G4V7S3_SCHMA Loading...

Chromobox protein-related (Chromobox 1) (Heterochromatin 1)

AlphaFold DB , UniProt , Accession G4V7S3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 929 aa.

						>G4V7S3_SCHMA|G4V7S3
MASVGDTQIRKQLRACRRRQRRYLSLKSSKSSNKKNSNLESSDTNSVNVYIVESILNERIIKGQKYYKVRWEGFPPEADSWEPEKNLTNVLDIISEFHNGSKSKISKNLDIHKDCQTVFENSPASVPTPPATPCSVLQNSHNSLRGSSEERQLNKSVKRKHFTKSRTGGRYEYVPKHQLVASKTKYFDDIRDGKIDLCSNDLYSRVKTRKRCAAESASNSVSNESTQSRNGSLQGETELECEASMEHFSTCSPKRDPVSPSFPCFSTNESLQNFNCTFRNDEQSQPMFPVGGSEDYHPEITENLATANVSPSHQSDIISKFDSKAVQSELHPNSSKGISCNLYLCDSISKVDIGLSPVSSYPLDNKPLQAFERESTSNFSAVEQPGNFYNLYNKLYERSVSSLRTLVNIYFNLILSHISNKDEITHSEQPTDFHHELECLPHLCVYNHLTSIQTPSEFLNAINNQRWSLVATMPSGNLFPENSQAQKSSTCSFSLEKTPESRKSDNKPDLEENNRFKEDALLACITGGAGRPLVLDRLLASGLDPNKVTEPNSKWPLLALAVCLGRLHAAQALLDAGAKPNCVEPNRRQRSALGLAIAAGDFDMANMLILSGANFYEVEPGTTALNLIMKLLNAHLSAQQNPKINHRQINKSYLALAELQDKLRSMGSQFPPVPSPSPPSGLNVPSLPESHIFNALISSSMRNHSDSSQLNNINNNISKSGNALPSVDSLRRLHELIVAHHARLSMSVTNLVRTWLTRADLVQVGLVSPCQWISVRQCSASVKFSWPNELSNSKLQPSRVVAPILILVHGRIAPPACYDVWMDDDGPCVIERVCLDQTYIQRALSRMPFVTTVYPLGWNSLKPQEHEVSINFKPESISSIHSTRPTCVAIMIVAVALSQSDNKEKVSQQNGNLNAIQSSRLSIANSQLT
					

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(Predicted Aligned Error values between residue pairs)

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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	43.1	Very low	55.6	Low	187 Å²	187	93.3 Å²	93.3	92%	0.921	51%	0.512	S	S	*	.				0	-53	0	-83.2	-172.6	161.3	0	0	113.5	S3 V4 F187	M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 2.95Å; M1-S3 VanDerWaalsContact O-N 3.13Å; M1-V4 PolarHBondContact O-N 3.32Å; M1-V4 VanDerWaalsContact O-N 3.13Å; M1-F187 HydrophobicContact CE-CD2 4.46Å; M1-F187 HydrophobicContact CE-CG 4.48Å
2	A	39.2	Very low	56.6	Low	70 Å²	70	94.9 Å²	94.9	58%	0.579	51%	0.513	S	S	*	.	H	α-helix	trans	-42.8	-50.3	-176.1	0	0	0	0	0	115.4	V4 G5 D6	A2-V4 PolarHBondContact O-N 3.19Å; A2-G5 PolarHBondContact O-N 3.23Å; A2-D6 PolarHBondContact O-N 3.33Å
3	S	42.5	Very low	57.5	Low	84 Å²	84	92.5 Å²	92.5	59%	0.587	50%	0.499	S	S	*	.	H	α-helix	trans	-49.4	-32	-178.9	151	0	0	0	0	115.6	M1 T7	M1-S3 VanDerWaalsContact C-N 3.33Å; M1-S3 PolarHBondContact O-N 2.95Å; M1-S3 VanDerWaalsContact O-N 3.13Å; S3-T7 WeakPolarHBondContact O-CG2 3.45Å
4	V	49.9	Very low	58.1	Low	79 Å²	79	97.9 Å²	97.9	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-74.3	-41.6	179.2	-177.1	0	0	0	0	110.9	M1 A2 D6 T7 Q8	M1-V4 PolarHBondContact O-N 3.32Å; M1-V4 VanDerWaalsContact O-N 3.13Å; A2-V4 PolarHBondContact O-N 3.19Å; V4-D6 VanDerWaalsContact C-N 3.3Å; V4-D6 PolarHBondContact O-N 3.36Å; V4-T7 PolarHBondContact O-N 3.46Å; V4-T7 VanDerWaalsContact O-N 3.1Å; V4-T7 PolarHBondContact O-OG1 2.66Å; V4-Q8 PolarHBondContact O-N 2.89Å
5	G	50.2	Low	58.6	Low	37 Å²	37	94.5 Å²	94.5	38%	0.381	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-40.3	175.5	0	0	0	0	0	112.1	A2 T7 Q8 I9	A2-G5 PolarHBondContact O-N 3.23Å; G5-T7 PolarHBondContact O-N 2.75Å; G5-Q8 PolarHBondContact O-N 3Å; G5-Q8 VanDerWaalsContact O-N 3.11Å; G5-I9 WeakPolarHBondContact O-CG1 3.42Å; G5-I9 PolarHBondContact O-N 2.85Å
6	D	53.8	Low	59	Low	59 Å²	59	93 Å²	93	32%	0.316	50%	0.499	S	S	.	.	H	α-helix	trans	-56.7	-35.9	174.5	-69.1	-34.9	0	0	0	112.4	A2 V4 R10	A2-D6 PolarHBondContact O-N 3.33Å; V4-D6 VanDerWaalsContact C-N 3.3Å; V4-D6 PolarHBondContact O-N 3.36Å; D6-R10 WeakPolarHBondContact O-CB 3.3Å; D6-R10 WeakPolarHBondContact O-CD 3.36Å; D6-R10 WeakPolarHBondContact O-CG 3.5Å; D6-R10 PolarHBondContact O-N 3.38Å
7	T	63.1	Low	59.2	Low	70 Å²	70	94.1 Å²	94.1	43%	0.429	49%	0.494	S	S	.	.	H	α-helix	trans	-67.3	-39	177.9	73.4	0	0	0	0	112.5	S3 V4 G5 K11	S3-T7 WeakPolarHBondContact O-CG2 3.45Å; V4-T7 PolarHBondContact O-N 3.46Å; V4-T7 VanDerWaalsContact O-N 3.1Å; V4-T7 PolarHBondContact O-OG1 2.66Å; G5-T7 PolarHBondContact O-N 2.75Å; T7-K11 WeakPolarHBondContact O-CG 3.42Å; T7-K11 PolarHBondContact O-N 3.4Å
8	Q	66.2	Low	59.6	Low	92 Å²	92	99.5 Å²	99.5	43%	0.43	51%	0.507	S	S	.	.	H	α-helix	trans	-75	-39.8	-179.4	-158.5	75	-26.4	0	0	111	V4 G5 K11 Q12	V4-Q8 PolarHBondContact O-N 2.89Å; G5-Q8 PolarHBondContact O-N 3Å; G5-Q8 VanDerWaalsContact O-N 3.11Å; Q8-K11 WeakPolarHBondContact O-CB 3.4Å; Q8-K11 PolarHBondContact O-N 2.66Å; Q8-Q12 PolarHBondContact O-N 3.05Å
9	I	67.2	Low	59.8	Low	87 Å²	87	104.5 Å²	104.5	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-63.8	-45.8	172.2	-66.3	169	0	0	0	110.3	G5 K11 Q12 L13	G5-I9 WeakPolarHBondContact O-CG1 3.42Å; G5-I9 PolarHBondContact O-N 2.85Å; I9-K11 VanDerWaalsContact C-N 3.32Å; I9-K11 PolarHBondContact O-N 3.02Å; I9-Q12 PolarHBondContact O-N 3.38Å; I9-L13 HydrophobicContact CG2-CD1 3.8Å; I9-L13 HydrophobicContact CG2-CG 4.2Å; I9-L13 WeakPolarHBondContact O-CB 3.46Å; I9-L13 WeakPolarHBondContact O-CG 3.43Å; I9-L13 PolarHBondContact O-N 3.37Å
10	R	65.9	Low	59.8	Low	131 Å²	131	105.9 Å²	105.9	49%	0.494	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-35.4	174.5	-73.3	171.3	-169.6	-114.3	3.4	112.3	D6 R14	D6-R10 WeakPolarHBondContact O-CB 3.3Å; D6-R10 WeakPolarHBondContact O-CD 3.36Å; D6-R10 WeakPolarHBondContact O-CG 3.5Å; D6-R10 PolarHBondContact O-N 3.38Å; R10-R14 VanDerWaalsContact O-CB 3.27Å; R10-R14 WeakPolarHBondContact O-CB 3.44Å; R10-R14 WeakPolarHBondContact O-CG 3.4Å; R10-R14 PolarHBondContact O-N 2.78Å
11	K	70.8	Confident	60	Low	130 Å²	130	110.5 Å²	110.5	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-62.3	-48.7	171.2	-78.3	169.9	-177.5	172.3	0	111.5	T7 Q8 I9 R14 A15	T7-K11 WeakPolarHBondContact O-CG 3.42Å; T7-K11 PolarHBondContact O-N 3.4Å; Q8-K11 WeakPolarHBondContact O-CB 3.4Å; Q8-K11 PolarHBondContact O-N 2.66Å; I9-K11 VanDerWaalsContact C-N 3.32Å; I9-K11 PolarHBondContact O-N 3.02Å; K11-R14 PolarHBondContact O-N 3.03Å; K11-A15 PolarHBondContact O-N 2.85Å
12	Q	67.8	Low	60.7	Low	113 Å²	113	110.8 Å²	110.8	53%	0.528	53%	0.526	S	S	.	.	H	α-helix	trans	-65.4	-42.7	177.8	-72.2	-163.5	-4.9	0	0	112.6	Q8 I9 R14 A15 C16	Q8-Q12 PolarHBondContact O-N 3.05Å; I9-Q12 PolarHBondContact O-N 3.38Å; Q12-R14 PolarHBondContact O-N 2.94Å; Q12-A15 WeakPolarHBondContact O-CB 3.09Å; Q12-A15 PolarHBondContact O-N 3.33Å; Q12-A15 VanDerWaalsContact O-N 3.1Å; Q12-C16 PolarHBondContact O-N 2.61Å
13	L	67.3	Low	61.6	Low	64 Å²	64	115 Å²	115	34%	0.335	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-40.6	175.1	-71	173.7	0	0	0	111.8	I9 A15 C16 R17	I9-L13 HydrophobicContact CG2-CD1 3.8Å; I9-L13 HydrophobicContact CG2-CG 4.2Å; I9-L13 WeakPolarHBondContact O-CB 3.46Å; I9-L13 WeakPolarHBondContact O-CG 3.43Å; I9-L13 PolarHBondContact O-N 3.37Å; L13-A15 VanDerWaalsContact C-N 3.34Å; L13-A15 PolarHBondContact O-N 3.48Å; L13-C16 PolarHBondContact O-N 3.48Å; L13-R17 WeakPolarHBondContact O-CB 3.28Å; L13-R17 WeakPolarHBondContact O-CG 3.48Å; L13-R17 PolarHBondContact O-N 3.02Å
14	R	66.7	Low	62.4	Low	168 Å²	168	116.1 Å²	116.1	63%	0.634	53%	0.527	S	S	*	.	H	α-helix	trans	-62.3	-38.6	171.7	-76.9	172.6	174.3	-170.8	-2.4	112	R10 K11 Q12 R18	R10-R14 VanDerWaalsContact O-CB 3.27Å; R10-R14 WeakPolarHBondContact O-CB 3.44Å; R10-R14 WeakPolarHBondContact O-CG 3.4Å; R10-R14 PolarHBondContact O-N 2.78Å; K11-R14 PolarHBondContact O-N 3.03Å; Q12-R14 PolarHBondContact O-N 2.94Å; R14-R18 WeakPolarHBondContact O-CB 3.47Å; R14-R18 VanDerWaalsContact O-CG 3.31Å; R14-R18 WeakPolarHBondContact O-CG 3.44Å; R14-R18 PolarHBondContact O-N 3.48Å
15	A	66	Low	62.8	Low	47 Å²	47	116 Å²	116	39%	0.388	53%	0.53	S	S	.	.	H	α-helix	trans	-66.2	-42.9	174.8	0	0	0	0	0	112.4	K11 Q12 L13 R18 R19	K11-A15 PolarHBondContact O-N 2.85Å; Q12-A15 WeakPolarHBondContact O-CB 3.09Å; Q12-A15 PolarHBondContact O-N 3.33Å; Q12-A15 VanDerWaalsContact O-N 3.1Å; L13-A15 VanDerWaalsContact C-N 3.34Å; L13-A15 PolarHBondContact O-N 3.48Å; A15-R18 PolarHBondContact O-N 3.34Å; A15-R19 PolarHBondContact O-N 3.11Å
16	C	63.6	Low	63.4	Low	70 Å²	70	120 Å²	120	47%	0.473	54%	0.542	S	S	.	.	H	α-helix	trans	-65.4	-46.5	175.1	-73.3	0	0	0	0	112.3	Q12 L13 R18 R19 Q20	Q12-C16 PolarHBondContact O-N 2.61Å; L13-C16 PolarHBondContact O-N 3.48Å; C16-R18 VanDerWaalsContact C-N 3.29Å; C16-R18 PolarHBondContact O-N 3.13Å; C16-R19 PolarHBondContact O-N 3.36Å; C16-R19 VanDerWaalsContact O-N 3.16Å; C16-Q20 WeakPolarHBondContact O-CB 3.4Å; C16-Q20 PolarHBondContact O-N 2.82Å
17	R	63.8	Low	63.5	Low	111 Å²	111	123.8 Å²	123.8	42%	0.419	56%	0.556	S	S	.	*	H	α-helix	trans	-57	-40.7	173	-73.7	-179.1	179.3	-149.2	-5.2	111.4	L13 Q20 R21 D825	L13-R17 WeakPolarHBondContact O-CB 3.28Å; L13-R17 WeakPolarHBondContact O-CG 3.48Å; L13-R17 PolarHBondContact O-N 3.02Å; R17-Q20 PolarHBondContact O-N 3.22Å; R17-R21 PolarHBondContact O-N 3.13Å; R17-D825 PolarHBondContact NH1-O 3.47Å; R17-D825 IonicContact NH1-OD1 3.23Å; R17-D825 PolarHBondContact NH1-OD1 3.43Å; R17-D825 PolarHBondContact NH2-O 2.98Å
18	R	65.4	Low	63.1	Low	192 Å²	192	124.1 Å²	124.1	73%	0.725	56%	0.561	S	S	*	*	H	α-helix	trans	-64.5	-43.9	174.2	-79.7	176.3	171.7	-174.8	-3.5	112.9	R14 A15 C16 R22	R14-R18 WeakPolarHBondContact O-CB 3.47Å; R14-R18 VanDerWaalsContact O-CG 3.31Å; R14-R18 WeakPolarHBondContact O-CG 3.44Å; R14-R18 PolarHBondContact O-N 3.48Å; A15-R18 PolarHBondContact O-N 3.34Å; C16-R18 VanDerWaalsContact C-N 3.29Å; C16-R18 PolarHBondContact O-N 3.13Å; R18-R22 PolarHBondContact O-N 3.37Å; R18-R22 VanDerWaalsContact O-N 3.12Å
19	R	64.1	Low	62.5	Low	194 Å²	194	123.6 Å²	123.6	73%	0.732	57%	0.567	S	S	*	*	H	α-helix	trans	-61	-43.9	174.2	-76	178.7	173.9	170.8	-2.1	111.6	A15 C16 R22 Y23	A15-R19 PolarHBondContact O-N 3.11Å; C16-R19 PolarHBondContact O-N 3.36Å; C16-R19 VanDerWaalsContact O-N 3.16Å; R19-R22 PolarHBondContact O-N 3.45Å; R19-Y23 PolarHBondContact O-N 2.73Å
20	Q	60.1	Low	61.7	Low	132 Å²	132	128.6 Å²	128.6	62%	0.617	59%	0.586	S	S	*	*	H	α-helix	trans	-69.7	-38.9	-178.6	-162.7	167.8	2.7	0	0	112.7	C16 R17 Y23 L24	C16-Q20 WeakPolarHBondContact O-CB 3.4Å; C16-Q20 PolarHBondContact O-N 2.82Å; R17-Q20 PolarHBondContact O-N 3.22Å; Q20-Y23 PolarHBondContact O-N 2.89Å; Q20-L24 WeakPolarHBondContact O-CG 3.43Å; Q20-L24 PolarHBondContact O-N 3.47Å; Q20-L24 VanDerWaalsContact O-N 3.1Å
21	R	62.8	Low	60.9	Low	203 Å²	203	127 Å²	127	77%	0.766	60%	0.595	S	S	*	*	H	α-helix	trans	-61.1	-42.4	170.7	-77.6	-168.7	-179	-174.2	2.3	112.4	R17 L24 S25	R17-R21 PolarHBondContact O-N 3.13Å; R21-L24 PolarHBondContact O-N 3.44Å; R21-S25 WeakPolarHBondContact O-CB 3.47Å; R21-S25 PolarHBondContact O-N 3.36Å
22	R	59	Low	59.7	Low	193 Å²	193	125.3 Å²	125.3	73%	0.728	60%	0.599	S	S	*	*	H	α-helix	trans	-60.8	-43.7	175.1	-75.4	-177.5	178.7	-179.6	-1.4	112.2	R18 R19 L24 S25 L26	R18-R22 PolarHBondContact O-N 3.37Å; R18-R22 VanDerWaalsContact O-N 3.12Å; R19-R22 PolarHBondContact O-N 3.45Å; R22-L24 VanDerWaalsContact C-N 3.35Å; R22-L24 PolarHBondContact O-N 2.98Å; R22-S25 PolarHBondContact O-N 2.77Å; R22-L26 WeakPolarHBondContact O-CB 3.29Å; R22-L26 WeakPolarHBondContact O-CG 3.08Å; R22-L26 PolarHBondContact O-N 2.81Å
23	Y	57.4	Low	58.2	Low	159 Å²	159	127.3 Å²	127.3	62%	0.624	61%	0.613	S	S	*	*	H	α-helix	trans	-62.9	-38.6	178.3	-175.3	-101.7	0	0	0	112.9	R19 Q20 K27	R19-Y23 PolarHBondContact O-N 2.73Å; Q20-Y23 PolarHBondContact O-N 2.89Å; Y23-K27 PolarHBondContact O-N 3.01Å
24	L	60.2	Low	56.7	Low	107 Å²	107	134.3 Å²	134.3	56%	0.56	64%	0.641	S	S	*	*	H	α-helix	trans	-69	-43.3	175.5	-68.7	170	0	0	0	112	Q20 R21 R22 L26 K27 S28	Q20-L24 WeakPolarHBondContact O-CG 3.43Å; Q20-L24 PolarHBondContact O-N 3.47Å; Q20-L24 VanDerWaalsContact O-N 3.1Å; R21-L24 PolarHBondContact O-N 3.44Å; R22-L24 VanDerWaalsContact C-N 3.35Å; R22-L24 PolarHBondContact O-N 2.98Å; L24-L26 PolarHBondContact O-N 3.47Å; L24-K27 PolarHBondContact O-N 3.25Å; L24-S28 PolarHBondContact O-N 3.21Å
25	S	58.2	Low	55.2	Low	77 Å²	77	135.9 Å²	135.9	54%	0.538	65%	0.653	S	S	.	*	H	α-helix	trans	-59	-43.1	175.7	165	0	0	0	0	112.7	R21 R22 K27 S28 S29	R21-S25 WeakPolarHBondContact O-CB 3.47Å; R21-S25 PolarHBondContact O-N 3.36Å; R22-S25 PolarHBondContact O-N 2.77Å; S25-K27 PolarHBondContact O-N 3.36Å; S25-S28 PolarHBondContact O-OG 3.11Å; S25-S29 PolarHBondContact O-N 3.18Å; S25-S29 PolarHBondContact O-OG 2.76Å
26	L	61.7	Low	53.8	Low	120 Å²	120	141 Å²	141	63%	0.628	67%	0.674	S	S	*	*	H	α-helix	trans	-67.4	-16.3	175	-75.7	163.7	0	0	0	113.7	R22 L24 S29	R22-L26 WeakPolarHBondContact O-CB 3.29Å; R22-L26 WeakPolarHBondContact O-CG 3.08Å; R22-L26 PolarHBondContact O-N 2.81Å; L24-L26 PolarHBondContact O-N 3.47Å; L26-S29 PolarHBondContact O-OG 2.98Å
27	K	55.9	Low	52.6	Low	140 Å²	140	142.8 Å²	142.8	61%	0.609	69%	0.687	S	S	*	*	H	α-helix	trans	-93.6	-36.6	178.3	-154.4	179.5	-176.1	-168.3	0	112.3	Y23 L24 S25 K30	Y23-K27 PolarHBondContact O-N 3.01Å; L24-K27 PolarHBondContact O-N 3.25Å; S25-K27 PolarHBondContact O-N 3.36Å; K27-K30 PolarHBondContact O-N 2.74Å
28	S	54.8	Low	51	Low	76 Å²	76	144.7 Å²	144.7	53%	0.531	71%	0.705	S	S	.	*	H	α-helix	trans	-70.1	-31.1	176	61	0	0	0	0	112.9	L24 S25 K30 S31	L24-S28 PolarHBondContact O-N 3.21Å; S25-S28 PolarHBondContact O-OG 3.11Å; S28-K30 PolarHBondContact O-N 3.39Å; S28-S31 PolarHBondContact O-N 2.88Å; S28-S31 PolarHBondContact O-OG 3.47Å
