContact NH2-O 2.85Å; R790-N831 PolarHBondContact NE-OD1 3.26Å; R790-V834 HydrophobicContact CG-CG1 4.42Å; R790-V834 HydrophobicContact CG-CG2 4.46Å
791	W	94.8	Very high	72.3	Confident	37 Å²	37	55.6 Å²	55.6	14%	0.14	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-102.7	-7.1	177.9	-63.6	-98.4	0	0	0	112.2	A749 P788 I789 S810 I813 E817 P825	A749-W791 HydrophobicContact CB-CD2 4.19Å; A749-W791 HydrophobicContact CB-CG 4.02Å; P788-W791 HydrophobicContact CB-CE3 4.07Å; P788-W791 PolarHBondContact O-N 2.66Å; I789-W791 VanDerWaalsContact C-N 3.28Å; I789-W791 PolarHBondContact O-N 2.73Å; W791-S810 WeakPolarHBondContact O-CA 3.38Å; W791-S810 WeakPolarHBondContact O-CB 3.49Å; W791-S810 PolarHBondContact O-OG 3.06Å; W791-I813 HydrophobicContact CG-CG2 4.01Å; W791-E817 WeakPolarHBondContact CZ2-OE1 3.44Å; W791-E817 PolarHBondContact NE1-OE1 2.95Å; W791-E817 PolarHBondContact NE1-OE2 2.97Å; W791-P825 HydrophobicContact CZ2-CG 3.84Å
792	T	90	Very high	74.3	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.018	28%	0.283	C	S	.	.	S	Bend	trans	-92.4	139.1	-169.2	-54.6	0	0	0	0	111	I787 P788 I789 A796 I797 F802 W809	I787-T792 HydrophobicContact CG2-CG2 3.68Å; I787-T792 WeakPolarHBondContact CG2-OG1 3.45Å; P788-T792 PolarHBondContact O-N 2.92Å; P788-T792 PolarHBondContact O-OG1 2.83Å; I789-T792 PolarHBondContact O-N 3.37Å; T792-A796 HydrophobicContact CG2-CB 3.43Å; T792-A796 VanDerWaalsContact CG2-CB 3.43Å; T792-I797 HydrophobicContact CG2-CG1 3.74Å; T792-I797 WeakPolarHBondContact O-CD1 3.45Å; T792-F802 HydrophobicContact CG2-CE1 4.33Å; T792-W809 PolarHBondContact O-NE1 2.9Å
793	A	93.8	Very high	76.5	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.008	28%	0.278	C	S	.	.			trans	-67	152.5	177.3	0	0	0	0	0	112.7	E795 A796 I797 W809	A793-E795 VanDerWaalsContact C-N 3.32Å; A793-E795 WeakPolarHBondContact CB-OE1 3.11Å; A793-E795 WeakPolarHBondContact CB-OE2 3.47Å; A793-E795 PolarHBondContact O-N 2.88Å; A793-A796 HydrophobicContact CB-CB 4.44Å; A793-A796 WeakPolarHBondContact O-CB 3.25Å; A793-A796 PolarHBondContact O-N 2.7Å; A793-I797 WeakPolarHBondContact O-CG1 3.39Å; A793-I797 PolarHBondContact O-N 2.85Å; A793-W809 HydrophobicContact CB-CB 3.79Å; A793-W809 HydrophobicContact CB-CD2 4.14Å; A793-W809 HydrophobicContact CB-CG 3.77Å
794	P	90.9	Very high	79.2	Confident	9 Å²	9	44.6 Å²	44.6	6%	0.058	24%	0.244	C	C	.	.	H	α-helix	trans	-53.8	-44.2	-178	-21.5	28.2	0	0	0	113.4	A796 I797 A798 W809 I838	P794-A796 VanDerWaalsContact C-N 3.31Å; P794-A796 PolarHBondContact O-N 2.87Å; P794-I797 PolarHBondContact O-N 2.77Å; P794-A798 WeakPolarHBondContact O-CB 3.3Å; P794-A798 PolarHBondContact O-N 2.84Å; P794-W809 HydrophobicContact CG-CE3 4.39Å; P794-W809 HydrophobicContact CG-CH2 3.69Å; P794-W809 HydrophobicContact CG-CZ2 4.21Å; P794-W809 HydrophobicContact CG-CZ3 3.78Å; P794-I838 HydrophobicContact CB-CG2 4.33Å; P794-I838 HydrophobicContact CG-CG2 3.67Å
795	E	89.7	Confident	81.9	Confident	24 Å²	24	42.8 Å²	42.8	11%	0.112	22%	0.223	C	C	.	.	H	α-helix	trans	-67.9	-30.4	-179.9	71.7	-77.8	-172.8	0	0	113	A793 Y799 R800 K801 R869	A793-E795 VanDerWaalsContact C-N 3.32Å; A793-E795 WeakPolarHBondContact CB-OE1 3.11Å; A793-E795 WeakPolarHBondContact CB-OE2 3.47Å; A793-E795 PolarHBondContact O-N 2.88Å; E795-Y799 HydrophobicContact CB-CD2 4.46Å; E795-Y799 CarbonylContact O-C 3.55Å; E795-Y799 WeakPolarHBondContact O-CA 3.46Å; E795-Y799 WeakPolarHBondContact O-CB 3.22Å; E795-Y799 PolarHBondContact O-N 3.27Å; E795-R800 PolarHBondContact O-N 3.37Å; E795-K801 HydrophobicContact CG-CB 4.44Å; E795-K801 PolarHBondContact O-N 3.22Å; E795-R869 IonicContact OE1-CZ 3.5Å; E795-R869 IonicContact OE1-NH1 3.59Å; E795-R869 PolarHBondContact OE1-NH1 3.4Å; E795-R869 IonicContact OE1-NH2 2.7Å; E795-R869 PolarHBondContact OE1-NH2 2.96Å; E795-R869 IonicContact OE2-CZ 2.96Å; E795-R869 IonicContact OE2-NH1 2.84Å; E795-R869 IonicContact OE2-NH2 3.46Å; E795-R869 PolarHBondContact OE2-NH2 2.87Å
796	A	86.8	Confident	84.1	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-75.9	-33.1	175.3	0	0	0	0	0	111.6	T792 A793 P794 R800 K801 F802	T792-A796 HydrophobicContact CG2-CB 3.43Å; T792-A796 VanDerWaalsContact CG2-CB 3.43Å; A793-A796 HydrophobicContact CB-CB 4.44Å; A793-A796 WeakPolarHBondContact O-CB 3.25Å; A793-A796 PolarHBondContact O-N 2.7Å; P794-A796 VanDerWaalsContact C-N 3.31Å; P794-A796 PolarHBondContact O-N 2.87Å; A796-R800 WeakPolarHBondContact O-CA 3.27Å; A796-R800 PolarHBondContact O-N 2.73Å; A796-K801 VanDerWaalsContact CA-O 3.25Å; A796-K801 WeakPolarHBondContact CA-O 3.44Å; A796-K801 VanDerWaalsContact CB-O 3.3Å; A796-K801 WeakPolarHBondContact CB-O 3.49Å; A796-K801 PolarHBondContact N-O 2.73Å; A796-F802 HydrophobicContact CB-CD1 3.77Å; A796-F802 HydrophobicContact CB-CE1 3.77Å; A796-F802 HydrophobicContact CB-CG 4.15Å; A796-F802 HydrophobicContact CB-CZ 4.16Å
797	I	82.6	Confident	86.1	Confident	29 Å²	29	30.6 Å²	30.6	15%	0.149	15%	0.154	C	C	.	.	H	α-helix	trans	-68.9	-54.7	172.9	-65.6	170	0	0	0	110.4	I789 T792 A793 P794 I835	I789-I797 HydrophobicContact CD1-CG1 4.4Å; I789-I797 HydrophobicContact CD1-CG2 4.49Å; I789-I797 HydrophobicContact CG2-CD1 4.31Å; T792-I797 HydrophobicContact CG2-CG1 3.74Å; T792-I797 WeakPolarHBondContact O-CD1 3.45Å; A793-I797 WeakPolarHBondContact O-CG1 3.39Å; A793-I797 PolarHBondContact O-N 2.85Å; P794-I797 PolarHBondContact O-N 2.77Å; I797-I835 HydrophobicContact CD1-CG1 4.43Å; I797-I835 HydrophobicContact CG2-CD1 4.09Å; I797-I835 HydrophobicContact CG2-CG1 4.02Å; I797-I835 HydrophobicContact CG2-CG2 4.29Å
798	A	79	Confident	87.6	Confident	52 Å²	52	29.2 Å²	29.2	43%	0.43	15%	0.147	S	C	.	.	H	α-helix	trans	-74.2	-43.4	-171.3	0	0	0	0	0	112.8	P794	P794-A798 WeakPolarHBondContact O-CB 3.3Å; P794-A798 PolarHBondContact O-N 2.84Å
799	Y	78	Confident	88.4	Confident	153 Å²	153	28 Å²	28	60%	0.6	14%	0.14	S	C	*	.	H	α-helix	trans	-118.9	6	-170.1	-50.4	-66.5	0	0	0	113.4	T781 E795 K801	T781-Y799 WeakPolarHBondContact CG2-O 3.31Å; E795-Y799 HydrophobicContact CB-CD2 4.46Å; E795-Y799 CarbonylContact O-C 3.55Å; E795-Y799 WeakPolarHBondContact O-CA 3.46Å; E795-Y799 WeakPolarHBondContact O-CB 3.22Å; E795-Y799 PolarHBondContact O-N 3.27Å; Y799-K801 PolarHBondContact O-N 3.21Å; Y799-K801 VanDerWaalsContact O-N 3.11Å
800	R	73.4	Confident	89.1	Confident	71 Å²	71	27.1 Å²	27.1	27%	0.268	14%	0.135	S	C	.	.			trans	55.8	28.2	-176.9	-62.7	-66	-171.9	131.4	-12.8	113.2	T781 G785 I787 E795 A796 F802	T781-R800 HydrophobicContact CG2-CB 4.37Å; G785-R800 PolarHBondContact O-NH1 2.8Å; G785-R800 PolarHBondContact O-NH2 3.12Å; G785-R800 VanDerWaalsContact O-NH2 3.16Å; I787-R800 VanDerWaalsContact CD1-NE 3.29Å; E795-R800 PolarHBondContact O-N 3.37Å; A796-R800 WeakPolarHBondContact O-CA 3.27Å; A796-R800 PolarHBondContact O-N 2.73Å; R800-F802 WeakPolarHBondContact O-CD2 3.49Å; R800-F802 WeakPolarHBondContact O-CE2 3.47Å
801	K	78.5	Confident	89.4	Confident	85 Å²	85	26.6 Å²	26.6	37%	0.37	13%	0.133	S	C	.	.			trans	-93.8	109.4	-177.7	-84.7	-175.5	176.5	-176.4	0	111.6	A779 Y780 E795 A796 Y799	A779-K801 HydrophobicContact CB-CB 3.7Å; A779-K801 HydrophobicContact CB-CD 3.69Å; A779-K801 HydrophobicContact CB-CG 3.65Å; Y780-K801 VanDerWaalsContact O-CA 3.25Å; Y780-K801 WeakPolarHBondContact O-CA 3.34Å; E795-K801 HydrophobicContact CG-CB 4.44Å; E795-K801 PolarHBondContact O-N 3.22Å; A796-K801 VanDerWaalsContact CA-O 3.25Å; A796-K801 WeakPolarHBondContact CA-O 3.44Å; A796-K801 VanDerWaalsContact CB-O 3.3Å; A796-K801 WeakPolarHBondContact CB-O 3.49Å; A796-K801 PolarHBondContact N-O 2.73Å; Y799-K801 PolarHBondContact O-N 3.21Å; Y799-K801 VanDerWaalsContact O-N 3.11Å
802	F	83.8	Confident	89.6	Confident	14 Å²	14	24.8 Å²	24.8	6%	0.061	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-116.1	153.8	176.6	-44.2	-113	0	0	0	112	V744 R746 Y780 I787 T792 A796 R800 S806	V744-F802 HydrophobicContact CG1-CB 4.13Å; R746-F802 HydrophobicContact CB-CD1 4.04Å; R746-F802 HydrophobicContact CB-CE1 4.26Å; R746-F802 HydrophobicContact CG-CB 4.34Å; R746-F802 HydrophobicContact CG-CD1 4.01Å; R746-F802 HydrophobicContact CG-CG 4.23Å; Y780-F802 WeakPolarHBondContact CD1-O 3.07Å; Y780-F802 HydrophobicContact CE1-CB 3.74Å; Y780-F802 HydrophobicContact CE1-CD2 4.45Å; Y780-F802 WeakPolarHBondContact CE1-O 3.28Å; Y780-F802 HydrophobicContact CE2-CD2 4.17Å; Y780-F802 AromaticContact CZ-CD2 3.66Å; Y780-F802 WeakPolarHBondContact OH-CB 3.3Å; Y780-F802 WeakPolarHBondContact OH-CD2 3.07Å; Y780-F802 WeakPolarHBondContact OH-CG 2.99Å; I787-F802 HydrophobicContact CD1-CZ 4.04Å; T792-F802 HydrophobicContact CG2-CE1 4.33Å; A796-F802 HydrophobicContact CB-CD1 3.77Å; A796-F802 HydrophobicContact CB-CE1 3.77Å; A796-F802 HydrophobicContact CB-CG 4.15Å; A796-F802 HydrophobicContact CB-CZ 4.16Å; R800-F802 WeakPolarHBondContact O-CD2 3.49Å; R800-F802 WeakPolarHBondContact O-CE2 3.47Å; F802-S806 WeakPolarHBondContact CA-OG 3.38Å
803	S	89	Confident	90	Very high	15 Å²	15	24.7 Å²	24.7	11%	0.105	13%	0.126	C	C	.	.			trans	-163.6	174.6	-177.4	60.1	0	0	0	0	109.9	A805 S806 D807	S803-A805 PolarHBondContact O-N 2.84Å; S803-A805 VanDerWaalsContact O-N 3.13Å; S803-A805 PolarHBondContact OG-N 2.76Å; S803-S806 PolarHBondContact N-OG 3.2Å; S803-S806 PolarHBondContact O-N 3.41Å; S803-S806 PolarHBondContact O-OG 3.17Å; S803-S806 PolarHBondContact OG-N 3.43Å; S803-D807 PolarHBondContact O-N 3.14Å; S803-D807 VanDerWaalsContact O-N 3.15Å
804	S	91.8	Very high	90.2	Very high	29 Å²	29	24.6 Å²	24.6	20%	0.203	13%	0.126	C	C	.	.	H	α-helix	trans	-56	-28.7	169.8	-54.8	0	0	0	0	112.8	S739 D807 A808	S739-S804 WeakPolarHBondContact OG-CB 3.35Å; S739-S804 PolarHBondContact OG-OG 2.93Å; S804-D807 PolarHBondContact O-N 3.3Å; S804-A808 PolarHBondContact O-N 3.25Å
805	A	94.6	Very high	90.5	Very high	24 Å²	24	24.2 Å²	24.2	20%	0.198	12%	0.123	C	C	.	.	H	α-helix	trans	-74.1	-28.7	176	0	0	0	0	0	113.2	S803 A808 W809 R866 R869	S803-A805 PolarHBondContact O-N 2.84Å; S803-A805 VanDerWaalsContact O-N 3.13Å; S803-A805 PolarHBondContact OG-N 2.76Å; A805-A808 PolarHBondContact O-N 3.42Å; A805-W809 PolarHBondContact O-N 3.49Å; A805-R866 HydrophobicContact CB-CB 4.07Å; A805-R866 WeakPolarHBondContact CB-O 3.49Å; A805-R869 VanDerWaalsContact O-CD 3.28Å; A805-R869 WeakPolarHBondContact O-CD 3.05Å; A805-R869 PolarHBondContact O-NH1 2.95Å
806	S	94.3	Very high	90.9	Very high	3 Å²	3	23.2 Å²	23.2	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-73	-34.4	170.8	64.6	0	0	0	0	111.2	F802 S803 A808 W809 S810	F802-S806 WeakPolarHBondContact CA-OG 3.38Å; S803-S806 PolarHBondContact N-OG 3.2Å; S803-S806 PolarHBondContact O-N 3.41Å; S803-S806 PolarHBondContact O-OG 3.17Å; S803-S806 PolarHBondContact OG-N 3.43Å; S806-A808 VanDerWaalsContact C-N 3.32Å; S806-W809 WeakPolarHBondContact O-CB 3.45Å; S806-W809 PolarHBondContact O-N 3.29Å; S806-S810 PolarHBondContact O-N 3.02Å; S806-S810 PolarHBondContact O-OG 3.4Å
807	D	95.3	Very high	91.4	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.011	12%	0.12	C	C	.	.	H	α-helix	trans	-67.5	-32.1	171.4	-78.3	-13.3	0	0	0	112.1	M735 V744 H745 R746 S803 S804 W809 S810 Y811 F872	M735-D807 HydrophobicContact CE-CB 3.79Å; M735-D807 WeakPolarHBondContact CE-OD2 3.45Å; V744-D807 WeakPolarHBondContact CA-OD2 3.38Å; V744-D807 WeakPolarHBondContact CG1-OD2 3.41Å; H745-D807 PolarHBondContact N-OD2 3.47Å; R746-D807 PolarHBondContact N-OD1 2.95Å; S803-D807 PolarHBondContact O-N 3.14Å; S803-D807 VanDerWaalsContact O-N 3.15Å; S804-D807 PolarHBondContact O-N 3.3Å; D807-W809 VanDerWaalsContact C-N 3.32Å; D807-W809 PolarHBondContact O-N 3.27Å; D807-S810 WeakPolarHBondContact O-CB 3.49Å; D807-S810 PolarHBondContact O-N 2.87Å; D807-Y811 WeakPolarHBondContact O-CB 3.44Å; D807-Y811 PolarHBondContact O-N 3.3Å; D807-F872 HydrophobicContact CB-CE2 3.99Å; D807-F872 HydrophobicContact CB-CZ 4.08Å
808	A	97.8	Very high	92	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.008	11%	0.113	C	C	.	.	H	α-helix	trans	-63.3	-37.3	172.9	0	0	0	0	0	112.1	S804 A805 S806 Y811 G812 C861 F872	S804-A808 PolarHBondContact O-N 3.25Å; A805-A808 PolarHBondContact O-N 3.42Å; S806-A808 VanDerWaalsContact C-N 3.32Å; A808-Y811 WeakPolarHBondContact O-CB 3.37Å; A808-Y811 PolarHBondContact O-N 3.1Å; A808-G812 PolarHBondContact O-N 3.49Å; A808-C861 WeakPolarHBondContact O-CB 3.4Å; A808-F872 HydrophobicContact CB-CE2 4.5Å; A808-F872 HydrophobicContact CB-CZ 4.38Å
809	W	97.8	Very high	92.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61	-49	170.7	175.9	-74	0	0	0	111.4	T792 A793 P794 A805 S806 D807 Y811 G812 I813 I838 C861 W862	T792-W809 PolarHBondContact O-NE1 2.9Å; A793-W809 HydrophobicContact CB-CB 3.79Å; A793-W809 HydrophobicContact CB-CD2 4.14Å; A793-W809 HydrophobicContact CB-CG 3.77Å; P794-W809 HydrophobicContact CG-CE3 4.39Å; P794-W809 HydrophobicContact CG-CH2 3.69Å; P794-W809 HydrophobicContact CG-CZ2 4.21Å; P794-W809 HydrophobicContact CG-CZ3 3.78Å; A805-W809 PolarHBondContact O-N 3.49Å; S806-W809 WeakPolarHBondContact O-CB 3.45Å; S806-W809 PolarHBondContact O-N 3.29Å; D807-W809 VanDerWaalsContact C-N 3.32Å; D807-W809 PolarHBondContact O-N 3.27Å; W809-Y811 VanDerWaalsContact C-N 3.25Å; W809-Y811 PolarHBondContact O-N 2.81Å; W809-G812 WeakPolarHBondContact O-CA 3.49Å; W809-G812 PolarHBondContact O-N 2.99Å; W809-I813 PolarHBondContact O-N 3.25Å; W809-I838 HydrophobicContact CH2-CG2 3.86Å; W809-I838 HydrophobicContact CZ2-CD1 4.28Å; W809-I838 HydrophobicContact CZ2-CG1 4.46Å; W809-I838 HydrophobicContact CZ2-CG2 3.89Å; W809-C861 WeakPolarHBondContact CA-O 3.27Å; W809-W862 AromaticContact CD2-CD1 3.78Å; W809-W862 AromaticContact CE2-CD1 3.87Å; W809-W862 HydrophobicContact CE3-CB 4.11Å; W809-W862 HydrophobicContact CH2-CB 4.12Å; W809-W862 VanDerWaalsContact CZ3-C 3.46Å; W809-W862 HydrophobicContact CZ3-CB 3.9Å; W809-W862 WeakPolarHBondContact CZ3-O 3.3Å; W809-W862 PolarHBondContact O-NE1 3.45Å
810	S	97.7	Very high	93.1	Very high	6 Å²	6	13.5 Å²	13.5	4%	0.042	7%	0.07	C	C	.	.	H	α-helix	trans	-59.5	-38.3	176.8	-55.6	0	0	0	0	111.6	L748 W791 S806 D807 G812 I813 V814	L748-S810 WeakPolarHBondContact O-CB 3.48Å; W791-S810 WeakPolarHBondContact O-CA 3.38Å; W791-S810 WeakPolarHBondContact O-CB 3.49Å; W791-S810 PolarHBondContact O-OG 3.06Å; S806-S810 PolarHBondContact O-N 3.02Å; S806-S810 PolarHBondContact O-OG 3.4Å; D807-S810 WeakPolarHBondContact O-CB 3.49Å; D807-S810 PolarHBondContact O-N 2.87Å; S810-G812 VanDerWaalsContact C-N 3.34Å; S810-G812 PolarHBondContact O-N 2.82Å; S810-I813 WeakPolarHBondContact O-CB 3.33Å; S810-I813 PolarHBondContact O-N 3.4Å; S810-I813 VanDerWaalsContact O-N 3.11Å; S810-V814 PolarHBondContact O-N 3.28Å
811	Y	98.5	Very high	93.9	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-61.3	-39.9	173.6	180	-97	0	0	0	112.1	L728 I731 A732 L748 D807 A808 W809 I813 V814 M815 F872 I875 L879	L728-Y811 PolarHBondContact O-OH 3.07Å; I731-Y811 HydrophobicContact CB-CE2 4.08Å; I731-Y811 HydrophobicContact CG2-CD2 3.96Å; I731-Y811 HydrophobicContact CG2-CE2 3.81Å; A732-Y811 HydrophobicContact CB-CE2 3.9Å; L748-Y811 HydrophobicContact CD2-CD2 4.3Å; D807-Y811 WeakPolarHBondContact O-CB 3.44Å; D807-Y811 PolarHBondContact O-N 3.3Å; A808-Y811 WeakPolarHBondContact O-CB 3.37Å; A808-Y811 PolarHBondContact O-N 3.1Å; W809-Y811 VanDerWaalsContact C-N 3.25Å; W809-Y811 PolarHBondContact O-N 2.81Å; Y811-I813 VanDerWaalsContact C-N 3.28Å; Y811-I813 PolarHBondContact O-N 3.47Å; Y811-V814 CarbonylContact O-C 3.58Å; Y811-V814 WeakPolarHBondContact O-CB 3.39Å; Y811-V814 PolarHBondContact O-N 3.21Å; Y811-V814 VanDerWaalsContact O-N 3.13Å; Y811-M815 HydrophobicContact CD1-CG 3.98Å; Y811-M815 HydrophobicContact CD1-SD 3.88Å; Y811-M815 HydrophobicContact CE1-CG 3.51Å; Y811-M815 HydrophobicContact CE1-SD 3.38Å; Y811-M815 WeakPolarHBondContact CE1-SD 3.34Å; Y811-M815 WeakPolarHBondContact O-CG 3.38Å; Y811-M815 PolarHBondContact O-N 3.43Å; Y811-F872 HydrophobicContact CD1-CE1 4.45Å; Y811-F872 HydrophobicContact CD2-CE1 4.11Å; Y811-F872 AromaticContact CG-CE1 3.86Å; Y811-F872 HydrophobicContact CG-CE1 3.86Å; Y811-I875 HydrophobicContact CD1-CD1 3.95Å; Y811-I875 HydrophobicContact CD1-CG2 4.12Å; Y811-I875 HydrophobicContact CE1-CD1 4.31Å; Y811-I875 HydrophobicContact CE1-CG2 3.41Å; Y811-I875 VanDerWaalsContact CE1-CG2 3.41Å; Y811-L879 WeakPolarHBondContact OH-CD1 3.45Å