29	S	53.3	Low	49.7	Very low	81 Å²	81	143.7 Å²	143.7	57%	0.566	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-4	176	63.7	0	0	0	0	114.6	S25 L26	S25-S29 PolarHBondContact O-N 3.18Å; S25-S29 PolarHBondContact O-OG 2.76Å; L26-S29 PolarHBondContact O-OG 2.98Å
30	K	50.9	Low	48.2	Very low	192 Å²	192	143 Å²	143	84%	0.835	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	-2.6	179	-98.7	-171.8	173.8	-174.6	0	114.7	K27 S28	K27-K30 PolarHBondContact O-N 2.74Å; S28-K30 PolarHBondContact O-N 3.39Å
31	S	49.3	Very low	47	Very low	99 Å²	99	142.1 Å²	142.1	69%	0.692	73%	0.727	S	S	*	*	S	Bend	trans	-110.1	4.1	-171.6	57.6	0	0	0	0	115.8	S28	S28-S31 PolarHBondContact O-N 2.88Å; S28-S31 PolarHBondContact O-OG 3.47Å
32	S	44.8	Very low	45.5	Very low	94 Å²	94	136.9 Å²	136.9	66%	0.657	72%	0.722	S	S	*	*	S	Bend	trans	-108.3	3.1	-169	56.5	0	0	0	0	116.5
33	N	36.2	Very low	44.2	Very low	154 Å²	154	134.7 Å²	134.7	82%	0.824	72%	0.724	S	S	*	*			trans	-133.3	82.4	-174.8	-101	-8.1	0	0	0	113.5
34	K	36.1	Very low	42.8	Very low	212 Å²	212	132.8 Å²	132.8	92%	0.922	73%	0.73	S	S	*	*			trans	-176.8	115.3	142.2	-111.2	179.6	177.3	-175.4	0	113.1
35	K	36.1	Very low	41.3	Very low	200 Å²	200	135.1 Å²	135.1	87%	0.87	74%	0.743	S	S	*	*			trans	-153.2	113.7	151.1	-90.5	-166.7	176.1	-175.9	0	108.3
36	N	37.1	Very low	40.1	Very low	155 Å²	155	136 Å²	136	83%	0.829	75%	0.749	S	S	*	*			trans	174.4	139	132.8	-90.8	0.9	0	0	0	112.9
37	S	37.3	Very low	39.4	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	76%	0.757	S	S	*	*			trans	40.6	109.8	151.1	58	0	0	0	0	122.1
38	N	30.8	Very low	39.9	Very low	151 Å²	151	135.5 Å²	135.5	81%	0.807	76%	0.758	S	S	*	*			trans	-22.4	144.1	145.3	-41.9	-5.5	0	0	0	117.3
39	L	38.6	Very low	41	Very low	172 Å²	172	137.5 Å²	137.5	90%	0.901	77%	0.766	S	S	*	*				-155.6	-179.6	105.1	-133.1	72.5	0	0	0	110.3
40	E	31.9	Very low	42.3	Very low	178 Å²	178	140.1 Å²	140.1	83%	0.832	77%	0.765	S	S	*	*			trans	-109	145.2	-157.6	-57	166.9	135.1	0	0	114.2
41	S	35.2	Very low	43.8	Very low	115 Å²	115	136.4 Å²	136.4	80%	0.804	75%	0.753	S	S	*	*				159.8	142.7	125	48.9	0	0	0	0	114.9
42	S	31.8	Very low	45.7	Very low	93 Å²	93	132.3 Å²	132.3	65%	0.65	72%	0.724	S	S	*	*			trans	42.2	103.8	155.4	55	0	0	0	0	122.2
43	D	31.4	Very low	47.7	Very low	146 Å²	146	132.4 Å²	132.4	78%	0.781	71%	0.714	S	S	*	*				85.3	144.9	116.6	-56.5	-34.4	0	0	0	125.2
44	T	26.6	Very low	50.2	Low	120 Å²	120	126.6 Å²	126.6	74%	0.736	69%	0.685	S	S	*	*			trans	77.9	120.4	167.7	69.8	0	0	0	0	119.7
45	N	28.9	Very low	52.9	Low	156 Å²	156	117 Å²	117	83%	0.834	64%	0.644	S	S	*	*			trans	53.9	132.6	136.4	-53.4	-21.1	0	0	0	119.7
46	S	33.6	Very low	55.3	Low	96 Å²	96	110.5 Å²	110.5	67%	0.671	62%	0.619	S	S	*	*			cis	-151.4	159.5	16.8	52.2	0	0	0	0	112
47	V	47.8	Very low	57.7	Low	132 Å²	132	107.2 Å²	107.2	80%	0.8	60%	0.601	S	S	*	*			trans	-79.1	120.7	166	178.7	0	0	0	0	107.5	V49	V47-V49 VanDerWaalsContact C-N 3.28Å; V47-V49 HydrophobicContact CG1-CG2 4.39Å; V47-V49 PolarHBondContact O-N 3.47Å
48	N	65.8	Low	60.3	Low	117 Å²	117	105.9 Å²	105.9	63%	0.626	58%	0.583	S	S	*	*			trans	-70.8	80	-177.7	-70.5	-16.2	0	0	0	112	Y50	N48-Y50 HydrophobicContact CB-CE2 3.9Å; N48-Y50 WeakPolarHBondContact O-CD2 3.38Å
49	V	77.1	Confident	63.2	Low	117 Å²	117	103.1 Å²	103.1	71%	0.709	56%	0.561	S	S	*	*			trans	-80.4	127.9	166.6	-178.5	0	0	0	0	108.3	V47	V47-V49 VanDerWaalsContact C-N 3.28Å; V47-V49 HydrophobicContact CG1-CG2 4.39Å; V47-V49 PolarHBondContact O-N 3.47Å
50	Y	81.3	Confident	65.7	Low	136 Å²	136	100.9 Å²	100.9	53%	0.533	55%	0.549	S	S	.	.			trans	-106.7	138.9	175.7	-66.6	-93.7	0	0	0	109.8	N48 F74	N48-Y50 HydrophobicContact CB-CE2 3.9Å; N48-Y50 WeakPolarHBondContact O-CD2 3.38Å; Y50-F74 HydrophobicContact CD1-CE2 4.41Å; Y50-F74 HydrophobicContact CE1-CZ 4.49Å
51	I	83	Confident	68.3	Low	114 Å²	114	95.8 Å²	95.8	59%	0.585	53%	0.527	S	S	*	.			trans	-80.7	136.7	179.7	-51.6	173	0	0	0	109.5	E72	I51-E72 HydrophobicContact CB-CB 4.17Å; I51-E72 WeakPolarHBondContact CB-OE2 3.43Å; I51-E72 HydrophobicContact CG2-CB 4.31Å; I51-E72 WeakPolarHBondContact CG2-OE2 3.27Å; I51-E72 PolarHBondContact O-N 3.01Å
52	V	88.3	Confident	70.4	Confident	14 Å²	14	100.2 Å²	100.2	9%	0.085	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	119.6	179.1	173.3	0	0	0	0	108.9	I55 V69 W71 L87 V90 I93	V52-I55 HydrophobicContact CG1-CG1 4.47Å; V52-V69 HydrophobicContact CB-CG1 4.3Å; V52-V69 HydrophobicContact CG1-CG1 3.86Å; V52-V69 HydrophobicContact CG2-CG1 3.69Å; V52-W71 HydrophobicContact CG2-CE3 4.11Å; V52-W71 HydrophobicContact CG2-CZ3 3.78Å; V52-L87 HydrophobicContact CG2-CD2 4.16Å; V52-V90 HydrophobicContact CB-CG1 4.03Å; V52-V90 HydrophobicContact CG1-CG1 4.24Å; V52-V90 HydrophobicContact CG2-CG1 4.36Å; V52-V90 HydrophobicContact CG2-CG2 4.26Å; V52-I93 HydrophobicContact CB-CD1 4.49Å; V52-I93 HydrophobicContact CG1-CD1 4.27Å; V52-I93 WeakPolarHBondContact O-CD1 3.35Å
53	E	87.6	Confident	72.9	Confident	95 Å²	95	99.3 Å²	99.3	44%	0.444	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	-46.6	175.2	-176.2	-157.1	116.7	0	0	110.4	R70 E72	E53-R70 HydrophobicContact CB-CB 4.33Å; E53-R70 HydrophobicContact CB-CG 3.66Å; E53-R70 HydrophobicContact CG-CG 4.09Å; E53-R70 PolarHBondContact N-O 3Å; E53-R70 IonicContact OE1-NH1 3.84Å; E53-R70 PolarHBondContact OE1-NH1 2.94Å; E53-R70 VanDerWaalsContact OE1-NH1 3.14Å; E53-R70 WeakPolarHBondContact OE2-CD 3.48Å; E53-R70 WeakPolarHBondContact OE2-CG 3.34Å; E53-R70 IonicContact OE2-NH1 3.13Å; E53-E72 HydrophobicContact CB-CB 4.37Å
54	S	88.9	Confident	75.4	Confident	32 Å²	32	97.3 Å²	97.3	22%	0.224	52%	0.522	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	158.3	-179.2	57.4	0	0	0	0	112.8	R70	S54-R70 PolarHBondContact O-N 2.82Å
55	I	91.5	Very high	78.4	Confident	11 Å²	11	94.8 Å²	94.8	6%	0.056	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.7	167.7	-68.2	174.9	0	0	0	108.6	V52 Y67 L87 I93 I94 F97	V52-I55 HydrophobicContact CG1-CG1 4.47Å; I55-Y67 HydrophobicContact CG2-CD1 4.08Å; I55-Y67 HydrophobicContact CG2-CG 4.39Å; I55-L87 HydrophobicContact CD1-CD1 4.42Å; I55-I93 HydrophobicContact CG1-CG2 4.33Å; I55-I94 HydrophobicContact CD1-CB 4.35Å; I55-I94 HydrophobicContact CD1-CD1 4.36Å; I55-I94 HydrophobicContact CD1-CG1 3.33Å; I55-F97 HydrophobicContact CB-CB 4.27Å; I55-F97 HydrophobicContact CB-CD2 4.42Å; I55-F97 HydrophobicContact CB-CG 4.26Å; I55-F97 HydrophobicContact CG2-CB 4.29Å; I55-F97 HydrophobicContact CG2-CD1 4Å; I55-F97 HydrophobicContact CG2-CD2 4.05Å; I55-F97 HydrophobicContact CG2-CE1 4.41Å; I55-F97 HydrophobicContact CG2-CE2 4.45Å; I55-F97 HydrophobicContact CG2-CG 3.82Å; I55-F97 WeakPolarHBondContact O-CD2 3.46Å
56	L	87	Confident	81.5	Confident	64 Å²	64	90 Å²	90	34%	0.335	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-25.8	-170.8	-62.1	177.2	0	0	0	113.6	K68 R70 D79	L56-K68 HydrophobicContact CB-CB 4.37Å; L56-K68 HydrophobicContact CB-CD 4.22Å; L56-K68 HydrophobicContact CB-CG 4.49Å; L56-K68 HydrophobicContact CD1-CD 4.33Å; L56-K68 PolarHBondContact N-O 3.3Å; L56-R70 HydrophobicContact CD1-CB 4.26Å; L56-R70 HydrophobicContact CG-CB 4.42Å; L56-D79 WeakPolarHBondContact CD1-OD2 3.47Å
57	N	87.8	Confident	84.4	Confident	85 Å²	85	85.5 Å²	85.5	46%	0.455	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	160.6	-174.8	-142.5	-30.3	0	0	0	112.3	Y67 K68 W81	N57-Y67 CarbonylContact O-C 3.58Å; N57-Y67 WeakPolarHBondContact O-CA 3.46Å; N57-K68 HydrophobicContact CB-CB 3.97Å; N57-K68 PolarHBondContact O-N 3.13Å; N57-W81 HydrophobicContact CB-CH2 3.86Å; N57-W81 HydrophobicContact CB-CZ2 4.47Å; N57-W81 HydrophobicContact CB-CZ3 4.5Å
58	E	91.7	Very high	86.6	Confident	79 Å²	79	81.7 Å²	81.7	37%	0.369	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	156.4	171.2	70.6	168.6	159.5	0	0	112.3	Y66 Y67 F97 H98	E58-Y66 CarbonylContact C-O 3.38Å; E58-Y67 HydrophobicContact CB-CD1 3.82Å; E58-Y67 HydrophobicContact CB-CE1 3.93Å; E58-F97 HydrophobicContact CB-CE1 4.23Å; E58-F97 HydrophobicContact CG-CE1 4.33Å; E58-H98 IonicContact OE1-CE1 3.59Å; E58-H98 IonicContact OE2-CE1 3.42Å; E58-H98 PolarHBondContact OE2-CE1 3.38Å; E58-H98 IonicContact OE2-NE2 3.99Å
59	R	91.6	Very high	87.9	Confident	94 Å²	94	76.1 Å²	76.1	36%	0.355	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	150.2	169.8	71	-172.2	-177.5	-170.8	1.2	111.7	I61 Y66 W81	R59-I61 HydrophobicContact CG-CD1 4.33Å; R59-I61 HydrophobicContact CG-CG1 4.33Å; R59-Y66 PolarHBondContact N-O 3.01Å; R59-Y66 PolarHBondContact O-N 2.89Å; R59-W81 HydrophobicContact CB-CH2 4.12Å; R59-W81 HydrophobicContact CB-CZ3 3.94Å; R59-W81 VanDerWaalsContact CD-CZ3 3.48Å; R59-W81 HydrophobicContact CG-CE3 3.79Å; R59-W81 HydrophobicContact CG-CH2 3.94Å; R59-W81 HydrophobicContact CG-CZ3 3.44Å; R59-W81 VanDerWaalsContact CG-CZ3 3.44Å; R59-W81 VanDerWaalsContact NH2-CG 3.27Å
60	I	92.1	Very high	88.6	Confident	125 Å²	125	72.8 Å²	72.8	64%	0.641	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.7	173.2	-63.1	160.4	0	0	0	109.5	Q64 K65	I60-Q64 WeakPolarHBondContact CA-O 3.43Å; I60-K65 HydrophobicContact CG1-CG 4.13Å
61	I	85.9	Confident	89.1	Confident	71 Å²	71	68.4 Å²	68.4	36%	0.364	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	121.1	174.7	-64.2	178.9	0	0	0	108.3	R59 G63 Q64 Y66	R59-I61 HydrophobicContact CG-CD1 4.33Å; R59-I61 HydrophobicContact CG-CG1 4.33Å; I61-G63 PolarHBondContact O-N 3.21Å; I61-Q64 PolarHBondContact N-O 2.99Å; I61-Q64 PolarHBondContact O-N 3.32Å; I61-Y66 HydrophobicContact CB-CD2 4.01Å; I61-Y66 HydrophobicContact CB-CE2 3.88Å; I61-Y66 HydrophobicContact CD1-CD2 4.43Å; I61-Y66 HydrophobicContact CG1-CD2 4.38Å; I61-Y66 HydrophobicContact CG2-CE2 4.49Å
62	K	78.4	Confident	89.3	Confident	208 Å²	208	68.2 Å²	68.2	90%	0.904	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	38	179.8	-61.4	-178.7	173.6	-174.7	0	114.1	Q64	K62-Q64 VanDerWaalsContact C-N 3.26Å; K62-Q64 PolarHBondContact O-N 3.22Å
63	G	84.5	Confident	89.3	Confident	74 Å²	74	71.5 Å²	71.5	76%	0.763	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	2.2	-178.8	0	0	0	0	0	115.3	I61	I61-G63 PolarHBondContact O-N 3.21Å
64	Q	85	Confident	89.2	Confident	103 Å²	103	71.8 Å²	71.8	48%	0.481	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	135	171.6	-64.8	178.9	-1.8	0	0	109.7	I60 I61 K62 Y66	I60-Q64 WeakPolarHBondContact CA-O 3.43Å; I61-Q64 PolarHBondContact N-O 2.99Å; I61-Q64 PolarHBondContact O-N 3.32Å; K62-Q64 VanDerWaalsContact C-N 3.26Å; K62-Q64 PolarHBondContact O-N 3.22Å; Q64-Y66 HydrophobicContact CB-CE2 4.08Å
65	K	89.7	Confident	89.2	Confident	68 Å²	68	73.9 Å²	73.9	30%	0.296	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	143	168.9	-70.7	-166.2	-157.2	156.2	0	111.1	I60 Y67 P83 E84	I60-K65 HydrophobicContact CG1-CG 4.13Å; K65-Y67 HydrophobicContact CB-CE2 4.42Å; K65-Y67 HydrophobicContact CD-CE2 4.41Å; K65-Y67 VanDerWaalsContact CD-OH 3.24Å; K65-Y67 WeakPolarHBondContact CD-OH 3.26Å; K65-Y67 PolarHBondContact NZ-OH 2.94Å; K65-P83 WeakPolarHBondContact O-CA 3.23Å; K65-E84 HydrophobicContact CB-CB 4.22Å; K65-E84 WeakPolarHBondContact CD-OE1 3.33Å; K65-E84 IonicContact NZ-OE1 3.61Å; K65-E84 PolarHBondContact NZ-OE1 3.45Å; K65-E84 PolarHBondContact O-N 3.25Å; K65-E84 VanDerWaalsContact O-N 3.1Å
66	Y	93.8	Very high	88.9	Confident	56 Å²	56	77.4 Å²	77.4	22%	0.22	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	136.4	168.5	-69.8	-100.2	0	0	0	109	E58 R59 I61 Q64 W81 E82 P83	E58-Y66 CarbonylContact C-O 3.38Å; R59-Y66 PolarHBondContact N-O 3.01Å; R59-Y66 PolarHBondContact O-N 2.89Å; I61-Y66 HydrophobicContact CB-CD2 4.01Å; I61-Y66 HydrophobicContact CB-CE2 3.88Å; I61-Y66 HydrophobicContact CD1-CD2 4.43Å; I61-Y66 HydrophobicContact CG1-CD2 4.38Å; I61-Y66 HydrophobicContact CG2-CE2 4.49Å; Q64-Y66 HydrophobicContact CB-CE2 4.08Å; Y66-W81 WeakPolarHBondContact O-CZ3 3.46Å; Y66-E82 CarbonylContact C-O 3.59Å; Y66-E82 WeakPolarHBondContact CA-O 3.4Å; Y66-P83 HydrophobicContact CD1-CB 4.1Å; Y66-P83 HydrophobicContact CE1-CB 3.85Å; Y66-P83 HydrophobicContact CE1-CG 4.41Å
67	Y	94.1	Very high	88.9	Confident	0 Å²	0	83.1 Å²	83.1	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.9	174.8	-60.4	-80.1	0	0	0	109.5	I55 N57 E58 K65 W81 E82 E84 L87 I94 H98	I55-Y67 HydrophobicContact CG2-CD1 4.08Å; I55-Y67 HydrophobicContact CG2-CG 4.39Å; N57-Y67 CarbonylContact O-C 3.58Å; N57-Y67 WeakPolarHBondContact O-CA 3.46Å; E58-Y67 HydrophobicContact CB-CD1 3.82Å; E58-Y67 HydrophobicContact CB-CE1 3.93Å; K65-Y67 HydrophobicContact CB-CE2 4.42Å; K65-Y67 HydrophobicContact CD-CE2 4.41Å; K65-Y67 VanDerWaalsContact CD-OH 3.24Å; K65-Y67 WeakPolarHBondContact CD-OH 3.26Å; K65-Y67 PolarHBondContact NZ-OH 2.94Å; Y67-W81 VanDerWaalsContact C-CE3 3.5Å; Y67-W81 CarbonylContact O-C 3.43Å; Y67-W81 WeakPolarHBondContact O-CA 3.29Å; Y67-E82 PolarHBondContact N-O 3.34Å; Y67-E82 PolarHBondContact O-N 3.14Å; Y67-E84 HydrophobicContact CD2-CB 4.45Å; Y67-E84 HydrophobicContact CE2-CB 3.88Å; Y67-E84 HydrophobicContact CE2-CG 3.86Å; Y67-E84 PolarHBondContact OH-OE1 3.13Å; Y67-L87 HydrophobicContact CD2-CD1 3.85Å; Y67-L87 HydrophobicContact CG-CD1 4.26Å; Y67-I94 HydrophobicContact CE1-CG2 4.42Å; Y67-I94 HydrophobicContact CE2-CD1 4.23Å; Y67-H98 AromaticContact CE1-NE2 3.53Å