812	G	97.9	Very high	94.4	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-58.5	-39.3	172.2	0	0	0	0	0	112.7	A808 W809 S810 M815 W816 W862	A808-G812 PolarHBondContact O-N 3.49Å; W809-G812 WeakPolarHBondContact O-CA 3.49Å; W809-G812 PolarHBondContact O-N 2.99Å; S810-G812 VanDerWaalsContact C-N 3.34Å; S810-G812 PolarHBondContact O-N 2.82Å; G812-M815 WeakPolarHBondContact O-CB 3.21Å; G812-M815 PolarHBondContact O-N 3.04Å; G812-W816 PolarHBondContact O-N 3.24Å; G812-W816 VanDerWaalsContact O-N 3.1Å; G812-W862 VanDerWaalsContact C-CZ2 3.46Å; G812-W862 WeakPolarHBondContact O-CZ2 3.27Å
813	I	98.1	Very high	94.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-67.1	-41.1	173.8	-56.4	-68.6	0	0	0	111	W791 W809 S810 Y811 M815 W816 E817 P825 Y826 L844 W862	W791-I813 HydrophobicContact CG-CG2 4.01Å; W809-I813 PolarHBondContact O-N 3.25Å; S810-I813 WeakPolarHBondContact O-CB 3.33Å; S810-I813 PolarHBondContact O-N 3.4Å; S810-I813 VanDerWaalsContact O-N 3.11Å; Y811-I813 VanDerWaalsContact C-N 3.28Å; Y811-I813 PolarHBondContact O-N 3.47Å; I813-M815 VanDerWaalsContact C-N 3.31Å; I813-M815 PolarHBondContact O-N 3.47Å; I813-W816 WeakPolarHBondContact O-CA 3.45Å; I813-W816 WeakPolarHBondContact O-CB 3.4Å; I813-W816 PolarHBondContact O-N 3.25Å; I813-W816 VanDerWaalsContact O-N 3.1Å; I813-E817 WeakPolarHBondContact O-CG 3.11Å; I813-E817 PolarHBondContact O-N 2.96Å; I813-P825 HydrophobicContact CG2-CB 3.84Å; I813-P825 HydrophobicContact CG2-CG 3.59Å; I813-Y826 HydrophobicContact CD1-CE2 4.15Å; I813-L844 HydrophobicContact CD1-CD1 3.83Å; I813-W862 HydrophobicContact CD1-CZ2 3.75Å; I813-W862 HydrophobicContact CG1-CZ2 4.47Å
814	V	98.4	Very high	94.3	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.7	-39.5	173.9	173.9	0	0	0	0	111.6	I731 L748 S810 Y811 W816 E817 V818	I731-V814 HydrophobicContact CD1-CG1 3.97Å; L748-V814 HydrophobicContact CG-CG2 4.16Å; S810-V814 PolarHBondContact O-N 3.28Å; Y811-V814 CarbonylContact O-C 3.58Å; Y811-V814 WeakPolarHBondContact O-CB 3.39Å; Y811-V814 PolarHBondContact O-N 3.21Å; Y811-V814 VanDerWaalsContact O-N 3.13Å; V814-W816 VanDerWaalsContact C-N 3.27Å; V814-W816 PolarHBondContact O-N 3.03Å; V814-E817 PolarHBondContact O-N 2.95Å; V814-V818 HydrophobicContact CG1-CG2 4.31Å; V814-V818 VanDerWaalsContact O-CG2 3.31Å; V814-V818 WeakPolarHBondContact O-CG2 3.15Å; V814-V818 PolarHBondContact O-N 3.47Å
815	M	98.2	Very high	94.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-57.6	-44.1	173	-69.5	179.5	70.5	0	0	111.2	L728 Y811 G812 I813 V818 M819 L854 L857 M858	L728-M815 HydrophobicContact CD1-CB 4.44Å; L728-M815 HydrophobicContact CD1-CE 4.42Å; L728-M815 HydrophobicContact CD1-CG 4.23Å; L728-M815 HydrophobicContact CD2-CB 4.26Å; L728-M815 HydrophobicContact CD2-CG 3.93Å; Y811-M815 HydrophobicContact CD1-CG 3.98Å; Y811-M815 HydrophobicContact CD1-SD 3.88Å; Y811-M815 HydrophobicContact CE1-CG 3.51Å; Y811-M815 HydrophobicContact CE1-SD 3.38Å; Y811-M815 WeakPolarHBondContact CE1-SD 3.34Å; Y811-M815 WeakPolarHBondContact O-CG 3.38Å; Y811-M815 PolarHBondContact O-N 3.43Å; G812-M815 WeakPolarHBondContact O-CB 3.21Å; G812-M815 PolarHBondContact O-N 3.04Å; I813-M815 VanDerWaalsContact C-N 3.31Å; I813-M815 PolarHBondContact O-N 3.47Å; M815-V818 PolarHBondContact O-N 2.79Å; M815-M819 VanDerWaalsContact O-CG 3.31Å; M815-M819 WeakPolarHBondContact O-CG 3.41Å; M815-M819 PolarHBondContact O-N 3.08Å; M815-L854 HydrophobicContact CE-CD2 4.34Å; M815-L857 HydrophobicContact CE-CB 4.05Å; M815-L857 HydrophobicContact CE-CD2 3.63Å; M815-L857 HydrophobicContact CE-CG 3.87Å; M815-L857 HydrophobicContact SD-CD2 4Å; M815-L857 HydrophobicContact SD-CG 4.01Å; M815-M858 HydrophobicContact CB-CE 3.89Å; M815-M858 HydrophobicContact CB-CG 3.79Å; M815-M858 HydrophobicContact CB-SD 4.45Å; M815-M858 HydrophobicContact CE-CG 4.04Å; M815-M858 HydrophobicContact SD-CG 4.16Å
816	W	96.9	Very high	93.6	Very high	4 Å²	4	14.3 Å²	14.3	2%	0.015	7%	0.067	C	C	.	.	H	α-helix	trans	-62.7	-48.2	176	-171.3	93.2	0	0	0	111.5	G812 I813 V814 V818 M819 S820 E823 P825 W827 L844 P845 P847 M858 W862	G812-W816 PolarHBondContact O-N 3.24Å; G812-W816 VanDerWaalsContact O-N 3.1Å; I813-W816 WeakPolarHBondContact O-CA 3.45Å; I813-W816 WeakPolarHBondContact O-CB 3.4Å; I813-W816 PolarHBondContact O-N 3.25Å; I813-W816 VanDerWaalsContact O-N 3.1Å; V814-W816 VanDerWaalsContact C-N 3.27Å; V814-W816 PolarHBondContact O-N 3.03Å; W816-V818 VanDerWaalsContact C-N 3.3Å; W816-V818 PolarHBondContact O-N 3.41Å; W816-M819 PolarHBondContact O-N 3.27Å; W816-S820 VanDerWaalsContact CZ3-OG 3.31Å; W816-S820 WeakPolarHBondContact CZ3-OG 3.5Å; W816-S820 WeakPolarHBondContact O-CB 3.24Å; W816-S820 PolarHBondContact O-N 3.28Å; W816-S820 PolarHBondContact O-OG 2.89Å; W816-E823 HydrophobicContact CH2-CB 3.71Å; W816-E823 HydrophobicContact CZ3-CB 3.8Å; W816-P825 HydrophobicContact CE3-CG 4.44Å; W816-P825 HydrophobicContact CZ3-CG 4.48Å; W816-W827 HydrophobicContact CZ2-CZ2 4.33Å; W816-L844 HydrophobicContact CB-CD1 4.45Å; W816-L844 HydrophobicContact CD2-CD1 3.85Å; W816-L844 HydrophobicContact CE3-CD1 4.24Å; W816-L844 HydrophobicContact CG-CB 4.3Å; W816-L844 HydrophobicContact CG-CD1 3.92Å; W816-P845 PolarHBondContact NE1-O 3.16Å; W816-P847 HydrophobicContact CD2-CG 4.41Å; W816-P847 HydrophobicContact CG-CG 4.18Å; W816-M858 HydrophobicContact CB-SD 4.21Å; W816-W862 HydrophobicContact CB-CH2 4.06Å; W816-W862 HydrophobicContact CB-CZ2 4.1Å; W816-W862 HydrophobicContact CG-CH2 4.34Å
817	E	97.4	Very high	93.2	Very high	9 Å²	9	18.4 Å²	18.4	4%	0.042	8%	0.082	C	C	.	.	H	α-helix	trans	-56.4	-40.9	176.4	-70.1	179.3	118.4	0	0	112.2	A750 W791 I813 V814 S820 Y821 G822 P825	A750-E817 HydrophobicContact CB-CB 4.03Å; A750-E817 HydrophobicContact CB-CG 4.48Å; A750-E817 WeakPolarHBondContact CB-OE2 3.38Å; A750-E817 PolarHBondContact N-OE2 3.38Å; W791-E817 WeakPolarHBondContact CZ2-OE1 3.44Å; W791-E817 PolarHBondContact NE1-OE1 2.95Å; W791-E817 PolarHBondContact NE1-OE2 2.97Å; I813-E817 WeakPolarHBondContact O-CG 3.11Å; I813-E817 PolarHBondContact O-N 2.96Å; V814-E817 PolarHBondContact O-N 2.95Å; E817-S820 PolarHBondContact O-OG 3.41Å; E817-Y821 PolarHBondContact O-N 3.24Å; E817-G822 PolarHBondContact O-N 3.4Å; E817-P825 HydrophobicContact CG-CG 3.77Å
818	V	96.4	Very high	92.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68.1	-43.1	178.5	172.6	0	0	0	0	111.5	L708 L712 L724 L728 V814 M815 W816 S820 Y821	L708-V818 HydrophobicContact CD2-CG2 3.81Å; L712-V818 HydrophobicContact CD1-CB 4.37Å; L712-V818 HydrophobicContact CD1-CG2 4.09Å; L724-V818 HydrophobicContact CB-CG1 4.01Å; L724-V818 HydrophobicContact CD2-CG1 3.96Å; L724-V818 HydrophobicContact CG-CG1 4.47Å; L728-V818 HydrophobicContact CD1-CG1 4.46Å; L728-V818 HydrophobicContact CD2-CB 3.78Å; L728-V818 HydrophobicContact CD2-CG1 4.04Å; L728-V818 HydrophobicContact CD2-CG2 3.68Å; L728-V818 HydrophobicContact CG-CB 4.31Å; L728-V818 HydrophobicContact CG-CG1 4.04Å; V814-V818 HydrophobicContact CG1-CG2 4.31Å; V814-V818 VanDerWaalsContact O-CG2 3.31Å; V814-V818 WeakPolarHBondContact O-CG2 3.15Å; V814-V818 PolarHBondContact O-N 3.47Å; M815-V818 PolarHBondContact O-N 2.79Å; W816-V818 VanDerWaalsContact C-N 3.3Å; W816-V818 PolarHBondContact O-N 3.41Å; V818-S820 VanDerWaalsContact C-N 3.3Å; V818-S820 PolarHBondContact O-N 3.22Å; V818-Y821 PolarHBondContact O-N 3.24Å
819	M	91.7	Very high	90.9	Very high	9 Å²	9	27.5 Å²	27.5	4%	0.044	13%	0.125	C	C	.	.	H	α-helix	trans	-74.7	-20.7	-179.5	-66.5	-55	-57.5	0	0	113.1	L724 M815 W816 P847 C850 L854 M858	L724-M819 HydrophobicContact CB-SD 4.18Å; L724-M819 HydrophobicContact CD1-CE 4.36Å; L724-M819 HydrophobicContact CD1-SD 4.03Å; M815-M819 VanDerWaalsContact O-CG 3.31Å; M815-M819 WeakPolarHBondContact O-CG 3.41Å; M815-M819 PolarHBondContact O-N 3.08Å; W816-M819 PolarHBondContact O-N 3.27Å; M819-P847 HydrophobicContact CB-CB 4.27Å; M819-P847 HydrophobicContact CB-CG 3.94Å; M819-C850 HydrophobicContact CE-CB 4.28Å; M819-L854 HydrophobicContact CE-CD1 4.11Å; M819-L854 HydrophobicContact SD-CD1 3.8Å; M819-M858 HydrophobicContact CB-CE 4.09Å; M819-M858 HydrophobicContact CG-CE 3.66Å
820	S	87.9	Confident	89.3	Confident	12 Å²	12	29.9 Å²	29.9	8%	0.084	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	14.8	173.6	66	0	0	0	0	113.5	W816 E817 V818 G822 E823	W816-S820 VanDerWaalsContact CZ3-OG 3.31Å; W816-S820 WeakPolarHBondContact CZ3-OG 3.5Å; W816-S820 WeakPolarHBondContact O-CB 3.24Å; W816-S820 PolarHBondContact O-N 3.28Å; W816-S820 PolarHBondContact O-OG 2.89Å; E817-S820 PolarHBondContact O-OG 3.41Å; V818-S820 VanDerWaalsContact C-N 3.3Å; V818-S820 PolarHBondContact O-N 3.22Å; S820-G822 PolarHBondContact O-N 2.96Å; S820-G822 VanDerWaalsContact O-N 3.16Å; S820-E823 WeakPolarHBondContact O-CG 3.17Å; S820-E823 PolarHBondContact O-N 3.43Å
821	Y	89.2	Confident	87.9	Confident	31 Å²	31	33.4 Å²	33.4	12%	0.122	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	36.2	179.6	-71.4	-96.6	0	0	0	114.8	L712 R713 H715 D716 F719 L724 E817 V818	L712-Y821 CarbonylContact C-O 3.47Å; L712-Y821 HydrophobicContact CD2-CD1 4.32Å; R713-Y821 WeakPolarHBondContact CA-O 3.34Å; R713-Y821 WeakPolarHBondContact CG-O 3.4Å; R713-Y821 PolarHBondContact N-O 2.85Å; H715-Y821 WeakPolarHBondContact O-CE1 3.04Å; D716-Y821 VanDerWaalsContact OD1-CB 3.24Å; D716-Y821 WeakPolarHBondContact OD1-CB 3.06Å; D716-Y821 VanDerWaalsContact OD1-CG 3.26Å; F719-Y821 HydrophobicContact CB-CE1 4.42Å; F719-Y821 AromaticContact CD2-CE1 3.88Å; F719-Y821 HydrophobicContact CD2-CE1 3.88Å; F719-Y821 PolarHBondContact O-OH 3.3Å; L724-Y821 HydrophobicContact CD1-CE2 4.17Å; E817-Y821 PolarHBondContact O-N 3.24Å; V818-Y821 PolarHBondContact O-N 3.24Å
822	G	88.9	Confident	86.3	Confident	12 Å²	12	39 Å²	39	12%	0.124	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	23.8	175	0	0	0	0	0	114.3	E817 S820	E817-G822 PolarHBondContact O-N 3.4Å; S820-G822 PolarHBondContact O-N 2.96Å; S820-G822 VanDerWaalsContact O-N 3.16Å
823	E	86.8	Confident	84.9	Confident	97 Å²	97	42.4 Å²	42.4	45%	0.453	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-57.3	154.2	165.7	-77.7	-171	-170.9	0	0	111.6	W816 S820 P825 W827	W816-E823 HydrophobicContact CH2-CB 3.71Å; W816-E823 HydrophobicContact CZ3-CB 3.8Å; S820-E823 WeakPolarHBondContact O-CG 3.17Å; S820-E823 PolarHBondContact O-N 3.43Å; E823-P825 WeakPolarHBondContact O-CD 3.3Å; E823-W827 PolarHBondContact OE2-NE1 3.15Å; E823-W827 VanDerWaalsContact OE2-NE1 3.16Å
824	R	84.8	Confident	83.5	Confident	113 Å²	113	42.4 Å²	42.4	43%	0.426	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-74.4	122.8	178.5	-176.8	177.9	175.1	-170	-6.8	110.7	Y826 W827 E828	R824-Y826 PolarHBondContact O-N 3.34Å; R824-W827 WeakPolarHBondContact CD-O 3.36Å; R824-W827 PolarHBondContact NE-O 3.5Å; R824-W827 PolarHBondContact O-N 3.06Å; R824-E828 IonicContact CZ-OE2 2.72Å; R824-E828 VanDerWaalsContact NH1-CD 3.29Å; R824-E828 IonicContact NH1-OE1 3.4Å; R824-E828 PolarHBondContact NH1-OE1 2.78Å; R824-E828 VanDerWaalsContact NH1-OE1 3.1Å; R824-E828 IonicContact NH1-OE2 2.66Å; R824-E828 PolarHBondContact NH1-OE2 3.07Å
825	P	88.5	Confident	82.3	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.006	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	131.6	176.4	-26.5	35.9	0	0	0	112.1	R790 W791 I813 W816 E817 E823 W827 L844	R790-P825 HydrophobicContact CB-CB 4.31Å; R790-P825 WeakPolarHBondContact CD-O 3.36Å; R790-P825 PolarHBondContact NH1-O 3.13Å; W791-P825 HydrophobicContact CZ2-CG 3.84Å; I813-P825 HydrophobicContact CG2-CB 3.84Å; I813-P825 HydrophobicContact CG2-CG 3.59Å; W816-P825 HydrophobicContact CE3-CG 4.44Å; W816-P825 HydrophobicContact CZ3-CG 4.48Å; E817-P825 HydrophobicContact CG-CG 3.77Å; E823-P825 WeakPolarHBondContact O-CD 3.3Å; P825-W827 PolarHBondContact O-N 2.91Å; P825-L844 HydrophobicContact CB-CD1 4.21Å
826	Y	82.3	Confident	80.9	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	19	-174.6	-53.3	-89	0	0	0	114.4	R790 I813 R824 E828 M829 V834 I838 Y842 L844	R790-Y826 HydrophobicContact CB-CD2 4.24Å; R790-Y826 HydrophobicContact CG-CD2 4.4Å; I813-Y826 HydrophobicContact CD1-CE2 4.15Å; R824-Y826 PolarHBondContact O-N 3.34Å; Y826-E828 PolarHBondContact O-N 3.47Å; Y826-M829 HydrophobicContact CD1-SD 4.32Å; Y826-M829 WeakPolarHBondContact O-CB 3.48Å; Y826-M829 WeakPolarHBondContact O-CG 3.28Å; Y826-M829 PolarHBondContact O-N 3.39Å; Y826-V834 HydrophobicContact CD1-CG1 4.36Å; Y826-V834 HydrophobicContact CD1-CG2 4.43Å; Y826-V834 HydrophobicContact CD2-CG1 3.82Å; Y826-V834 HydrophobicContact CD2-CG2 4.3Å; Y826-V834 HydrophobicContact CE2-CG1 4.02Å; Y826-V834 HydrophobicContact CG-CG1 4.01Å; Y826-V834 HydrophobicContact CG-CG2 3.88Å; Y826-I838 HydrophobicContact CE1-CG1 4.22Å; Y826-I838 HydrophobicContact CE2-CD1 4.26Å; Y826-Y842 HydrophobicContact CD1-CD1 4.23Å; Y826-Y842 AromaticContact CD1-CE1 3.93Å; Y826-Y842 HydrophobicContact CD1-CE1 3.93Å; Y826-Y842 AromaticContact CE1-CD1 3.93Å; Y826-Y842 HydrophobicContact CE1-CD1 3.93Å; Y826-Y842 AromaticContact CE1-CE1 3.95Å; Y826-Y842 HydrophobicContact CE1-CE1 3.95Å; Y826-L844 HydrophobicContact CD1-CD2 3.68Å; Y826-L844 HydrophobicContact CD1-CG 4.22Å; Y826-L844 HydrophobicContact CD2-CD1 4.39Å; Y826-L844 HydrophobicContact CD2-CD2 4.26Å; Y826-L844 HydrophobicContact CD2-CG 4.5Å; Y826-L844 HydrophobicContact CE1-CD2 3.89Å; Y826-L844 HydrophobicContact CE1-CG 3.91Å; Y826-L844 HydrophobicContact CE2-CD1 4.1Å; Y826-L844 HydrophobicContact CE2-CD2 4.45Å; Y826-L844 HydrophobicContact CE2-CG 4.22Å; Y826-L844 HydrophobicContact CG-CD2 3.86Å; Y826-L844 HydrophobicContact CG-CG 4.49Å
827	W	86.9	Confident	79.8	Confident	89 Å²	89	49.4 Å²	49.4	34%	0.337	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	-128.6	174.7	-49.2	-69.4	0	0	0	112.8	R790 W816 E823 R824 P825 P845	R790-W827 PolarHBondContact NH1-O 2.05Å; W816-W827 HydrophobicContact CZ2-CZ2 4.33Å; E823-W827 PolarHBondContact OE2-NE1 3.15Å; E823-W827 VanDerWaalsContact OE2-NE1 3.16Å; R824-W827 WeakPolarHBondContact CD-O 3.36Å; R824-W827 PolarHBondContact NE-O 3.5Å; R824-W827 PolarHBondContact O-N 3.06Å; P825-W827 PolarHBondContact O-N 2.91Å; W827-P845 HydrophobicContact CH2-CG 3.79Å; W827-P845 HydrophobicContact CZ2-CG 4.37Å
828	E	76.4	Confident	79	Confident	146 Å²	146	49.1 Å²	49.1	68%	0.682	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	6.6	-175.3	-59.8	-48.8	128.1	0	0	114.8	R824 Y826 S830	R824-E828 IonicContact CZ-OE2 2.72Å; R824-E828 VanDerWaalsContact NH1-CD 3.29Å; R824-E828 IonicContact NH1-OE1 3.4Å; R824-E828 PolarHBondContact NH1-OE1 2.78Å; R824-E828 VanDerWaalsContact NH1-OE1 3.1Å; R824-E828 IonicContact NH1-OE2 2.66Å; R824-E828 PolarHBondContact NH1-OE2 3.07Å; Y826-E828 PolarHBondContact O-N 3.47Å; E828-S830 PolarHBondContact O-N 2.91Å
829	M	69	Low	78.2	Confident	48 Å²	48	53.1 Å²	53.1	24%	0.236	26%	0.26	C	S	.	.			trans	-55.6	141	173	-68.3	175.5	65.8	0	0	110.6	R790 Y826 D833 V834 S837	R790-M829 PolarHBondContact NH1-O 3.47Å; R790-M829 PolarHBondContact NH2-O 2.85Å; Y826-M829 HydrophobicContact CD1-SD 4.32Å; Y826-M829 WeakPolarHBondContact O-CB 3.48Å; Y826-M829 WeakPolarHBondContact O-CG 3.28Å; Y826-M829 PolarHBondContact O-N 3.39Å; M829-D833 HydrophobicContact CB-CB 4.28Å; M829-D833 HydrophobicContact CE-CB 3.93Å; M829-D833 WeakPolarHBondContact CE-O 3.27Å; M829-V834 HydrophobicContact CB-CG2 3.78Å; M829-V834 HydrophobicContact CE-CG2 4.31Å; M829-S837 WeakPolarHBondContact CE-OG 3.31Å
830	S	64.2	Low	77.5	Confident	51 Å²	51	58.6 Å²	58.6	36%	0.357	29%	0.286	S	S	.	.			trans	-67.7	160	174	78.8	0	0	0	0	110.7	E828 Q832 D833 V834	E828-S830 PolarHBondContact O-N 2.91Å; S830-Q832 PolarHBondContact O-N 2.86Å; S830-Q832 PolarHBondContact OG-N 3.25Å; S830-D833 VanDerWaalsContact CB-OD2 3.29Å; S830-D833 WeakPolarHBondContact CB-OD2 3.23Å; S830-D833 PolarHBondContact N-OD2 3.48Å; S830-D833 PolarHBondContact O-N 3.06Å; S830-D833 VanDerWaalsContact O-N 3.12Å; S830-D833 PolarHBondContact OG-N 2.94Å; S830-D833 VanDerWaalsContact OG-N 3.16Å; S830-D833 PolarHBondContact OG-OD2 2.81Å; S830-V834 WeakPolarHBondContact O-CG2 3.29Å; S830-V834 PolarHBondContact O-N 3.5Å