68	K	93.9	Very high	88.9	Confident	53 Å²	53	81 Å²	81	23%	0.23	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	113.7	173	-167.7	-169.9	178.4	-138.4	0	108.3	L56 N57 D79 S80 W81	L56-K68 HydrophobicContact CB-CB 4.37Å; L56-K68 HydrophobicContact CB-CD 4.22Å; L56-K68 HydrophobicContact CB-CG 4.49Å; L56-K68 HydrophobicContact CD1-CD 4.33Å; L56-K68 PolarHBondContact N-O 3.3Å; N57-K68 HydrophobicContact CB-CB 3.97Å; N57-K68 PolarHBondContact O-N 3.13Å; K68-D79 HydrophobicContact CD-CB 4.42Å; K68-D79 WeakPolarHBondContact CE-OD2 3.48Å; K68-D79 HydrophobicContact CG-CB 4.35Å; K68-D79 IonicContact NZ-OD2 2.81Å; K68-D79 PolarHBondContact NZ-OD2 3.5Å; K68-S80 CarbonylContact C-O 3.51Å; K68-S80 WeakPolarHBondContact CA-O 3.39Å; K68-W81 HydrophobicContact CB-CD2 3.88Å; K68-W81 HydrophobicContact CB-CE3 3.87Å; K68-W81 HydrophobicContact CB-CH2 3.93Å; K68-W81 HydrophobicContact CB-CZ2 3.9Å; K68-W81 HydrophobicContact CB-CZ3 3.88Å; K68-W81 HydrophobicContact CD-CZ2 4.36Å; K68-W81 HydrophobicContact CG-CD2 4.25Å; K68-W81 HydrophobicContact CG-CZ2 4.3Å
69	V	93	Very high	88.9	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.2	-171.9	-178.7	0	0	0	0	109.7	V52 W71 D79 S80 E82 L87	V52-V69 HydrophobicContact CB-CG1 4.3Å; V52-V69 HydrophobicContact CG1-CG1 3.86Å; V52-V69 HydrophobicContact CG2-CG1 3.69Å; V69-W71 HydrophobicContact CB-CZ2 4.11Å; V69-W71 HydrophobicContact CG1-CD2 3.77Å; V69-W71 HydrophobicContact CG1-CE3 3.82Å; V69-W71 HydrophobicContact CG1-CG 4.48Å; V69-W71 HydrophobicContact CG1-CH2 3.88Å; V69-W71 HydrophobicContact CG1-CZ2 3.8Å; V69-W71 HydrophobicContact CG1-CZ3 3.88Å; V69-D79 VanDerWaalsContact O-CA 3.27Å; V69-D79 WeakPolarHBondContact O-CA 3.41Å; V69-S80 PolarHBondContact N-O 3.02Å; V69-S80 PolarHBondContact O-N 2.93Å; V69-E82 HydrophobicContact CB-CG 4.48Å; V69-E82 HydrophobicContact CG2-CB 3.96Å; V69-E82 HydrophobicContact CG2-CG 3.86Å; V69-L87 HydrophobicContact CG2-CD1 3.96Å; V69-L87 HydrophobicContact CG2-CD2 4.11Å
70	R	91.6	Very high	89	Confident	46 Å²	46	75.3 Å²	75.3	17%	0.174	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	128.2	159.3	170.2	68.3	57.3	64	10.2	108.5	E53 S54 L56 D79	E53-R70 HydrophobicContact CB-CB 4.33Å; E53-R70 HydrophobicContact CB-CG 3.66Å; E53-R70 HydrophobicContact CG-CG 4.09Å; E53-R70 PolarHBondContact N-O 3Å; E53-R70 IonicContact OE1-NH1 3.84Å; E53-R70 PolarHBondContact OE1-NH1 2.94Å; E53-R70 VanDerWaalsContact OE1-NH1 3.14Å; E53-R70 WeakPolarHBondContact OE2-CD 3.48Å; E53-R70 WeakPolarHBondContact OE2-CG 3.34Å; E53-R70 IonicContact OE2-NH1 3.13Å; S54-R70 PolarHBondContact O-N 2.82Å; L56-R70 HydrophobicContact CD1-CB 4.26Å; L56-R70 HydrophobicContact CG-CB 4.42Å; R70-D79 WeakPolarHBondContact CD-OD1 3.43Å; R70-D79 IonicContact CZ-OD1 2.73Å; R70-D79 IonicContact NE-OD1 2.91Å; R70-D79 PolarHBondContact NE-OD1 3.11Å; R70-D79 IonicContact NH2-OD1 3.22Å; R70-D79 IonicContact NH2-OD2 2.77Å
71	W	91.6	Very high	89	Confident	45 Å²	45	73 Å²	73	17%	0.17	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	133.5	177	-55.6	107.4	0	0	0	110.2	V52 V69 G73 F74 S80 E82	V52-W71 HydrophobicContact CG2-CE3 4.11Å; V52-W71 HydrophobicContact CG2-CZ3 3.78Å; V69-W71 HydrophobicContact CB-CZ2 4.11Å; V69-W71 HydrophobicContact CG1-CD2 3.77Å; V69-W71 HydrophobicContact CG1-CE3 3.82Å; V69-W71 HydrophobicContact CG1-CG 4.48Å; V69-W71 HydrophobicContact CG1-CH2 3.88Å; V69-W71 HydrophobicContact CG1-CZ2 3.8Å; V69-W71 HydrophobicContact CG1-CZ3 3.88Å; W71-G73 PolarHBondContact O-N 3.22Å; W71-F74 HydrophobicContact CB-CB 4.1Å; W71-F74 HydrophobicContact CB-CD2 3.55Å; W71-F74 HydrophobicContact CB-CE2 4.33Å; W71-F74 HydrophobicContact CB-CG 4.08Å; W71-F74 PolarHBondContact O-N 2.56Å; W71-S80 WeakPolarHBondContact CZ2-OG 3.18Å; W71-S80 PolarHBondContact NE1-OG 2.74Å; W71-E82 HydrophobicContact CH2-CG 3.96Å; W71-E82 HydrophobicContact CZ2-CG 3.65Å
72	E	87.4	Confident	89.3	Confident	110 Å²	110	71.6 Å²	71.6	51%	0.514	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	131.5	-179.5	-171.9	179.6	-157.7	0	0	110.9	I51 E53 F74	I51-E72 HydrophobicContact CB-CB 4.17Å; I51-E72 WeakPolarHBondContact CB-OE2 3.43Å; I51-E72 HydrophobicContact CG2-CB 4.31Å; I51-E72 WeakPolarHBondContact CG2-OE2 3.27Å; I51-E72 PolarHBondContact O-N 3.01Å; E53-E72 HydrophobicContact CB-CB 4.37Å; E72-F74 VanDerWaalsContact C-N 3.3Å; E72-F74 VanDerWaalsContact O-CD2 3.3Å; E72-F74 WeakPolarHBondContact O-CD2 3.47Å; E72-F74 PolarHBondContact O-N 2.76Å
73	G	87.9	Confident	89.9	Confident	82 Å²	82	63 Å²	63	85%	0.845	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	-0.6	-178.9	0	0	0	0	0	115.7	W71	W71-G73 PolarHBondContact O-N 3.22Å
74	F	86.2	Confident	90.1	Very high	102 Å²	102	63.3 Å²	63.3	45%	0.447	33%	0.333	S	S	.	.	S	Bend	trans	-103.4	148.5	178.2	-69.6	-92.6	0	0	0	112.7	Y50 W71 E72 A78	Y50-F74 HydrophobicContact CD1-CE2 4.41Å; Y50-F74 HydrophobicContact CE1-CZ 4.49Å; W71-F74 HydrophobicContact CB-CB 4.1Å; W71-F74 HydrophobicContact CB-CD2 3.55Å; W71-F74 HydrophobicContact CB-CE2 4.33Å; W71-F74 HydrophobicContact CB-CG 4.08Å; W71-F74 PolarHBondContact O-N 2.56Å; E72-F74 VanDerWaalsContact C-N 3.3Å; E72-F74 VanDerWaalsContact O-CD2 3.3Å; E72-F74 WeakPolarHBondContact O-CD2 3.47Å; E72-F74 PolarHBondContact O-N 2.76Å; F74-A78 HydrophobicContact CB-CB 3.99Å; F74-A78 HydrophobicContact CD1-CB 4.44Å
75	P	88.1	Confident	90.1	Very high	76 Å²	76	66.4 Å²	66.4	49%	0.494	34%	0.344	S	S	.	.			trans	-66.6	156.5	176.2	29.1	-35.9	0	0	0	111.8	E77 A78	P75-E77 PolarHBondContact O-N 2.91Å; P75-A78 WeakPolarHBondContact O-CB 3.25Å; P75-A78 PolarHBondContact O-N 3.22Å
76	P	85.4	Confident	89.9	Confident	84 Å²	84	68.1 Å²	68.1	55%	0.545	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-62.4	-11.1	-179.1	26.5	-36.7	0	0	0	114.7	A78	P76-A78 VanDerWaalsContact C-N 3.3Å
77	E	87	Confident	89.5	Confident	185 Å²	185	65.6 Å²	65.6	86%	0.864	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-73.6	-21.8	172.1	-57.8	-173	168.5	0	0	112.7	P75	P75-E77 PolarHBondContact O-N 2.91Å
78	A	87.7	Confident	88.7	Confident	40 Å²	40	70 Å²	70	33%	0.331	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-86.7	-1.3	178	0	0	0	0	0	113.8	F74 P75 P76 S80	F74-A78 HydrophobicContact CB-CB 3.99Å; F74-A78 HydrophobicContact CD1-CB 4.44Å; P75-A78 WeakPolarHBondContact O-CB 3.25Å; P75-A78 PolarHBondContact O-N 3.22Å; P76-A78 VanDerWaalsContact C-N 3.3Å; A78-S80 PolarHBondContact O-N 3.15Å
79	D	92.3	Very high	87.9	Confident	22 Å²	22	74.5 Å²	74.5	12%	0.118	40%	0.401	C	S	.	.			trans	-59	108.9	-178.3	-60.9	-17.4	0	0	0	111.4	L56 K68 V69 R70	L56-D79 WeakPolarHBondContact CD1-OD2 3.47Å; K68-D79 HydrophobicContact CD-CB 4.42Å; K68-D79 WeakPolarHBondContact CE-OD2 3.48Å; K68-D79 HydrophobicContact CG-CB 4.35Å; K68-D79 IonicContact NZ-OD2 2.81Å; K68-D79 PolarHBondContact NZ-OD2 3.5Å; V69-D79 VanDerWaalsContact O-CA 3.27Å; V69-D79 WeakPolarHBondContact O-CA 3.41Å; R70-D79 WeakPolarHBondContact CD-OD1 3.43Å; R70-D79 IonicContact CZ-OD1 2.73Å; R70-D79 IonicContact NE-OD1 2.91Å; R70-D79 PolarHBondContact NE-OD1 3.11Å; R70-D79 IonicContact NH2-OD1 3.22Å; R70-D79 IonicContact NH2-OD2 2.77Å
80	S	93.1	Very high	87.3	Confident	31 Å²	31	75.9 Å²	75.9	22%	0.217	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	174.9	-178.4	74.5	0	0	0	0	112.5	K68 V69 W71 A78 E82	K68-S80 CarbonylContact C-O 3.51Å; K68-S80 WeakPolarHBondContact CA-O 3.39Å; V69-S80 PolarHBondContact N-O 3.02Å; V69-S80 PolarHBondContact O-N 2.93Å; W71-S80 WeakPolarHBondContact CZ2-OG 3.18Å; W71-S80 PolarHBondContact NE1-OG 2.74Å; A78-S80 PolarHBondContact O-N 3.15Å; S80-E82 WeakPolarHBondContact CB-OE1 3.29Å; S80-E82 PolarHBondContact OG-OE1 2.94Å
81	W	93	Very high	86.9	Confident	77 Å²	77	79 Å²	79	29%	0.292	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	94.6	176.2	-80.8	94.3	0	0	0	109.7	N57 R59 Y66 Y67 K68	N57-W81 HydrophobicContact CB-CH2 3.86Å; N57-W81 HydrophobicContact CB-CZ2 4.47Å; N57-W81 HydrophobicContact CB-CZ3 4.5Å; R59-W81 HydrophobicContact CB-CH2 4.12Å; R59-W81 HydrophobicContact CB-CZ3 3.94Å; R59-W81 VanDerWaalsContact CD-CZ3 3.48Å; R59-W81 HydrophobicContact CG-CE3 3.79Å; R59-W81 HydrophobicContact CG-CH2 3.94Å; R59-W81 HydrophobicContact CG-CZ3 3.44Å; R59-W81 VanDerWaalsContact CG-CZ3 3.44Å; R59-W81 VanDerWaalsContact NH2-CG 3.27Å; Y66-W81 WeakPolarHBondContact O-CZ3 3.46Å; Y67-W81 VanDerWaalsContact C-CE3 3.5Å; Y67-W81 CarbonylContact O-C 3.43Å; Y67-W81 WeakPolarHBondContact O-CA 3.29Å; K68-W81 HydrophobicContact CB-CD2 3.88Å; K68-W81 HydrophobicContact CB-CE3 3.87Å; K68-W81 HydrophobicContact CB-CH2 3.93Å; K68-W81 HydrophobicContact CB-CZ2 3.9Å; K68-W81 HydrophobicContact CB-CZ3 3.88Å; K68-W81 HydrophobicContact CD-CZ2 4.36Å; K68-W81 HydrophobicContact CG-CD2 4.25Å; K68-W81 HydrophobicContact CG-CZ2 4.3Å
82	E	91.4	Very high	86.5	Confident	41 Å²	41	83 Å²	83	19%	0.192	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	142.2	-177.1	-61.7	-48.7	125.2	0	0	111.9	Y66 Y67 V69 W71 S80 N86 L87	Y66-E82 CarbonylContact C-O 3.59Å; Y66-E82 WeakPolarHBondContact CA-O 3.4Å; Y67-E82 PolarHBondContact N-O 3.34Å; Y67-E82 PolarHBondContact O-N 3.14Å; V69-E82 HydrophobicContact CB-CG 4.48Å; V69-E82 HydrophobicContact CG2-CB 3.96Å; V69-E82 HydrophobicContact CG2-CG 3.86Å; W71-E82 HydrophobicContact CH2-CG 3.96Å; W71-E82 HydrophobicContact CZ2-CG 3.65Å; S80-E82 WeakPolarHBondContact CB-OE1 3.29Å; S80-E82 PolarHBondContact OG-OE1 2.94Å; E82-N86 HydrophobicContact CB-CB 4.28Å; E82-N86 PolarHBondContact OE2-ND2 3.13Å; E82-L87 HydrophobicContact CB-CD1 4.24Å; E82-L87 HydrophobicContact CB-CG 4.37Å
83	P	90.9	Very high	86.4	Confident	27 Å²	27	79.9 Å²	79.9	18%	0.175	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	152.1	170.9	31.4	-34.8	0	0	0	110.4	K65 Y66 K85 N86	K65-P83 WeakPolarHBondContact O-CA 3.23Å; Y66-P83 HydrophobicContact CD1-CB 4.1Å; Y66-P83 HydrophobicContact CE1-CB 3.85Å; Y66-P83 HydrophobicContact CE1-CG 4.41Å; P83-K85 PolarHBondContact O-N 3.04Å; P83-N86 HydrophobicContact CG-CB 4.28Å; P83-N86 PolarHBondContact O-N 3.08Å
84	E	88.1	Confident	86.4	Confident	81 Å²	81	76.8 Å²	76.8	38%	0.379	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-51.5	-28.6	177.2	-172.3	159.6	-123.7	0	0	113.4	K65 Y67 N86 L87	K65-E84 HydrophobicContact CB-CB 4.22Å; K65-E84 WeakPolarHBondContact CD-OE1 3.33Å; K65-E84 IonicContact NZ-OE1 3.61Å; K65-E84 PolarHBondContact NZ-OE1 3.45Å; K65-E84 PolarHBondContact O-N 3.25Å; K65-E84 VanDerWaalsContact O-N 3.1Å; Y67-E84 HydrophobicContact CD2-CB 4.45Å; Y67-E84 HydrophobicContact CE2-CB 3.88Å; Y67-E84 HydrophobicContact CE2-CG 3.86Å; Y67-E84 PolarHBondContact OH-OE1 3.13Å; E84-N86 VanDerWaalsContact C-N 3.31Å; E84-N86 PolarHBondContact O-N 3.47Å; E84-L87 PolarHBondContact O-N 3.25Å
85	K	86.6	Confident	86.2	Confident	168 Å²	168	74.6 Å²	74.6	73%	0.73	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-67.9	-19	175.6	-63.5	-167.4	175.2	-165.1	0	115.7	P83	P83-K85 PolarHBondContact O-N 3.04Å
86	N	84.7	Confident	86.1	Confident	104 Å²	104	77.5 Å²	77.5	56%	0.556	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-88.4	-12.2	176.9	-74.1	8.3	0	0	0	112.3	E82 P83 E84	E82-N86 HydrophobicContact CB-CB 4.28Å; E82-N86 PolarHBondContact OE2-ND2 3.13Å; P83-N86 HydrophobicContact CG-CB 4.28Å; P83-N86 PolarHBondContact O-N 3.08Å; E84-N86 VanDerWaalsContact C-N 3.31Å; E84-N86 PolarHBondContact O-N 3.47Å
87	L	86.6	Confident	86.1	Confident	4 Å²	4	75.3 Å²	75.3	2%	0.021	39%	0.39	C	S	.	.			trans	-111.6	22.8	-169.3	-65.9	169	0	0	0	113	V52 I55 Y67 V69 E82 E84 N89 V90 I94	V52-L87 HydrophobicContact CG2-CD2 4.16Å; I55-L87 HydrophobicContact CD1-CD1 4.42Å; Y67-L87 HydrophobicContact CD2-CD1 3.85Å; Y67-L87 HydrophobicContact CG-CD1 4.26Å; V69-L87 HydrophobicContact CG2-CD1 3.96Å; V69-L87 HydrophobicContact CG2-CD2 4.11Å; E82-L87 HydrophobicContact CB-CD1 4.24Å; E82-L87 HydrophobicContact CB-CG 4.37Å; E84-L87 PolarHBondContact O-N 3.25Å; L87-N89 PolarHBondContact O-N 2.98Å; L87-N89 VanDerWaalsContact O-N 3.17Å; L87-V90 HydrophobicContact CD2-CB 4.46Å; L87-V90 HydrophobicContact CD2-CG2 4.11Å; L87-V90 PolarHBondContact O-N 3.1Å; L87-I94 HydrophobicContact CB-CD1 4.1Å
88	T	77	Confident	86	Confident	91 Å²	91	69.1 Å²	69.1	56%	0.558	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-24.8	-177.9	42.6	0	0	0	0	114.5	V90	T88-V90 VanDerWaalsContact C-N 3.35Å
89	N	77.2	Confident	85.6	Confident	148 Å²	148	71.8 Å²	71.8	79%	0.791	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	0.7	176	-68.8	23.5	0	0	0	113.1	L87	L87-N89 PolarHBondContact O-N 2.98Å; L87-N89 VanDerWaalsContact O-N 3.17Å