831	N	67.9	Low	77	Confident	80 Å²	80	60.2 Å²	60.2	43%	0.428	30%	0.304	S	S	.	.	H	α-helix	trans	-59.1	-29.5	175.6	-74.2	-7.9	0	0	0	112	I789 R790 I835	I789-N831 HydrophobicContact CB-CB 4.27Å; I789-N831 HydrophobicContact CG1-CB 4.24Å; I789-N831 HydrophobicContact CG2-CB 4.2Å; R790-N831 PolarHBondContact NE-OD1 3.26Å; N831-I835 WeakPolarHBondContact O-CD1 3.4Å; N831-I835 VanDerWaalsContact O-CG1 3.23Å; N831-I835 WeakPolarHBondContact O-CG1 3.31Å; N831-I835 PolarHBondContact O-N 3.27Å
832	Q	64.8	Low	76.6	Confident	116 Å²	116	63 Å²	63	54%	0.542	32%	0.315	S	S	.	.	H	α-helix	trans	-68.6	-44.5	175.8	-173.6	62.1	29.6	0	0	111.3	S830 V834 I835 L836	S830-Q832 PolarHBondContact O-N 2.86Å; S830-Q832 PolarHBondContact OG-N 3.25Å; Q832-V834 VanDerWaalsContact C-N 3.3Å; Q832-V834 PolarHBondContact O-N 3.48Å; Q832-I835 PolarHBondContact O-N 3.5Å; Q832-L836 HydrophobicContact CG-CD1 4.41Å; Q832-L836 WeakPolarHBondContact O-CG 3.31Å; Q832-L836 PolarHBondContact O-N 2.99Å
833	D	67.4	Low	76.5	Confident	73 Å²	73	64.5 Å²	64.5	39%	0.39	32%	0.317	S	S	.	.	H	α-helix	trans	-66.2	-35.4	178.7	-56.2	-42.5	0	0	0	111.5	M829 S830 L836 S837	M829-D833 HydrophobicContact CB-CB 4.28Å; M829-D833 HydrophobicContact CE-CB 3.93Å; M829-D833 WeakPolarHBondContact CE-O 3.27Å; S830-D833 VanDerWaalsContact CB-OD2 3.29Å; S830-D833 WeakPolarHBondContact CB-OD2 3.23Å; S830-D833 PolarHBondContact N-OD2 3.48Å; S830-D833 PolarHBondContact O-N 3.06Å; S830-D833 VanDerWaalsContact O-N 3.12Å; S830-D833 PolarHBondContact OG-N 2.94Å; S830-D833 VanDerWaalsContact OG-N 3.16Å; S830-D833 PolarHBondContact OG-OD2 2.81Å; D833-L836 PolarHBondContact O-N 2.94Å; D833-S837 VanDerWaalsContact O-CB 3.27Å; D833-S837 WeakPolarHBondContact O-CB 3.28Å; D833-S837 PolarHBondContact O-N 2.87Å; D833-S837 PolarHBondContact O-OG 2.87Å
834	V	70	Confident	76.3	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-46.4	174.9	172.3	0	0	0	0	110.8	I789 R790 Y826 M829 S830 Q832 L836 S837 I838	I789-V834 HydrophobicContact CG2-CG1 4.36Å; R790-V834 HydrophobicContact CG-CG1 4.42Å; R790-V834 HydrophobicContact CG-CG2 4.46Å; Y826-V834 HydrophobicContact CD1-CG1 4.36Å; Y826-V834 HydrophobicContact CD1-CG2 4.43Å; Y826-V834 HydrophobicContact CD2-CG1 3.82Å; Y826-V834 HydrophobicContact CD2-CG2 4.3Å; Y826-V834 HydrophobicContact CE2-CG1 4.02Å; Y826-V834 HydrophobicContact CG-CG1 4.01Å; Y826-V834 HydrophobicContact CG-CG2 3.88Å; M829-V834 HydrophobicContact CB-CG2 3.78Å; M829-V834 HydrophobicContact CE-CG2 4.31Å; S830-V834 WeakPolarHBondContact O-CG2 3.29Å; S830-V834 PolarHBondContact O-N 3.5Å; Q832-V834 VanDerWaalsContact C-N 3.3Å; Q832-V834 PolarHBondContact O-N 3.48Å; V834-L836 PolarHBondContact O-N 2.88Å; V834-S837 PolarHBondContact O-N 2.88Å; V834-I838 HydrophobicContact CG1-CD1 3.66Å; V834-I838 HydrophobicContact CG1-CG1 4.37Å; V834-I838 WeakPolarHBondContact O-CB 3.39Å; V834-I838 VanDerWaalsContact O-CG1 3.27Å; V834-I838 WeakPolarHBondContact O-CG1 3.34Å; V834-I838 PolarHBondContact O-N 2.9Å
835	I	72.2	Confident	76	Confident	43 Å²	43	57.4 Å²	57.4	22%	0.221	29%	0.294	C	S	.	.	H	α-helix	trans	-59.2	-49.7	177.7	-67.2	165.3	0	0	0	110.3	I789 I797 N831 Q832 S837 I838 E839	I789-I835 HydrophobicContact CD1-CD1 4.22Å; I789-I835 HydrophobicContact CG2-CD1 4.01Å; I789-I835 HydrophobicContact CG2-CG1 3.63Å; I797-I835 HydrophobicContact CD1-CG1 4.43Å; I797-I835 HydrophobicContact CG2-CD1 4.09Å; I797-I835 HydrophobicContact CG2-CG1 4.02Å; I797-I835 HydrophobicContact CG2-CG2 4.29Å; N831-I835 WeakPolarHBondContact O-CD1 3.4Å; N831-I835 VanDerWaalsContact O-CG1 3.23Å; N831-I835 WeakPolarHBondContact O-CG1 3.31Å; N831-I835 PolarHBondContact O-N 3.27Å; Q832-I835 PolarHBondContact O-N 3.5Å; I835-S837 PolarHBondContact O-N 3.45Å; I835-I838 PolarHBondContact O-N 3.19Å; I835-E839 PolarHBondContact O-N 3.33Å; I835-E839 VanDerWaalsContact O-N 3.08Å
836	L	69.1	Low	75.3	Confident	86 Å²	86	58.8 Å²	58.8	45%	0.45	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-44.7	179.2	-68.9	172.2	0	0	0	111.7	Q832 D833 V834 E839 E840	Q832-L836 HydrophobicContact CG-CD1 4.41Å; Q832-L836 WeakPolarHBondContact O-CG 3.31Å; Q832-L836 PolarHBondContact O-N 2.99Å; D833-L836 PolarHBondContact O-N 2.94Å; V834-L836 PolarHBondContact O-N 2.88Å; L836-E839 PolarHBondContact O-N 3.42Å; L836-E840 WeakPolarHBondContact O-CB 3.38Å; L836-E840 WeakPolarHBondContact O-CG 3.46Å; L836-E840 PolarHBondContact O-N 3.05Å
837	S	75	Confident	75.3	Confident	22 Å²	22	59.5 Å²	59.5	15%	0.154	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-41.7	-178.3	-56.4	0	0	0	0	111.9	M829 D833 V834 I835 E839 E840 G841 Y842	M829-S837 WeakPolarHBondContact CE-OG 3.31Å; D833-S837 VanDerWaalsContact O-CB 3.27Å; D833-S837 WeakPolarHBondContact O-CB 3.28Å; D833-S837 PolarHBondContact O-N 2.87Å; D833-S837 PolarHBondContact O-OG 2.87Å; V834-S837 PolarHBondContact O-N 2.88Å; I835-S837 PolarHBondContact O-N 3.45Å; S837-E839 VanDerWaalsContact C-N 3.32Å; S837-E839 PolarHBondContact O-N 2.9Å; S837-E840 CarbonylContact O-C 3.55Å; S837-E840 PolarHBondContact O-N 2.84Å; S837-G841 PolarHBondContact O-N 3.37Å; S837-Y842 WeakPolarHBondContact O-CB 3.44Å; S837-Y842 PolarHBondContact O-N 2.92Å
838	I	80.3	Confident	74.6	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.015	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-42.2	176.3	-72.3	170.5	0	0	0	111	P794 W809 Y826 V834 I835 G841 R843	P794-I838 HydrophobicContact CB-CG2 4.33Å; P794-I838 HydrophobicContact CG-CG2 3.67Å; W809-I838 HydrophobicContact CH2-CG2 3.86Å; W809-I838 HydrophobicContact CZ2-CD1 4.28Å; W809-I838 HydrophobicContact CZ2-CG1 4.46Å; W809-I838 HydrophobicContact CZ2-CG2 3.89Å; Y826-I838 HydrophobicContact CE1-CG1 4.22Å; Y826-I838 HydrophobicContact CE2-CD1 4.26Å; V834-I838 HydrophobicContact CG1-CD1 3.66Å; V834-I838 HydrophobicContact CG1-CG1 4.37Å; V834-I838 WeakPolarHBondContact O-CB 3.39Å; V834-I838 VanDerWaalsContact O-CG1 3.27Å; V834-I838 WeakPolarHBondContact O-CG1 3.34Å; V834-I838 PolarHBondContact O-N 2.9Å; I835-I838 PolarHBondContact O-N 3.19Å; I838-G841 PolarHBondContact O-N 3.27Å; I838-G841 VanDerWaalsContact O-N 3.12Å; I838-R843 PolarHBondContact O-NH1 3.19Å
839	E	78.3	Confident	74.2	Confident	83 Å²	83	57.5 Å²	57.5	39%	0.388	32%	0.315	S	S	.	.	H	α-helix	trans	-63.9	-39.9	175.7	-82	-64.4	165.3	0	0	112.6	I835 L836 S837 G841 K864	I835-E839 PolarHBondContact O-N 3.33Å; I835-E839 VanDerWaalsContact O-N 3.08Å; L836-E839 PolarHBondContact O-N 3.42Å; S837-E839 VanDerWaalsContact C-N 3.32Å; S837-E839 PolarHBondContact O-N 2.9Å; E839-G841 PolarHBondContact O-N 3.27Å; E839-G841 VanDerWaalsContact O-N 3.17Å; E839-K864 PolarHBondContact O-NZ 2.97Å; E839-K864 IonicContact OE2-NZ 2.69Å; E839-K864 PolarHBondContact OE2-NZ 3.41Å
840	E	78.5	Confident	74.7	Confident	125 Å²	125	55.4 Å²	55.4	58%	0.584	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-0.7	173.1	-72	-177.8	174.7	0	0	113	L836 S837 K923	L836-E840 WeakPolarHBondContact O-CB 3.38Å; L836-E840 WeakPolarHBondContact O-CG 3.46Å; L836-E840 PolarHBondContact O-N 3.05Å; S837-E840 CarbonylContact O-C 3.55Å; S837-E840 PolarHBondContact O-N 2.84Å; E840-K923 IonicContact OE1-NZ 2.78Å; E840-K923 PolarHBondContact OE1-NZ 3.36Å; E840-K923 IonicContact OE2-NZ 3.84Å; E840-K923 PolarHBondContact OE2-NZ 3.15Å
841	G	77.6	Confident	75.6	Confident	45 Å²	45	53 Å²	53	46%	0.464	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	1.3	176.5	0	0	0	0	0	114.7	S837 I838 E839 R843	S837-G841 PolarHBondContact O-N 3.37Å; I838-G841 PolarHBondContact O-N 3.27Å; I838-G841 VanDerWaalsContact O-N 3.12Å; E839-G841 PolarHBondContact O-N 3.27Å; E839-G841 VanDerWaalsContact O-N 3.17Å; G841-R843 PolarHBondContact O-N 2.81Å; G841-R843 PolarHBondContact O-NH1 3.49Å
842	Y	79.4	Confident	76	Confident	90 Å²	90	50.8 Å²	50.8	35%	0.353	28%	0.278	S	S	.	.			trans	-63	136.6	175.9	-179.5	-98.3	0	0	0	110.9	Y826 S837	Y826-Y842 HydrophobicContact CD1-CD1 4.23Å; Y826-Y842 AromaticContact CD1-CE1 3.93Å; Y826-Y842 HydrophobicContact CD1-CE1 3.93Å; Y826-Y842 AromaticContact CE1-CD1 3.93Å; Y826-Y842 HydrophobicContact CE1-CD1 3.93Å; Y826-Y842 AromaticContact CE1-CE1 3.95Å; Y826-Y842 HydrophobicContact CE1-CE1 3.95Å; S837-Y842 WeakPolarHBondContact O-CB 3.44Å; S837-Y842 PolarHBondContact O-N 2.92Å
843	R	87.2	Confident	76.7	Confident	43 Å²	43	46.4 Å²	46.4	16%	0.162	26%	0.261	C	S	.	.			trans	-129.4	153.5	174.6	-60.5	-58.8	-179.2	-95.6	-0.7	109.3	I838 G841 L859 W862	I838-R843 PolarHBondContact O-NH1 3.19Å; G841-R843 PolarHBondContact O-N 2.81Å; G841-R843 PolarHBondContact O-NH1 3.49Å; R843-L859 HydrophobicContact CB-CD2 4.13Å; R843-L859 HydrophobicContact CG-CD2 4.5Å; R843-W862 HydrophobicContact CB-CE3 4.08Å; R843-W862 HydrophobicContact CG-CB 4.37Å; R843-W862 PolarHBondContact NE-O 3.02Å; R843-W862 PolarHBondContact NH2-O 2.75Å; R843-W862 VanDerWaalsContact NH2-O 3.14Å
844	L	83.3	Confident	77.6	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.01	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-63.1	135.5	179.9	-70	169	0	0	0	110.4	I813 W816 P825 Y826 H855 W862	I813-L844 HydrophobicContact CD1-CD1 3.83Å; W816-L844 HydrophobicContact CB-CD1 4.45Å; W816-L844 HydrophobicContact CD2-CD1 3.85Å; W816-L844 HydrophobicContact CE3-CD1 4.24Å; W816-L844 HydrophobicContact CG-CB 4.3Å; W816-L844 HydrophobicContact CG-CD1 3.92Å; P825-L844 HydrophobicContact CB-CD1 4.21Å; Y826-L844 HydrophobicContact CD1-CD2 3.68Å; Y826-L844 HydrophobicContact CD1-CG 4.22Å; Y826-L844 HydrophobicContact CD2-CD1 4.39Å; Y826-L844 HydrophobicContact CD2-CD2 4.26Å; Y826-L844 HydrophobicContact CD2-CG 4.5Å; Y826-L844 HydrophobicContact CE1-CD2 3.89Å; Y826-L844 HydrophobicContact CE1-CG 3.91Å; Y826-L844 HydrophobicContact CE2-CD1 4.1Å; Y826-L844 HydrophobicContact CE2-CD2 4.45Å; Y826-L844 HydrophobicContact CE2-CG 4.22Å; Y826-L844 HydrophobicContact CG-CD2 3.86Å; Y826-L844 HydrophobicContact CG-CG 4.49Å; L844-H855 PolarHBondContact O-CE1 3.47Å; L844-W862 HydrophobicContact CB-CH2 3.85Å; L844-W862 HydrophobicContact CB-CZ3 4.15Å; L844-W862 HydrophobicContact CD1-CH2 4.43Å; L844-W862 HydrophobicContact CD1-CZ2 4.4Å
845	P	78.4	Confident	78.4	Confident	59 Å²	59	44 Å²	44	38%	0.383	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-70.6	161.3	176	30.3	-34.9	0	0	0	111.1	W816 W827	W816-P845 PolarHBondContact NE1-O 3.16Å; W827-P845 HydrophobicContact CH2-CG 3.79Å; W827-P845 HydrophobicContact CZ2-CG 4.37Å
846	A	74	Confident	79	Confident	30 Å²	30	46.1 Å²	46.1	25%	0.248	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-56.5	130.6	173	0	0	0	0	0	111.2	C850 H855 V893	A846-C850 HydrophobicContact CB-CB 4.38Å; A846-H855 HydrophobicContact CB-CB 4.15Å; A846-H855 PolarHBondContact N-CE1 3.01Å; A846-H855 VanDerWaalsContact N-CE1 3.3Å; A846-V893 HydrophobicContact CB-CB 4.41Å; A846-V893 HydrophobicContact CB-CG1 4.37Å; A846-V893 HydrophobicContact CB-CG2 3.9Å
847	P	81.4	Confident	79.9	Confident	16 Å²	16	42.3 Å²	42.3	10%	0.104	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-60.9	156.1	168.5	-24.7	36.1	0	0	0	112	W816 M819 G849 C850	W816-P847 HydrophobicContact CD2-CG 4.41Å; W816-P847 HydrophobicContact CG-CG 4.18Å; M819-P847 HydrophobicContact CB-CB 4.27Å; M819-P847 HydrophobicContact CB-CG 3.94Å; P847-G849 PolarHBondContact O-N 3.25Å; P847-C850 HydrophobicContact CB-CB 4.41Å; P847-C850 WeakPolarHBondContact O-CB 3.48Å; P847-C850 PolarHBondContact O-N 3.39Å; P847-C850 VanDerWaalsContact O-N 3.12Å
848	M	71.8	Confident	80.9	Confident	159 Å²	159	41.3 Å²	41.3	78%	0.783	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	136.8	177.2	-66.8	-136.7	-59.2	0	0	110.9	C850	M848-C850 PolarHBondContact O-N 3.16Å
849	G	68.7	Low	81.2	Confident	34 Å²	34	43.4 Å²	43.4	35%	0.351	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	12.5	-177.1	0	0	0	0	0	115.1	P847 P851	P847-G849 PolarHBondContact O-N 3.25Å; G849-P851 WeakPolarHBondContact O-CD 3.47Å
850	C	79.8	Confident	81.8	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.02	24%	0.242	C	C	.	.			trans	-77.3	126.4	176.8	-173.1	0	0	0	0	111.6	M819 A846 P847 M848	M819-C850 HydrophobicContact CE-CB 4.28Å; A846-C850 HydrophobicContact CB-CB 4.38Å; P847-C850 HydrophobicContact CB-CB 4.41Å; P847-C850 WeakPolarHBondContact O-CB 3.48Å; P847-C850 PolarHBondContact O-N 3.39Å; P847-C850 VanDerWaalsContact O-N 3.12Å; M848-C850 PolarHBondContact O-N 3.16Å
851	P	81.9	Confident	82.6	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-61.7	141.6	171.3	-20.8	30	0	0	0	112.6	V721 G849 A853 L854 H855 L889	V721-P851 HydrophobicContact CG1-CG 3.5Å; G849-P851 WeakPolarHBondContact O-CD 3.47Å; P851-A853 VanDerWaalsContact C-N 3.26Å; P851-A853 PolarHBondContact O-N 2.77Å; P851-L854 HydrophobicContact CB-CG 4.45Å; P851-L854 HydrophobicContact CG-CD1 4.07Å; P851-L854 HydrophobicContact CG-CG 4.49Å; P851-L854 PolarHBondContact O-N 3.2Å; P851-H855 PolarHBondContact O-N 2.86Å; P851-L889 HydrophobicContact CB-CB 4.45Å; P851-L889 HydrophobicContact CB-CD2 4.15Å; P851-L889 HydrophobicContact CG-CB 4.26Å; P851-L889 HydrophobicContact CG-CD2 4.1Å
852	V	75.9	Confident	83.5	Confident	35 Å²	35	35.7 Å²	35.7	21%	0.212	19%	0.192	C	C	.	.	H	α-helix	trans	-55.3	-43	-179.6	177.4	0	0	0	0	111.9	L854 H855 Q856 P891 V893 L896	V852-L854 PolarHBondContact O-N 3.39Å; V852-H855 PolarHBondContact O-N 3.37Å; V852-Q856 HydrophobicContact CG1-CG 3.97Å; V852-Q856 WeakPolarHBondContact O-CB 3.39Å; V852-Q856 VanDerWaalsContact O-CG 3.32Å; V852-Q856 WeakPolarHBondContact O-CG 3.37Å; V852-Q856 PolarHBondContact O-N 2.9Å; V852-P891 PolarHBondContact N-O 2.81Å; V852-P891 VanDerWaalsContact N-O 3.08Å; V852-V893 HydrophobicContact CB-CG2 4.4Å; V852-V893 HydrophobicContact CG2-CB 4.2Å; V852-V893 HydrophobicContact CG2-CG2 3.69Å; V852-L896 HydrophobicContact CB-CD1 4.18Å; V852-L896 HydrophobicContact CG1-CD1 4.42Å; V852-L896 HydrophobicContact CG2-CD1 3.58Å
853	A	80.8	Confident	84.2	Confident	23 Å²	23	35 Å²	35	19%	0.19	19%	0.192	C	C	.	.	H	α-helix	trans	-58.2	-36.1	-179.2	0	0	0	0	0	112.9	P851 L857 F878 L882	P851-A853 VanDerWaalsContact C-N 3.26Å; P851-A853 PolarHBondContact O-N 2.77Å; A853-L857 PolarHBondContact O-N 3.35Å; A853-F878 HydrophobicContact CB-CZ 4.21Å; A853-F878 WeakPolarHBondContact O-CE1 3.49Å; A853-F878 WeakPolarHBondContact O-CZ 3.11Å; A853-L882 HydrophobicContact CB-CD1 4.31Å; A853-L882 HydrophobicContact CB-CD2 4.02Å
854	L	85.3	Confident	84.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-76	-41.6	178.7	-65.8	-179.1	0	0	0	111.4	V721 V725 M815 M819 P851 V852 L857 M858 L879 L882 L889	V721-L854 HydrophobicContact CG1-CD1 4.41Å; V725-L854 HydrophobicContact CG2-CD1 3.67Å; V725-L854 HydrophobicContact CG2-CD2 4.13Å; V725-L854 HydrophobicContact CG2-CG 4.45Å; M815-L854 HydrophobicContact CE-CD2 4.34Å; M819-L854 HydrophobicContact CE-CD1 4.11Å; M819-L854 HydrophobicContact SD-CD1 3.8Å; P851-L854 HydrophobicContact CB-CG 4.45Å; P851-L854 HydrophobicContact CG-CD1 4.07Å; P851-L854 HydrophobicContact CG-CG 4.49Å; P851-L854 PolarHBondContact O-N 3.2Å; V852-L854 PolarHBondContact O-N 3.39Å; L854-L857 PolarHBondContact O-N 2.84Å; L854-M858 WeakPolarHBondContact O-CG 3.18Å; L854-M858 PolarHBondContact O-N 3.29Å; L854-L879 HydrophobicContact CD2-CD2 3.93Å; L854-L882 HydrophobicContact CD2-CD1 3.57Å; L854-L882 HydrophobicContact CG-CD1 4.37Å; L854-L889 HydrophobicContact CD1-CD2 4.39Å; L854-L889 HydrophobicContact CG-CD2 4.31Å
855	H	88.5	Confident	84.5	Confident	24 Å²	24	43 Å²	43	11%	0.111	23%	0.23	C	C	.	.	H	α-helix	trans	-65.3	-39.1	176.9	-172.6	50.1	0	0	0	112.3	L844 A846 P851 V852 L857 M858 L859 V893	L844-H855 PolarHBondContact O-CE1 3.47Å; A846-H855 HydrophobicContact CB-CB 4.15Å; A846-H855 PolarHBondContact N-CE1 3.01Å; A846-H855 VanDerWaalsContact N-CE1 3.3Å; P851-H855 PolarHBondContact O-N 2.86Å; V852-H855 PolarHBondContact O-N 3.37Å; H855-L857 VanDerWaalsContact C-N 3.31Å; H855-L857 PolarHBondContact O-N 3.41Å; H855-M858 WeakPolarHBondContact O-CA 3.36Å; H855-M858 WeakPolarHBondContact O-CB 3.35Å; H855-M858 PolarHBondContact O-N 3.27Å; H855-M858 VanDerWaalsContact O-N 3.08Å; H855-L859 WeakPolarHBondContact O-CG 3.2Å; H855-L859 PolarHBondContact O-N 3.25Å; H855-V893 HydrophobicContact CB-CG2 4.45Å