90	V	80.5	Confident	84.5	Confident	30 Å²	30	72.1 Å²	72.1	18%	0.182	38%	0.378	C	S	.	.			trans	-124.7	30.3	-168.7	-152.5	0	0	0	0	111.5	V52 L87 T88 D92 I93 I94	V52-V90 HydrophobicContact CB-CG1 4.03Å; V52-V90 HydrophobicContact CG1-CG1 4.24Å; V52-V90 HydrophobicContact CG2-CG1 4.36Å; V52-V90 HydrophobicContact CG2-CG2 4.26Å; L87-V90 HydrophobicContact CD2-CB 4.46Å; L87-V90 HydrophobicContact CD2-CG2 4.11Å; L87-V90 PolarHBondContact O-N 3.1Å; T88-V90 VanDerWaalsContact C-N 3.35Å; V90-D92 PolarHBondContact O-N 3.42Å; V90-I93 HydrophobicContact CG1-CB 3.95Å; V90-I93 HydrophobicContact CG1-CD1 3.67Å; V90-I93 HydrophobicContact CG1-CG1 3.85Å; V90-I93 PolarHBondContact O-N 3.39Å; V90-I94 WeakPolarHBondContact O-CG1 3.4Å; V90-I94 PolarHBondContact O-N 3.35Å
91	L	81.7	Confident	82.9	Confident	112 Å²	112	72.6 Å²	72.6	59%	0.586	38%	0.381	S	S	*	.	H	α-helix	trans	-62	-30.6	-177.7	-64.9	175.6	0	0	0	112.8	I94 S95	L91-I94 HydrophobicContact CD2-CD1 4.39Å; L91-I94 WeakPolarHBondContact O-CB 3.35Å; L91-I94 PolarHBondContact O-N 3.29Å; L91-S95 PolarHBondContact O-N 3.22Å
92	D	84.5	Confident	81.2	Confident	127 Å²	127	75.7 Å²	75.7	68%	0.679	40%	0.397	S	S	*	.	H	α-helix	trans	-67.7	-47.3	-178.8	-60	-25.7	0	0	0	111.5	V90 I94 S95 E96	V90-D92 PolarHBondContact O-N 3.42Å; D92-I94 VanDerWaalsContact C-N 3.29Å; D92-I94 PolarHBondContact O-N 3.45Å; D92-S95 CarbonylContact O-C 3.58Å; D92-S95 WeakPolarHBondContact O-CA 3.31Å; D92-S95 WeakPolarHBondContact O-CB 3.36Å; D92-S95 PolarHBondContact O-N 3.08Å; D92-S95 PolarHBondContact O-OG 3.15Å; D92-E96 PolarHBondContact O-N 3.05Å
93	I	84.9	Confident	79.2	Confident	45 Å²	45	76.4 Å²	76.4	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-66.1	-32.2	176	-49.5	-175.7	0	0	0	110.9	V52 I55 V90 F97	V52-I93 HydrophobicContact CB-CD1 4.49Å; V52-I93 HydrophobicContact CG1-CD1 4.27Å; V52-I93 WeakPolarHBondContact O-CD1 3.35Å; I55-I93 HydrophobicContact CG1-CG2 4.33Å; V90-I93 HydrophobicContact CG1-CB 3.95Å; V90-I93 HydrophobicContact CG1-CD1 3.67Å; V90-I93 HydrophobicContact CG1-CG1 3.85Å; V90-I93 PolarHBondContact O-N 3.39Å; I93-F97 WeakPolarHBondContact O-CB 3.41Å; I93-F97 PolarHBondContact O-N 2.86Å
94	I	87.1	Confident	77.3	Confident	18 Å²	18	82.5 Å²	82.5	9%	0.092	43%	0.43	C	S	.	.	H	α-helix	trans	-61.9	-47.7	168.4	-65.2	168	0	0	0	109.5	I55 Y67 L87 V90 L91 D92 E96 F97 H98	I55-I94 HydrophobicContact CD1-CB 4.35Å; I55-I94 HydrophobicContact CD1-CD1 4.36Å; I55-I94 HydrophobicContact CD1-CG1 3.33Å; Y67-I94 HydrophobicContact CE1-CG2 4.42Å; Y67-I94 HydrophobicContact CE2-CD1 4.23Å; L87-I94 HydrophobicContact CB-CD1 4.1Å; V90-I94 WeakPolarHBondContact O-CG1 3.4Å; V90-I94 PolarHBondContact O-N 3.35Å; L91-I94 HydrophobicContact CD2-CD1 4.39Å; L91-I94 WeakPolarHBondContact O-CB 3.35Å; L91-I94 PolarHBondContact O-N 3.29Å; D92-I94 VanDerWaalsContact C-N 3.29Å; D92-I94 PolarHBondContact O-N 3.45Å; I94-E96 VanDerWaalsContact C-N 3.33Å; I94-E96 PolarHBondContact O-N 2.98Å; I94-F97 PolarHBondContact O-N 2.97Å; I94-H98 PolarHBondContact O-CD2 3.18Å; I94-H98 PolarHBondContact O-N 3.05Å
95	S	83.4	Confident	75.6	Confident	55 Å²	55	84.6 Å²	84.6	39%	0.385	44%	0.442	S	S	.	.	H	α-helix	trans	-60.1	-42	179.3	89.1	0	0	0	0	112.2	L91 D92 H98 N99	L91-S95 PolarHBondContact O-N 3.22Å; D92-S95 CarbonylContact O-C 3.58Å; D92-S95 WeakPolarHBondContact O-CA 3.31Å; D92-S95 WeakPolarHBondContact O-CB 3.36Å; D92-S95 PolarHBondContact O-N 3.08Å; D92-S95 PolarHBondContact O-OG 3.15Å; S95-H98 PolarHBondContact O-N 3.26Å; S95-N99 WeakPolarHBondContact O-CB 3.27Å; S95-N99 PolarHBondContact O-N 3.03Å; S95-N99 PolarHBondContact O-ND2 3.01Å
96	E	84.1	Confident	73.8	Confident	137 Å²	137	79.7 Å²	79.7	64%	0.64	43%	0.429	S	S	*	.	H	α-helix	trans	-64.1	-43.4	175.1	-69.8	-166.6	156.1	0	0	112.1	D92 I94 H98 N99 G100	D92-E96 PolarHBondContact O-N 3.05Å; I94-E96 VanDerWaalsContact C-N 3.33Å; I94-E96 PolarHBondContact O-N 2.98Å; E96-H98 VanDerWaalsContact C-N 3.34Å; E96-H98 PolarHBondContact O-N 3.46Å; E96-N99 PolarHBondContact O-N 3.39Å; E96-G100 PolarHBondContact O-N 3.26Å
97	F	86.7	Confident	72	Confident	38 Å²	38	82.6 Å²	82.6	17%	0.167	44%	0.437	C	S	.	.	H	α-helix	trans	-60.2	-43.4	176.1	177.6	-101.7	0	0	0	111.8	I55 E58 I93 I94 S101	I55-F97 HydrophobicContact CB-CB 4.27Å; I55-F97 HydrophobicContact CB-CD2 4.42Å; I55-F97 HydrophobicContact CB-CG 4.26Å; I55-F97 HydrophobicContact CG2-CB 4.29Å; I55-F97 HydrophobicContact CG2-CD1 4Å; I55-F97 HydrophobicContact CG2-CD2 4.05Å; I55-F97 HydrophobicContact CG2-CE1 4.41Å; I55-F97 HydrophobicContact CG2-CE2 4.45Å; I55-F97 HydrophobicContact CG2-CG 3.82Å; I55-F97 WeakPolarHBondContact O-CD2 3.46Å; E58-F97 HydrophobicContact CB-CE1 4.23Å; E58-F97 HydrophobicContact CG-CE1 4.33Å; I93-F97 WeakPolarHBondContact O-CB 3.41Å; I93-F97 PolarHBondContact O-N 2.86Å; I94-F97 PolarHBondContact O-N 2.97Å; F97-S101 VanDerWaalsContact O-CB 3.29Å; F97-S101 WeakPolarHBondContact O-CB 3.2Å; F97-S101 PolarHBondContact O-N 2.86Å; F97-S101 PolarHBondContact O-OG 3.39Å
98	H	84.8	Confident	70.1	Confident	55 Å²	55	89.1 Å²	89.1	26%	0.255	47%	0.472	S	S	.	.	H	α-helix	trans	-71	-36.3	177.9	-79.2	-94.9	0	0	0	112.8	E58 Y67 I94 S95 E96 K102	E58-H98 IonicContact OE1-CE1 3.59Å; E58-H98 IonicContact OE2-CE1 3.42Å; E58-H98 PolarHBondContact OE2-CE1 3.38Å; E58-H98 IonicContact OE2-NE2 3.99Å; Y67-H98 AromaticContact CE1-NE2 3.53Å; I94-H98 PolarHBondContact O-CD2 3.18Å; I94-H98 PolarHBondContact O-N 3.05Å; S95-H98 PolarHBondContact O-N 3.26Å; E96-H98 VanDerWaalsContact C-N 3.34Å; E96-H98 PolarHBondContact O-N 3.46Å; H98-K102 PolarHBondContact O-N 2.82Å
99	N	79.4	Confident	68.7	Low	97 Å²	97	91.2 Å²	91.2	52%	0.519	48%	0.479	S	S	.	.	H	α-helix	trans	-69.9	-44.9	175	-72.3	-26	0	0	0	111.9	S95 E96 S101 K102 S103	S95-N99 WeakPolarHBondContact O-CB 3.27Å; S95-N99 PolarHBondContact O-N 3.03Å; S95-N99 PolarHBondContact O-ND2 3.01Å; E96-N99 PolarHBondContact O-N 3.39Å; N99-S101 VanDerWaalsContact C-N 3.31Å; N99-S101 PolarHBondContact O-N 3.45Å; N99-K102 PolarHBondContact O-N 2.79Å; N99-S103 PolarHBondContact O-N 3.34Å
100	G	68.3	Low	66.9	Low	28 Å²	28	90.2 Å²	90.2	29%	0.289	47%	0.474	S	S	.	.	H	α-helix	trans	-59.1	-41.3	174.4	0	0	0	0	0	112.4	E96 K102 S103 K104	E96-G100 PolarHBondContact O-N 3.26Å; G100-K102 PolarHBondContact O-N 2.82Å; G100-S103 PolarHBondContact O-N 3Å; G100-S103 PolarHBondContact O-OG 3.09Å; G100-K104 PolarHBondContact O-N 3.36Å
101	S	60.8	Low	65.1	Low	41 Å²	41	95.4 Å²	95.4	29%	0.287	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-40	177.9	-64.9	0	0	0	0	113.1	F97 N99 S103 K104 I105	F97-S101 VanDerWaalsContact O-CB 3.29Å; F97-S101 WeakPolarHBondContact O-CB 3.2Å; F97-S101 PolarHBondContact O-N 2.86Å; F97-S101 PolarHBondContact O-OG 3.39Å; N99-S101 VanDerWaalsContact C-N 3.31Å; N99-S101 PolarHBondContact O-N 3.45Å; S101-S103 PolarHBondContact O-N 3.19Å; S101-K104 PolarHBondContact O-N 3.33Å; S101-I105 WeakPolarHBondContact O-CG1 3.37Å; S101-I105 PolarHBondContact O-N 3.41Å
102	K	55.8	Low	63.2	Low	143 Å²	143	98.3 Å²	98.3	62%	0.622	51%	0.509	S	S	*	.	H	α-helix	trans	-58.8	-46.8	172	-69.9	172.6	-178.6	171.9	0	111.3	H98 N99 G100 K104 I105 S106	H98-K102 PolarHBondContact O-N 2.82Å; N99-K102 PolarHBondContact O-N 2.79Å; G100-K102 PolarHBondContact O-N 2.82Å; K102-K104 PolarHBondContact O-N 3.21Å; K102-I105 PolarHBondContact O-N 2.97Å; K102-S106 PolarHBondContact O-N 3.3Å; K102-S106 PolarHBondContact O-OG 2.96Å
103	S	50.7	Low	60.8	Low	55 Å²	55	101.7 Å²	101.7	39%	0.385	52%	0.518	S	S	.	.	H	α-helix	trans	-66.1	-33.9	-179.4	78.8	0	0	0	0	114.3	N99 G100 S101 S106 K107	N99-S103 PolarHBondContact O-N 3.34Å; G100-S103 PolarHBondContact O-N 3Å; G100-S103 PolarHBondContact O-OG 3.09Å; S101-S103 PolarHBondContact O-N 3.19Å; S103-S106 PolarHBondContact O-N 3.33Å; S103-K107 PolarHBondContact O-N 3.1Å; S103-K107 VanDerWaalsContact O-N 3.09Å
104	K	50.7	Low	58.4	Low	156 Å²	156	106.9 Å²	106.9	68%	0.678	55%	0.546	S	S	*	.	H	α-helix	trans	-74.4	-25.7	178.8	-76.3	179.5	177.9	173.4	0	112.8	G100 S101 K102	G100-K104 PolarHBondContact O-N 3.36Å; S101-K104 PolarHBondContact O-N 3.33Å; K102-K104 PolarHBondContact O-N 3.21Å
105	I	52.2	Low	55.7	Low	124 Å²	124	111.3 Å²	111.3	64%	0.636	58%	0.577	S	S	*	*	H	α-helix	trans	-70	-42.7	171	-72.3	169.2	0	0	0	110.3	S101 K102	S101-I105 WeakPolarHBondContact O-CG1 3.37Å; S101-I105 PolarHBondContact O-N 3.41Å; K102-I105 PolarHBondContact O-N 2.97Å
106	S	48.2	Very low	53.5	Low	66 Å²	66	117 Å²	117	46%	0.462	60%	0.598	S	S	.	*	H	α-helix	trans	-62.6	-53.9	175.4	-53.5	0	0	0	0	112.5	K102 S103 N108 L109	K102-S106 PolarHBondContact O-N 3.3Å; K102-S106 PolarHBondContact O-OG 2.96Å; S103-S106 PolarHBondContact O-N 3.33Å; S106-N108 PolarHBondContact O-N 2.97Å; S106-L109 PolarHBondContact O-N 3.49Å
107	K	47.1	Very low	50.8	Low	165 Å²	165	116 Å²	116	72%	0.717	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-7.4	-170.9	-74.6	-177.1	175.5	-178.4	0	116	S103	S103-K107 PolarHBondContact O-N 3.1Å; S103-K107 VanDerWaalsContact O-N 3.09Å
108	N	46.3	Very low	48.4	Very low	141 Å²	141	120.9 Å²	120.9	75%	0.754	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	0.3	174.8	-111.9	-40.7	0	0	0	113.9	S106	S106-N108 PolarHBondContact O-N 2.97Å
109	L	48.8	Very low	46	Very low	135 Å²	135	126.6 Å²	126.6	71%	0.707	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-21.4	179.4	-85.6	151.3	0	0	0	114.1	S106	S106-L109 PolarHBondContact O-N 3.49Å
110	D	38.9	Very low	43.8	Very low	127 Å²	127	129.1 Å²	129.1	68%	0.679	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	7.2	-160.9	-60.8	-36.3	0	0	0	116.1	H112	D110-H112 PolarHBondContact O-N 2.86Å
111	I	43.9	Very low	42.3	Very low	139 Å²	139	133.7 Å²	133.7	71%	0.713	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-13.7	-176.8	-70.1	177.8	0	0	0	113.4
112	H	41.1	Very low	41.3	Very low	172 Å²	172	137.3 Å²	137.3	80%	0.796	71%	0.71	S	S	*	*	S	Bend	trans	-144	81.5	176.4	-85.6	-53.4	0	0	0	114.6	D110	D110-H112 PolarHBondContact O-N 2.86Å
113	K	33.4	Very low	40.5	Very low	199 Å²	199	136.7 Å²	136.7	87%	0.865	72%	0.721	S	S	*	*				-171.5	142.7	122.2	-108	166.4	-175.5	175.6	0	114.3
114	D	35.7	Very low	39.7	Very low	154 Å²	154	138.8 Å²	138.8	82%	0.824	74%	0.741	S	S	*	*			trans	-63.9	129.5	166.3	-53.4	-83.8	0	0	0	111.9
115	C	30.3	Very low	39.1	Very low	110 Å²	110	137.3 Å²	137.3	74%	0.743	75%	0.75	S	S	*	*			trans	39.2	142.5	135.8	-71.6	0	0	0	0	123.1
116	Q	35.9	Very low	38.4	Very low	175 Å²	175	138.4 Å²	138.4	82%	0.818	76%	0.762	S	S	*	*			trans	81.3	80.5	151.3	-69.7	166.8	11.4	0	0	118.3
117	T	29.1	Very low	37.9	Very low	116 Å²	116	140.2 Å²	140.2	71%	0.712	77%	0.773	S	S	*	*				42.9	115.4	115.9	57.5	0	0	0	0	119.1
118	V	36	Very low	37.5	Very low	140 Å²	140	138.6 Å²	138.6	85%	0.848	78%	0.777	S	S	*	*				-146.9	156.2	96.5	174.6	0	0	0	0	107.6
119	F	33.7	Very low	37.1	Very low	175 Å²	175	136.3 Å²	136.3	77%	0.768	77%	0.77	S	S	*	*			trans	-66	166.1	175	-59.6	-98.3	0	0	0	111.2
120	E	34.3	Very low	36.6	Very low	151 Å²	151	136.1 Å²	136.1	71%	0.706	78%	0.776	S	S	*	*			cis	-164	174.5	18.3	-144.9	166.1	-107.2	0	0	112.2
121	N	36.8	Very low	36.4	Very low	124 Å²	124	134.9 Å²	134.9	66%	0.663	78%	0.784	S	S	*	*			trans	65.1	95.4	155.2	-60.6	-40.3	0	0	0	122.8
122	S	38.6	Very low	36.1	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	79%	0.788	S	S	*	*				65.4	125.9	124.9	-60.3	0	0	0	0	123.1
123	P	38.4	Very low	35.8	Very low	131 Å²	131	132 Å²	132	85%	0.851	79%	0.787	S	S	*	*			trans	-113.1	153.4	179.4	40.4	-32.3	0	0	0	115.8
124	A	35.6	Very low	35.6	Very low	98 Å²	98	129 Å²	129	81%	0.81	79%	0.79	S	S	*	*			trans	-166.2	85.4	153.7	0	0	0	0	0	113.3
125	S	36.9	Very low	35.5	Very low	125 Å²	125	127 Å²	127	87%	0.874	79%	0.788	S	S	*	*			trans	-162.6	126.9	167.2	-83.6	0	0	0	0	112.4
126	V	37.3	Very low	35.6	Very low	147 Å²	147	127.1 Å²	127.1	89%	0.891	79%	0.785	S	S	*	*			trans	-110.9	129.5	174.2	178.4	0	0	0	0	108.9
127	P	37.1	Very low	35.4	Very low	104 Å²	104	127.2 Å²	127.2	68%	0.675	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-96.4	150.1	-154.6	35.8	-37.8	0	0	0	116.3
128	T	39	Very low	35.6	Very low	132 Å²	132	129.7 Å²	129.7	81%	0.81	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-68.2	148.1	165.6	12.6	0	0	0	0	112.4
129	P	38.4	Very low	35.4	Very low	93 Å²	93	130.7 Å²	130.7	60%	0.604	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-80.1	152.1	175.3	32.9	-34.5	0	0	0	112.8
130	P	38.6	Very low	35.2	Very low	130 Å²	130	127.3 Å²	127.3	84%	0.844	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-83.6	154.8	-174	33.9	-36.7	0	0	0	114
131	A	35	Very low	35.1	Very low	102 Å²	102	128.1 Å²	128.1	84%	0.843	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-93.5	139.3	168.3	0	0	0	0	0	111.4
132	T	36.8	Very low	35	Very low	128 Å²	128	129.5 Å²	129.5	79%	0.785	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-88.4	150.8	174.7	40.8	0	0	0	0	112.4
133	P	34.3	Very low	34.6	Very low	122 Å²	122	128.8 Å²	128.8	79%	0.792	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-84	158.5	-165.5	34.1	-37.8	0	0	0	114.7
134	C	30	Very low	34.4	Very low	136 Å²	136	129.4 Å²	129.4	92%	0.919	79%	0.794	S	S	*	*			trans	-111.7	122.4	156.7	-82.1	0	0	0	0	109.1
135	S	33.6	Very low	34.2	Very low	113 Å²	113	136.4 Å²	136.4	79%	0.79	80%	0.799	S	S	*	*			trans	-91.6	119.9	177.3	52.2	0	0	0	0	111.6
136	V	31.5	Very low	34	Very low	111 Å²	111	134 Å²	134	67%	0.673	79%	0.794	S	S	*	*			trans	28.9	114.8	142.8	-170.4	0	0	0	0	117.8	Q138	V136-Q138 HydrophobicContact CG1-CB 4.26Å; V136-Q138 HydrophobicContact CG1-CG 3.75Å
137	L	31.7	Very low	34	Very low	177 Å²	177	132.7 Å²	132.7	93%	0.927	79%	0.791	S	S	*	*			trans	-110	115.7	144	-82.9	169.4	0	0	0	108
138	Q	34.1	Very low	34	Very low	169 Å²	169	132.2 Å²	132.2	79%	0.79	79%	0.79	S	S	*	*			trans	-106	120.6	168.2	-85.6	173.1	-15.7	0	0	108.2	V136	V136-Q138 HydrophobicContact CG1-CB 4.26Å; V136-Q138 HydrophobicContact CG1-CG 3.75Å
139	N	31.8	Very low	33.9	Very low	161 Å²	161	133.8 Å²	133.8	86%	0.861	79%	0.788	S	S	*	*			trans	-89.5	111.2	161.3	-94	5.5	0	0	0	108.4
140	S	28.9	Very low	33.6	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	79%	0.789	S	S	*	*			trans	-82.4	136.8	174.7	54.7	0	0	0	0	111.5
141	H	33.7	Very low	33.4	Very low	168 Å²	168	138 Å²	138	78%	0.778	78%	0.781	S	S	*	*			trans	-135	127.1	156.2	-87.6	-76.7	0	0	0	110.7
142	N	34.1	Very low	33.4	Very low	153 Å²	153	141 Å²	141	82%	0.818	78%	0.778	S	S	*	*			trans	68.7	141.3	172.6	-48.4	-23.9	0	0	0	114.7
143	S	29.9	Very low	33.3	Very low	100 Å²	100	141.4 Å²	141.4	70%	0.699	77%	0.774	S	S	*	*			cis	-147.4	152	16	-148.5	0	0	0	0	114.6
144	L	34.9	Very low	33.2	Very low	145 Å²	145	141.6 Å²	141.6	76%	0.759	77%	0.769	S	S	*	*			trans	69.3	108.4	153	-72.1	158.9	0	0	0	122
145	R	30.8	Very low	33.6	Very low	245 Å²	245	144.3 Å²	144.3	93%	0.925	77%	0.765	S	S	*	*				84.8	114.1	117.8	-175.3	-174.2	-86.5	-138.2	-2.4	119.1
146	G	32.6	Very low	33.8	Very low	74 Å²	74	143.7 Å²	143.7	76%	0.763	76%	0.761	S	S	*	*			trans	166.4	69.9	163.8	0	0	0	0	0	116.9
147	S	37.4	Very low	34.2	Very low	119 Å²	119	143.7 Å²	143.7	83%	0.832	76%	0.761	S	S	*	*			trans	24.1	122.8	160.9	-53.6	0	0	0	0	123.2
148	S	37.8	Very low	34.5	Very low	94 Å²	94	144 Å²	144	66%	0.657	76%	0.755	S	S	*	*			trans	46.8	119.7	130.3	-72.4	0	0	0	0	124
149	E	35.6	Very low	34.6	Very low	165 Å²	165	147 Å²	147	77%	0.771	76%	0.759	S	S	*	*				93	117	119.6	-72.9	157.8	-120.9	0	0	123
150	E	33.4	Very low	35	Very low	132 Å²	132	146.9 Å²	146.9	62%	0.617	75%	0.75	S	S	*	*			trans	76	121.5	131.8	-67.7	-126.5	107.7	0	0	123.1
151	R	34.2	Very low	35.5	Very low	181 Å²	181	148.3 Å²	148.3	68%	0.683	75%	0.745	S	S	*	*			trans	72.1	104	136.5	-66.2	179.7	-164.6	172	21.4	121.4
152	Q	34.1	Very low	35.3	Very low	164 Å²	164	148.5 Å²	148.5	77%	0.766	74%	0.744	S	S	*	*				78.1	160.5	118.7	-66.9	-177.1	12	0	0	120.8
153	L	35.1	Very low	35.6	Very low	136 Å²	136	147.5 Å²	147.5	71%	0.712	74%	0.744	S	S	*	*			trans	68.1	96.8	159.5	-96.3	74.9	0	0	0	120.6
154	N	32.8	Very low	35.8	Very low	127 Å²	127	152 Å²	152	68%	0.679	75%	0.751	S	S	*	*				65	139.7	107.6	-89	-35.2	0	0	0	123
155	K	38.2	Very low	36.1	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.835	76%	0.755	S	S	*	*			trans	70.8	160.2	156.7	-62.1	157.1	-176.5	176.4	0	115.7
156	S	36.7	Very low	36.5	Very low	101 Å²	101	151.1 Å²	151.1	71%	0.706	76%	0.756	S	S	*	*			cis	-177.1	-169	-30.7	-169.9	0	0	0	0	106.8
157	V	39.4	Very low	36.7	Very low	111 Å²	111	154.8 Å²	154.8	67%	0.673	76%	0.764	S	S	*	*			trans	69.2	96.3	167.9	-168.8	0	0	0	0	114.2
158	K	38.4	Very low	36.6	Very low	184 Å²	184	153 Å²	153	80%	0.8	76%	0.764	S	S	*	*				76.9	137.9	70.6	-71	175.4	176.8	177.3	0	115.2
159	R	37.9	Very low	36.6	Very low	231 Å²	231	151.6 Å²	151.6	87%	0.872	77%	0.765	S	S	*	*			trans	98.9	147.1	161.8	-63.6	178.4	173.7	136.9	-6	116.8
160	K	39.4	Very low	36.4	Very low	158 Å²	158	155.7 Å²	155.7	69%	0.687	77%	0.773	S	S	*	*			cis	-172.8	165.9	-25.8	-163.9	175.3	167.4	-153.7	0	109.3
161	H	39.1	Very low	36.7	Very low	134 Å²	134	160.5 Å²	160.5	62%	0.62	79%	0.787	S	S	*	*			trans	81.7	114	171.4	-59.4	-84.4	0	0	0	115.9
162	F	30.2	Very low	37.7	Very low	172 Å²	172	158.5 Å²	158.5	75%	0.754	79%	0.785	S	S	*	*				71.8	128.3	81.9	-82.7	-78.6	0	0	0	111.9
163	T	39.7	Very low	38.6	Very low	132 Å²	132	159.7 Å²	159.7	81%	0.81	78%	0.784	S	S	*	*			cis	-141.1	150.4	43.2	48.4	0	0	0	0	117.7
164	K	33.8	Very low	39.7	Very low	196 Å²	196	155.3 Å²	155.3	85%	0.852	76%	0.763	S	S	*	*			trans	-5.7	121.4	162.5	-57	172	179.7	177.7	0	120.5
165	S	41.4	Very low	41.1	Very low	120 Å²	120	151.4 Å²	151.4	84%	0.839	75%	0.745	S	S	*	*			trans	-158.6	152.1	135.4	68.8	0	0	0	0	113.4
166	R	40	Very low	42.3	Very low	251 Å²	251	150.6 Å²	150.6	95%	0.947	74%	0.741	S	S	*	*			trans	10.7	112.7	175.7	-70.4	-178.7	170.3	-179.3	-2.9	120.5
167	T	36.5	Very low	43.7	Very low	151 Å²	151	152 Å²	152	93%	0.926	74%	0.736	S	S	*	*			trans	-70.3	141.6	162.6	44.7	0	0	0	0	113.2
168	G	34.5	Very low	45	Very low	81 Å²	81	151.6 Å²	151.6	84%	0.835	73%	0.727	S	S	*	*			trans	-152.5	13.6	-175.3	0	0	0	0	0	118.6
169	G	37.8	Very low	45.9	Very low	65 Å²	65	147.3 Å²	147.3	67%	0.67	71%	0.712	S	S	*	*			trans	78.6	102.9	172.2	0	0	0	0	0	116.1
170	R	33.2	Very low	47.1	Very low	251 Å²	251	140.6 Å²	140.6	95%	0.947	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-71.1	130.3	165.9	-76.8	-172.3	175.8	-166.3	-1.2	110.1
171	Y	39.8	Very low	48	Very low	233 Å²	233	135.7 Å²	135.7	91%	0.914	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-78.3	124.2	161.8	-70.7	-89.5	0	0	0	109.2
172	E	53.5	Low	49.1	Very low	139 Å²	139	132.7 Å²	132.7	65%	0.65	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-94.5	128.5	177.1	178.2	179.7	-127.9	0	0	109.1	V174 K210	E172-V174 PolarHBondContact O-N 3.45Å; E172-K210 IonicContact OE2-NZ 3.64Å; E172-K210 PolarHBondContact OE2-NZ 3.17Å
173	Y	54.3	Low	50.6	Low	189 Å²	189	131.1 Å²	131.1	74%	0.741	67%	0.673	S	S	*	*			trans	-70.4	112.8	179.4	179.4	-89.9	0	0	0	110.2	P175	Y173-P175 WeakPolarHBondContact O-CD 3.44Å
174	V	57.5	Low	52.1	Low	43 Å²	43	127.8 Å²	127.8	26%	0.261	65%	0.653	S	S	.	*			trans	-86.8	118.1	176	179.9	0	0	0	0	109	E172 Q178 L179	E172-V174 PolarHBondContact O-N 3.45Å; V174-Q178 HydrophobicContact CG1-CB 3.5Å; V174-L179 HydrophobicContact CB-CD2 4.05Å; V174-L179 HydrophobicContact CB-CG 4.32Å; V174-L179 HydrophobicContact CG1-CD2 3.87Å; V174-L179 HydrophobicContact CG1-CG 3.98Å
175	P	61.8	Low	54.1	Low	46 Å²	46	124.8 Å²	124.8	30%	0.299	64%	0.639	S	S	.	*			trans	-57.2	148.5	179.4	-27.2	36.5	0	0	0	113.1	Y173 H177 Q178 L179	Y173-P175 WeakPolarHBondContact O-CD 3.44Å; P175-H177 PolarHBondContact O-N 3.39Å; P175-Q178 PolarHBondContact O-N 2.93Å; P175-L179 PolarHBondContact O-N 3.29Å; P175-L179 VanDerWaalsContact O-N 3.13Å
176	K	63.2	Low	55.4	Low	174 Å²	174	122.6 Å²	122.6	76%	0.757	61%	0.613	S	S	*	*	H	α-helix	trans	-54.6	-28.8	-172.9	-154.8	174.3	-174.4	178.3	0	113.9	V180	K176-V180 PolarHBondContact O-N 2.99Å
177	H	67.1	Low	56.9	Low	132 Å²	132	114.1 Å²	114.1	61%	0.611	58%	0.584	S	S	*	*	H	α-helix	trans	-74.3	-38.4	174.8	66	-103.3	0	0	0	113.4	P175 L179 V180 A181	P175-H177 PolarHBondContact O-N 3.39Å; H177-L179 VanDerWaalsContact C-N 3.29Å; H177-L179 PolarHBondContact O-N 2.83Å; H177-V180 WeakPolarHBondContact O-CB 3.12Å; H177-V180 PolarHBondContact O-N 2.93Å; H177-V180 VanDerWaalsContact O-N 3.11Å; H177-A181 PolarHBondContact O-N 3.26Å; H177-A181 VanDerWaalsContact O-N 3.13Å
178	Q	66.5	Low	58.7	Low	101 Å²	101	109.5 Å²	109.5	47%	0.472	55%	0.553	S	S	.	*	H	α-helix	trans	-69.1	-29.5	173.8	-80.7	-174	-2.3	0	0	111.7	V174 P175 V180 A181 S182	V174-Q178 HydrophobicContact CG1-CB 3.5Å; P175-Q178 PolarHBondContact O-N 2.93Å; Q178-V180 VanDerWaalsContact C-N 3.3Å; Q178-V180 PolarHBondContact O-N 2.81Å; Q178-A181 PolarHBondContact O-N 3.37Å; Q178-S182 WeakPolarHBondContact O-CB 3.16Å; Q178-S182 PolarHBondContact O-N 2.94Å; Q178-S182 PolarHBondContact O-OG 3.22Å
179	L	57	Low	60.7	Low	95 Å²	95	106.1 Å²	106.1	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-63.1	-35.5	169.3	-68.4	177.1	0	0	0	111.9	V174 P175 H177 S182 K183	V174-L179 HydrophobicContact CB-CD2 4.05Å; V174-L179 HydrophobicContact CB-CG 4.32Å; V174-L179 HydrophobicContact CG1-CD2 3.87Å; V174-L179 HydrophobicContact CG1-CG 3.98Å; P175-L179 PolarHBondContact O-N 3.29Å; P175-L179 VanDerWaalsContact O-N 3.13Å; H177-L179 VanDerWaalsContact C-N 3.29Å; H177-L179 PolarHBondContact O-N 2.83Å; L179-S182 PolarHBondContact O-N 3Å; L179-K183 WeakPolarHBondContact O-CB 3.5Å; L179-K183 PolarHBondContact O-N 2.71Å
180	V	62.8	Low	62.3	Low	89 Å²	89	105.4 Å²	105.4	54%	0.539	50%	0.496	S	S	.	.	H	α-helix	trans	-64.8	-48.6	172.2	177.1	0	0	0	0	110.7	K176 H177 Q178 S182 K183 T184	K176-V180 PolarHBondContact O-N 2.99Å; H177-V180 WeakPolarHBondContact O-CB 3.12Å; H177-V180 PolarHBondContact O-N 2.93Å; H177-V180 VanDerWaalsContact O-N 3.11Å; Q178-V180 VanDerWaalsContact C-N 3.3Å; Q178-V180 PolarHBondContact O-N 2.81Å; V180-S182 VanDerWaalsContact C-N 3.28Å; V180-S182 PolarHBondContact O-N 3.47Å; V180-K183 CarbonylContact O-C 3.56Å; V180-K183 WeakPolarHBondContact O-CA 3.18Å; V180-K183 WeakPolarHBondContact O-CB 3.32Å; V180-K183 PolarHBondContact O-N 3.18Å; V180-T184 HydrophobicContact CG1-CG2 4.47Å; V180-T184 PolarHBondContact O-N 3.02Å; V180-T184 PolarHBondContact O-OG1 2.84Å
181	A	59.6	Low	64.1	Low	56 Å²	56	100.8 Å²	100.8	46%	0.463	48%	0.479	S	S	.	.	H	α-helix	trans	-60.9	-35.1	176.8	0	0	0	0	0	113.2	H177 Q178 K183 T184 K185	H177-A181 PolarHBondContact O-N 3.26Å; H177-A181 VanDerWaalsContact O-N 3.13Å; Q178-A181 PolarHBondContact O-N 3.37Å; A181-K183 VanDerWaalsContact C-N 3.35Å; A181-T184 WeakPolarHBondContact CA-OG1 3.41Å; A181-T184 PolarHBondContact O-OG1 3.24Å; A181-K185 WeakPolarHBondContact O-CB 3.47Å; A181-K185 PolarHBondContact O-N 3.08Å
182	S	60.3	Low	65.9	Low	71 Å²	71	94.5 Å²	94.5	50%	0.497	46%	0.461	S	S	.	.	H	α-helix	trans	-65.6	-39.5	172.7	-57.3	0	0	0	0	111.5	Q178 L179 V180 Y186	Q178-S182 WeakPolarHBondContact O-CB 3.16Å; Q178-S182 PolarHBondContact O-N 2.94Å; Q178-S182 PolarHBondContact O-OG 3.22Å; L179-S182 PolarHBondContact O-N 3Å; V180-S182 VanDerWaalsContact C-N 3.28Å; V180-S182 PolarHBondContact O-N 3.47Å; S182-Y186 PolarHBondContact O-N 2.83Å; S182-Y186 VanDerWaalsContact O-N 3.11Å
183	K	63.2	Low	66.7	Low	138 Å²	138	90.2 Å²	90.2	60%	0.6	45%	0.454	S	S	*	.	H	α-helix	trans	-72.7	-37.8	179.4	-147.9	177.7	-170.7	179.7	0	111.8	L179 V180 A181 Y186 F187	L179-K183 WeakPolarHBondContact O-CB 3.5Å; L179-K183 PolarHBondContact O-N 2.71Å; V180-K183 CarbonylContact O-C 3.56Å; V180-K183 WeakPolarHBondContact O-CA 3.18Å; V180-K183 WeakPolarHBondContact O-CB 3.32Å; V180-K183 PolarHBondContact O-N 3.18Å; A181-K183 VanDerWaalsContact C-N 3.35Å; K183-Y186 PolarHBondContact O-N 3.45Å; K183-F187 HydrophobicContact CG-CE2 3.98Å; K183-F187 WeakPolarHBondContact O-CD2 3.29Å; K183-F187 PolarHBondContact O-N 3.27Å
184	T	71.1	Confident	67.7	Low	63 Å²	63	87.3 Å²	87.3	39%	0.387	45%	0.445	S	S	.	.	H	α-helix	trans	-63.2	-49.7	171.8	55.5	0	0	0	0	110.1	V180 A181 Y186 F187 D188	V180-T184 HydrophobicContact CG1-CG2 4.47Å; V180-T184 PolarHBondContact O-N 3.02Å; V180-T184 PolarHBondContact O-OG1 2.84Å; A181-T184 WeakPolarHBondContact CA-OG1 3.41Å; A181-T184 PolarHBondContact O-OG1 3.24Å; T184-Y186 PolarHBondContact O-N 3.01Å; T184-F187 CarbonylContact O-C 3.5Å; T184-F187 WeakPolarHBondContact O-CA 3.19Å; T184-F187 PolarHBondContact O-N 3.18Å; T184-D188 PolarHBondContact O-N 3.44Å
185	K	75.3	Confident	68.1	Low	133 Å²	133	86.6 Å²	86.6	58%	0.578	44%	0.44	S	S	*	.	H	α-helix	trans	-58.7	-33.6	178.8	-170.6	172.2	-178.3	176.8	0	113.4	A181 D188 D189	A181-K185 WeakPolarHBondContact O-CB 3.47Å; A181-K185 PolarHBondContact O-N 3.08Å; K185-D188 WeakPolarHBondContact CA-OD2 3.38Å; K185-D188 PolarHBondContact N-OD2 3.28Å; K185-D188 PolarHBondContact O-N 2.96Å; K185-D189 PolarHBondContact O-N 3.06Å
186	Y	68.8	Low	68.1	Low	73 Å²	73	89.4 Å²	89.4	29%	0.286	45%	0.452	S	S	.	.	H	α-helix	trans	-63.1	-44	170.9	174.8	-99.6	0	0	0	112.4	S182 K183 T184 D188 D189 I190 I195 V206	S182-Y186 PolarHBondContact O-N 2.83Å; S182-Y186 VanDerWaalsContact O-N 3.11Å; K183-Y186 PolarHBondContact O-N 3.45Å; T184-Y186 PolarHBondContact O-N 3.01Å; Y186-D188 VanDerWaalsContact C-N 3.34Å; Y186-D189 PolarHBondContact O-N 2.84Å; Y186-I190 HydrophobicContact CD1-CD1 4.09Å; Y186-I190 HydrophobicContact CE1-CD1 3.5Å; Y186-I190 HydrophobicContact CE2-CD1 4.37Å; Y186-I190 WeakPolarHBondContact O-CG1 3.2Å; Y186-I190 PolarHBondContact O-N 2.92Å; Y186-I190 VanDerWaalsContact O-N 3.14Å; Y186-I195 HydrophobicContact CD2-CD1 3.99Å; Y186-I195 HydrophobicContact CE2-CD1 3.98Å; Y186-V206 HydrophobicContact CE2-CG2 4.08Å
187	F	70.4	Confident	68.2	Low	74 Å²	74	86.1 Å²	86.1	33%	0.325	44%	0.442	S	S	.	.	H	α-helix	trans	-72.4	-25	174	-66.8	-56.9	0	0	0	113.4	M1 K183 T184 I190 R191	M1-F187 HydrophobicContact CE-CD2 4.46Å; M1-F187 HydrophobicContact CE-CG 4.48Å; K183-F187 HydrophobicContact CG-CE2 3.98Å; K183-F187 WeakPolarHBondContact O-CD2 3.29Å; K183-F187 PolarHBondContact O-N 3.27Å; T184-F187 CarbonylContact O-C 3.5Å; T184-F187 WeakPolarHBondContact O-CA 3.19Å; T184-F187 PolarHBondContact O-N 3.18Å; F187-I190 HydrophobicContact CD1-CD1 4.39Å; F187-R191 WeakPolarHBondContact O-CB 3.38Å; F187-R191 VanDerWaalsContact O-CG 3.29Å; F187-R191 WeakPolarHBondContact O-CG 3.23Å; F187-R191 PolarHBondContact O-N 3.13Å