856	Q	82.9	Confident	85.1	Confident	86 Å²	86	43.3 Å²	43.3	40%	0.402	22%	0.224	S	C	.	.	H	α-helix	trans	-59.9	-41.5	173.8	-72.9	-62.5	-22.7	0	0	111.9	V852 M858 L859 H860	V852-Q856 HydrophobicContact CG1-CG 3.97Å; V852-Q856 WeakPolarHBondContact O-CB 3.39Å; V852-Q856 VanDerWaalsContact O-CG 3.32Å; V852-Q856 WeakPolarHBondContact O-CG 3.37Å; V852-Q856 PolarHBondContact O-N 2.9Å; Q856-M858 VanDerWaalsContact C-N 3.34Å; Q856-M858 PolarHBondContact O-N 3.23Å; Q856-L859 PolarHBondContact O-N 2.96Å; Q856-H860 PolarHBondContact O-N 3.36Å; Q856-H860 PolarHBondContact O-ND1 2.8Å
857	L	89.4	Confident	85.8	Confident	7 Å²	7	47 Å²	47	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-39	173.2	178.9	61.2	0	0	0	112.1	M815 A853 L854 H855 L859 H860 C861 P870 I875 F878 L879	M815-L857 HydrophobicContact CE-CB 4.05Å; M815-L857 HydrophobicContact CE-CD2 3.63Å; M815-L857 HydrophobicContact CE-CG 3.87Å; M815-L857 HydrophobicContact SD-CD2 4Å; M815-L857 HydrophobicContact SD-CG 4.01Å; A853-L857 PolarHBondContact O-N 3.35Å; L854-L857 PolarHBondContact O-N 2.84Å; H855-L857 VanDerWaalsContact C-N 3.31Å; H855-L857 PolarHBondContact O-N 3.41Å; L857-L859 VanDerWaalsContact C-N 3.34Å; L857-L859 PolarHBondContact O-N 3.2Å; L857-H860 PolarHBondContact O-N 3.31Å; L857-C861 PolarHBondContact O-N 3.14Å; L857-C861 PolarHBondContact O-SG 2.99Å; L857-C861 VanDerWaalsContact O-SG 3.35Å; L857-P870 HydrophobicContact CD1-CG 4.29Å; L857-I875 HydrophobicContact CD1-CG1 4.4Å; L857-I875 HydrophobicContact CD2-CG2 4.27Å; L857-F878 HydrophobicContact CB-CD1 4.31Å; L857-F878 HydrophobicContact CB-CE1 3.89Å; L857-F878 HydrophobicContact CB-CZ 4.4Å; L857-F878 HydrophobicContact CD2-CD1 3.49Å; L857-F878 VanDerWaalsContact CD2-CD1 3.49Å; L857-F878 HydrophobicContact CD2-CE1 3.87Å; L857-F878 HydrophobicContact CD2-CG 4.3Å; L857-F878 HydrophobicContact CG-CD1 4.31Å; L857-F878 HydrophobicContact CG-CE1 4.39Å; L857-L879 HydrophobicContact CD2-CD2 4.17Å; L857-L879 HydrophobicContact CD2-CG 4.4Å
858	M	94.5	Very high	86.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.3	-44.7	173.3	-61.3	169.2	-165.3	0	0	111.5	M815 W816 M819 L854 H855 Q856 H860 C861 W862	M815-M858 HydrophobicContact CB-CE 3.89Å; M815-M858 HydrophobicContact CB-CG 3.79Å; M815-M858 HydrophobicContact CB-SD 4.45Å; M815-M858 HydrophobicContact CE-CG 4.04Å; M815-M858 HydrophobicContact SD-CG 4.16Å; W816-M858 HydrophobicContact CB-SD 4.21Å; M819-M858 HydrophobicContact CB-CE 4.09Å; M819-M858 HydrophobicContact CG-CE 3.66Å; L854-M858 WeakPolarHBondContact O-CG 3.18Å; L854-M858 PolarHBondContact O-N 3.29Å; H855-M858 WeakPolarHBondContact O-CA 3.36Å; H855-M858 WeakPolarHBondContact O-CB 3.35Å; H855-M858 PolarHBondContact O-N 3.27Å; H855-M858 VanDerWaalsContact O-N 3.08Å; Q856-M858 VanDerWaalsContact C-N 3.34Å; Q856-M858 PolarHBondContact O-N 3.23Å; M858-H860 PolarHBondContact O-N 3.23Å; M858-C861 WeakPolarHBondContact O-CB 3.23Å; M858-C861 PolarHBondContact O-N 3.41Å; M858-C861 VanDerWaalsContact O-N 3.12Å; M858-W862 HydrophobicContact CB-CD2 4.48Å; M858-W862 HydrophobicContact CB-CE3 4.08Å; M858-W862 HydrophobicContact CB-CH2 3.68Å; M858-W862 HydrophobicContact CB-CZ2 4.09Å; M858-W862 HydrophobicContact CB-CZ3 3.68Å; M858-W862 HydrophobicContact CG-CH2 4.27Å; M858-W862 PolarHBondContact O-N 3.46Å; M858-W862 HydrophobicContact SD-CH2 4.13Å
859	L	88.5	Confident	87.5	Confident	48 Å²	48	45.6 Å²	45.6	25%	0.251	23%	0.228	S	C	.	.	H	α-helix	trans	-63.5	-38.6	177.3	-67.2	171.9	0	0	0	112.3	R843 H855 Q856 L857 C861 W862 Q863	R843-L859 HydrophobicContact CB-CD2 4.13Å; R843-L859 HydrophobicContact CG-CD2 4.5Å; H855-L859 WeakPolarHBondContact O-CG 3.2Å; H855-L859 PolarHBondContact O-N 3.25Å; Q856-L859 PolarHBondContact O-N 2.96Å; L857-L859 VanDerWaalsContact C-N 3.34Å; L857-L859 PolarHBondContact O-N 3.2Å; L859-C861 VanDerWaalsContact C-N 3.33Å; L859-W862 HydrophobicContact CD2-CE3 4.19Å; L859-W862 HydrophobicContact CD2-CZ3 4.5Å; L859-W862 CarbonylContact O-C 3.54Å; L859-W862 PolarHBondContact O-N 2.03Å; L859-W862 VanDerWaalsContact O-N 3.14Å; L859-Q863 PolarHBondContact O-N 3.04Å; L859-Q863 PolarHBondContact O-NE2 2.86Å
860	H	90	Very high	88.7	Confident	90 Å²	90	45.2 Å²	45.2	42%	0.417	22%	0.22	S	C	.	.	H	α-helix	trans	-63.1	-37.9	171.5	-66.7	144	0	0	0	112.4	Q856 L857 M858 W862 Q863 P870	Q856-H860 PolarHBondContact O-N 3.36Å; Q856-H860 PolarHBondContact O-ND1 2.8Å; L857-H860 PolarHBondContact O-N 3.31Å; M858-H860 PolarHBondContact O-N 3.23Å; H860-W862 VanDerWaalsContact C-N 3.26Å; H860-W862 PolarHBondContact O-N 3.09Å; H860-Q863 WeakPolarHBondContact O-CG 3.13Å; H860-P870 HydrophobicContact CB-CG 4.33Å; H860-P870 VanDerWaalsContact O-CD 3.29Å; H860-P870 WeakPolarHBondContact O-CD 3.44Å
861	C	95.7	Very high	89.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-28.3	172.8	-69.3	0	0	0	0	112.7	A808 W809 L857 M858 L859 R869	A808-C861 WeakPolarHBondContact O-CB 3.4Å; W809-C861 WeakPolarHBondContact CA-O 3.27Å; L857-C861 PolarHBondContact O-N 3.14Å; L857-C861 PolarHBondContact O-SG 2.99Å; L857-C861 VanDerWaalsContact O-SG 3.35Å; M858-C861 WeakPolarHBondContact O-CB 3.23Å; M858-C861 PolarHBondContact O-N 3.41Å; M858-C861 VanDerWaalsContact O-N 3.12Å; L859-C861 VanDerWaalsContact C-N 3.33Å; C861-R869 VanDerWaalsContact O-CD 3.26Å; C861-R869 WeakPolarHBondContact O-CD 3.03Å; C861-R869 WeakPolarHBondContact O-CG 3.41Å
862	W	96.6	Very high	90.1	Very high	1 Å²	1	52.7 Å²	52.7	0%	0.004	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	23	-178.5	-55.2	-41.2	0	0	0	115.1	W809 G812 I813 W816 R843 L844 M858 L859 H860 K864	W809-W862 AromaticContact CD2-CD1 3.78Å; W809-W862 AromaticContact CE2-CD1 3.87Å; W809-W862 HydrophobicContact CE3-CB 4.11Å; W809-W862 HydrophobicContact CH2-CB 4.12Å; W809-W862 VanDerWaalsContact CZ3-C 3.46Å; W809-W862 HydrophobicContact CZ3-CB 3.9Å; W809-W862 WeakPolarHBondContact CZ3-O 3.3Å; W809-W862 PolarHBondContact O-NE1 3.45Å; G812-W862 VanDerWaalsContact C-CZ2 3.46Å; G812-W862 WeakPolarHBondContact O-CZ2 3.27Å; I813-W862 HydrophobicContact CD1-CZ2 3.75Å; I813-W862 HydrophobicContact CG1-CZ2 4.47Å; W816-W862 HydrophobicContact CB-CH2 4.06Å; W816-W862 HydrophobicContact CB-CZ2 4.1Å; W816-W862 HydrophobicContact CG-CH2 4.34Å; R843-W862 HydrophobicContact CB-CE3 4.08Å; R843-W862 HydrophobicContact CG-CB 4.37Å; R843-W862 PolarHBondContact NE-O 3.02Å; R843-W862 PolarHBondContact NH2-O 2.75Å; R843-W862 VanDerWaalsContact NH2-O 3.14Å; L844-W862 HydrophobicContact CB-CH2 3.85Å; L844-W862 HydrophobicContact CB-CZ3 4.15Å; L844-W862 HydrophobicContact CD1-CH2 4.43Å; L844-W862 HydrophobicContact CD1-CZ2 4.4Å; M858-W862 HydrophobicContact CB-CD2 4.48Å; M858-W862 HydrophobicContact CB-CE3 4.08Å; M858-W862 HydrophobicContact CB-CH2 3.68Å; M858-W862 HydrophobicContact CB-CZ2 4.09Å; M858-W862 HydrophobicContact CB-CZ3 3.68Å; M858-W862 HydrophobicContact CG-CH2 4.27Å; M858-W862 PolarHBondContact O-N 3.46Å; M858-W862 HydrophobicContact SD-CH2 4.13Å; L859-W862 HydrophobicContact CD2-CE3 4.19Å; L859-W862 HydrophobicContact CD2-CZ3 4.5Å; L859-W862 CarbonylContact O-C 3.54Å; L859-W862 PolarHBondContact O-N 2.03Å; L859-W862 VanDerWaalsContact O-N 3.14Å; H860-W862 VanDerWaalsContact C-N 3.26Å; H860-W862 PolarHBondContact O-N 3.09Å; W862-K864 PolarHBondContact O-N 3.42Å
863	Q	93.6	Very high	91	Very high	75 Å²	75	54.4 Å²	54.4	35%	0.35	26%	0.262	S	S	.	.			trans	-59.5	136.6	169.9	-68.7	-61.3	-33.3	0	0	110.7	L859 H860 H868 R869	L859-Q863 PolarHBondContact O-N 3.04Å; L859-Q863 PolarHBondContact O-NE2 2.86Å; H860-Q863 WeakPolarHBondContact O-CG 3.13Å; Q863-H868 HydrophobicContact CB-CB 3.98Å; Q863-H868 HydrophobicContact CG-CB 4.18Å; Q863-R869 HydrophobicContact CB-CG 4.02Å; Q863-R869 PolarHBondContact O-NE 2.92Å; Q863-R869 PolarHBondContact O-NH2 2.87Å
864	K	87.1	Confident	91.7	Very high	97 Å²	97	57.4 Å²	57.4	42%	0.422	28%	0.275	S	S	.	.	S	Bend	trans	-60.5	-50.5	-178.5	-173.8	168.3	-173.7	159.1	0	110	E839 W862 R869	E839-K864 PolarHBondContact O-NZ 2.97Å; E839-K864 IonicContact OE2-NZ 2.69Å; E839-K864 PolarHBondContact OE2-NZ 3.41Å; W862-K864 PolarHBondContact O-N 3.42Å; K864-R869 PolarHBondContact O-NH2 2.84Å; K864-R869 VanDerWaalsContact O-NH2 3.13Å
865	E	89.1	Confident	92.2	Very high	117 Å²	117	57.4 Å²	57.4	55%	0.547	28%	0.275	S	S	.	.	S	Bend	trans	-73.3	124.3	175.5	-65.7	-54.4	142.7	0	0	111.8	N867 H868	E865-N867 PolarHBondContact O-N 2.78Å; E865-H868 PolarHBondContact O-N 2.89Å
866	R	91.7	Very high	92.7	Very high	65 Å²	65	57 Å²	57	25%	0.245	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-59	-34.5	-175.7	76.5	-176.3	-178.7	161.2	-0.8	112.9	E777 A805 H868 R869	E777-R866 VanDerWaalsContact O-CZ 3.3Å; E777-R866 PolarHBondContact O-NH1 3.27Å; E777-R866 PolarHBondContact O-NH2 2.78Å; A805-R866 HydrophobicContact CB-CB 4.07Å; A805-R866 WeakPolarHBondContact CB-O 3.49Å; R866-H868 VanDerWaalsContact C-N 3.26Å; R866-H868 PolarHBondContact O-N 2.87Å; R866-R869 PolarHBondContact O-N 2.83Å
867	N	89.3	Confident	93.2	Very high	108 Å²	108	55.6 Å²	55.6	58%	0.578	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-74.4	-17.4	-175	-67.9	1.2	0	0	0	112.6	E865	E865-N867 PolarHBondContact O-N 2.78Å
868	H	91.4	Very high	93.3	Very high	132 Å²	132	58.5 Å²	58.5	61%	0.611	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-87.9	-6.7	177	-62.5	160.4	0	0	0	113.1	Q863 E865 R866	Q863-H868 HydrophobicContact CB-CB 3.98Å; Q863-H868 HydrophobicContact CG-CB 4.18Å; E865-H868 PolarHBondContact O-N 2.89Å; R866-H868 VanDerWaalsContact C-N 3.26Å; R866-H868 PolarHBondContact O-N 2.87Å
869	R	96.1	Very high	93.3	Very high	13 Å²	13	58.5 Å²	58.5	5%	0.049	29%	0.287	C	S	.	.	S	Bend	trans	-78.1	142.4	177.6	-60.2	177.1	-165	152.1	10.3	110	E795 A805 C861 Q863 K864 R866	E795-R869 IonicContact OE1-CZ 3.5Å; E795-R869 IonicContact OE1-NH1 3.59Å; E795-R869 PolarHBondContact OE1-NH1 3.4Å; E795-R869 IonicContact OE1-NH2 2.7Å; E795-R869 PolarHBondContact OE1-NH2 2.96Å; E795-R869 IonicContact OE2-CZ 2.96Å; E795-R869 IonicContact OE2-NH1 2.84Å; E795-R869 IonicContact OE2-NH2 3.46Å; E795-R869 PolarHBondContact OE2-NH2 2.87Å; A805-R869 VanDerWaalsContact O-CD 3.28Å; A805-R869 WeakPolarHBondContact O-CD 3.05Å; A805-R869 PolarHBondContact O-NH1 2.95Å; C861-R869 VanDerWaalsContact O-CD 3.26Å; C861-R869 WeakPolarHBondContact O-CD 3.03Å; C861-R869 WeakPolarHBondContact O-CG 3.41Å; Q863-R869 HydrophobicContact CB-CG 4.02Å; Q863-R869 PolarHBondContact O-NE 2.92Å; Q863-R869 PolarHBondContact O-NH2 2.87Å; K864-R869 PolarHBondContact O-NH2 2.84Å; K864-R869 VanDerWaalsContact O-NH2 3.13Å; R866-R869 PolarHBondContact O-N 2.83Å
870	P	94.5	Very high	93.4	Very high	26 Å²	26	57.9 Å²	57.9	17%	0.169	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-65.1	145.6	179.2	27.6	-34.5	0	0	0	111	L857 H860 D874 I875	L857-P870 HydrophobicContact CD1-CG 4.29Å; H860-P870 HydrophobicContact CB-CG 4.33Å; H860-P870 VanDerWaalsContact O-CD 3.29Å; H860-P870 WeakPolarHBondContact O-CD 3.44Å; P870-D874 HydrophobicContact CB-CB 4.29Å; P870-I875 HydrophobicContact CB-CG1 4Å; P870-I875 HydrophobicContact CG-CD1 4.13Å; P870-I875 HydrophobicContact CG-CG1 3.91Å
871	K	94.1	Very high	93.4	Very high	154 Å²	154	60.1 Å²	60.1	67%	0.67	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-75.9	155.5	171.2	-61	-179.7	179	-179.5	0	109.1	V873 D874 I875	K871-V873 HydrophobicContact CB-CG1 4.03Å; K871-V873 PolarHBondContact O-N 3.25Å; K871-V873 VanDerWaalsContact O-N 3.11Å; K871-D874 WeakPolarHBondContact CB-OD2 3.2Å; K871-D874 PolarHBondContact N-OD2 3.28Å; K871-D874 WeakPolarHBondContact O-CA 3.17Å; K871-D874 WeakPolarHBondContact O-CB 3.12Å; K871-D874 PolarHBondContact O-N 3.2Å; K871-I875 PolarHBondContact O-N 3.02Å; K871-I875 VanDerWaalsContact O-N 3.09Å
872	F	97.3	Very high	93	Very high	5 Å²	5	60.6 Å²	60.6	2%	0.022	29%	0.294	C	S	.	.	H	α-helix	trans	-59.1	-27.9	-179.6	-78.6	-70	0	0	0	113.9	M735 K736 D807 A808 Y811 D874 I875 V876	M735-F872 HydrophobicContact CB-CD1 3.5Å; M735-F872 HydrophobicContact CB-CD2 4.05Å; M735-F872 HydrophobicContact CB-CE1 3.31Å; M735-F872 HydrophobicContact CB-CE2 3.87Å; M735-F872 HydrophobicContact CB-CG 3.88Å; M735-F872 HydrophobicContact CB-CZ 3.5Å; M735-F872 HydrophobicContact CE-CE2 4.1Å; M735-F872 HydrophobicContact CE-CZ 3.98Å; M735-F872 HydrophobicContact CG-CE1 3.92Å; M735-F872 HydrophobicContact CG-CZ 3.99Å; K736-F872 HydrophobicContact CB-CB 3.8Å; K736-F872 HydrophobicContact CG-CB 4.37Å; D807-F872 HydrophobicContact CB-CE2 3.99Å; D807-F872 HydrophobicContact CB-CZ 4.08Å; A808-F872 HydrophobicContact CB-CE2 4.5Å; A808-F872 HydrophobicContact CB-CZ 4.38Å; Y811-F872 HydrophobicContact CD1-CE1 4.45Å; Y811-F872 HydrophobicContact CD2-CE1 4.11Å; Y811-F872 AromaticContact CG-CE1 3.86Å; Y811-F872 HydrophobicContact CG-CE1 3.86Å; F872-D874 VanDerWaalsContact C-N 3.33Å; F872-I875 HydrophobicContact CD1-CD1 3.95Å; F872-I875 HydrophobicContact CE1-CD1 4.23Å; F872-I875 PolarHBondContact O-N 2.73Å; F872-V876 VanDerWaalsContact O-CG2 3.3Å; F872-V876 WeakPolarHBondContact O-CG2 3.5Å; F872-V876 PolarHBondContact O-N 2.94Å
873	V	94.8	Very high	92.7	Very high	71 Å²	71	63.4 Å²	63.4	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-39.4	171.7	63.2	0	0	0	0	112.4	K736 K871 S877	K736-V873 HydrophobicContact CD-CB 4.3Å; K871-V873 HydrophobicContact CB-CG1 4.03Å; K871-V873 PolarHBondContact O-N 3.25Å; K871-V873 VanDerWaalsContact O-N 3.11Å; V873-S877 WeakPolarHBondContact O-CB 3.42Å; V873-S877 PolarHBondContact O-N 3.44Å
874	D	94.8	Very high	92.5	Very high	87 Å²	87	69.7 Å²	69.7	47%	0.465	33%	0.329	S	S	.	.	H	α-helix	trans	-70.6	-42	178.7	-51.6	-47.6	0	0	0	110.3	P870 K871 F872 S877 F878	P870-D874 HydrophobicContact CB-CB 4.29Å; K871-D874 WeakPolarHBondContact CB-OD2 3.2Å; K871-D874 PolarHBondContact N-OD2 3.28Å; K871-D874 WeakPolarHBondContact O-CA 3.17Å; K871-D874 WeakPolarHBondContact O-CB 3.12Å; K871-D874 PolarHBondContact O-N 3.2Å; F872-D874 VanDerWaalsContact C-N 3.33Å; D874-S877 PolarHBondContact O-N 3.19Å; D874-F878 WeakPolarHBondContact O-CB 3.46Å; D874-F878 PolarHBondContact O-N 2.89Å
875	I	97.2	Very high	92.4	Very high	0 Å²	0	69 Å²	69	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-58.9	-49.4	175.6	-62.1	176.6	0	0	0	110.7	A732 Y811 L857 P870 K871 F872 S877 F878 L879	A732-I875 HydrophobicContact CB-CG2 3.85Å; Y811-I875 HydrophobicContact CD1-CD1 3.95Å; Y811-I875 HydrophobicContact CD1-CG2 4.12Å; Y811-I875 HydrophobicContact CE1-CD1 4.31Å; Y811-I875 HydrophobicContact CE1-CG2 3.41Å; Y811-I875 VanDerWaalsContact CE1-CG2 3.41Å; L857-I875 HydrophobicContact CD1-CG1 4.4Å; L857-I875 HydrophobicContact CD2-CG2 4.27Å; P870-I875 HydrophobicContact CB-CG1 4Å; P870-I875 HydrophobicContact CG-CD1 4.13Å; P870-I875 HydrophobicContact CG-CG1 3.91Å; K871-I875 PolarHBondContact O-N 3.02Å; K871-I875 VanDerWaalsContact O-N 3.09Å; F872-I875 HydrophobicContact CD1-CD1 3.95Å; F872-I875 HydrophobicContact CE1-CD1 4.23Å; F872-I875 PolarHBondContact O-N 2.73Å; I875-S877 VanDerWaalsContact C-N 3.34Å; I875-S877 PolarHBondContact O-N 3.1Å; I875-F878 PolarHBondContact O-N 2.9Å; I875-L879 HydrophobicContact CG2-CD1 4.03Å; I875-L879 WeakPolarHBondContact O-CG 3.04Å; I875-L879 PolarHBondContact O-N 3.15Å
876	V	97.4	Very high	92	Very high	15 Å²	15	66.6 Å²	66.6	9%	0.091	33%	0.325	C	S	.	.	H	α-helix	trans	-61.2	-43.7	177.9	171.8	0	0	0	0	110.9	A732 A733 K736 F872 F878 L879 D880	A732-V876 HydrophobicContact CB-CG2 3.69Å; A733-V876 HydrophobicContact CB-CG2 4.46Å; K736-V876 HydrophobicContact CB-CG2 4.29Å; K736-V876 HydrophobicContact CD-CG2 4.34Å; F872-V876 VanDerWaalsContact O-CG2 3.3Å; F872-V876 WeakPolarHBondContact O-CG2 3.5Å; F872-V876 PolarHBondContact O-N 2.94Å; V876-F878 VanDerWaalsContact C-N 3.32Å; V876-F878 PolarHBondContact O-N 3.39Å; V876-L879 PolarHBondContact O-N 3.48Å; V876-D880 WeakPolarHBondContact O-CB 3.42Å; V876-D880 PolarHBondContact O-N 3.29Å
877	S	93.6	Very high	91.1	Very high	57 Å²	57	67.1 Å²	67.1	40%	0.399	34%	0.338	S	S	.	.	H	α-helix	trans	-60.6	-42.1	177	-171.2	0	0	0	0	112.1	V873 D874 I875 D880 K881	V873-S877 WeakPolarHBondContact O-CB 3.42Å; V873-S877 PolarHBondContact O-N 3.44Å; D874-S877 PolarHBondContact O-N 3.19Å; I875-S877 VanDerWaalsContact C-N 3.34Å; I875-S877 PolarHBondContact O-N 3.1Å; S877-D880 PolarHBondContact O-N 3.21Å; S877-K881 WeakPolarHBondContact O-CG 3.45Å; S877-K881 PolarHBondContact O-N 3.38Å; S877-K881 VanDerWaalsContact O-N 3.07Å