188	D	76	Confident	68	Low	54 Å²	54	84.1 Å²	84.1	29%	0.289	44%	0.442	S	S	.	.	H	α-helix	trans	-68.4	-47.5	170.4	-59.5	-37.7	0	0	0	110.3	T184 K185 Y186 I190 R191 D192	T184-D188 PolarHBondContact O-N 3.44Å; K185-D188 WeakPolarHBondContact CA-OD2 3.38Å; K185-D188 PolarHBondContact N-OD2 3.28Å; K185-D188 PolarHBondContact O-N 2.96Å; Y186-D188 VanDerWaalsContact C-N 3.34Å; D188-I190 PolarHBondContact O-N 3.07Å; D188-R191 CarbonylContact O-C 3.59Å; D188-R191 WeakPolarHBondContact O-CA 3.17Å; D188-R191 WeakPolarHBondContact O-CB 3.46Å; D188-R191 PolarHBondContact O-N 3.44Å; D188-R191 IonicContact OD1-CZ 2.95Å; D188-R191 VanDerWaalsContact OD1-CZ 3.25Å; D188-R191 IonicContact OD1-NE 2.92Å; D188-R191 PolarHBondContact OD1-NE 2.76Å; D188-R191 IonicContact OD1-NH2 3.8Å; D188-R191 PolarHBondContact OD1-NH2 3.19Å; D188-D192 WeakPolarHBondContact O-CB 3.38Å; D188-D192 VanDerWaalsContact O-CG 3.24Å; D188-D192 PolarHBondContact O-N 3.2Å
189	D	74.8	Confident	67.6	Low	9 Å²	9	81.3 Å²	81.3	5%	0.048	43%	0.433	C	S	.	.	H	α-helix	trans	-63.8	-28	176.1	-73.5	-21.4	0	0	0	113.1	K185 Y186 G193 K194 I195 R209	K185-D189 PolarHBondContact O-N 3.06Å; Y186-D189 PolarHBondContact O-N 2.84Å; D189-G193 PolarHBondContact O-N 3.21Å; D189-K194 HydrophobicContact CB-CB 4.23Å; D189-K194 HydrophobicContact CB-CD 4.17Å; D189-K194 PolarHBondContact O-N 2.89Å; D189-K194 WeakPolarHBondContact OD1-CD 3.07Å; D189-K194 IonicContact OD1-NZ 2.66Å; D189-K194 PolarHBondContact OD1-NZ 2.96Å; D189-I195 HydrophobicContact CB-CD1 3.68Å; D189-I195 HydrophobicContact CB-CG1 4.12Å; D189-R209 IonicContact OD2-CZ 2.66Å; D189-R209 VanDerWaalsContact OD2-CZ 3.22Å; D189-R209 IonicContact OD2-NH1 3.25Å; D189-R209 PolarHBondContact OD2-NH1 3.16Å; D189-R209 IonicContact OD2-NH2 2.61Å; D189-R209 PolarHBondContact OD2-NH2 2.93Å
190	I	72.9	Confident	67.5	Low	51 Å²	51	85.2 Å²	85.2	26%	0.262	46%	0.455	S	S	.	.	H	α-helix	trans	-72.5	-42.7	168.7	-69.3	174.2	0	0	0	111.4	Y186 F187 D188 D192 G193 I195	Y186-I190 HydrophobicContact CD1-CD1 4.09Å; Y186-I190 HydrophobicContact CE1-CD1 3.5Å; Y186-I190 HydrophobicContact CE2-CD1 4.37Å; Y186-I190 WeakPolarHBondContact O-CG1 3.2Å; Y186-I190 PolarHBondContact O-N 2.92Å; Y186-I190 VanDerWaalsContact O-N 3.14Å; F187-I190 HydrophobicContact CD1-CD1 4.39Å; D188-I190 PolarHBondContact O-N 3.07Å; I190-D192 VanDerWaalsContact C-N 3.31Å; I190-D192 PolarHBondContact O-N 3.29Å; I190-G193 PolarHBondContact O-N 3.4Å; I190-I195 HydrophobicContact CG1-CB 4.19Å; I190-I195 HydrophobicContact CG1-CD1 3.98Å; I190-I195 HydrophobicContact CG1-CG2 4.38Å
191	R	70.6	Confident	67.1	Low	153 Å²	153	84.7 Å²	84.7	58%	0.577	45%	0.449	S	S	*	.	H	α-helix	trans	-61.5	-39.6	176.2	-80.9	-175	-83.3	-161.5	-3.3	112	F187 D188 G193	F187-R191 WeakPolarHBondContact O-CB 3.38Å; F187-R191 VanDerWaalsContact O-CG 3.29Å; F187-R191 WeakPolarHBondContact O-CG 3.23Å; F187-R191 PolarHBondContact O-N 3.13Å; D188-R191 CarbonylContact O-C 3.59Å; D188-R191 WeakPolarHBondContact O-CA 3.17Å; D188-R191 WeakPolarHBondContact O-CB 3.46Å; D188-R191 PolarHBondContact O-N 3.44Å; D188-R191 IonicContact OD1-CZ 2.95Å; D188-R191 VanDerWaalsContact OD1-CZ 3.25Å; D188-R191 IonicContact OD1-NE 2.92Å; D188-R191 PolarHBondContact OD1-NE 2.76Å; D188-R191 IonicContact OD1-NH2 3.8Å; D188-R191 PolarHBondContact OD1-NH2 3.19Å; R191-G193 VanDerWaalsContact C-N 3.27Å; R191-G193 PolarHBondContact O-N 2.9Å
192	D	76.5	Confident	67.1	Low	102 Å²	102	84.8 Å²	84.8	55%	0.545	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-8.8	178.8	-65.7	-10.3	0	0	0	113.2	D188 I190 K194	D188-D192 WeakPolarHBondContact O-CB 3.38Å; D188-D192 VanDerWaalsContact O-CG 3.24Å; D188-D192 PolarHBondContact O-N 3.2Å; I190-D192 VanDerWaalsContact C-N 3.31Å; I190-D192 PolarHBondContact O-N 3.29Å; D192-K194 VanDerWaalsContact C-N 3.32Å; D192-K194 HydrophobicContact CB-CD 3.94Å; D192-K194 HydrophobicContact CB-CG 4.01Å; D192-K194 PolarHBondContact O-N 3.41Å; D192-K194 VanDerWaalsContact OD2-CE 3.3Å; D192-K194 WeakPolarHBondContact OD2-CE 3.41Å; D192-K194 IonicContact OD2-NZ 3Å; D192-K194 PolarHBondContact OD2-NZ 3.14Å
193	G	72	Confident	66.4	Low	48 Å²	48	88.8 Å²	88.8	50%	0.495	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	16.3	-178.3	0	0	0	0	0	115.1	D189 I190 R191 I195	D189-G193 PolarHBondContact O-N 3.21Å; I190-G193 PolarHBondContact O-N 3.4Å; R191-G193 VanDerWaalsContact C-N 3.27Å; R191-G193 PolarHBondContact O-N 2.9Å; G193-I195 PolarHBondContact O-N 2.72Å
194	K	74.2	Confident	66.2	Low	129 Å²	129	84.5 Å²	84.5	56%	0.561	43%	0.434	S	S	*	.			trans	-75.4	-8.3	177.2	-61.4	161.1	-178.6	155.2	0	113.4	D189 D192	D189-K194 HydrophobicContact CB-CB 4.23Å; D189-K194 HydrophobicContact CB-CD 4.17Å; D189-K194 PolarHBondContact O-N 2.89Å; D189-K194 WeakPolarHBondContact OD1-CD 3.07Å; D189-K194 IonicContact OD1-NZ 2.66Å; D189-K194 PolarHBondContact OD1-NZ 2.96Å; D192-K194 VanDerWaalsContact C-N 3.32Å; D192-K194 HydrophobicContact CB-CD 3.94Å; D192-K194 HydrophobicContact CB-CG 4.01Å; D192-K194 PolarHBondContact O-N 3.41Å; D192-K194 VanDerWaalsContact OD2-CE 3.3Å; D192-K194 WeakPolarHBondContact OD2-CE 3.41Å; D192-K194 IonicContact OD2-NZ 3Å; D192-K194 PolarHBondContact OD2-NZ 3.14Å
195	I	65.2	Low	65.3	Low	28 Å²	28	89.1 Å²	89.1	14%	0.144	44%	0.444	C	S	.	.	S	Bend	trans	-119.2	113	178.3	-67.2	168.8	0	0	0	108.3	Y186 D189 I190 G193 L197 L202	Y186-I195 HydrophobicContact CD2-CD1 3.99Å; Y186-I195 HydrophobicContact CE2-CD1 3.98Å; D189-I195 HydrophobicContact CB-CD1 3.68Å; D189-I195 HydrophobicContact CB-CG1 4.12Å; I190-I195 HydrophobicContact CG1-CB 4.19Å; I190-I195 HydrophobicContact CG1-CD1 3.98Å; I190-I195 HydrophobicContact CG1-CG2 4.38Å; G193-I195 PolarHBondContact O-N 2.72Å; I195-L197 PolarHBondContact O-N 3.01Å; I195-L202 HydrophobicContact CG2-CD2 3.59Å
196	D	63.2	Low	64.3	Low	105 Å²	105	87 Å²	87	56%	0.561	44%	0.442	S	S	*	.			trans	-81.1	104.7	175.5	-172.1	-0.3	0	0	0	111.1	C198 S199	D196-C198 PolarHBondContact O-N 2.85Å; D196-C198 WeakPolarHBondContact OD1-CB 3.37Å; D196-C198 PolarHBondContact OD1-N 2.75Å; D196-S199 PolarHBondContact O-N 2.6Å; D196-S199 VanDerWaalsContact O-N 3.15Å; D196-S199 PolarHBondContact O-OG 3.02Å
197	L	64.7	Low	63.5	Low	105 Å²	105	90.5 Å²	90.5	55%	0.55	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-12.9	177.8	-66.8	167.8	0	0	0	113.7	I195 S199 L202	I195-L197 PolarHBondContact O-N 3.01Å; L197-S199 VanDerWaalsContact C-N 3.34Å; L197-L202 HydrophobicContact CD2-CD1 4.46Å; L197-L202 HydrophobicContact CD2-CD2 4.47Å
198	C	62.4	Low	62.6	Low	90 Å²	90	90.6 Å²	90.6	61%	0.608	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-2.5	174.6	-68	0	0	0	0	113.5	D196	D196-C198 PolarHBondContact O-N 2.85Å; D196-C198 WeakPolarHBondContact OD1-CB 3.37Å; D196-C198 PolarHBondContact OD1-N 2.75Å
199	S	58.3	Low	61.4	Low	41 Å²	41	93.8 Å²	93.8	29%	0.287	47%	0.474	S	S	.	.			trans	-88.6	132.7	174.7	67.5	0	0	0	0	112	D196 L197 D201	D196-S199 PolarHBondContact O-N 2.6Å; D196-S199 VanDerWaalsContact O-N 3.15Å; D196-S199 PolarHBondContact O-OG 3.02Å; L197-S199 VanDerWaalsContact C-N 3.34Å; S199-D201 PolarHBondContact O-N 3.18Å; S199-D201 VanDerWaalsContact O-N 3.08Å
200	N	54.4	Low	60	Low	178 Å²	178	100.5 Å²	100.5	95%	0.952	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-5.9	174.1	-82.2	-6	0	0	0	113.5	L202	N200-L202 PolarHBondContact O-N 3.41Å
201	D	56	Low	58.4	Low	77 Å²	77	107.8 Å²	107.8	41%	0.412	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	6.7	-170	-167.6	42.9	0	0	0	114.2	S199 Y203 S204 R205	S199-D201 PolarHBondContact O-N 3.18Å; S199-D201 VanDerWaalsContact O-N 3.08Å; D201-Y203 PolarHBondContact O-N 3.12Å; D201-S204 PolarHBondContact O-N 3.43Å; D201-S204 VanDerWaalsContact O-N 3.13Å; D201-S204 PolarHBondContact O-OG 3.49Å; D201-S204 VanDerWaalsContact OD1-CB 3.26Å; D201-S204 WeakPolarHBondContact OD1-CB 3.45Å; D201-S204 PolarHBondContact OD1-OG 3.47Å; D201-S204 PolarHBondContact OD2-OG 3Å; D201-R205 PolarHBondContact O-N 3.31Å; D201-R205 WeakPolarHBondContact OD2-CD 3.44Å; D201-R205 VanDerWaalsContact OD2-CG 3.29Å; D201-R205 WeakPolarHBondContact OD2-CG 3.27Å
202	L	58.4	Low	57.1	Low	59 Å²	59	104.8 Å²	104.8	31%	0.309	53%	0.528	S	S	.	.	H	α-helix	trans	-51.4	-33.5	-178.3	-73.3	166.9	0	0	0	113.8	I195 L197 N200 V206	I195-L202 HydrophobicContact CG2-CD2 3.59Å; L197-L202 HydrophobicContact CD2-CD1 4.46Å; L197-L202 HydrophobicContact CD2-CD2 4.47Å; N200-L202 PolarHBondContact O-N 3.41Å; L202-V206 VanDerWaalsContact O-CG2 3.25Å; L202-V206 WeakPolarHBondContact O-CG2 3.13Å
203	Y	46.8	Very low	55.5	Low	154 Å²	154	104.1 Å²	104.1	60%	0.604	54%	0.537	S	S	*	.	H	α-helix	trans	-78	-32.5	-177.2	-155.8	-90.8	0	0	0	113.5	D201	D201-Y203 PolarHBondContact O-N 3.12Å
204	S	57.6	Low	54	Low	48 Å²	48	105.7 Å²	105.7	34%	0.336	55%	0.545	S	S	.	.	H	α-helix	trans	-71.9	-46.4	-179	87.1	0	0	0	0	110.6	D201 V206 K207 T208	D201-S204 PolarHBondContact O-N 3.43Å; D201-S204 VanDerWaalsContact O-N 3.13Å; D201-S204 PolarHBondContact O-OG 3.49Å; D201-S204 VanDerWaalsContact OD1-CB 3.26Å; D201-S204 WeakPolarHBondContact OD1-CB 3.45Å; D201-S204 PolarHBondContact OD1-OG 3.47Å; D201-S204 PolarHBondContact OD2-OG 3Å; S204-V206 PolarHBondContact O-N 3.33Å; S204-K207 PolarHBondContact O-N 3.41Å; S204-T208 PolarHBondContact O-N 3.45Å; S204-T208 PolarHBondContact O-OG1 3.33Å
205	R	53.8	Low	52.2	Low	160 Å²	160	106.6 Å²	106.6	60%	0.604	55%	0.551	S	S	*	*	H	α-helix	trans	-69.3	-20.7	-175.2	-56.5	-171.4	75.4	165.8	3.3	113.2	D201 T208 R209	D201-R205 PolarHBondContact O-N 3.31Å; D201-R205 WeakPolarHBondContact OD2-CD 3.44Å; D201-R205 VanDerWaalsContact OD2-CG 3.29Å; D201-R205 WeakPolarHBondContact OD2-CG 3.27Å; R205-T208 WeakPolarHBondContact CA-OG1 3.15Å; R205-R209 WeakPolarHBondContact O-CD 3.49Å; R205-R209 VanDerWaalsContact O-CG 3.28Å; R205-R209 WeakPolarHBondContact O-CG 3.45Å
206	V	52.7	Low	50.9	Low	88 Å²	88	110.5 Å²	110.5	53%	0.533	58%	0.581	S	S	.	*	H	α-helix	trans	-72	-38.4	170	169.3	0	0	0	0	111.6	Y186 L202 S204	Y186-V206 HydrophobicContact CE2-CG2 4.08Å; L202-V206 VanDerWaalsContact O-CG2 3.25Å; L202-V206 WeakPolarHBondContact O-CG2 3.13Å; S204-V206 PolarHBondContact O-N 3.33Å
207	K	53.6	Low	49.4	Very low	147 Å²	147	109.9 Å²	109.9	64%	0.639	59%	0.591	S	S	*	*	H	α-helix	trans	-82.3	-31.9	178.1	-87.6	-173.5	174	179.2	0	114.1	S204	S204-K207 PolarHBondContact O-N 3.41Å
208	T	51.6	Low	47.9	Very low	76 Å²	76	109 Å²	109	47%	0.466	59%	0.594	S	S	.	*	H	α-helix	trans	-79.6	-18.7	-176.4	53.4	0	0	0	0	114.5	S204 R205 K210 R211	S204-T208 PolarHBondContact O-N 3.45Å; S204-T208 PolarHBondContact O-OG1 3.33Å; R205-T208 WeakPolarHBondContact CA-OG1 3.15Å; T208-K210 PolarHBondContact O-N 3.3Å; T208-R211 PolarHBondContact O-N 2.89Å
209	R	49.2	Very low	46.5	Very low	121 Å²	121	112.7 Å²	112.7	46%	0.457	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.2	-16.2	-170.6	-103.5	174.8	174.9	-136.9	-3.7	117.5	D189 R205	D189-R209 IonicContact OD2-CZ 2.66Å; D189-R209 VanDerWaalsContact OD2-CZ 3.22Å; D189-R209 IonicContact OD2-NH1 3.25Å; D189-R209 PolarHBondContact OD2-NH1 3.16Å; D189-R209 IonicContact OD2-NH2 2.61Å; D189-R209 PolarHBondContact OD2-NH2 2.93Å; R205-R209 WeakPolarHBondContact O-CD 3.49Å; R205-R209 VanDerWaalsContact O-CG 3.28Å; R205-R209 WeakPolarHBondContact O-CG 3.45Å
210	K	47.1	Very low	45	Very low	150 Å²	150	116.3 Å²	116.3	65%	0.652	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-0.7	174	-149.6	-174.1	176.6	-177	0	114.1	E172 T208	E172-K210 IonicContact OE2-NZ 3.64Å; E172-K210 PolarHBondContact OE2-NZ 3.17Å; T208-K210 PolarHBondContact O-N 3.3Å
211	R	38.7	Very low	44.1	Very low	205 Å²	205	114.1 Å²	114.1	77%	0.774	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-54.4	176.5	-70.1	-168	179.7	-175.5	0.7	113.8	T208 A213 A214	T208-R211 PolarHBondContact O-N 2.89Å; R211-A213 PolarHBondContact O-N 3.34Å; R211-A214 PolarHBondContact O-N 3.35Å
212	C	42	Very low	43	Very low	89 Å²	89	115.1 Å²	115.1	60%	0.601	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	2.4	-170.4	-49.8	0	0	0	0	116.2
213	A	44.5	Very low	41.8	Very low	89 Å²	89	118.5 Å²	118.5	74%	0.736	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-7	-180	0	0	0	0	0	113.8	R211	R211-A213 PolarHBondContact O-N 3.34Å
214	A	40	Very low	41.3	Very low	80 Å²	80	119.2 Å²	119.2	66%	0.661	67%	0.665	S	S	*	*	S	Bend	trans	-102.3	-18.6	-179.3	0	0	0	0	0	113.9	R211	R211-A214 PolarHBondContact O-N 3.35Å
215	E	37.2	Very low	40.3	Very low	148 Å²	148	121.5 Å²	121.5	69%	0.692	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	0.3	-171.2	-67.9	163.2	153.6	0	0	113.1	A217	E215-A217 VanDerWaalsContact C-N 3.3Å; E215-A217 PolarHBondContact O-N 2.96Å
216	S	37.3	Very low	39.5	Very low	110 Å²	110	119.4 Å²	119.4	77%	0.769	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	10.6	177.5	-45.3	0	0	0	0	114.2
217	A	32.4	Very low	38.8	Very low	93 Å²	93	123 Å²	123	77%	0.769	70%	0.698	S	S	*	*	S	Bend	trans	-126.8	26.1	-168.2	0	0	0	0	0	114	E215	E215-A217 VanDerWaalsContact C-N 3.3Å; E215-A217 PolarHBondContact O-N 2.96Å
218	S	32	Very low	38.2	Very low	87 Å²	87	121.4 Å²	121.4	61%	0.608	71%	0.705	S	S	*	*			trans	-152.8	95.9	173.8	57.6	0	0	0	0	111.9
219	N	32.5	Very low	37.4	Very low	167 Å²	167	128.7 Å²	128.7	89%	0.893	72%	0.724	S	S	*	*			trans	170.5	84.7	141.9	-88	-6.5	0	0	0	109.8
220	S	28.1	Very low	36.8	Very low	116 Å²	116	130.9 Å²	130.9	81%	0.811	74%	0.744	S	S	*	*			trans	-85.1	143.2	153.9	46.3	0	0	0	0	109.3
221	V	34.3	Very low	36.2	Very low	132 Å²	132	127.2 Å²	127.2	80%	0.8	75%	0.75	S	S	*	*			trans	172.9	139.7	148.9	143.2	0	0	0	0	108.4
222	S	32.9	Very low	36.2	Very low	98 Å²	98	122.8 Å²	122.8	69%	0.685	75%	0.75	S	S	*	*			trans	59.9	136.3	172.1	59.6	0	0	0	0	118.5
223	N	34.6	Very low	36	Very low	131 Å²	131	125 Å²	125	70%	0.701	76%	0.755	S	S	*	*			cis	-145.5	153.6	-7.7	-104.7	10.1	0	0	0	110.1
224	E	34.9	Very low	35.4	Very low	168 Å²	168	129.6 Å²	129.6	79%	0.785	76%	0.761	S	S	*	*			trans	34.6	138.9	137.6	-53.4	177.9	118.4	0	0	120.1
225	S	37	Very low	35.1	Very low	96 Å²	96	129.3 Å²	129.3	67%	0.671	77%	0.766	S	S	*	*			cis	-163.1	151.8	32.6	52.2	0	0	0	0	113.7
226	T	38	Very low	34.9	Very low	116 Å²	116	131.2 Å²	131.2	71%	0.712	78%	0.775	S	S	*	*			trans	61	143.7	157.9	59.5	0	0	0	0	120
227	Q	37.9	Very low	34.8	Very low	164 Å²	164	132.1 Å²	132.1	77%	0.766	78%	0.776	S	S	*	*			cis	-161.2	119.9	-7.8	-119.5	170.7	23.3	0	0	112.1
228	S	39.5	Very low	34.6	Very low	113 Å²	113	135.8 Å²	135.8	79%	0.79	78%	0.777	S	S	*	*			trans	61.5	159.8	153.7	83.7	0	0	0	0	119.2
229	R	36.1	Very low	34.8	Very low	230 Å²	230	138.9 Å²	138.9	87%	0.868	79%	0.787	S	S	*	*			cis	-152.5	156.1	-2.5	-146.2	169.4	178.3	169.8	-3.2	110.6
230	N	36.4	Very low	34.8	Very low	166 Å²	166	138.6 Å²	138.6	89%	0.888	78%	0.78	S	S	*	*			trans	-58.2	160.7	174.8	-37	-23	0	0	0	112
231	G	34.8	Very low	35	Very low	74 Å²	74	138.3 Å²	138.3	76%	0.763	78%	0.776	S	S	*	*			cis	-179.3	-152.2	5.7	0	0	0	0	0	108.2
232	S	37.1	Very low	34.8	Very low	112 Å²	112	140.8 Å²	140.8	78%	0.783	78%	0.779	S	S	*	*			cis	-169.9	171.5	-7.2	-157	0	0	0	0	110.9
233	L	38.2	Very low	34.7	Very low	136 Å²	136	140.2 Å²	140.2	71%	0.712	78%	0.781	S	S	*	*			trans	51.4	120.7	159.6	-70.9	167.8	0	0	0	122.9
234	Q	33.3	Very low	34.6	Very low	184 Å²	184	139.8 Å²	139.8	86%	0.86	79%	0.788	S	S	*	*			trans	39.6	134.8	132.7	-65	177.2	-41.7	0	0	122.4
235	G	32	Very low	34.4	Very low	74 Å²	74	139.2 Å²	139.2	76%	0.763	79%	0.787	S	S	*	*			trans	154.4	96.4	147	0	0	0	0	0	118
236	E	34	Very low	34.2	Very low	188 Å²	188	141.3 Å²	141.3	88%	0.879	79%	0.786	S	S	*	*			trans	41.5	121.6	135.7	-71	179.8	-168	0	0	123.8
237	T	34.9	Very low	34	Very low	130 Å²	130	142.1 Å²	142.1	80%	0.798	78%	0.781	S	S	*	*			trans	86.3	158.1	135.9	-46.2	0	0	0	0	119.3
238	E	29	Very low	33.6	Very low	169 Å²	169	142.8 Å²	142.8	79%	0.79	78%	0.782	S	S	*	*			trans	-90.8	141.6	-165.8	-52.7	162.1	130.1	0	0	112.1
239	L	36.2	Very low	33.2	Very low	153 Å²	153	142.7 Å²	142.7	80%	0.801	78%	0.781	S	S	*	*				165.8	154.8	115.4	-87.5	165.9	0	0	0	113.9
240	E	33	Very low	32.7	Very low	161 Å²	161	138.5 Å²	138.5	75%	0.752	78%	0.782	S	S	*	*			trans	59.8	113.9	149.7	-71.3	179.1	175.5	0	0	123.3
241	C	31	Very low	32.4	Very low	109 Å²	109	136.3 Å²	136.3	74%	0.736	78%	0.778	S	S	*	*				88.4	120.8	121.8	-67.1	0	0	0	0	123.4
242	E	30.5	Very low	32.2	Very low	185 Å²	185	137.3 Å²	137.3	86%	0.864	77%	0.774	S	S	*	*			trans	74.8	124.3	138.3	-63.1	-158.4	134.6	0	0	124
243	A	31.5	Very low	31.9	Very low	86 Å²	86	138 Å²	138	71%	0.711	78%	0.775	S	S	*	*			trans	80	103.6	132.7	0	0	0	0	0	121.8
244	S	31.3	Very low	31.7	Very low	122 Å²	122	141.7 Å²	141.7	85%	0.853	79%	0.786	S	S	*	*				98.7	149.5	125.8	-62.8	0	0	0	0	121.4
245	M	31.8	Very low	31.7	Very low	156 Å²	156	144.4 Å²	144.4	77%	0.768	79%	0.788	S	S	*	*			trans	80.7	83.9	159.6	-120.9	154.1	-175	0	0	120.4
246	E	32.9	Very low	31.5	Very low	139 Å²	139	147.7 Å²	147.7	65%	0.65	79%	0.788	S	S	*	*				88.8	139.1	115.6	-82.4	179	-152.9	0	0	124.4
247	H	32.5	Very low	31.5	Very low	133 Å²	133	144.9 Å²	144.9	62%	0.616	79%	0.786	S	S	*	*			trans	91.9	120.8	142.9	-82.4	42.5	0	0	0	122
248	F	30.3	Very low	31.5	Very low	178 Å²	178	145.1 Å²	145.1	78%	0.781	79%	0.787	S	S	*	*			trans	66.9	135.2	160.3	-52	-50	0	0	0	119.3
249	S	31.3	Very low	31.4	Very low	111 Å²	111	141.9 Å²	141.9	78%	0.776	78%	0.783	S	S	*	*			cis	-149.8	140.9	-1.6	-105.1	0	0	0	0	113
250	T	25.7	Very low	31.2	Very low	142 Å²	142	140.1 Å²	140.1	87%	0.871	78%	0.781	S	S	*	*			trans	-85.2	139.8	-177	-50.4	0	0	0	0	112.4
251	C	29.1	Very low	31.1	Very low	120 Å²	120	137.6 Å²	137.6	81%	0.811	78%	0.781	S	S	*	*			trans	-144.1	83	167.5	-161	0	0	0	0	114.7
252	S	30.8	Very low	31.2	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	79%	0.786	S	S	*	*			trans	49.9	120.8	138.9	-56.9	0	0	0	0	121.7
253	P	31.6	Very low	31.2	Very low	126 Å²	126	138 Å²	138	82%	0.818	78%	0.779	S	S	*	*			trans	-71.6	147	164.4	32.4	-34.4	0	0	0	111.5	R255	P253-R255 PolarHBondContact O-N 3.45Å
254	K	33.2	Very low	31	Very low	214 Å²	214	139.4 Å²	139.4	93%	0.93	78%	0.782	S	S	*	*			trans	-78.8	113.9	176.2	-81.8	-178.3	174	174.3	0	111.3
255	R	33.1	Very low	30.9	Very low	241 Å²	241	143 Å²	143	91%	0.909	78%	0.783	S	S	*	*			trans	-63.1	154.3	174.6	-69.6	175.8	169.5	158.3	-4.7	112.9	P253	P253-R255 PolarHBondContact O-N 3.45Å
256	D	26.9	Very low	30.6	Very low	143 Å²	143	139.9 Å²	139.9	77%	0.765	78%	0.777	S	S	*	*			trans	-64.2	150.8	159.8	-64.6	-75	0	0	0	112.4	V258	D256-V258 PolarHBondContact O-N 3.36Å
257	P	35.1	Very low	30.4	Very low	128 Å²	128	138.7 Å²	138.7	83%	0.831	78%	0.779	S	S	*	*			trans	-81.5	103.9	170.5	32.1	-31.7	0	0	0	111
258	V	33.9	Very low	30.1	Very low	136 Å²	136	138.6 Å²	138.6	82%	0.824	78%	0.783	S	S	*	*			trans	-77.8	146.9	167.9	178.4	0	0	0	0	110.1	D256	D256-V258 PolarHBondContact O-N 3.36Å
259	S	28.3	Very low	30.1	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	78%	0.782	S	S	*	*			trans	-61.4	149.6	-176.1	-51.2	0	0	0	0	114.2	S261	S259-S261 PolarHBondContact O-N 2.85Å
260	P	31.9	Very low	30	Very low	115 Å²	115	136.8 Å²	136.8	75%	0.747	77%	0.774	S	S	*	*			trans	-74.1	114.7	157.8	31.3	-30.4	0	0	0	109.5	F262	P260-F262 HydrophobicContact CB-CE2 4.35Å
261	S	30.6	Very low	30.3	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	77%	0.769	S	S	*	*			trans	-81.9	146	158.4	45.4	0	0	0	0	109.6	S259	S259-S261 PolarHBondContact O-N 2.85Å
262	F	32.1	Very low	30.4	Very low	191 Å²	191	138.2 Å²	138.2	84%	0.838	76%	0.763	S	S	*	*			trans	-128.9	148.1	162.8	-84	-78.4	0	0	0	108.9	P260	P260-F262 HydrophobicContact CB-CE2 4.35Å
263	P	32	Very low	30.4	Very low	110 Å²	110	138.7 Å²	138.7	71%	0.714	76%	0.758	S	S	*	*			trans	-87.5	160.6	-152.6	33.6	-37.3	0	0	0	114.3
264	C	26.5	Very low	30.3	Very low	116 Å²	116	143 Å²	143	78%	0.784	76%	0.764	S	S	*	*			trans	-76.4	133.3	155.8	-178.7	0	0	0	0	109.2
265	F	30.2	Very low	30.2	Very low	199 Å²	199	138.4 Å²	138.4	87%	0.873	75%	0.75	S	S	*	*			trans	-144.7	150.8	148	-101.3	-73.4	0	0	0	109.4
266	S	24.1	Very low	30	Very low	90 Å²	90	133.1 Å²	133.1	63%	0.629	75%	0.748	S	S	*	*			trans	-107.8	-174.1	-168.4	56	0	0	0	0	112.7
267	T	29.6	Very low	30.2	Very low	114 Å²	114	130.6 Å²	130.6	70%	0.699	74%	0.738	S	S	*	*			trans	66.9	108.1	158.8	44.9	0	0	0	0	118.7
268	N	26.6	Very low	30	Very low	130 Å²	130	134.3 Å²	134.3	70%	0.695	74%	0.742	S	S	*	*			trans	77	149.3	130	-74.5	30.2	0	0	0	122.2
269	E	30.5	Very low	29.9	Very low	164 Å²	164	138 Å²	138	77%	0.766	74%	0.741	S	S	*	*			trans	58.6	138	151	-70.6	150.2	-121.9	0	0	119.3
270	S	28.3	Very low	29.9	Very low	88 Å²	88	137.6 Å²	137.6	62%	0.615	73%	0.731	S	S	*	*			cis	-173.1	170.4	-17.8	50.4	0	0	0	0	107
271	L	31.5	Very low	30.1	Very low	144 Å²	144	138.4 Å²	138.4	75%	0.754	73%	0.729	S	S	*	*			trans	68.4	147.7	170.1	-43	178.5	0	0	0	115.5
272	Q	31.8	Very low	30	Very low	148 Å²	148	139.7 Å²	139.7	69%	0.692	72%	0.723	S	S	*	*			cis	-153.6	147.4	-14.6	-121.2	169.5	2.6	0	0	110.8
273	N	30.6	Very low	29.9	Very low	106 Å²	106	138.2 Å²	138.2	57%	0.567	72%	0.718	S	S	*	*			trans	33.6	121.7	147.8	-56.1	-13.7	0	0	0	120.4
274	F	30.4	Very low	30	Very low	217 Å²	217	138.5 Å²	138.5	95%	0.952	72%	0.723	S	S	*	*				-146	142.4	96	-98.8	-74.2	0	0	0	110.1
275	N	29.9	Very low	30.1	Very low	117 Å²	117	141.9 Å²	141.9	63%	0.626	73%	0.727	S	S	*	*			trans	-115.4	156.3	-165.6	-76.4	-43.8	0	0	0	113.3	T277	N275-T277 HydrophobicContact CB-CG2 4.08Å
276	C	29.4	Very low	30.3	Very low	129 Å²	129	137.2 Å²	137.2	87%	0.872	72%	0.717	S	S	*	*			trans	170.8	94.2	141.4	-97.4	0	0	0	0	107.6
277	T	29.9	Very low	30.5	Very low	91 Å²	91	141.7 Å²	141.7	56%	0.558	73%	0.73	S	S	*	*			cis	74.9	93.8	30.8	76.7	0	0	0	0	117.5	N275	N275-T277 HydrophobicContact CB-CG2 4.08Å
278	F	31.5	Very low	30.6	Very low	206 Å²	206	145.4 Å²	145.4	90%	0.904	74%	0.737	S	S	*	*			trans	-145.7	121.1	133.5	-92.6	-85.1	0	0	0	105
279	R	31.3	Very low	31.1	Very low	213 Å²	213	144.5 Å²	144.5	80%	0.804	74%	0.738	S	S	*	*			cis	65.1	136.7	39	-71.6	-159.9	152.6	-172.5	-6.5	113.9
280	N	29.7	Very low	31.2	Very low	93 Å²	93	143.5 Å²	143.5	50%	0.497	74%	0.743	S	S	.	*			cis	-144.7	-167.5	-12.2	-134.6	60.3	0	0	0	106.3	E282	N280-E282 PolarHBondContact ND2-OE2 2.98Å
281	D	34.8	Very low	31.5	Very low	132 Å²	132	142.9 Å²	142.9	71%	0.706	75%	0.751	S	S	*	*			cis	-137.2	-176.6	11.7	-77.2	-68.9	0	0	0	108.2
282	E	29.6	Very low	31.5	Very low	135 Å²	135	139.6 Å²	139.6	63%	0.631	75%	0.751	S	S	*	*			cis	77.3	142	22.2	-52.6	-170.4	70.3	0	0	114.7	N280	N280-E282 PolarHBondContact ND2-OE2 2.98Å
283	Q	29.8	Very low	31.6	Very low	160 Å²	160	137.1 Å²	137.1	75%	0.748	75%	0.751	S	S	*	*			cis	-156.5	178.1	-0.4	-129	178.9	55.9	0	0	111.9
284	S	33	Very low	31.9	Very low	117 Å²	117	140 Å²	140	82%	0.818	76%	0.761	S	S	*	*			trans	70.3	167.1	170.3	81.7	0	0	0	0	118.8
285	Q	28.9	Very low	31.9	Very low	186 Å²	186	136 Å²	136	87%	0.869	75%	0.749	S	S	*	*				-162.1	163.5	-60.4	-105.8	-108.9	-19	0	0	107.9
286	P	34.6	Very low	32.1	Very low	102 Å²	102	139.5 Å²	139.5	66%	0.662	76%	0.755	S	S	*	*			trans	-113.3	157.7	-160.2	39.7	-31.1	0	0	0	116.8
287	M	29.2	Very low	32.3	Very low	183 Å²	183	140.7 Å²	140.7	90%	0.901	75%	0.747	S	S	*	*			trans	-159.2	157.9	153.7	-119.1	170.9	67.4	0	0	114.3
288	F	32.2	Very low	32.5	Very low	193 Å²	193	140.8 Å²	140.8	85%	0.846	75%	0.749	S	S	*	*			trans	-102.7	-153.5	177.9	-57.2	-107.4	0	0	0	110.4
289	P	37.2	Very low	32.3	Very low	110 Å²	110	138.8 Å²	138.8	71%	0.714	74%	0.743	S	S	*	*			cis	-135.9	-166.1	-25.9	21.8	4.5	0	0	0	114.9
290	V	31.6	Very low	32.2	Very low	144 Å²	144	135.8 Å²	135.8	87%	0.873	74%	0.741	S	S	*	*			trans	112.7	133.7	141.6	-173.2	0	0	0	0	119.3
291	G	34.7	Very low	32.1	Very low	75 Å²	75	135.9 Å²	135.9	77%	0.773	75%	0.745	S	S	*	*			trans	107.2	124.5	166.8	0	0	0	0	0	113.6
292	G	31.3	Very low	31.8	Very low	74 Å²	74	137.5 Å²	137.5	76%	0.763	75%	0.748	S	S	*	*			cis	115.6	132.5	9.4	0	0	0	0	0	110.8
293	S	34.9	Very low	31.7	Very low	97 Å²	97	136.6 Å²	136.6	68%	0.678	75%	0.748	S	S	*	*			cis	-162.1	168.9	4	-51.5	0	0	0	0	111.7
294	E	35.1	Very low	31.6	Very low	167 Å²	167	136.1 Å²	136.1	78%	0.78	75%	0.75	S	S	*	*			trans	62.3	173.1	150.1	-65.2	145.3	-123.6	0	0	119.9
295	D	32	Very low	31.5	Very low	131 Å²	131	135.3 Å²	135.3	70%	0.701	75%	0.75	S	S	*	*				-159.7	-154.8	-72.2	-123.6	-74.3	0	0	0	108.9
296	Y	34.2	Very low	31.3	Very low	192 Å²	192	132.6 Å²	132.6	75%	0.753	75%	0.747	S	S	*	*			cis	-159.7	122.4	7.7	-127.8	-62.5	0	0	0	111.1
297	H	32.8	Very low	31	Very low	153 Å²	153	132.2 Å²	132.2	71%	0.708	75%	0.752	S	S	*	*			trans	61	-172.4	148.7	-87.7	-115.5	0	0	0	120.8
298	P	35.1	Very low	30.8	Very low	93 Å²	93	130.9 Å²	130.9	60%	0.604	75%	0.749	S	S	*	*				-144	-179.1	-76.1	46.5	-28	0	0	0	117.6
299	E	27	Very low	30.7	Very low	164 Å²	164	128.9 Å²	128.9	77%	0.766	75%	0.752	S	S	*	*			trans	47.8	162.5	136.7	-75	179.8	148.3	0	0	125.8
300	I	29	Very low	30.2	Very low	151 Å²	151	128.5 Å²	128.5	77%	0.774	75%	0.752	S	S	*	*			trans	77.3	140.5	152	-78	153.4	0	0	0	118.3
301	T	27.9	Very low	30.4	Very low	94 Å²	94	126.8 Å²	126.8	58%	0.577	74%	0.743	S	S	*	*			cis	-174.5	154.2	-22.1	-95.4	0	0	0	0	108.7
302	E	28	Very low	29.9	Very low	166 Å²	166	127.3 Å²	127.3	78%	0.776	74%	0.735	S	S	*	*			trans	65.1	167.3	162.2	-83.3	163.9	-140.8	0	0	118.5
303	N	27.6	Very low	29.8	Very low	117 Å²	117	131.5 Å²	131.5	63%	0.626	74%	0.735	S	S	*	*			cis	-148.4	-178	-3	-132.6	-36.6	0	0	0	113.8
304	L	26.8	Very low	29.4	Very low	150 Å²	150	134.6 Å²	134.6	79%	0.785	74%	0.738	S	S	*	*			trans	-24.2	154.6	160.9	-91.9	58.2	0	0	0	117.1
305	A	30.6	Very low	29.1	Very low	99 Å²	99	131 Å²	131	82%	0.818	73%	0.732	S	S	*	*				-159.1	170.8	54.5	0	0	0	0	0	117.4
306	T	24.9	Very low	28.8	Very low	130 Å²	130	130.8 Å²	130.8	80%	0.798	73%	0.731	S	S	*	*			trans	-100.9	139.2	-174	51.2	0	0	0	0	115