878	F	92.3	Very high	90.3	Very high	68 Å²	68	64.3 Å²	64.3	30%	0.298	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-48	177.7	-175.6	-91	0	0	0	111.8	A853 L857 D874 I875 V876 K881 L882	A853-F878 HydrophobicContact CB-CZ 4.21Å; A853-F878 WeakPolarHBondContact O-CE1 3.49Å; A853-F878 WeakPolarHBondContact O-CZ 3.11Å; L857-F878 HydrophobicContact CB-CD1 4.31Å; L857-F878 HydrophobicContact CB-CE1 3.89Å; L857-F878 HydrophobicContact CB-CZ 4.4Å; L857-F878 HydrophobicContact CD2-CD1 3.49Å; L857-F878 VanDerWaalsContact CD2-CD1 3.49Å; L857-F878 HydrophobicContact CD2-CE1 3.87Å; L857-F878 HydrophobicContact CD2-CG 4.3Å; L857-F878 HydrophobicContact CG-CD1 4.31Å; L857-F878 HydrophobicContact CG-CE1 4.39Å; D874-F878 WeakPolarHBondContact O-CB 3.46Å; D874-F878 PolarHBondContact O-N 2.89Å; I875-F878 PolarHBondContact O-N 2.9Å; V876-F878 VanDerWaalsContact C-N 3.32Å; V876-F878 PolarHBondContact O-N 3.39Å; F878-K881 WeakPolarHBondContact O-CB 3.39Å; F878-K881 PolarHBondContact O-N 3.14Å; F878-L882 HydrophobicContact CD1-CD1 3.91Å; F878-L882 HydrophobicContact CD1-CG 4.42Å; F878-L882 HydrophobicContact CE1-CD1 3.48Å; F878-L882 VanDerWaalsContact CE1-CD1 3.48Å; F878-L882 HydrophobicContact CE1-CG 4.19Å; F878-L882 HydrophobicContact CZ-CD1 4.26Å; F878-L882 PolarHBondContact O-N 3.11Å; F878-L882 VanDerWaalsContact O-N 3.14Å
879	L	93.9	Very high	89.5	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.8	-38.4	178.8	-63.8	170.9	0	0	0	112.1	V725 L728 R729 A732 Y811 L854 L857 I875 V876 K881 L882 I883	V725-L879 HydrophobicContact CG1-CD2 4.28Å; L728-L879 HydrophobicContact CB-CD1 4.3Å; R729-L879 HydrophobicContact CB-CB 4.07Å; R729-L879 HydrophobicContact CB-CD1 4.21Å; R729-L879 HydrophobicContact CG-CB 4.13Å; A732-L879 HydrophobicContact CB-CD1 4.09Å; Y811-L879 WeakPolarHBondContact OH-CD1 3.45Å; L854-L879 HydrophobicContact CD2-CD2 3.93Å; L857-L879 HydrophobicContact CD2-CD2 4.17Å; L857-L879 HydrophobicContact CD2-CG 4.4Å; I875-L879 HydrophobicContact CG2-CD1 4.03Å; I875-L879 WeakPolarHBondContact O-CG 3.04Å; I875-L879 PolarHBondContact O-N 3.15Å; V876-L879 PolarHBondContact O-N 3.48Å; L879-K881 VanDerWaalsContact C-N 3.27Å; L879-K881 PolarHBondContact O-N 3.44Å; L879-L882 HydrophobicContact CD2-CD1 4.47Å; L879-L882 PolarHBondContact O-N 3.15Å; L879-I883 WeakPolarHBondContact O-CG1 3.19Å; L879-I883 PolarHBondContact O-N 3.03Å
880	D	91.7	Very high	88	Confident	34 Å²	34	64.2 Å²	64.2	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-61.4	-35.9	174.2	-82.3	-11.6	0	0	0	111.7	R729 V876 S877 I883 R884	R729-D880 IonicContact CZ-OD1 3.81Å; R729-D880 IonicContact NE-OD1 3.26Å; R729-D880 PolarHBondContact NE-OD1 3.37Å; R729-D880 IonicContact NH2-OD1 4Å; R729-D880 PolarHBondContact NH2-OD1 3.49Å; R729-D880 IonicContact NH2-OD2 3.46Å; R729-D880 PolarHBondContact NH2-OD2 2.9Å; V876-D880 WeakPolarHBondContact O-CB 3.42Å; V876-D880 PolarHBondContact O-N 3.29Å; S877-D880 PolarHBondContact O-N 3.21Å; D880-I883 PolarHBondContact O-N 3.07Å; D880-R884 VanDerWaalsContact O-CG 3.27Å; D880-R884 WeakPolarHBondContact O-CG 3.42Å; D880-R884 PolarHBondContact O-N 3.3Å
881	K	89.8	Confident	86.4	Confident	137 Å²	137	65.4 Å²	65.4	60%	0.596	34%	0.339	S	S	*	.	H	α-helix	trans	-65.1	-42.9	173.6	-72.3	170.5	-174.7	176.5	0	111.7	S877 F878 L879 I883 R884 N885	S877-K881 WeakPolarHBondContact O-CG 3.45Å; S877-K881 PolarHBondContact O-N 3.38Å; S877-K881 VanDerWaalsContact O-N 3.07Å; F878-K881 WeakPolarHBondContact O-CB 3.39Å; F878-K881 PolarHBondContact O-N 3.14Å; L879-K881 VanDerWaalsContact C-N 3.27Å; L879-K881 PolarHBondContact O-N 3.44Å; K881-I883 VanDerWaalsContact C-N 3.34Å; K881-I883 PolarHBondContact O-N 3.28Å; K881-R884 PolarHBondContact O-N 3.16Å; K881-N885 PolarHBondContact O-N 3.42Å
882	L	87.8	Confident	84.8	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.052	32%	0.32	C	S	.	.	H	α-helix	trans	-64.9	-37.3	176.9	-66.9	179.5	0	0	0	112.4	A853 L854 F878 L879 N885 L889	A853-L882 HydrophobicContact CB-CD1 4.31Å; A853-L882 HydrophobicContact CB-CD2 4.02Å; L854-L882 HydrophobicContact CD2-CD1 3.57Å; L854-L882 HydrophobicContact CG-CD1 4.37Å; F878-L882 HydrophobicContact CD1-CD1 3.91Å; F878-L882 HydrophobicContact CD1-CG 4.42Å; F878-L882 HydrophobicContact CE1-CD1 3.48Å; F878-L882 VanDerWaalsContact CE1-CD1 3.48Å; F878-L882 HydrophobicContact CE1-CG 4.19Å; F878-L882 HydrophobicContact CZ-CD1 4.26Å; F878-L882 PolarHBondContact O-N 3.11Å; F878-L882 VanDerWaalsContact O-N 3.14Å; L879-L882 HydrophobicContact CD2-CD1 4.47Å; L879-L882 PolarHBondContact O-N 3.15Å; L882-N885 CarbonylContact O-C 3.19Å; L882-N885 PolarHBondContact O-N 2.64Å; L882-L889 HydrophobicContact CB-CD2 4.25Å; L882-L889 HydrophobicContact CD1-CD2 4.02Å; L882-L889 HydrophobicContact CD2-CD2 4.2Å; L882-L889 HydrophobicContact CG-CD2 4.39Å
883	I	90.1	Very high	82.8	Confident	61 Å²	61	62.7 Å²	62.7	31%	0.313	33%	0.334	S	S	.	.	H	α-helix	trans	-67.4	-39.8	176	-66.8	168.5	0	0	0	111.4	I722 V725 R729 L879 D880 K881 N885	I722-I883 HydrophobicContact CD1-CB 4.39Å; I722-I883 HydrophobicContact CD1-CG1 4.11Å; V725-I883 HydrophobicContact CG1-CD1 4.12Å; V725-I883 HydrophobicContact CG1-CG1 3.64Å; R729-I883 HydrophobicContact CB-CD1 3.92Å; R729-I883 HydrophobicContact CG-CD1 3.88Å; L879-I883 WeakPolarHBondContact O-CG1 3.19Å; L879-I883 PolarHBondContact O-N 3.03Å; D880-I883 PolarHBondContact O-N 3.07Å; K881-I883 VanDerWaalsContact C-N 3.34Å; K881-I883 PolarHBondContact O-N 3.28Å; I883-N885 VanDerWaalsContact C-N 3.35Å
884	R	88.4	Confident	80.6	Confident	207 Å²	207	65.1 Å²	65.1	78%	0.781	34%	0.34	S	S	*	.	H	α-helix	trans	-72.8	-26.8	177.8	-69.7	177.4	-152.7	-154.2	6.2	113.2	D880 K881	D880-R884 VanDerWaalsContact O-CG 3.27Å; D880-R884 WeakPolarHBondContact O-CG 3.42Å; D880-R884 PolarHBondContact O-N 3.3Å; K881-R884 PolarHBondContact O-N 3.16Å
885	N	85.1	Confident	77.8	Confident	82 Å²	82	66.1 Å²	66.1	44%	0.439	35%	0.346	S	S	.	.			trans	-128.4	75.4	177.3	-173.1	10.3	0	0	0	112	K881 L882 I883 S887 S888	K881-N885 PolarHBondContact O-N 3.42Å; L882-N885 CarbonylContact O-C 3.19Å; L882-N885 PolarHBondContact O-N 2.64Å; I883-N885 VanDerWaalsContact C-N 3.35Å; N885-S887 PolarHBondContact O-N 3.04Å; N885-S888 PolarHBondContact ND2-OG 3.3Å; N885-S888 WeakPolarHBondContact O-CB 3.18Å; N885-S888 PolarHBondContact O-N 3.45Å; N885-S888 PolarHBondContact O-OG 3.48Å
886	P	80.6	Confident	75.1	Confident	66 Å²	66	71.2 Å²	71.2	43%	0.429	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-59.9	-20.2	-177.5	-24.7	35.1	0	0	0	114.4	I722 S888 L889	I722-P886 HydrophobicContact CD1-CG 4.5Å; P886-S888 PolarHBondContact O-N 3.44Å; P886-L889 VanDerWaalsContact O-CB 3.28Å; P886-L889 WeakPolarHBondContact O-CB 3.26Å; P886-L889 PolarHBondContact O-N 3.13Å
887	S	72.3	Confident	72.5	Confident	76 Å²	76	76.8 Å²	76.8	53%	0.531	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-59.8	-24.6	174.8	-52.7	0	0	0	0	112.8	N885 L889 L890	N885-S887 PolarHBondContact O-N 3.04Å; S887-L889 PolarHBondContact O-N 3.38Å; S887-L890 WeakPolarHBondContact O-CB 3.35Å; S887-L890 WeakPolarHBondContact O-CG 3.4Å; S887-L890 PolarHBondContact O-N 2.69Å
888	S	72.9	Confident	69.5	Low	49 Å²	49	78.6 Å²	78.6	34%	0.343	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-71	-9.9	175	-49.5	0	0	0	0	113.2	N885 P886	N885-S888 PolarHBondContact ND2-OG 3.3Å; N885-S888 WeakPolarHBondContact O-CB 3.18Å; N885-S888 PolarHBondContact O-N 3.45Å; N885-S888 PolarHBondContact O-OG 3.48Å; P886-S888 PolarHBondContact O-N 3.44Å
889	L	75.1	Confident	66.5	Low	17 Å²	17	83.7 Å²	83.7	9%	0.089	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-94.1	-3.7	176	-59.3	168.8	0	0	0	112.7	V721 I722 V725 P851 L854 L882 P886 S887	V721-L889 HydrophobicContact CG1-CB 4.46Å; V721-L889 HydrophobicContact CG1-CD1 4.26Å; V721-L889 HydrophobicContact CG1-CD2 4.39Å; I722-L889 HydrophobicContact CD1-CD1 4.06Å; V725-L889 HydrophobicContact CG2-CD1 4.26Å; V725-L889 HydrophobicContact CG2-CD2 4.21Å; P851-L889 HydrophobicContact CB-CB 4.45Å; P851-L889 HydrophobicContact CB-CD2 4.15Å; P851-L889 HydrophobicContact CG-CB 4.26Å; P851-L889 HydrophobicContact CG-CD2 4.1Å; L854-L889 HydrophobicContact CD1-CD2 4.39Å; L854-L889 HydrophobicContact CG-CD2 4.31Å; L882-L889 HydrophobicContact CB-CD2 4.25Å; L882-L889 HydrophobicContact CD1-CD2 4.02Å; L882-L889 HydrophobicContact CD2-CD2 4.2Å; L882-L889 HydrophobicContact CG-CD2 4.39Å; P886-L889 VanDerWaalsContact O-CB 3.28Å; P886-L889 WeakPolarHBondContact O-CB 3.26Å; P886-L889 PolarHBondContact O-N 3.13Å; S887-L889 PolarHBondContact O-N 3.38Å
890	L	64.2	Low	64.5	Low	127 Å²	127	88.9 Å²	88.9	67%	0.665	47%	0.473	S	S	*	.			trans	-70.6	-38.7	-179.9	-69.7	166.1	0	0	0	113.9	S887 L892	S887-L890 WeakPolarHBondContact O-CB 3.35Å; S887-L890 WeakPolarHBondContact O-CG 3.4Å; S887-L890 PolarHBondContact O-N 2.69Å; L890-L892 PolarHBondContact O-N 2.83Å
891	P	60.3	Low	61.8	Low	50 Å²	50	96.9 Å²	96.9	33%	0.325	51%	0.51	S	S	.	.			trans	-69.5	108.6	178.2	-17.4	31.8	0	0	0	110.6	V852 L896	V852-P891 PolarHBondContact N-O 2.81Å; V852-P891 VanDerWaalsContact N-O 3.08Å; P891-L896 HydrophobicContact CB-CD1 3.5Å; P891-L896 HydrophobicContact CB-CG 4.12Å
892	L	61.3	Low	59.2	Low	51 Å²	51	94.6 Å²	94.6	27%	0.267	51%	0.511	S	S	.	.	B	Isolated β-bridge	trans	-80.6	151	170.9	-59.9	178.9	0	0	0	109.4	L890 E894 D895	L890-L892 PolarHBondContact O-N 2.83Å; L892-E894 PolarHBondContact O-N 2.97Å; L892-E894 VanDerWaalsContact O-N 3.12Å; L892-D895 PolarHBondContact O-N 3.21Å
893	V	54.4	Low	57.4	Low	52 Å²	52	99.7 Å²	99.7	32%	0.315	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-26.8	175.7	176.9	0	0	0	0	111.6	A846 V852 H855	A846-V893 HydrophobicContact CB-CB 4.41Å; A846-V893 HydrophobicContact CB-CG1 4.37Å; A846-V893 HydrophobicContact CB-CG2 3.9Å; V852-V893 HydrophobicContact CB-CG2 4.4Å; V852-V893 HydrophobicContact CG2-CB 4.2Å; V852-V893 HydrophobicContact CG2-CG2 3.69Å; H855-V893 HydrophobicContact CB-CG2 4.45Å
894	E	48.5	Very low	54.6	Low	122 Å²	122	101 Å²	101	57%	0.57	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-23.7	177.6	-65.2	170	-161.3	0	0	113.2	L892	L892-E894 PolarHBondContact O-N 2.97Å; L892-E894 VanDerWaalsContact O-N 3.12Å
895	D	37.2	Very low	51.9	Low	108 Å²	108	100.3 Å²	100.3	58%	0.578	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	-19.4	-172	-69.8	-34.1	0	0	0	114.5	L892	L892-D895 PolarHBondContact O-N 3.21Å
896	L	41.2	Very low	49.5	Very low	107 Å²	107	103.2 Å²	103.2	56%	0.56	59%	0.585	S	S	*	*			trans	-92.3	11.2	-172.2	-82.1	168	0	0	0	115.1	V852 P891 S898	V852-L896 HydrophobicContact CB-CD1 4.18Å; V852-L896 HydrophobicContact CG1-CD1 4.42Å; V852-L896 HydrophobicContact CG2-CD1 3.58Å; P891-L896 HydrophobicContact CB-CD1 3.5Å; P891-L896 HydrophobicContact CB-CG 4.12Å; L896-S898 PolarHBondContact O-N 3.22Å
897	Q	41.7	Very low	47.3	Very low	132 Å²	132	107 Å²	107	62%	0.617	60%	0.599	S	S	*	*			trans	-81.7	21.3	178.8	-68.9	-179.3	-3.6	0	0	114.4
898	S	31.7	Very low	45.5	Very low	95 Å²	95	111.7 Å²	111.7	66%	0.664	62%	0.618	S	S	*	*	S	Bend	trans	-136.7	107.3	173.4	62.6	0	0	0	0	113.3	L896	L896-S898 PolarHBondContact O-N 3.22Å
899	L	29.4	Very low	44.1	Very low	174 Å²	174	114.7 Å²	114.7	91%	0.911	62%	0.623	S	S	*	*			trans	87.1	148	166	-66.5	163.3	0	0	0	120.1
900	P	52	Low	42.7	Very low	110 Å²	110	118.2 Å²	118.2	71%	0.714	65%	0.646	S	S	*	*			trans	-120.2	162.6	-148.5	40	-25.1	0	0	0	114.9
901	E	33.7	Very low	41.9	Very low	202 Å²	202	119.1 Å²	119.1	94%	0.944	65%	0.649	S	S	*	*			trans	-167.5	129.7	141.2	-109.7	169	-170.2	0	0	111.7
902	S	35.1	Very low	42	Very low	88 Å²	88	118.9 Å²	118.9	62%	0.615	64%	0.643	S	S	*	*			trans	-85.3	-174	177.1	-162.7	0	0	0	0	110.6
903	P	49.3	Very low	42	Very low	118 Å²	118	123.6 Å²	123.6	77%	0.766	67%	0.667	S	S	*	*			cis	-131.5	-178.7	-4.1	45.1	-28	0	0	0	112.3
904	A	32.7	Very low	43	Very low	87 Å²	87	123.2 Å²	123.2	72%	0.719	67%	0.667	S	S	*	*			cis	-162.8	150.8	15	0	0	0	0	0	108.7
905	E	31.7	Very low	44.6	Very low	193 Å²	193	117.7 Å²	117.7	90%	0.902	64%	0.641	S	S	*	*				176.7	129.4	121.3	-94.7	178.9	-168.8	0	0	109.5
906	D	34.2	Very low	46.5	Very low	143 Å²	143	112.8 Å²	112.8	77%	0.765	62%	0.616	S	S	*	*			trans	-54.7	126.9	-164.6	-79.5	-47.5	0	0	0	114.9
907	M	33.8	Very low	48.2	Very low	147 Å²	147	111.1 Å²	111.1	72%	0.724	61%	0.608	S	S	*	*			trans	-118.4	122.2	161.2	-81	-83.8	-72.3	0	0	107.9	Y909	M907-Y909 HydrophobicContact CB-CD2 4.48Å; M907-Y909 HydrophobicContact CB-CE2 4.03Å; M907-Y909 WeakPolarHBondContact O-CD2 3.45Å; M907-Y909 PolarHBondContact O-N 3.24Å; M907-Y909 VanDerWaalsContact O-N 3.11Å
908	D	34.8	Very low	50.3	Low	173 Å²	173	104.8 Å²	104.8	93%	0.925	58%	0.578	S	S	*	*			trans	-69.9	103.1	-177.2	-138.3	1.9	0	0	0	109.5
909	Y	43.6	Very low	52.6	Low	113 Å²	113	100.3 Å²	100.3	44%	0.443	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-93	136.2	178.5	-80.2	-82.3	0	0	0	110.9	M907 M911 T970 Q974	M907-Y909 HydrophobicContact CB-CD2 4.48Å; M907-Y909 HydrophobicContact CB-CE2 4.03Å; M907-Y909 WeakPolarHBondContact O-CD2 3.45Å; M907-Y909 PolarHBondContact O-N 3.24Å; M907-Y909 VanDerWaalsContact O-N 3.11Å; Y909-M911 PolarHBondContact O-N 3.05Å; Y909-T970 HydrophobicContact CE1-CG2 4.42Å; Y909-Q974 HydrophobicContact CD1-CG 4.47Å; Y909-Q974 HydrophobicContact CG-CG 4.36Å
910	P	45.6	Very low	54.9	Low	90 Å²	90	94.8 Å²	94.8	58%	0.584	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-66.6	122.5	175	26.1	-31.4	0	0	0	110.4	F912	P910-F912 HydrophobicContact CG-CZ 4.36Å; P910-F912 PolarHBondContact O-N 3.22Å
911	M	48.5	Very low	55.8	Low	146 Å²	146	92.5 Å²	92.5	72%	0.719	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-74.6	116.9	179.2	-155.7	177.4	87.1	0	0	109.9	Y909	Y909-M911 PolarHBondContact O-N 3.05Å
912	F	61.9	Low	57.8	Low	46 Å²	46	83.9 Å²	83.9	20%	0.202	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-84.2	129.4	179.9	-56.5	-67.9	0	0	0	110.8	P910 W918 S921 L939 L971 Q974	P910-F912 HydrophobicContact CG-CZ 4.36Å; P910-F912 PolarHBondContact O-N 3.22Å; F912-W918 HydrophobicContact CB-CB 4.25Å; F912-W918 HydrophobicContact CD1-CB 4.47Å; F912-W918 HydrophobicContact CG-CB 4.2Å; F912-S921 VanDerWaalsContact CE1-OG 3.29Å; F912-S921 WeakPolarHBondContact CE1-OG 3.38Å; F912-L939 HydrophobicContact CB-CD1 3.87Å; F912-L939 WeakPolarHBondContact O-CD1 3.29Å; F912-L971 HydrophobicContact CD2-CD1 3.89Å; F912-L971 HydrophobicContact CE2-CD1 4.43Å; F912-Q974 VanDerWaalsContact CD2-OE1 3.28Å
913	I	60.2	Low	59.6	Low	150 Å²	150	85 Å²	85	77%	0.769	46%	0.459	S	S	*	.			trans	-89.9	-21.3	-173.3	-56.6	171.3	0	0	0	111.7
914	S	76.6	Confident	61.4	Low	44 Å²	44	79.5 Å²	79.5	31%	0.308	42%	0.423	S	S	.	.	S	Bend	trans	-152.2	161.9	177.1	74.1	0	0	0	0	113.3	G916 D917 W918	S914-G916 PolarHBondContact O-N 2.93Å; S914-G916 PolarHBondContact OG-N 3.26Å; S914-D917 WeakPolarHBondContact CB-OD2 3.46Å; S914-D917 PolarHBondContact N-OD2 2.92Å; S914-D917 PolarHBondContact O-N 3.05Å; S914-D917 VanDerWaalsContact O-N 3.14Å; S914-D917 PolarHBondContact OG-N 3.36Å; S914-D917 VanDerWaalsContact OG-N 3.1Å; S914-D917 PolarHBondContact OG-OD2 3.13Å; S914-W918 PolarHBondContact O-N 2.76Å
915	V	80.8	Confident	63.9	Low	5 Å²	5	78.5 Å²	78.5	3%	0.03	41%	0.408	C	S	.	.	H	α-helix	trans	-56.8	-31.7	171.1	176.7	0	0	0	0	111.1	W918 L919 F931 L939 V942	V915-W918 HydrophobicContact CG1-CE3 4.24Å; V915-L919 HydrophobicContact CG1-CD1 4.09Å; V915-L919 HydrophobicContact CG1-CG 4.43Å; V915-L919 WeakPolarHBondContact O-CB 3.34Å; V915-L919 VanDerWaalsContact O-CG 3.31Å; V915-L919 WeakPolarHBondContact O-CG 3.36Å; V915-L919 PolarHBondContact O-N 3.13Å; V915-F931 HydrophobicContact CG1-CB 4.24Å; V915-F931 HydrophobicContact CG1-CD1 4.25Å; V915-F931 HydrophobicContact CG1-CG 4.47Å; V915-L939 HydrophobicContact CG2-CD2 4.07Å; V915-L939 HydrophobicContact CG2-CG 4.37Å; V915-V942 HydrophobicContact CG1-CG2 3.85Å; V915-V942 HydrophobicContact CG2-CG2 3.81Å
916	G	79.1	Confident	66.2	Low	6 Å²	6	74.1 Å²	74.1	6%	0.062	39%	0.387	C	S	.	.	H	α-helix	trans	-63.4	-51.8	174.2	0	0	0	0	0	112.6	S914 W918 L919 D920 K928	S914-G916 PolarHBondContact O-N 2.93Å; S914-G916 PolarHBondContact OG-N 3.26Å; G916-W918 VanDerWaalsContact C-N 3.28Å; G916-W918 PolarHBondContact O-N 3.47Å; G916-L919 PolarHBondContact O-N 2.88Å; G916-D920 WeakPolarHBondContact O-CB 3.39Å; G916-D920 PolarHBondContact O-N 3.37Å; G916-K928 VanDerWaalsContact CA-CE 3.4Å
917	D	76.3	Confident	68.8	Low	71 Å²	71	68.4 Å²	68.4	38%	0.38	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-34.2	-178.6	-54	-42.2	0	0	0	111.5	S914 D920 S921	S914-D917 WeakPolarHBondContact CB-OD2 3.46Å; S914-D917 PolarHBondContact N-OD2 2.92Å; S914-D917 PolarHBondContact O-N 3.05Å; S914-D917 VanDerWaalsContact O-N 3.14Å; S914-D917 PolarHBondContact OG-N 3.36Å; S914-D917 VanDerWaalsContact OG-N 3.1Å; S914-D917 PolarHBondContact OG-OD2 3.13Å; D917-D920 PolarHBondContact O-N 2.95Å; D917-S921 WeakPolarHBondContact O-CB 3.32Å; D917-S921 PolarHBondContact O-N 3.37Å
918	W	85	Confident	71.3	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-63.9	-50.1	172.3	170.2	66.3	0	0	0	111.9	F912 S914 V915 G916 D920 S921 I922 F931 L939 V942 I964 S967 I968 L971	F912-W918 HydrophobicContact CB-CB 4.25Å; F912-W918 HydrophobicContact CD1-CB 4.47Å; F912-W918 HydrophobicContact CG-CB 4.2Å; S914-W918 PolarHBondContact O-N 2.76Å; V915-W918 HydrophobicContact CG1-CE3 4.24Å; G916-W918 VanDerWaalsContact C-N 3.28Å; G916-W918 PolarHBondContact O-N 3.47Å; W918-D920 VanDerWaalsContact C-N 3.28Å; W918-D920 PolarHBondContact O-N 3.43Å; W918-S921 WeakPolarHBondContact O-CB 3.09Å; W918-S921 PolarHBondContact O-N 3.37Å; W918-S921 VanDerWaalsContact O-N 3.17Å; W918-S921 PolarHBondContact O-OG 2.97Å; W918-I922 HydrophobicContact CH2-CD1 4.29Å; W918-I922 HydrophobicContact CZ2-CD1 3.95Å; W918-I922 PolarHBondContact O-N 3.45Å; W918-F931 HydrophobicContact CH2-CE1 4.29Å; W918-F931 HydrophobicContact CH2-CZ 4.36Å; W918-F931 HydrophobicContact CZ3-CD1 4.47Å; W918-F931 AromaticContact CZ3-CE1 3.86Å; W918-F931 HydrophobicContact CZ3-CE1 3.86Å; W918-F931 HydrophobicContact CZ3-CZ 4.13Å; W918-L939 HydrophobicContact CB-CD2 3.68Å; W918-L939 HydrophobicContact CD2-CD2 4.43Å; W918-L939 HydrophobicContact CG-CD2 4.04Å; W918-V942 HydrophobicContact CD2-CG1 4.43Å; W918-V942 HydrophobicContact CE3-CG1 3.83Å; W918-V942 HydrophobicContact CH2-CG1 3.28Å; W918-V942 HydrophobicContact CZ2-CG1 3.93Å; W918-V942 HydrophobicContact CZ3-CB 4.41Å; W918-V942 HydrophobicContact CZ3-CG1 3.24Å; W918-V942 HydrophobicContact CZ3-CG2 4.39Å; W918-I964 HydrophobicContact CH2-CG2 4.17Å; W918-S967 PolarHBondContact NE1-OG 2.86Å; W918-I968 HydrophobicContact CH2-CD1 4.26Å; W918-I968 HydrophobicContact CH2-CG1 3.62Å; W918-I968 HydrophobicContact CZ2-CG1 3.71Å; W918-L971 HydrophobicContact CD2-CD1 4.45Å; W918-L971 HydrophobicContact CG-CD1 3.97Å
919	L	81	Confident	73.5	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-60.1	-38.9	175.4	-75.6	172.2	0	0	0	111.5	V915 G916 I922 K923 M924 T925 K928 F931	V915-L919 HydrophobicContact CG1-CD1 4.09Å; V915-L919 HydrophobicContact CG1-CG 4.43Å; V915-L919 WeakPolarHBondContact O-CB 3.34Å; V915-L919 VanDerWaalsContact O-CG 3.31Å; V915-L919 WeakPolarHBondContact O-CG 3.36Å; V915-L919 PolarHBondContact O-N 3.13Å; G916-L919 PolarHBondContact O-N 2.88Å; L919-I922 HydrophobicContact CD2-CD1 4.37Å; L919-I922 WeakPolarHBondContact O-CG1 3.36Å; L919-I922 PolarHBondContact O-N 3.12Å; L919-K923 PolarHBondContact O-N 3.15Å; L919-M924 HydrophobicContact CD2-CB 3.81Å; L919-M924 CarbonylContact O-C 3.6Å; L919-M924 WeakPolarHBondContact O-CA 3.46Å; L919-M924 PolarHBondContact O-N 3Å; L919-T925 PolarHBondContact O-N 3.49Å; L919-K928 HydrophobicContact CD1-CB 4.13Å; L919-F931 HydrophobicContact CD1-CB 4.3Å; L919-F931 HydrophobicContact CD1-CD2 3.92Å; L919-F931 HydrophobicContact CD1-CE2 4.45Å; L919-F931 HydrophobicContact CD1-CG 4.08Å; L919-F931 HydrophobicContact CD2-CD2 4.26Å; L919-F931 HydrophobicContact CD2-CE2 3.96Å; L919-F931 HydrophobicContact CD2-CZ 4.27Å
920	D	77.8	Confident	75.7	Confident	59 Å²	59	58 Å²	58	32%	0.316	31%	0.313	S	S	.	.	H	α-helix	trans	-63.2	-42.1	176.5	-63.4	-15.5	0	0	0	111.1	G916 D917 W918 I922 K923 T925 K928	G916-D920 WeakPolarHBondContact O-CB 3.39Å; G916-D920 PolarHBondContact O-N 3.37Å; D917-D920 PolarHBondContact O-N 2.95Å; W918-D920 VanDerWaalsContact C-N 3.28Å; W918-D920 PolarHBondContact O-N 3.43Å; D920-I922 VanDerWaalsContact C-N 3.28Å; D920-I922 PolarHBondContact O-N 3.47Å; D920-K923 PolarHBondContact O-N 3Å; D920-T925 WeakPolarHBondContact CA-OG1 3.42Å; D920-T925 WeakPolarHBondContact OD1-CB 3.39Å; D920-T925 WeakPolarHBondContact OD1-CG2 3.31Å; D920-T925 PolarHBondContact OD1-OG1 3.05Å; D920-K928 IonicContact OD2-NZ 2.89Å
921	S	71.1	Confident	77.8	Confident	61 Å²	61	53.7 Å²	53.7	43%	0.427	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-32.1	178.9	81.1	0	0	0	0	113.5	F912 D917 W918 K923	F912-S921 VanDerWaalsContact CE1-OG 3.29Å; F912-S921 WeakPolarHBondContact CE1-OG 3.38Å; D917-S921 WeakPolarHBondContact O-CB 3.32Å; D917-S921 PolarHBondContact O-N 3.37Å; W918-S921 WeakPolarHBondContact O-CB 3.09Å; W918-S921 PolarHBondContact O-N 3.37Å; W918-S921 VanDerWaalsContact O-N 3.17Å; W918-S921 PolarHBondContact O-OG 2.97Å; S921-K923 VanDerWaalsContact C-N 3.34Å
922	I	75.4	Confident	79.5	Confident	21 Å²	21	52 Å²	52	11%	0.108	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	11.6	177.2	64.6	173.5	0	0	0	112.8	W918 L919 D920 M924 R963 I964 S967	W918-I922 HydrophobicContact CH2-CD1 4.29Å; W918-I922 HydrophobicContact CZ2-CD1 3.95Å; W918-I922 PolarHBondContact O-N 3.45Å; L919-I922 HydrophobicContact CD2-CD1 4.37Å; L919-I922 WeakPolarHBondContact O-CG1 3.36Å; L919-I922 PolarHBondContact O-N 3.12Å; D920-I922 VanDerWaalsContact C-N 3.28Å; D920-I922 PolarHBondContact O-N 3.47Å; I922-M924 VanDerWaalsContact C-N 3.26Å; I922-M924 HydrophobicContact CD1-CB 4.06Å; I922-M924 HydrophobicContact CD1-CG 3.92Å; I922-M924 HydrophobicContact CG1-CB 3.8Å; I922-M924 HydrophobicContact CG1-CG 3.78Å; I922-M924 PolarHBondContact O-N 3.37Å; I922-R963 PolarHBondContact O-NE 3.5Å; I922-R963 PolarHBondContact O-NH2 3Å; I922-R963 VanDerWaalsContact O-NH2 3.14Å; I922-I964 HydrophobicContact CD1-CG1 4.18Å; I922-S967 WeakPolarHBondContact CG2-OG 3.47Å
923	K	73.1	Confident	80.4	Confident	112 Å²	112	54.1 Å²	54.1	49%	0.487	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	41.3	-179	-56.8	178.2	-179	162.1	0	111.8	E840 L919 D920 S921	E840-K923 IonicContact OE1-NZ 2.78Å; E840-K923 PolarHBondContact OE1-NZ 3.36Å; E840-K923 IonicContact OE2-NZ 3.84Å; E840-K923 PolarHBondContact OE2-NZ 3.15Å; L919-K923 PolarHBondContact O-N 3.15Å; D920-K923 PolarHBondContact O-N 3Å; S921-K923 VanDerWaalsContact C-N 3.34Å
924	M	87.1	Confident	81.5	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	29%	0.285	C	S	.	.			trans	-120.6	23	178	-66.8	-64	141.2	0	0	112.5	L919 I922 Q926 Y927 H960 R963 I964	L919-M924 HydrophobicContact CD2-CB 3.81Å; L919-M924 CarbonylContact O-C 3.6Å; L919-M924 WeakPolarHBondContact O-CA 3.46Å; L919-M924 PolarHBondContact O-N 3Å; I922-M924 VanDerWaalsContact C-N 3.26Å; I922-M924 HydrophobicContact CD1-CB 4.06Å; I922-M924 HydrophobicContact CD1-CG 3.92Å; I922-M924 HydrophobicContact CG1-CB 3.8Å; I922-M924 HydrophobicContact CG1-CG 3.78Å; I922-M924 PolarHBondContact O-N 3.37Å; M924-Q926 PolarHBondContact O-N 3.34Å; M924-Y927 HydrophobicContact CB-CD2 4.11Å; M924-Y927 PolarHBondContact O-N 3.2Å; M924-Y927 HydrophobicContact SD-CD2 3.87Å; M924-Y927 HydrophobicContact SD-CE2 3.64Å; M924-H960 HydrophobicContact CE-CB 4.26Å; M924-H960 HydrophobicContact SD-CB 3.94Å; M924-R963 HydrophobicContact CE-CB 4.44Å; M924-R963 HydrophobicContact CE-CG 4.21Å; M924-I964 HydrophobicContact CB-CD1 4.25Å; M924-I964 HydrophobicContact CB-CG1 4.2Å; M924-I964 HydrophobicContact CG-CD1 4.07Å; M924-I964 HydrophobicContact CG-CG1 3.7Å; M924-I964 HydrophobicContact SD-CD1 4.18Å; M924-I964 HydrophobicContact SD-CG1 4.22Å
925	T	83.7	Confident	81.8	Confident	66 Å²	66	49.4 Å²	49.4	41%	0.405	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-48.9	-34.8	177.9	-51.4	0	0	0	0	113.2	L919 D920 Y927 K928	L919-T925 PolarHBondContact O-N 3.49Å; D920-T925 WeakPolarHBondContact CA-OG1 3.42Å; D920-T925 WeakPolarHBondContact OD1-CB 3.39Å; D920-T925 WeakPolarHBondContact OD1-CG2 3.31Å; D920-T925 PolarHBondContact OD1-OG1 3.05Å; T925-Y927 PolarHBondContact O-N 2.91Å; T925-Y927 VanDerWaalsContact O-N 3.08Å; T925-K928 WeakPolarHBondContact O-CB 3.46Å; T925-K928 PolarHBondContact O-N 3.5Å
926	Q	81.1	Confident	82.1	Confident	101 Å²	101	51 Å²	51	47%	0.472	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-61.4	-19.9	-178.8	69	-94.7	17.8	0	0	113.6	M924	M924-Q926 PolarHBondContact O-N 3.34Å
927	Y	88.2	Confident	82.2	Confident	24 Å²	24	55.4 Å²	55.4	9%	0.094	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-92.2	1.7	178.2	-59.4	-65.7	0	0	0	113.3	M924 T925 S929 N930 F931 V955 H960 I964	M924-Y927 HydrophobicContact CB-CD2 4.11Å; M924-Y927 PolarHBondContact O-N 3.2Å; M924-Y927 HydrophobicContact SD-CD2 3.87Å; M924-Y927 HydrophobicContact SD-CE2 3.64Å; T925-Y927 PolarHBondContact O-N 2.91Å; T925-Y927 VanDerWaalsContact O-N 3.08Å; Y927-S929 VanDerWaalsContact C-N 3.32Å; Y927-S929 PolarHBondContact O-N 3.35Å; Y927-N930 WeakPolarHBondContact O-CA 3.31Å; Y927-N930 WeakPolarHBondContact O-CB 3.28Å; Y927-N930 PolarHBondContact O-N 3.43Å; Y927-F931 WeakPolarHBondContact O-CD2 3.41Å; Y927-F931 PolarHBondContact O-N 3.06Å; Y927-V955 HydrophobicContact CD1-CG2 3.78Å; Y927-V955 HydrophobicContact CD2-CG2 4.36Å; Y927-V955 HydrophobicContact CE1-CB 4.36Å; Y927-V955 HydrophobicContact CE1-CG1 4.33Å; Y927-V955 HydrophobicContact CE1-CG2 4.02Å; Y927-V955 HydrophobicContact CE2-CG1 4.21Å; Y927-V955 HydrophobicContact CG-CG2 3.96Å; Y927-H960 HydrophobicContact CE2-CB 4.07Å; Y927-H960 AromaticContact CE2-ND1 3.56Å; Y927-H960 AromaticContact CZ-ND1 3.64Å; Y927-H960 PolarHBondContact OH-ND1 3.05Å; Y927-I964 HydrophobicContact CD2-CD1 3.81Å; Y927-I964 HydrophobicContact CE2-CD1 4.26Å; Y927-I964 HydrophobicContact CG-CD1 4.4Å
928	K	86.8	Confident	82.5	Confident	81 Å²	81	55.2 Å²	55.2	35%	0.352	32%	0.323	S	S	.	.	H	α-helix	trans	-56.7	-42.1	-177.4	-171.4	169.8	-175.9	161.4	0	112.8	G916 L919 D920 T925 N930 M932	G916-K928 VanDerWaalsContact CA-CE 3.4Å; L919-K928 HydrophobicContact CD1-CB 4.13Å; D920-K928 IonicContact OD2-NZ 2.89Å; T925-K928 WeakPolarHBondContact O-CB 3.46Å; T925-K928 PolarHBondContact O-N 3.5Å; K928-N930 VanDerWaalsContact C-N 3.32Å; K928-N930 PolarHBondContact O-N 2.74Å; K928-M932 WeakPolarHBondContact O-CB 3.32Å; K928-M932 WeakPolarHBondContact O-CG 3.45Å; K928-M932 PolarHBondContact O-N 3.06Å; K928-M932 VanDerWaalsContact O-N 3.17Å
929	S	80.8	Confident	82.3	Confident	79 Å²	79	56.5 Å²	56.5	55%	0.552	33%	0.33	S	S	*	.	H	α-helix	trans	-65.1	-35.5	174.3	49.6	0	0	0	0	112.7	Y927 M932 A933	Y927-S929 VanDerWaalsContact C-N 3.32Å; Y927-S929 PolarHBondContact O-N 3.35Å; S929-M932 PolarHBondContact O-N 2.88Å; S929-A933 WeakPolarHBondContact O-CB 3.48Å; S929-A933 PolarHBondContact O-N 2.96Å
930	N	89.4	Confident	82.1	Confident	54 Å²	54	59.9 Å²	59.9	29%	0.289	35%	0.348	S	S	.	.	H	α-helix	trans	-72.1	-43.2	-176.4	-64.3	13	0	0	0	111.4	Y927 K928 A934 I953	Y927-N930 WeakPolarHBondContact O-CA 3.31Å; Y927-N930 WeakPolarHBondContact O-CB 3.28Å; Y927-N930 PolarHBondContact O-N 3.43Å; K928-N930 VanDerWaalsContact C-N 3.32Å; K928-N930 PolarHBondContact O-N 2.74Å; N930-A934 VanDerWaalsContact O-CB 3.3Å; N930-A934 WeakPolarHBondContact O-CB 3.26Å; N930-A934 PolarHBondContact O-N 2.95Å; N930-I953 WeakPolarHBondContact CB-O 3.35Å; N930-I953 PolarHBondContact ND2-O 2.99Å
931	F	90.9	Very high	82.3	Confident	0 Å²	0	58 Å²	58	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-45.4	173	-85.6	-103.1	0	0	0	111.4	V915 W918 L919 Y927 A934 G935 F936 V942 M945 I953 I964	V915-F931 HydrophobicContact CG1-CB 4.24Å; V915-F931 HydrophobicContact CG1-CD1 4.25Å; V915-F931 HydrophobicContact CG1-CG 4.47Å; W918-F931 HydrophobicContact CH2-CE1 4.29Å; W918-F931 HydrophobicContact CH2-CZ 4.36Å; W918-F931 HydrophobicContact CZ3-CD1 4.47Å; W918-F931 AromaticContact CZ3-CE1 3.86Å; W918-F931 HydrophobicContact CZ3-CE1 3.86Å; W918-F931 HydrophobicContact CZ3-CZ 4.13Å; L919-F931 HydrophobicContact CD1-CB 4.3Å; L919-F931 HydrophobicContact CD1-CD2 3.92Å; L919-F931 HydrophobicContact CD1-CE2 4.45Å; L919-F931 HydrophobicContact CD1-CG 4.08Å; L919-F931 HydrophobicContact CD2-CD2 4.26Å; L919-F931 HydrophobicContact CD2-CE2 3.96Å; L919-F931 HydrophobicContact CD2-CZ 4.27Å; Y927-F931 WeakPolarHBondContact O-CD2 3.41Å; Y927-F931 PolarHBondContact O-N 3.06Å; F931-A934 PolarHBondContact O-N 3.27Å; F931-G935 PolarHBondContact O-N 2.84Å; F931-F936 HydrophobicContact CB-CB 4.41Å; F931-F936 HydrophobicContact CD1-CB 3.93Å; F931-F936 WeakPolarHBondContact O-CA 3.45Å; F931-F936 WeakPolarHBondContact O-CB 3.29Å; F931-F936 PolarHBondContact O-N 3.45Å; F931-V942 HydrophobicContact CD1-CG2 3.75Å; F931-V942 HydrophobicContact CE1-CG1 4.15Å; F931-V942 HydrophobicContact CE1-CG2 3.97Å; F931-M945 HydrophobicContact CD1-CE 4.48Å; F931-M945 HydrophobicContact CD1-SD 3.95Å; F931-M945 HydrophobicContact CE1-CE 3.89Å; F931-M945 HydrophobicContact CE1-SD 3.41Å; F931-M945 WeakPolarHBondContact CE1-SD 3.49Å; F931-M945 HydrophobicContact CZ-CE 4.24Å; F931-M945 HydrophobicContact CZ-SD 4.26Å; F931-I953 HydrophobicContact CD1-CD1 4Å; F931-I953 HydrophobicContact CD2-CD1 3.35Å; F931-I953 HydrophobicContact CE1-CD1 3.89Å; F931-I953 HydrophobicContact CE2-CD1 3.22Å; F931-I953 HydrophobicContact CG-CD1 3.76Å; F931-I953 HydrophobicContact CZ-CD1 3.51Å; F931-I964 HydrophobicContact CE2-CD1 4.26Å; F931-I964 HydrophobicContact CE2-CG2 4.49Å; F931-I964 HydrophobicContact CZ-CG2 3.77Å
932	M	83.4	Confident	83	Confident	109 Å²	109	55.1 Å²	55.1	54%	0.537	32%	0.319	S	S	.	.	H	α-helix	trans	-66.4	-41.4	178.9	-66.6	-66.8	-73.5	0	0	112.6	K928 S929 A934 G935 N937	K928-M932 WeakPolarHBondContact O-CB 3.32Å; K928-M932 WeakPolarHBondContact O-CG 3.45Å; K928-M932 PolarHBondContact O-N 3.06Å; K928-M932 VanDerWaalsContact O-N 3.17Å; S929-M932 PolarHBondContact O-N 2.88Å; M932-A934 VanDerWaalsContact C-N 3.32Å; M932-A934 PolarHBondContact O-N 3.16Å; M932-G935 PolarHBondContact O-N 3.48Å; M932-N937 HydrophobicContact CE-CB 4.19Å; M932-N937 HydrophobicContact SD-CB 3.84Å
933	A	80.9	Confident	83.2	Confident	92 Å²	92	54.5 Å²	54.5	76%	0.76	32%	0.317	S	S	*	.	H	α-helix	trans	-68.2	-30.8	179.2	0	0	0	0	0	112.9	S929 G935	S929-A933 WeakPolarHBondContact O-CB 3.48Å; S929-A933 PolarHBondContact O-N 2.96Å; A933-G935 VanDerWaalsContact C-N 3.28Å; A933-G935 PolarHBondContact O-N 3.4Å
934	A	83.9	Confident	83.6	Confident	49 Å²	49	57.5 Å²	57.5	41%	0.405	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	2	176.2	0	0	0	0	0	114.1	N930 F931 M932 F936 I953	N930-A934 VanDerWaalsContact O-CB 3.3Å; N930-A934 WeakPolarHBondContact O-CB 3.26Å; N930-A934 PolarHBondContact O-N 2.95Å; F931-A934 PolarHBondContact O-N 3.27Å; M932-A934 VanDerWaalsContact C-N 3.32Å; M932-A934 PolarHBondContact O-N 3.16Å; A934-F936 HydrophobicContact CB-CD2 3.81Å; A934-F936 HydrophobicContact CB-CE2 4.07Å; A934-I953 HydrophobicContact CB-CB 4.06Å; A934-I953 HydrophobicContact CB-CG2 3.23Å
935	G	81.1	Confident	83.4	Confident	45 Å²	45	57.8 Å²	57.8	46%	0.464	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	8.1	178	0	0	0	0	0	115	F931 M932 A933 N937	F931-G935 PolarHBondContact O-N 2.84Å; M932-G935 PolarHBondContact O-N 3.48Å; A933-G935 VanDerWaalsContact C-N 3.28Å; A933-G935 PolarHBondContact O-N 3.4Å; G935-N937 VanDerWaalsContact C-N 3.3Å; G935-N937 PolarHBondContact O-N 3.19Å; G935-N937 VanDerWaalsContact O-N 3.13Å
936	F	87.8	Confident	83.3	Confident	39 Å²	39	57 Å²	57	17%	0.171	32%	0.324	C	S	.	.			trans	-87.7	67.2	175	-62.2	-72.5	0	0	0	111	F931 A934 S941 V942 M945 D949 I953	F931-F936 HydrophobicContact CB-CB 4.41Å; F931-F936 HydrophobicContact CD1-CB 3.93Å; F931-F936 WeakPolarHBondContact O-CA 3.45Å; F931-F936 WeakPolarHBondContact O-CB 3.29Å; F931-F936 PolarHBondContact O-N 3.45Å; A934-F936 HydrophobicContact CB-CD2 3.81Å; A934-F936 HydrophobicContact CB-CE2 4.07Å; F936-S941 VanDerWaalsContact CA-OG 3.31Å; F936-S941 WeakPolarHBondContact CA-OG 3.45Å; F936-S941 WeakPolarHBondContact CD1-O 3.42Å; F936-V942 HydrophobicContact CB-CG2 3.95Å; F936-M945 HydrophobicContact CB-SD 4.16Å; F936-M945 HydrophobicContact CD1-CG 3.6Å; F936-M945 HydrophobicContact CD1-SD 3.59Å; F936-M945 VanDerWaalsContact CD1-SD 3.59Å; F936-M945 HydrophobicContact CD2-CE 3.81Å; F936-M945 HydrophobicContact CD2-CG 4.47Å; F936-M945 HydrophobicContact CD2-SD 3.74Å; F936-M945 HydrophobicContact CE1-CE 4.45Å; F936-M945 HydrophobicContact CE1-CG 3.31Å; F936-M945 HydrophobicContact CE1-SD 3.82Å; F936-M945 HydrophobicContact CE2-CE 3.68Å; F936-M945 HydrophobicContact CE2-CG 4.24Å; F936-M945 HydrophobicContact CE2-SD 3.97Å; F936-M945 HydrophobicContact CG-CE 4.26Å; F936-M945 HydrophobicContact CG-CG 4.18Å; F936-M945 HydrophobicContact CG-SD 3.55Å; F936-M945 VanDerWaalsContact CG-SD 3.55Å; F936-M945 HydrophobicContact CZ-CE 4.02Å; F936-M945 HydrophobicContact CZ-CG 3.66Å; F936-M945 HydrophobicContact CZ-SD 4Å; F936-D949 HydrophobicContact CZ-CB 4.37Å; F936-I953 HydrophobicContact CD2-CG2 3.97Å; F936-I953 HydrophobicContact CE2-CG2 3.72Å
937	N	82.6	Confident	83.2	Confident	99 Å²	99	54.8 Å²	54.8	53%	0.529	31%	0.314	S	S	.	.			trans	-95.5	-2	-174.3	60.8	7.1	0	0	0	114.3	M932 G935	M932-N937 HydrophobicContact CE-CB 4.19Å; M932-N937 HydrophobicContact SD-CB 3.84Å; G935-N937 VanDerWaalsContact C-N 3.3Å; G935-N937 PolarHBondContact O-N 3.19Å; G935-N937 VanDerWaalsContact O-N 3.13Å
938	T	82.3	Confident	82.7	Confident	66 Å²	66	58.3 Å²	58.3	41%	0.405	33%	0.332	S	S	.	.	S	Bend	trans	-128.6	148.4	178.2	54.4	0	0	0	0	110.9	D940 S941 V942	T938-D940 PolarHBondContact O-N 2.68Å; T938-S941 PolarHBondContact N-OG 3.1Å; T938-S941 PolarHBondContact O-N 2.76Å; T938-S941 PolarHBondContact O-OG 3.24Å; T938-S941 WeakPolarHBondContact OG1-CB 3.06Å; T938-S941 PolarHBondContact OG1-N 3.18Å; T938-S941 PolarHBondContact OG1-OG 3.08Å; T938-V942 PolarHBondContact O-N 3.36Å; T938-V942 VanDerWaalsContact O-N 3.15Å
939	L	79.8	Confident	82.6	Confident	27 Å²	27	56.2 Å²	56.2	14%	0.141	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-34.3	178.6	-68.8	173.4	0	0	0	111.9	F912 V915 W918 S941 V942 A943 L971	F912-L939 HydrophobicContact CB-CD1 3.87Å; F912-L939 WeakPolarHBondContact O-CD1 3.29Å; V915-L939 HydrophobicContact CG2-CD2 4.07Å; V915-L939 HydrophobicContact CG2-CG 4.37Å; W918-L939 HydrophobicContact CB-CD2 3.68Å; W918-L939 HydrophobicContact CD2-CD2 4.43Å; W918-L939 HydrophobicContact CG-CD2 4.04Å; L939-S941 PolarHBondContact O-N 3.13Å; L939-V942 PolarHBondContact O-N 2.72Å; L939-A943 VanDerWaalsContact O-CB 3.31Å; L939-A943 WeakPolarHBondContact O-CB 3.42Å; L939-A943 PolarHBondContact O-N 2.87Å; L939-L971 HydrophobicContact CB-CD2 4.07Å; L939-L971 HydrophobicContact CD2-CD1 3.87Å; L939-L971 HydrophobicContact CD2-CD2 3.96Å; L939-L971 WeakPolarHBondContact O-CD2 3.42Å
940	D	77.1	Confident	82.8	Confident	72 Å²	72	52.4 Å²	52.4	39%	0.385	30%	0.298	S	S	.	.	H	α-helix	trans	-59.3	-41.2	171	-78.2	-87	0	0	0	114.4	T938 V942 R944	T938-D940 PolarHBondContact O-N 2.68Å; D940-V942 VanDerWaalsContact C-N 3.35Å; D940-R944 VanDerWaalsContact O-CZ 3.25Å; D940-R944 PolarHBondContact O-N 2.81Å; D940-R944 PolarHBondContact O-NH2 2.67Å; D940-R944 IonicContact OD1-NH1 2.76Å
941	S	82.6	Confident	82.6	Confident	20 Å²	20	55.8 Å²	55.8	14%	0.14	31%	0.307	C	S	.	.	H	α-helix	trans	-69	-38.3	178.6	67.5	0	0	0	0	111.3	F936 T938 L939 R944	F936-S941 VanDerWaalsContact CA-OG 3.31Å; F936-S941 WeakPolarHBondContact CA-OG 3.45Å; F936-S941 WeakPolarHBondContact CD1-O 3.42Å; T938-S941 PolarHBondContact N-OG 3.1Å; T938-S941 PolarHBondContact O-N 2.76Å; T938-S941 PolarHBondContact O-OG 3.24Å; T938-S941 WeakPolarHBondContact OG1-CB 3.06Å; T938-S941 PolarHBondContact OG1-N 3.18Å; T938-S941 PolarHBondContact OG1-OG 3.08Å; L939-S941 PolarHBondContact O-N 3.13Å; S941-R944 PolarHBondContact O-N 2.83Å
942	V	85.4	Confident	82.3	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-67.3	-41.1	175.8	168.4	0	0	0	0	111.6	V915 W918 F931 F936 T938 L939 D940 R944 M945 I968 L971	V915-V942 HydrophobicContact CG1-CG2 3.85Å; V915-V942 HydrophobicContact CG2-CG2 3.81Å; W918-V942 HydrophobicContact CD2-CG1 4.43Å; W918-V942 HydrophobicContact CE3-CG1 3.83Å; W918-V942 HydrophobicContact CH2-CG1 3.28Å; W918-V942 HydrophobicContact CZ2-CG1 3.93Å; W918-V942 HydrophobicContact CZ3-CB 4.41Å; W918-V942 HydrophobicContact CZ3-CG1 3.24Å; W918-V942 HydrophobicContact CZ3-CG2 4.39Å; F931-V942 HydrophobicContact CD1-CG2 3.75Å; F931-V942 HydrophobicContact CE1-CG1 4.15Å; F931-V942 HydrophobicContact CE1-CG2 3.97Å; F936-V942 HydrophobicContact CB-CG2 3.95Å; T938-V942 PolarHBondContact O-N 3.36Å; T938-V942 VanDerWaalsContact O-N 3.15Å; L939-V942 PolarHBondContact O-N 2.72Å; D940-V942 VanDerWaalsContact C-N 3.35Å; V942-R944 PolarHBondContact O-N 2.96Å; V942-R944 VanDerWaalsContact O-N 3.13Å; V942-M945 HydrophobicContact CB-SD 4.47Å; V942-M945 HydrophobicContact CG2-SD 4.37Å; V942-M945 VanDerWaalsContact O-CB 3.29Å; V942-M945 WeakPolarHBondContact O-CB 3.22Å; V942-M945 WeakPolarHBondContact O-CG 3.35Å; V942-M945 PolarHBondContact O-N 2.91Å; V942-I968 HydrophobicContact CG1-CD1 4.46Å; V942-I968 HydrophobicContact CG1-CG1 3.92Å; V942-L971 HydrophobicContact CB-CD2 4.23Å; V942-L971 HydrophobicContact CG1-CD2 3.87Å
943	A	80.1	Confident	82.4	Confident	7 Å²	7	60.8 Å²	60.8	6%	0.058	32%	0.321	C	S	.	.	H	α-helix	trans	-62	-20	178.2	0	0	0	0	0	113.1	L939 L971 Q972 L975	L939-A943 VanDerWaalsContact O-CB 3.31Å; L939-A943 WeakPolarHBondContact O-CB 3.42Å; L939-A943 PolarHBondContact O-N 2.87Å; A943-L971 HydrophobicContact CB-CD2 4.13Å; A943-Q972 HydrophobicContact CB-CG 4.03Å; A943-Q972 VanDerWaalsContact O-CD 3.3Å; A943-Q972 WeakPolarHBondContact O-CG 3.5Å; A943-Q972 PolarHBondContact O-NE2 2.89Å; A943-L975 HydrophobicContact CB-CD1 3.37Å
944	R	81.6	Confident	82.3	Confident	176 Å²	176	58 Å²	58	66%	0.664	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	4.5	177.5	-69	-174.7	-72.3	-94.1	-0.6	113.7	D940 S941 V942	D940-R944 VanDerWaalsContact O-CZ 3.25Å; D940-R944 PolarHBondContact O-N 2.81Å; D940-R944 PolarHBondContact O-NH2 2.67Å; D940-R944 IonicContact OD1-NH1 2.76Å; S941-R944 PolarHBondContact O-N 2.83Å; V942-R944 PolarHBondContact O-N 2.96Å; V942-R944 VanDerWaalsContact O-N 3.13Å
945	M	82.9	Confident	82.4	Confident	8 Å²	8	55.6 Å²	55.6	4%	0.039	28%	0.281	C	S	.	.			trans	-74	134.9	-179	-71.4	179.8	71.3	0	0	112.1	F931 F936 V942 D949 V950 I953 I968	F931-M945 HydrophobicContact CD1-CE 4.48Å; F931-M945 HydrophobicContact CD1-SD 3.95Å; F931-M945 HydrophobicContact CE1-CE 3.89Å; F931-M945 HydrophobicContact CE1-SD 3.41Å; F931-M945 WeakPolarHBondContact CE1-SD 3.49Å; F931-M945 HydrophobicContact CZ-CE 4.24Å; F931-M945 HydrophobicContact CZ-SD 4.26Å; F936-M945 HydrophobicContact CB-SD 4.16Å; F936-M945 HydrophobicContact CD1-CG 3.6Å; F936-M945 HydrophobicContact CD1-SD 3.59Å; F936-M945 VanDerWaalsContact CD1-SD 3.59Å; F936-M945 HydrophobicContact CD2-CE 3.81Å; F936-M945 HydrophobicContact CD2-CG 4.47Å; F936-M945 HydrophobicContact CD2-SD 3.74Å; F936-M945 HydrophobicContact CE1-CE 4.45Å; F936-M945 HydrophobicContact CE1-CG 3.31Å; F936-M945 HydrophobicContact CE1-SD 3.82Å; F936-M945 HydrophobicContact CE2-CE 3.68Å; F936-M945 HydrophobicContact CE2-CG 4.24Å; F936-M945 HydrophobicContact CE2-SD 3.97Å; F936-M945 HydrophobicContact CG-CE 4.26Å; F936-M945 HydrophobicContact CG-CG 4.18Å; F936-M945 HydrophobicContact CG-SD 3.55Å; F936-M945 VanDerWaalsContact CG-SD 3.55Å; F936-M945 HydrophobicContact CZ-CE 4.02Å; F936-M945 HydrophobicContact CZ-CG 3.66Å; F936-M945 HydrophobicContact CZ-SD 4Å; V942-M945 HydrophobicContact CB-SD 4.47Å; V942-M945 HydrophobicContact CG2-SD 4.37Å; V942-M945 VanDerWaalsContact O-CB 3.29Å; V942-M945 WeakPolarHBondContact O-CB 3.22Å; V942-M945 WeakPolarHBondContact O-CG 3.35Å; V942-M945 PolarHBondContact O-N 2.91Å; M945-D949 HydrophobicContact CB-CB 4.19Å; M945-D949 HydrophobicContact CE-CB 4Å; M945-D949 HydrophobicContact CG-CB 4.34Å; M945-V950 HydrophobicContact CB-CG2 4.45Å; M945-V950 HydrophobicContact CE-CG2 3.81Å; M945-I953 HydrophobicContact CE-CD1 3.55Å; M945-I953 HydrophobicContact CE-CG1 4.12Å; M945-I953 HydrophobicContact CE-CG2 4.29Å; M945-I968 HydrophobicContact CB-CD1 4.02Å
946	S	80.5	Confident	81.9	Confident	48 Å²	48	59.9 Å²	59.9	34%	0.336	29%	0.289	S	S	.	.			trans	-86.9	167.3	169.3	67.6	0	0	0	0	112	E948 D949 V950	S946-E948 PolarHBondContact O-N 3.29Å; S946-D949 WeakPolarHBondContact CB-OD2 3.24Å; S946-D949 PolarHBondContact N-OD2 2.78Å; S946-D949 WeakPolarHBondContact O-CB 3.36Å; S946-D949 PolarHBondContact O-N 2.79Å; S946-D949 PolarHBondContact OG-N 2.84Å; S946-D949 PolarHBondContact OG-OD2 2.94Å; S946-V950 PolarHBondContact O-N 3.25Å
947	I	78.6	Confident	80.9	Confident	55 Å²	55	62.9 Å²	62.9	28%	0.282	31%	0.306	S	S	.	.	H	α-helix	trans	-57	-35.5	171.4	-175.7	68.9	0	0	0	111.6	V950 R951 Q961 I965	I947-V950 PolarHBondContact O-N 2.84Å; I947-R951 VanDerWaalsContact O-CG 3.31Å; I947-R951 WeakPolarHBondContact O-CG 3.1Å; I947-R951 PolarHBondContact O-N 3.46Å; I947-Q961 HydrophobicContact CD1-CB 3.92Å; I947-I965 HydrophobicContact CB-CD1 4.18Å; I947-I965 HydrophobicContact CB-CG1 4.26Å; I947-I965 HydrophobicContact CD1-CD1 4.44Å; I947-I965 HydrophobicContact CD1-CG1 3.64Å
948	E	78.9	Confident	80	Confident	98 Å²	98	63 Å²	63	46%	0.458	31%	0.306	S	S	.	.	H	α-helix	trans	-65.7	-35.6	172.9	-95.6	61.1	-122.4	0	0	112.8	S946 R951 R952	S946-E948 PolarHBondContact O-N 3.29Å; E948-R951 PolarHBondContact O-N 3.04Å; E948-R951 IonicContact OE1-CZ 2.87Å; E948-R951 IonicContact OE1-NH1 3.58Å; E948-R951 PolarHBondContact OE1-NH1 2.96Å; E948-R952 VanDerWaalsContact O-CB 3.28Å; E948-R952 WeakPolarHBondContact O-CB 3.45Å; E948-R952 PolarHBondContact O-N 3.5Å
949	D	84.8	Confident	78.6	Confident	37 Å²	37	62.3 Å²	62.3	20%	0.198	31%	0.312	C	S	.	.	H	α-helix	trans	-70.6	-42.5	176.1	-60.3	-50.9	0	0	0	111.2	F936 M945 S946 R951 R952 I953	F936-D949 HydrophobicContact CZ-CB 4.37Å; M945-D949 HydrophobicContact CB-CB 4.19Å; M945-D949 HydrophobicContact CE-CB 4Å; M945-D949 HydrophobicContact CG-CB 4.34Å; S946-D949 WeakPolarHBondContact CB-OD2 3.24Å; S946-D949 PolarHBondContact N-OD2 2.78Å; S946-D949 WeakPolarHBondContact O-CB 3.36Å; S946-D949 PolarHBondContact O-N 2.79Å; S946-D949 PolarHBondContact OG-N 2.84Å; S946-D949 PolarHBondContact OG-OD2 2.94Å; D949-R951 VanDerWaalsContact C-N 3.27Å; D949-R951 PolarHBondContact O-N 2.76Å; D949-R952 PolarHBondContact O-N 2.96Å; D949-R952 IonicContact OD1-NH1 2.91Å; D949-I953 WeakPolarHBondContact O-CG1 3.4Å; D949-I953 WeakPolarHBondContact O-CG2 3.28Å; D949-I953 PolarHBondContact O-N 2.9Å
950	V	85.4	Confident	78.6	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-38.8	175	173.9	0	0	0	0	111.2	M945 S946 I947 I953 V955 Q961 I964 I965 I968	M945-V950 HydrophobicContact CB-CG2 4.45Å; M945-V950 HydrophobicContact CE-CG2 3.81Å; S946-V950 PolarHBondContact O-N 3.25Å; I947-V950 PolarHBondContact O-N 2.84Å; V950-I953 VanDerWaalsContact O-CG1 3.22Å; V950-I953 WeakPolarHBondContact O-CG1 3.25Å; V950-V955 HydrophobicContact CG1-CB 3.75Å; V950-V955 HydrophobicContact CG1-CG1 4.13Å; V950-V955 HydrophobicContact CG1-CG2 3.9Å; V950-V955 WeakPolarHBondContact O-CB 3.31Å; V950-V955 PolarHBondContact O-N 3.5Å; V950-Q961 HydrophobicContact CG1-CG 4.39Å; V950-I964 HydrophobicContact CG1-CB 4.32Å; V950-I964 HydrophobicContact CG1-CG2 3.93Å; V950-I964 HydrophobicContact CG2-CG2 3.88Å; V950-I965 HydrophobicContact CB-CD1 4.32Å; V950-I965 HydrophobicContact CB-CG1 4.46Å; V950-I965 HydrophobicContact CG2-CD1 3.63Å; V950-I965 HydrophobicContact CG2-CG1 4.09Å; V950-I968 HydrophobicContact CG2-CD1 3.78Å
951	R	83.4	Confident	78.4	Confident	125 Å²	125	60.6 Å²	60.6	47%	0.472	30%	0.301	S	S	.	.	H	α-helix	trans	-65.6	-43.7	171.1	-75.2	170.4	177.2	170.5	-4	112.1	I947 E948 D949 I953 G954 Q961	I947-R951 VanDerWaalsContact O-CG 3.31Å; I947-R951 WeakPolarHBondContact O-CG 3.1Å; I947-R951 PolarHBondContact O-N 3.46Å; E948-R951 PolarHBondContact O-N 3.04Å; E948-R951 IonicContact OE1-CZ 2.87Å; E948-R951 IonicContact OE1-NH1 3.58Å; E948-R951 PolarHBondContact OE1-NH1 2.96Å; D949-R951 VanDerWaalsContact C-N 3.27Å; D949-R951 PolarHBondContact O-N 2.76Å; R951-I953 VanDerWaalsContact C-N 3.27Å; R951-I953 PolarHBondContact O-N 3.17Å; R951-G954 PolarHBondContact O-N 2.95Å; R951-Q961 HydrophobicContact CG-CG 4.42Å
952	R	84.8	Confident	77.8	Confident	195 Å²	195	66.9 Å²	66.9	74%	0.736	32%	0.321	S	S	*	.	H	α-helix	trans	-65.6	-29	-177.6	-168.5	-179.3	-65.5	159.7	2.8	113	E948 D949 G954	E948-R952 VanDerWaalsContact O-CB 3.28Å; E948-R952 WeakPolarHBondContact O-CB 3.45Å; E948-R952 PolarHBondContact O-N 3.5Å; D949-R952 PolarHBondContact O-N 2.96Å; D949-R952 IonicContact OD1-NH1 2.91Å; R952-G954 PolarHBondContact O-N 2.93Å
953	I	87.3	Confident	77	Confident	18 Å²	18	72 Å²	72	9%	0.092	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	8.3	175	68	163.5	0	0	0	113.5	N930 F931 A934 F936 M945 D949 V950 R951 V955	N930-I953 WeakPolarHBondContact CB-O 3.35Å; N930-I953 PolarHBondContact ND2-O 2.99Å; F931-I953 HydrophobicContact CD1-CD1 4Å; F931-I953 HydrophobicContact CD2-CD1 3.35Å; F931-I953 HydrophobicContact CE1-CD1 3.89Å; F931-I953 HydrophobicContact CE2-CD1 3.22Å; F931-I953 HydrophobicContact CG-CD1 3.76Å; F931-I953 HydrophobicContact CZ-CD1 3.51Å; A934-I953 HydrophobicContact CB-CB 4.06Å; A934-I953 HydrophobicContact CB-CG2 3.23Å; F936-I953 HydrophobicContact CD2-CG2 3.97Å; F936-I953 HydrophobicContact CE2-CG2 3.72Å; M945-I953 HydrophobicContact CE-CD1 3.55Å; M945-I953 HydrophobicContact CE-CG1 4.12Å; M945-I953 HydrophobicContact CE-CG2 4.29Å; D949-I953 WeakPolarHBondContact O-CG1 3.4Å; D949-I953 WeakPolarHBondContact O-CG2 3.28Å; D949-I953 PolarHBondContact O-N 2.9Å; V950-I953 VanDerWaalsContact O-CG1 3.22Å; V950-I953 WeakPolarHBondContact O-CG1 3.25Å; R951-I953 VanDerWaalsContact C-N 3.27Å; R951-I953 PolarHBondContact O-N 3.17Å; I953-V955 HydrophobicContact CD1-CG2 4.42Å; I953-V955 HydrophobicContact CG1-CG2 4.27Å
954	G	78.3	Confident	77	Confident	33 Å²	33	71.7 Å²	71.7	34%	0.34	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	25.8	171.3	0	0	0	0	0	115.1	R951 R952	R951-G954 PolarHBondContact O-N 2.95Å; R952-G954 PolarHBondContact O-N 2.93Å
955	V	84.6	Confident	77	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.313	C	S	.	.			trans	-89.6	97	166.1	-174.8	0	0	0	0	108.2	Y927 V950 I953 H960 Q961 I964	Y927-V955 HydrophobicContact CD1-CG2 3.78Å; Y927-V955 HydrophobicContact CD2-CG2 4.36Å; Y927-V955 HydrophobicContact CE1-CB 4.36Å; Y927-V955 HydrophobicContact CE1-CG1 4.33Å; Y927-V955 HydrophobicContact CE1-CG2 4.02Å; Y927-V955 HydrophobicContact CE2-CG1 4.21Å; Y927-V955 HydrophobicContact CG-CG2 3.96Å; V950-V955 HydrophobicContact CG1-CB 3.75Å; V950-V955 HydrophobicContact CG1-CG1 4.13Å; V950-V955 HydrophobicContact CG1-CG2 3.9Å; V950-V955 WeakPolarHBondContact O-CB 3.31Å; V950-V955 PolarHBondContact O-N 3.5Å; I953-V955 HydrophobicContact CD1-CG2 4.42Å; I953-V955 HydrophobicContact CG1-CG2 4.27Å; V955-H960 HydrophobicContact CG1-CB 3.77Å; V955-Q961 HydrophobicContact CB-CG 4.31Å; V955-Q961 HydrophobicContact CG1-CG 3.88Å; V955-Q961 WeakPolarHBondContact O-CG 3.36Å; V955-Q961 PolarHBondContact O-NE2 3.15Å; V955-I964 HydrophobicContact CB-CD1 4.49Å; V955-I964 HydrophobicContact CG1-CD1 3.9Å; V955-I964 HydrophobicContact CG2-CD1 3.81Å
956	E	70.6	Confident	76.4	Confident	134 Å²	134	67.4 Å²	67.4	63%	0.626	33%	0.333	S	S	*	.			trans	-92.9	-27.4	-172.9	-62.1	-170.8	168.5	0	0	114.2	I958 Q961	E956-I958 PolarHBondContact O-N 3.32Å; E956-Q961 PolarHBondContact O-NE2 3.2Å
957	L	68.7	Low	76.1	Confident	102 Å²	102	65.8 Å²	65.8	53%	0.534	32%	0.322	S	S	.	.			trans	-70.4	119.3	179.7	-71.5	171.1	0	0	0	110.7	G959 H960 Q961	L957-G959 PolarHBondContact O-N 3.05Å; L957-H960 HydrophobicContact CB-CB 4.01Å; L957-H960 WeakPolarHBondContact CD1-CE1 3.44Å; L957-H960 WeakPolarHBondContact CD1-ND1 3.45Å; L957-H960 CarbonylContact O-C 3.58Å; L957-H960 WeakPolarHBondContact O-CA 3.28Å; L957-H960 PolarHBondContact O-N 3.48Å; L957-Q961 WeakPolarHBondContact O-CG 3.24Å; L957-Q961 PolarHBondContact O-N 2.99Å
958	I	62.2	Low	76.2	Confident	103 Å²	103	63.2 Å²	63.2	53%	0.528	31%	0.309	S	S	.	.	H	α-helix	trans	-56.7	-37.7	-177.9	-64.2	173	0	0	0	111.6	E956 Q961 R962	E956-I958 PolarHBondContact O-N 3.32Å; I958-Q961 PolarHBondContact O-N 3.08Å; I958-R962 HydrophobicContact CG2-CG 4.34Å; I958-R962 VanDerWaalsContact O-CB 3.31Å; I958-R962 WeakPolarHBondContact O-CB 3.27Å; I958-R962 VanDerWaalsContact O-CG 3.23Å; I958-R962 WeakPolarHBondContact O-CG 3.29Å; I958-R962 PolarHBondContact O-N 3.39Å
959	G	52.8	Low	75.4	Confident	50 Å²	50	62 Å²	62	52%	0.515	30%	0.303	S	S	.	.	H	α-helix	trans	-64.2	-38.6	174.9	0	0	0	0	0	113.1	L957 R963	L957-G959 PolarHBondContact O-N 3.05Å; G959-R963 VanDerWaalsContact O-CB 3.24Å; G959-R963 WeakPolarHBondContact O-CB 3.21Å; G959-R963 PolarHBondContact O-N 2.65Å
960	H	79.4	Confident	74.4	Confident	50 Å²	50	63.2 Å²	63.2	23%	0.231	31%	0.311	C	S	.	.	H	α-helix	trans	-75.1	-40.2	176.8	-64.1	-178.9	0	0	0	111.3	M924 Y927 V955 L957 R962 R963 I964	M924-H960 HydrophobicContact CE-CB 4.26Å; M924-H960 HydrophobicContact SD-CB 3.94Å; Y927-H960 HydrophobicContact CE2-CB 4.07Å; Y927-H960 AromaticContact CE2-ND1 3.56Å; Y927-H960 AromaticContact CZ-ND1 3.64Å; Y927-H960 PolarHBondContact OH-ND1 3.05Å; V955-H960 HydrophobicContact CG1-CB 3.77Å; L957-H960 HydrophobicContact CB-CB 4.01Å; L957-H960 WeakPolarHBondContact CD1-CE1 3.44Å; L957-H960 WeakPolarHBondContact CD1-ND1 3.45Å; L957-H960 CarbonylContact O-C 3.58Å; L957-H960 WeakPolarHBondContact O-CA 3.28Å; L957-H960 PolarHBondContact O-N 3.48Å; H960-R962 VanDerWaalsContact C-N 3.33Å; H960-R962 PolarHBondContact O-N 3.19Å; H960-R963 PolarHBondContact O-N 3.12Å; H960-I964 VanDerWaalsContact O-CB 3.29Å; H960-I964 WeakPolarHBondContact O-CB 3.27Å; H960-I964 VanDerWaalsContact O-CG1 3.28Å; H960-I964 WeakPolarHBondContact O-CG1 3.44Å; H960-I964 PolarHBondContact O-N 3.3Å
961	Q	74.1	Confident	73.5	Confident	13 Å²	13	63.3 Å²	63.3	6%	0.061	31%	0.312	C	S	.	.	H	α-helix	trans	-55.3	-49.8	171.1	-70.3	174.9	17.8	0	0	110.5	I947 V950 R951 V955 E956 L957 I958 R963 I964 I965	I947-Q961 HydrophobicContact CD1-CB 3.92Å; V950-Q961 HydrophobicContact CG1-CG 4.39Å; R951-Q961 HydrophobicContact CG-CG 4.42Å; V955-Q961 HydrophobicContact CB-CG 4.31Å; V955-Q961 HydrophobicContact CG1-CG 3.88Å; V955-Q961 WeakPolarHBondContact O-CG 3.36Å; V955-Q961 PolarHBondContact O-NE2 3.15Å; E956-Q961 PolarHBondContact O-NE2 3.2Å; L957-Q961 WeakPolarHBondContact O-CG 3.24Å; L957-Q961 PolarHBondContact O-N 2.99Å; I958-Q961 PolarHBondContact O-N 3.08Å; Q961-R963 PolarHBondContact O-N 2.9Å; Q961-I964 PolarHBondContact O-N 3.01Å; Q961-I965 VanDerWaalsContact O-CB 3.28Å; Q961-I965 WeakPolarHBondContact O-CB 3.49Å; Q961-I965 VanDerWaalsContact O-CG1 3.27Å; Q961-I965 WeakPolarHBondContact O-CG1 3.38Å; Q961-I965 PolarHBondContact O-N 3.17Å
962	R	70.7	Confident	72.8	Confident	152 Å²	152	61.1 Å²	61.1	57%	0.574	31%	0.307	S	S	*	.	H	α-helix	trans	-64.3	-39.8	178.7	-74.5	177.4	177.1	-175.6	-1.6	112.2	I958 H960 S966	I958-R962 HydrophobicContact CG2-CG 4.34Å; I958-R962 VanDerWaalsContact O-CB 3.31Å; I958-R962 WeakPolarHBondContact O-CB 3.27Å; I958-R962 VanDerWaalsContact O-CG 3.23Å; I958-R962 WeakPolarHBondContact O-CG 3.29Å; I958-R962 PolarHBondContact O-N 3.39Å; H960-R962 VanDerWaalsContact C-N 3.33Å; H960-R962 PolarHBondContact O-N 3.19Å; R962-S966 WeakPolarHBondContact O-CB 3.39Å; R962-S966 PolarHBondContact O-N 2.83Å
963	R	67.9	Low	71.5	Confident	109 Å²	109	58 Å²	58	41%	0.411	30%	0.299	S	S	.	.	H	α-helix	trans	-69.1	-41.7	178.1	-175.5	160	172.7	174	11.5	112.8	I922 M924 G959 H960 Q961 S967	I922-R963 PolarHBondContact O-NE 3.5Å; I922-R963 PolarHBondContact O-NH2 3Å; I922-R963 VanDerWaalsContact O-NH2 3.14Å; M924-R963 HydrophobicContact CE-CB 4.44Å; M924-R963 HydrophobicContact CE-CG 4.21Å; G959-R963 VanDerWaalsContact O-CB 3.24Å; G959-R963 WeakPolarHBondContact O-CB 3.21Å; G959-R963 PolarHBondContact O-N 2.65Å; H960-R963 PolarHBondContact O-N 3.12Å; Q961-R963 PolarHBondContact O-N 2.9Å; R963-S967 WeakPolarHBondContact O-CB 3.42Å; R963-S967 PolarHBondContact O-N 3.18Å
964	I	79.8	Confident	70.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-45.4	175.5	-71.6	175.1	0	0	0	110.1	W918 I922 M924 Y927 F931 V950 V955 H960 Q961 S967 I968	W918-I964 HydrophobicContact CH2-CG2 4.17Å; I922-I964 HydrophobicContact CD1-CG1 4.18Å; M924-I964 HydrophobicContact CB-CD1 4.25Å; M924-I964 HydrophobicContact CB-CG1 4.2Å; M924-I964 HydrophobicContact CG-CD1 4.07Å; M924-I964 HydrophobicContact CG-CG1 3.7Å; M924-I964 HydrophobicContact SD-CD1 4.18Å; M924-I964 HydrophobicContact SD-CG1 4.22Å; Y927-I964 HydrophobicContact CD2-CD1 3.81Å; Y927-I964 HydrophobicContact CE2-CD1 4.26Å; Y927-I964 HydrophobicContact CG-CD1 4.4Å; F931-I964 HydrophobicContact CE2-CD1 4.26Å; F931-I964 HydrophobicContact CE2-CG2 4.49Å; F931-I964 HydrophobicContact CZ-CG2 3.77Å; V950-I964 HydrophobicContact CG1-CB 4.32Å; V950-I964 HydrophobicContact CG1-CG2 3.93Å; V950-I964 HydrophobicContact CG2-CG2 3.88Å; V955-I964 HydrophobicContact CB-CD1 4.49Å; V955-I964 HydrophobicContact CG1-CD1 3.9Å; V955-I964 HydrophobicContact CG2-CD1 3.81Å; H960-I964 VanDerWaalsContact O-CB 3.29Å; H960-I964 WeakPolarHBondContact O-CB 3.27Å; H960-I964 VanDerWaalsContact O-CG1 3.28Å; H960-I964 WeakPolarHBondContact O-CG1 3.44Å; H960-I964 PolarHBondContact O-N 3.3Å; Q961-I964 PolarHBondContact O-N 3.01Å; I964-S967 CarbonylContact O-C 3.46Å; I964-S967 PolarHBondContact O-N 3.33Å; I964-I968 HydrophobicContact CG2-CD1 3.74Å; I964-I968 HydrophobicContact CG2-CG1 4.41Å; I964-I968 WeakPolarHBondContact O-CB 3.49Å; I964-I968 VanDerWaalsContact O-CG1 3.24Å; I964-I968 WeakPolarHBondContact O-CG1 3.09Å; I964-I968 PolarHBondContact O-N 2.91Å
965	I	81.1	Confident	69.3	Low	29 Å²	29	58.4 Å²	58.4	15%	0.149	29%	0.293	C	S	.	.	H	α-helix	trans	-66	-41.3	177.5	-72.5	-70.5	0	0	0	112.2	I947 V950 Q961 S967 I968 Q969	I947-I965 HydrophobicContact CB-CD1 4.18Å; I947-I965 HydrophobicContact CB-CG1 4.26Å; I947-I965 HydrophobicContact CD1-CD1 4.44Å; I947-I965 HydrophobicContact CD1-CG1 3.64Å; V950-I965 HydrophobicContact CB-CD1 4.32Å; V950-I965 HydrophobicContact CB-CG1 4.46Å; V950-I965 HydrophobicContact CG2-CD1 3.63Å; V950-I965 HydrophobicContact CG2-CG1 4.09Å; Q961-I965 VanDerWaalsContact O-CB 3.28Å; Q961-I965 WeakPolarHBondContact O-CB 3.49Å; Q961-I965 VanDerWaalsContact O-CG1 3.27Å; Q961-I965 WeakPolarHBondContact O-CG1 3.38Å; Q961-I965 PolarHBondContact O-N 3.17Å; I965-S967 VanDerWaalsContact C-N 3.28Å; I965-S967 PolarHBondContact O-N 2.95Å; I965-I968 HydrophobicContact CD1-CD1 4.04Å; I965-I968 PolarHBondContact O-N 2.93Å; I965-Q969 WeakPolarHBondContact O-CG 3.46Å; I965-Q969 PolarHBondContact O-N 3.2Å
966	S	70.2	Confident	67.8	Low	64 Å²	64	63.4 Å²	63.4	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-35.8	174	177.9	0	0	0	0	112	R962 Q969 T970	R962-S966 WeakPolarHBondContact O-CB 3.39Å; R962-S966 PolarHBondContact O-N 2.83Å; S966-Q969 WeakPolarHBondContact O-CB 3.3Å; S966-T970 PolarHBondContact O-N 2.99Å; S966-T970 PolarHBondContact O-OG1 2.8Å; S966-T970 VanDerWaalsContact O-OG1 3.04Å
967	S	75.2	Confident	66.7	Low	14 Å²	14	61.1 Å²	61.1	10%	0.098	31%	0.308	C	S	.	.	H	α-helix	trans	-74.2	-35.1	173.9	-170.2	0	0	0	0	113.2	W918 I922 R963 I964 I965 Q969 T970 L971	W918-S967 PolarHBondContact NE1-OG 2.86Å; I922-S967 WeakPolarHBondContact CG2-OG 3.47Å; R963-S967 WeakPolarHBondContact O-CB 3.42Å; R963-S967 PolarHBondContact O-N 3.18Å; I964-S967 CarbonylContact O-C 3.46Å; I964-S967 PolarHBondContact O-N 3.33Å; I965-S967 VanDerWaalsContact C-N 3.28Å; I965-S967 PolarHBondContact O-N 2.95Å; S967-Q969 VanDerWaalsContact C-N 3.27Å; S967-Q969 PolarHBondContact O-N 3.46Å; S967-T970 CarbonylContact O-C 3.59Å; S967-T970 WeakPolarHBondContact O-CA 3.27Å; S967-T970 WeakPolarHBondContact O-CB 3.28Å; S967-T970 PolarHBondContact O-N 2.88Å; S967-L971 WeakPolarHBondContact O-CB 3.49Å; S967-L971 PolarHBondContact O-N 3.44Å
968	I	79.6	Confident	65.6	Low	2 Å²	2	61.4 Å²	61.4	1%	0.01	31%	0.307	C	S	.	.	H	α-helix	trans	-60.1	-40.4	171.9	-73.7	163.1	0	0	0	109.8	W918 V942 M945 V950 I964 I965 T970 L971 Q972	W918-I968 HydrophobicContact CH2-CD1 4.26Å; W918-I968 HydrophobicContact CH2-CG1 3.62Å; W918-I968 HydrophobicContact CZ2-CG1 3.71Å; V942-I968 HydrophobicContact CG1-CD1 4.46Å; V942-I968 HydrophobicContact CG1-CG1 3.92Å; M945-I968 HydrophobicContact CB-CD1 4.02Å; V950-I968 HydrophobicContact CG2-CD1 3.78Å; I964-I968 HydrophobicContact CG2-CD1 3.74Å; I964-I968 HydrophobicContact CG2-CG1 4.41Å; I964-I968 WeakPolarHBondContact O-CB 3.49Å; I964-I968 VanDerWaalsContact O-CG1 3.24Å; I964-I968 WeakPolarHBondContact O-CG1 3.09Å; I964-I968 PolarHBondContact O-N 2.91Å; I965-I968 HydrophobicContact CD1-CD1 4.04Å; I965-I968 PolarHBondContact O-N 2.93Å; I968-T970 VanDerWaalsContact C-N 3.28Å; I968-T970 PolarHBondContact O-N 3.09Å; I968-L971 WeakPolarHBondContact O-CB 3.31Å; I968-L971 PolarHBondContact O-N 2.77Å; I968-Q972 HydrophobicContact CG2-CG 4.42Å; I968-Q972 WeakPolarHBondContact O-CB 3.29Å; I968-Q972 VanDerWaalsContact O-CG 3.28Å; I968-Q972 WeakPolarHBondContact O-CG 3.28Å; I968-Q972 PolarHBondContact O-N 3.14Å
969	Q	63.5	Low	64.8	Low	73 Å²	73	63.8 Å²	63.8	34%	0.341	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-36.3	173.9	-70.6	164.5	-6.7	0	0	112.1	I965 S966 S967 F973	I965-Q969 WeakPolarHBondContact O-CG 3.46Å; I965-Q969 PolarHBondContact O-N 3.2Å; S966-Q969 WeakPolarHBondContact O-CB 3.3Å; S967-Q969 VanDerWaalsContact C-N 3.27Å; S967-Q969 PolarHBondContact O-N 3.46Å; Q969-F973 PolarHBondContact O-N 3.08Å
970	T	63.3	Low	64.4	Low	61 Å²	61	68.1 Å²	68.1	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-71.7	-39.2	174.9	-49.7	0	0	0	0	111.4	Y909 S966 S967 I968 F973 Q974	Y909-T970 HydrophobicContact CE1-CG2 4.42Å; S966-T970 PolarHBondContact O-N 2.99Å; S966-T970 PolarHBondContact O-OG1 2.8Å; S966-T970 VanDerWaalsContact O-OG1 3.04Å; S967-T970 CarbonylContact O-C 3.59Å; S967-T970 WeakPolarHBondContact O-CA 3.27Å; S967-T970 WeakPolarHBondContact O-CB 3.28Å; S967-T970 PolarHBondContact O-N 2.88Å; I968-T970 VanDerWaalsContact C-N 3.28Å; I968-T970 PolarHBondContact O-N 3.09Å; T970-F973 WeakPolarHBondContact O-CB 3.42Å; T970-F973 PolarHBondContact O-N 3.29Å; T970-Q974 WeakPolarHBondContact O-CG 3.33Å; T970-Q974 PolarHBondContact O-N 3.13Å; T970-Q974 VanDerWaalsContact O-N 3.1Å
971	L	67.1	Low	62.5	Low	3 Å²	3	73.5 Å²	73.5	2%	0.016	35%	0.345	C	S	.	.	H	α-helix	trans	-66.9	-38.6	177	-162.5	86.4	0	0	0	112	F912 W918 L939 V942 A943 S967 I968 F973 Q974 L975	F912-L971 HydrophobicContact CD2-CD1 3.89Å; F912-L971 HydrophobicContact CE2-CD1 4.43Å; W918-L971 HydrophobicContact CD2-CD1 4.45Å; W918-L971 HydrophobicContact CG-CD1 3.97Å; L939-L971 HydrophobicContact CB-CD2 4.07Å; L939-L971 HydrophobicContact CD2-CD1 3.87Å; L939-L971 HydrophobicContact CD2-CD2 3.96Å; L939-L971 WeakPolarHBondContact O-CD2 3.42Å; V942-L971 HydrophobicContact CB-CD2 4.23Å; V942-L971 HydrophobicContact CG1-CD2 3.87Å; A943-L971 HydrophobicContact CB-CD2 4.13Å; S967-L971 WeakPolarHBondContact O-CB 3.49Å; S967-L971 PolarHBondContact O-N 3.44Å; I968-L971 WeakPolarHBondContact O-CB 3.31Å; I968-L971 PolarHBondContact O-N 2.77Å; L971-F973 VanDerWaalsContact C-N 3.31Å; L971-F973 PolarHBondContact O-N 2.76Å; L971-Q974 PolarHBondContact O-N 3.45Å; L971-L975 HydrophobicContact CD2-CD1 4.34Å; L971-L975 HydrophobicContact CG-CD1 4.29Å; L971-L975 PolarHBondContact O-N 3.21Å
972	Q	68.8	Low	60.5	Low	78 Å²	78	75.1 Å²	75.1	36%	0.364	37%	0.366	S	S	.	.	H	α-helix	trans	-59.3	-43.1	172.4	-77.4	171.4	-13	0	0	111	A943 I968 Q974 L975 L976	A943-Q972 HydrophobicContact CB-CG 4.03Å; A943-Q972 VanDerWaalsContact O-CD 3.3Å; A943-Q972 WeakPolarHBondContact O-CG 3.5Å; A943-Q972 PolarHBondContact O-NE2 2.89Å; I968-Q972 HydrophobicContact CG2-CG 4.42Å; I968-Q972 WeakPolarHBondContact O-CB 3.29Å; I968-Q972 VanDerWaalsContact O-CG 3.28Å; I968-Q972 WeakPolarHBondContact O-CG 3.28Å; I968-Q972 PolarHBondContact O-N 3.14Å; Q972-Q974 VanDerWaalsContact C-N 3.33Å; Q972-Q974 PolarHBondContact O-N 3.29Å; Q972-L975 PolarHBondContact O-N 3.17Å; Q972-L976 WeakPolarHBondContact O-CB 3.46Å; Q972-L976 WeakPolarHBondContact O-CD1 3.37Å; Q972-L976 VanDerWaalsContact O-CG 3.29Å; Q972-L976 WeakPolarHBondContact O-CG 3.48Å; Q972-L976 PolarHBondContact O-N 3.06Å
973	F	57.3	Low	58.5	Low	130 Å²	130	77.3 Å²	77.3	57%	0.57	38%	0.38	S	S	*	.	H	α-helix	trans	-64.7	-37.2	177.3	-161.2	-95.4	0	0	0	112	Q969 T970 L971 H977	Q969-F973 PolarHBondContact O-N 3.08Å; T970-F973 WeakPolarHBondContact O-CB 3.42Å; T970-F973 PolarHBondContact O-N 3.29Å; L971-F973 VanDerWaalsContact C-N 3.31Å; L971-F973 PolarHBondContact O-N 2.76Å; F973-H977 PolarHBondContact O-N 3.28Å
974	Q	57.8	Low	56.5	Low	28 Å²	28	81.4 Å²	81.4	13%	0.131	40%	0.403	C	S	.	.	H	α-helix	trans	-69.5	-43.7	175.7	-70.7	175.6	-21.1	0	0	113.2	Y909 F912 T970 L971 Q972 H977 E978	Y909-Q974 HydrophobicContact CD1-CG 4.47Å; Y909-Q974 HydrophobicContact CG-CG 4.36Å; F912-Q974 VanDerWaalsContact CD2-OE1 3.28Å; T970-Q974 WeakPolarHBondContact O-CG 3.33Å; T970-Q974 PolarHBondContact O-N 3.13Å; T970-Q974 VanDerWaalsContact O-N 3.1Å; L971-Q974 PolarHBondContact O-N 3.45Å; Q972-Q974 VanDerWaalsContact C-N 3.33Å; Q972-Q974 PolarHBondContact O-N 3.29Å; Q974-H977 WeakPolarHBondContact O-CB 3.28Å; Q974-H977 PolarHBondContact O-N 3.21Å; Q974-H977 VanDerWaalsContact O-N 3.14Å; Q974-E978 PolarHBondContact O-N 3.44Å; Q974-E978 VanDerWaalsContact O-N 3.17Å
975	L	61.3	Low	54.2	Low	31 Å²	31	91 Å²	91	16%	0.162	46%	0.461	C	S	.	.	H	α-helix	trans	-69.6	-32.2	178.9	-75.5	162.4	0	0	0	112.8	A943 L971 Q972 H977 E978 Q979	A943-L975 HydrophobicContact CB-CD1 3.37Å; L971-L975 HydrophobicContact CD2-CD1 4.34Å; L971-L975 HydrophobicContact CG-CD1 4.29Å; L971-L975 PolarHBondContact O-N 3.21Å; Q972-L975 PolarHBondContact O-N 3.17Å; L975-H977 VanDerWaalsContact C-N 3.27Å; L975-H977 PolarHBondContact O-N 3.03Å; L975-E978 PolarHBondContact O-N 3.06Å; L975-Q979 PolarHBondContact O-N 3.24Å; L975-Q979 VanDerWaalsContact O-N 3.11Å
976	L	53.3	Low	52.9	Low	106 Å²	106	94.1 Å²	94.1	56%	0.555	48%	0.476	S	S	*	.	H	α-helix	trans	-63.7	-34.5	170.3	-78.8	161.9	0	0	0	111.5	Q972 E980	Q972-L976 WeakPolarHBondContact O-CB 3.46Å; Q972-L976 WeakPolarHBondContact O-CD1 3.37Å; Q972-L976 VanDerWaalsContact O-CG 3.29Å; Q972-L976 WeakPolarHBondContact O-CG 3.48Å; Q972-L976 PolarHBondContact O-N 3.06Å; L976-E980 PolarHBondContact O-N 3.26Å
977	H	45.9	Very low	52	Low	85 Å²	85	95.6 Å²	95.6	39%	0.394	48%	0.478	S	S	.	.	H	α-helix	trans	-72.9	-30.4	177.8	-145.9	55.4	0	0	0	113.2	F973 Q974 L975	F973-H977 PolarHBondContact O-N 3.28Å; Q974-H977 WeakPolarHBondContact O-CB 3.28Å; Q974-H977 PolarHBondContact O-N 3.21Å; Q974-H977 VanDerWaalsContact O-N 3.14Å; L975-H977 VanDerWaalsContact C-N 3.27Å; L975-H977 PolarHBondContact O-N 3.03Å
978	E	46	Very low	50.7	Low	108 Å²	108	100.2 Å²	100.2	51%	0.505	50%	0.499	S	S	.	.	H	α-helix	trans	-76.6	-33.6	172.7	-76.6	-170.9	156	0	0	113	Q974 L975 E980 K981	Q974-E978 PolarHBondContact O-N 3.44Å; Q974-E978 VanDerWaalsContact O-N 3.17Å; L975-E978 PolarHBondContact O-N 3.06Å; E978-E980 VanDerWaalsContact C-N 3.32Å; E978-E980 PolarHBondContact O-N 2.95Å; E978-K981 PolarHBondContact O-N 3.15Å; E978-K981 VanDerWaalsContact O-N 3.15Å
979	Q	46.4	Very low	49	Very low	153 Å²	153	105.9 Å²	105.9	72%	0.715	53%	0.528	S	S	*	.	H	α-helix	trans	-67.9	-27.7	176.3	-99.7	-176.4	-9.4	0	0	113.6	L975 K981	L975-Q979 PolarHBondContact O-N 3.24Å; L975-Q979 VanDerWaalsContact O-N 3.11Å; Q979-K981 VanDerWaalsContact C-N 3.29Å
980	E	44.1	Very low	48.1	Very low	142 Å²	142	108 Å²	108	66%	0.664	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-17	172.4	-79.4	-174.2	153.8	0	0	113.4	L976 E978	L976-E980 PolarHBondContact O-N 3.26Å; E978-E980 VanDerWaalsContact C-N 3.32Å; E978-E980 PolarHBondContact O-N 2.95Å
981	K	38.5	Very low	47	Very low	162 Å²	162	111.1 Å²	111.1	70%	0.704	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	10.9	-177.7	-75.6	-176.7	179.1	169.7	0	115	E978 Q979	E978-K981 PolarHBondContact O-N 3.15Å; E978-K981 VanDerWaalsContact O-N 3.15Å; Q979-K981 VanDerWaalsContact C-N 3.29Å
982	G	33.4	Very low	45.6	Very low	48 Å²	48	118.9 Å²	118.9	50%	0.495	59%	0.589	S	S	.	*			trans	-136.2	75.9	-173.2	0	0	0	0	0	117
983	F	27.5	Very low	43.8	Very low	198 Å²	198	122 Å²	122	87%	0.868	61%	0.606	S	S	*	*				177.6	94.6	128.6	-106.7	-77.1	0	0	0	110.3
984	H	27.3	Very low	42.7	Very low	195 Å²	195	121.3 Å²	121.3	90%	0.903	61%	0.609	S	S	*	*			trans	-145.3	122.3	140.8	-96.3	-63.2	0	0	0	108.3
985	V	30.8	Very low	41.3	Very low	200 Å²	200	129.8 Å²	129.8	100%	1.212	65%	0.652	S	S	*	*			trans	-57.5	0	154.2	172.7	0	0	0	0	109.2

Retrieved 985 of 985 residues in 426.2 ms (Link to these results)

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