307	A	29.6	Very low	28.7	Very low	94 Å²	94	129.9 Å²	129.9	78%	0.777	74%	0.737	S	S	*	*			trans	-162.8	127.2	145.5	0	0	0	0	0	107.8
308	N	25	Very low	28.4	Very low	155 Å²	155	129.3 Å²	129.3	83%	0.829	74%	0.738	S	S	*	*			cis	58.6	80.3	40.4	-72.2	-5.8	0	0	0	115.3
309	V	29.9	Very low	28.3	Very low	150 Å²	150	130.4 Å²	130.4	91%	0.909	75%	0.748	S	S	*	*			trans	-147.5	133.4	133.6	177.1	0	0	0	0	110.3
310	S	27	Very low	28.3	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	75%	0.749	S	S	*	*			trans	-142	167.8	157.5	68.4	0	0	0	0	106.9
311	P	34.9	Very low	28.5	Very low	107 Å²	107	134.3 Å²	134.3	70%	0.695	76%	0.757	S	S	*	*			cis	-134.2	-157.7	-6.3	39.2	-19.3	0	0	0	112.6
312	S	24.8	Very low	28.6	Very low	87 Å²	87	136.8 Å²	136.8	61%	0.608	77%	0.767	S	S	*	*			trans	76	156.6	143.6	64.3	0	0	0	0	122
313	H	28.5	Very low	28.7	Very low	162 Å²	162	133 Å²	133	75%	0.75	76%	0.759	S	S	*	*			trans	67.6	153.8	176	-60.2	-82.2	0	0	0	116
314	Q	27.5	Very low	28.9	Very low	161 Å²	161	136.4 Å²	136.4	75%	0.752	77%	0.768	S	S	*	*			cis	-177.8	146.8	-20.2	177.5	157	-7.3	0	0	103.7
315	S	28.4	Very low	28.9	Very low	93 Å²	93	133.9 Å²	133.9	65%	0.65	77%	0.769	S	S	*	*			cis	-158	168	32.1	49.6	0	0	0	0	112.6
316	D	25.9	Very low	28.9	Very low	126 Å²	126	136 Å²	136	67%	0.674	77%	0.771	S	S	*	*			trans	1.4	139.1	144	-44.5	-64.3	0	0	0	120.7
317	I	32.5	Very low	28.9	Very low	173 Å²	173	138.8 Å²	138.8	89%	0.887	78%	0.775	S	S	*	*				-144.7	142.2	123.7	-103.5	157.9	0	0	0	108.9
318	I	25.9	Very low	29	Very low	140 Å²	140	140 Å²	140	72%	0.718	78%	0.778	S	S	*	*			trans	-109.3	133.9	-173.6	-63	162.3	0	0	0	109.7
319	S	32.9	Very low	29	Very low	116 Å²	116	141.1 Å²	141.1	81%	0.811	78%	0.778	S	S	*	*			trans	-142.3	117.4	151	55.5	0	0	0	0	110.9
320	K	27.5	Very low	28.9	Very low	181 Å²	181	141.1 Å²	141.1	79%	0.787	77%	0.772	S	S	*	*			trans	-91.4	146	165.6	-62.4	174.4	-179.8	176.4	0	107.8
321	F	33.4	Very low	28.9	Very low	216 Å²	216	144.3 Å²	144.3	95%	0.947	78%	0.776	S	S	*	*			trans	-135.9	118.4	146	-106.4	-80.9	0	0	0	109.4
322	D	28.7	Very low	28.6	Very low	146 Å²	146	144.3 Å²	144.3	78%	0.781	78%	0.776	S	S	*	*			trans	-153.4	117.9	180	175.1	17.9	0	0	0	106.8
323	S	30.9	Very low	28.6	Very low	88 Å²	88	147.9 Å²	147.9	62%	0.615	79%	0.788	S	S	*	*			trans	-168.9	119.8	174	-87.4	0	0	0	0	113.5
324	K	30.5	Very low	28.5	Very low	188 Å²	188	146.1 Å²	146.1	82%	0.817	79%	0.794	S	S	*	*				54.7	104.5	129.3	-56.8	167.7	-173.2	174.6	0	116.7
325	A	26.9	Very low	28.3	Very low	97 Å²	97	143.6 Å²	143.6	80%	0.802	79%	0.794	S	S	*	*				73.3	133.4	64.3	0	0	0	0	0	115.2
326	V	31.2	Very low	28.2	Very low	143 Å²	143	148.9 Å²	148.9	87%	0.867	81%	0.805	S	S	*	*			trans	-155.8	147.9	136.7	147.6	0	0	0	0	107
327	Q	25.6	Very low	28.1	Very low	188 Å²	188	146.7 Å²	146.7	88%	0.879	81%	0.812	S	S	*	*			trans	-99.2	146.9	175.2	-60.5	156.9	-72.1	0	0	110.4
328	S	30.8	Very low	27.7	Very low	121 Å²	121	145.6 Å²	145.6	85%	0.846	81%	0.807	S	S	*	*			trans	-154.1	136.8	143.9	45.5	0	0	0	0	110.4
329	E	24.5	Very low	27.6	Very low	178 Å²	178	143.8 Å²	143.8	83%	0.832	81%	0.807	S	S	*	*			trans	-91	165.1	176.6	-58.3	168	130.6	0	0	109.7
330	L	29.8	Very low	27.2	Very low	149 Å²	149	143.9 Å²	143.9	78%	0.78	81%	0.806	S	S	*	*				168.3	117.4	120.3	-85.9	160.4	0	0	0	111.9
331	H	26.7	Very low	27	Very low	170 Å²	170	141.9 Å²	141.9	79%	0.787	80%	0.804	S	S	*	*			trans	44.7	130.9	159.8	-65.6	-68.2	0	0	0	123.3
332	P	28	Very low	26.6	Very low	108 Å²	108	139.3 Å²	139.3	70%	0.701	80%	0.799	S	S	*	*			trans	-82	151.9	156.8	36.4	-33	0	0	0	111.3
333	N	24	Very low	26.4	Very low	161 Å²	161	142.6 Å²	142.6	86%	0.861	80%	0.802	S	S	*	*			trans	168.4	102.3	139.1	-89.9	-23.4	0	0	0	112
334	S	26.6	Very low	26.1	Very low	125 Å²	125	146.8 Å²	146.8	87%	0.874	82%	0.817	S	S	*	*			trans	-175.7	141.8	137.1	41	0	0	0	0	111.3
335	S	24.3	Very low	25.8	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	81%	0.81	S	S	*	*			trans	-87.1	123.9	175	43.5	0	0	0	0	111.2
336	K	25.9	Very low	25.8	Very low	203 Å²	203	145 Å²	145	88%	0.883	81%	0.81	S	S	*	*			trans	-162.8	155.7	153.8	-100.6	133.8	-168.1	177.9	0	109.9
337	G	24.5	Very low	25.8	Very low	80 Å²	80	143.9 Å²	143.9	83%	0.825	81%	0.808	S	S	*	*			trans	-68.6	140.7	-165.4	0	0	0	0	0	114.1
338	I	23.9	Very low	26.3	Very low	151 Å²	151	140.1 Å²	140.1	77%	0.774	79%	0.793	S	S	*	*			trans	-94.6	104.8	173.8	-59.9	176.6	0	0	0	108.7	C340	I338-C340 PolarHBondContact O-N 2.71Å
339	S	22.5	Very low	27	Very low	101 Å²	101	135.8 Å²	135.8	71%	0.706	76%	0.762	S	S	*	*			trans	-75.9	104.5	161.6	53.2	0	0	0	0	109	N341	S339-N341 PolarHBondContact O-N 2.76Å
340	C	25.4	Very low	28.2	Very low	118 Å²	118	134.5 Å²	134.5	80%	0.797	75%	0.754	S	S	*	*			trans	-70.2	92.3	176.6	-67.2	0	0	0	0	110.9	I338	I338-C340 PolarHBondContact O-N 2.71Å
341	N	23.1	Very low	29.1	Very low	140 Å²	140	128.1 Å²	128.1	75%	0.749	72%	0.721	S	S	*	*			trans	-66.6	144.4	173.8	-94.7	-31.8	0	0	0	112	S339 Y343	S339-N341 PolarHBondContact O-N 2.76Å; N341-Y343 PolarHBondContact O-N 3.36Å
342	L	24.4	Very low	30.1	Very low	161 Å²	161	122.2 Å²	122.2	84%	0.843	70%	0.695	S	S	*	*			trans	-78.2	97.8	-174.7	-72.4	155.3	0	0	0	112.2
343	Y	23.9	Very low	30.9	Very low	215 Å²	215	121.6 Å²	121.6	84%	0.843	69%	0.685	S	S	*	*			trans	-143.1	74.2	164.9	-72.8	-68.5	0	0	0	113	N341	N341-Y343 PolarHBondContact O-N 3.36Å
344	L	25.7	Very low	31.9	Very low	176 Å²	176	114.9 Å²	114.9	92%	0.921	65%	0.654	S	S	*	*			trans	-158.5	107.6	148.1	-138.7	75.8	0	0	0	108.1
345	C	23.8	Very low	32.5	Very low	100 Å²	100	112.6 Å²	112.6	68%	0.676	63%	0.631	S	S	*	*			trans	-136.1	96.7	-176.2	-171.4	0	0	0	0	110
346	D	27.6	Very low	33	Very low	149 Å²	149	110.5 Å²	110.5	80%	0.797	62%	0.617	S	S	*	*	S	Bend	trans	-132.5	118.8	169.7	-94	-53.7	0	0	0	109.5
347	S	30.6	Very low	33.3	Very low	119 Å²	119	107 Å²	107	83%	0.832	62%	0.615	S	S	*	*			trans	60.3	49.4	169.1	67.3	0	0	0	0	118.5	S349	S347-S349 PolarHBondContact O-N 3.43Å
348	I	35.4	Very low	33.6	Very low	109 Å²	109	108.3 Å²	108.3	56%	0.559	61%	0.607	S	S	*	*			trans	-59.9	123.3	162.8	-56.2	177.4	0	0	0	109.1	D352 I353	I348-D352 HydrophobicContact CG2-CB 3.77Å; I348-I353 HydrophobicContact CG2-CG1 3.85Å
349	S	46.2	Very low	33.8	Very low	30 Å²	30	105.8 Å²	105.8	21%	0.21	60%	0.602	C	S	.	*			trans	-82	156.1	-177.1	83.8	0	0	0	0	112.3	S347 V351 D352 I353 N460	S347-S349 PolarHBondContact O-N 3.43Å; S349-V351 PolarHBondContact O-N 3.3Å; S349-V351 VanDerWaalsContact O-N 3.1Å; S349-V351 PolarHBondContact OG-N 2.92Å; S349-D352 VanDerWaalsContact CB-OD2 3.26Å; S349-D352 WeakPolarHBondContact CB-OD2 3.3Å; S349-D352 PolarHBondContact N-OD2 2.95Å; S349-D352 WeakPolarHBondContact O-CA 3.37Å; S349-D352 WeakPolarHBondContact O-CB 3.41Å; S349-D352 PolarHBondContact O-N 2.84Å; S349-D352 PolarHBondContact OG-OD2 2.76Å; S349-I353 PolarHBondContact O-N 2.87Å; S349-I353 VanDerWaalsContact O-N 3.1Å; S349-N460 PolarHBondContact OG-ND2 3.25Å
350	K	49.7	Very low	34.1	Very low	151 Å²	151	106.2 Å²	106.2	66%	0.657	61%	0.605	S	S	*	*	H	α-helix	trans	-52	-34.6	174.6	-76.7	-177.8	173.8	-178.6	0	113.3	D352 I353 G354 E457	K350-D352 PolarHBondContact O-N 3.04Å; K350-I353 PolarHBondContact O-N 2.97Å; K350-G354 PolarHBondContact O-N 3.29Å; K350-E457 WeakPolarHBondContact CD-OE1 3.34Å
351	V	49.8	Very low	34.2	Very low	14 Å²	14	110.1 Å²	110.1	9%	0.085	61%	0.605	C	S	.	*	H	α-helix	trans	-68.3	-23.8	178.6	-160.2	0	0	0	0	111.9	S349 E457 N460 A461 R466 L469	S349-V351 PolarHBondContact O-N 3.3Å; S349-V351 VanDerWaalsContact O-N 3.1Å; S349-V351 PolarHBondContact OG-N 2.92Å; V351-E457 HydrophobicContact CG2-CB 3.89Å; V351-E457 HydrophobicContact CG2-CG 3.82Å; V351-N460 HydrophobicContact CG2-CB 4.49Å; V351-A461 HydrophobicContact CG1-CB 4.27Å; V351-R466 PolarHBondContact O-NH1 2.86Å; V351-L469 HydrophobicContact CG1-CD1 3.97Å
352	D	47	Very low	34.5	Very low	46 Å²	46	109.3 Å²	109.3	25%	0.246	61%	0.607	C	S	.	*	H	α-helix	trans	-84.4	-43.8	174.4	-54.7	-57.5	0	0	0	111.3	I348 S349 K350 G354 L355 R466	I348-D352 HydrophobicContact CG2-CB 3.77Å; S349-D352 VanDerWaalsContact CB-OD2 3.26Å; S349-D352 WeakPolarHBondContact CB-OD2 3.3Å; S349-D352 PolarHBondContact N-OD2 2.95Å; S349-D352 WeakPolarHBondContact O-CA 3.37Å; S349-D352 WeakPolarHBondContact O-CB 3.41Å; S349-D352 PolarHBondContact O-N 2.84Å; S349-D352 PolarHBondContact OG-OD2 2.76Å; K350-D352 PolarHBondContact O-N 3.04Å; D352-G354 PolarHBondContact O-N 2.97Å; D352-L355 PolarHBondContact O-N 2.87Å; D352-R466 IonicContact OD1-CZ 3.47Å; D352-R466 IonicContact OD1-NH1 3.71Å; D352-R466 PolarHBondContact OD1-NH1 2.95Å; D352-R466 IonicContact OD1-NH2 3.79Å; D352-R466 PolarHBondContact OD1-NH2 3.2Å
353	I	44.9	Very low	34.8	Very low	96 Å²	96	109.4 Å²	109.4	49%	0.492	61%	0.607	S	S	.	*	H	α-helix	trans	-55.4	-38.1	178.5	-60.5	172.7	0	0	0	110.9	I348 S349 K350 L355 S356	I348-I353 HydrophobicContact CG2-CG1 3.85Å; S349-I353 PolarHBondContact O-N 2.87Å; S349-I353 VanDerWaalsContact O-N 3.1Å; K350-I353 PolarHBondContact O-N 2.97Å; I353-L355 PolarHBondContact O-N 3.41Å; I353-L355 VanDerWaalsContact O-N 3.12Å; I353-S356 WeakPolarHBondContact O-CB 3.39Å; I353-S356 PolarHBondContact O-N 3.46Å; I353-S356 PolarHBondContact O-OG 3.03Å
354	G	43.8	Very low	35.1	Very low	19 Å²	19	105.6 Å²	105.6	20%	0.196	60%	0.602	C	S	.	*	T	Hydrogen-bonded Turn	trans	-65.3	-5.6	177	0	0	0	0	0	116.5	K350 D352	K350-G354 PolarHBondContact O-N 3.29Å; D352-G354 PolarHBondContact O-N 2.97Å
355	L	39.7	Very low	35.1	Very low	77 Å²	77	104.1 Å²	104.1	40%	0.403	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.8	3.1	176.1	-62	178.8	0	0	0	113.5	D352 I353 Y446	D352-L355 PolarHBondContact O-N 2.87Å; I353-L355 PolarHBondContact O-N 3.41Å; I353-L355 VanDerWaalsContact O-N 3.12Å; L355-Y446 HydrophobicContact CD2-CD1 3.96Å; L355-Y446 HydrophobicContact CD2-CE1 3.79Å
356	S	35.3	Very low	35.4	Very low	66 Å²	66	108.8 Å²	108.8	46%	0.462	60%	0.604	S	S	.	*	S	Bend	trans	-70.4	140.2	168	-52.7	0	0	0	0	110.5	I353 V358	I353-S356 WeakPolarHBondContact O-CB 3.39Å; I353-S356 PolarHBondContact O-N 3.46Å; I353-S356 PolarHBondContact O-OG 3.03Å; S356-V358 PolarHBondContact O-N 3.02Å
357	P	31.3	Very low	35.3	Very low	130 Å²	130	107.5 Å²	107.5	84%	0.844	60%	0.604	S	S	*	*			trans	-70.4	95.9	168.2	29.5	-32.7	0	0	0	109.3	S359	P357-S359 PolarHBondContact O-N 3.45Å
358	V	31.7	Very low	35.2	Very low	107 Å²	107	110.1 Å²	110.1	65%	0.648	61%	0.607	S	S	*	*			trans	-72.8	123.4	177.5	178.7	0	0	0	0	109.4	S356 S360	S356-V358 PolarHBondContact O-N 3.02Å; V358-S360 PolarHBondContact O-N 3.26Å
359	S	28.1	Very low	34.7	Very low	97 Å²	97	113.5 Å²	113.5	68%	0.678	62%	0.621	S	S	*	*			trans	-65.8	98.1	172.4	40.3	0	0	0	0	110.5	P357 Y361	P357-S359 PolarHBondContact O-N 3.45Å; S359-Y361 VanDerWaalsContact C-N 3.33Å; S359-Y361 PolarHBondContact O-N 2.9Å
360	S	28.3	Very low	33.8	Very low	111 Å²	111	116.1 Å²	116.1	78%	0.776	64%	0.644	S	S	*	*			trans	-75.7	83	177.8	56	0	0	0	0	111.1	V358 P362	V358-S360 PolarHBondContact O-N 3.26Å; S360-P362 WeakPolarHBondContact O-CD 3.42Å
361	Y	28.2	Very low	32.8	Very low	200 Å²	200	117.2 Å²	117.2	78%	0.784	65%	0.649	S	S	*	*			trans	-74.7	115	156.3	-81.3	-77.2	0	0	0	108.7	S359 L363	S359-Y361 VanDerWaalsContact C-N 3.33Å; S359-Y361 PolarHBondContact O-N 2.9Å; Y361-L363 PolarHBondContact O-N 3.45Å
362	P	29.1	Very low	31.6	Very low	123 Å²	123	122.8 Å²	122.8	80%	0.799	67%	0.674	S	S	*	*			trans	-80.5	115.2	173.5	32	-30.3	0	0	0	109.1	S360	S360-P362 WeakPolarHBondContact O-CD 3.42Å
363	L	31.1	Very low	30.7	Very low	162 Å²	162	128.2 Å²	128.2	85%	0.848	69%	0.691	S	S	*	*			trans	-143.1	136	172.6	-107.2	161.4	0	0	0	110.6	Y361	Y361-L363 PolarHBondContact O-N 3.45Å
364	D	29.3	Very low	29.9	Very low	136 Å²	136	131.7 Å²	131.7	73%	0.727	71%	0.706	S	S	*	*			trans	-70.8	135.3	-158.1	-77	-75.3	0	0	0	116.6	K366	D364-K366 PolarHBondContact O-N 2.92Å; D364-K366 VanDerWaalsContact O-N 3.14Å
365	N	27.2	Very low	29.1	Very low	144 Å²	144	135.3 Å²	135.3	77%	0.77	73%	0.727	S	S	*	*				24.1	79.2	127	-61.8	-58.2	0	0	0	117.9
366	K	29.8	Very low	28.5	Very low	199 Å²	199	137.2 Å²	137.2	87%	0.865	74%	0.742	S	S	*	*			trans	-167.3	132.9	136.2	-103.3	143.7	-169.4	173.2	0	112.6	D364	D364-K366 PolarHBondContact O-N 2.92Å; D364-K366 VanDerWaalsContact O-N 3.14Å
367	P	25.4	Very low	28.1	Very low	122 Å²	122	138.4 Å²	138.4	79%	0.792	75%	0.751	S	S	*	*			trans	-91.7	121.7	174.1	33.9	-30.2	0	0	0	111.5
368	L	28	Very low	27.9	Very low	173 Å²	173	138.7 Å²	138.7	91%	0.906	75%	0.745	S	S	*	*			trans	-144.2	164.7	160.7	-90.2	-175.2	0	0	0	111.2
369	Q	24.6	Very low	27.6	Very low	181 Å²	181	142.5 Å²	142.5	85%	0.846	75%	0.754	S	S	*	*			trans	-100.4	157.5	-162.1	-61.3	161.1	-60.4	0	0	113.8
370	A	27.5	Very low	27.7	Very low	85 Å²	85	142.5 Å²	142.5	70%	0.702	75%	0.753	S	S	*	*			trans	87.5	156.8	144.7	0	0	0	0	0	121.3
371	F	28.2	Very low	27.5	Very low	174 Å²	174	141.7 Å²	141.7	76%	0.763	75%	0.754	S	S	*	*			trans	66.9	84.3	166.8	-69.1	-72.2	0	0	0	121.2
372	E	25.3	Very low	27.7	Very low	130 Å²	130	138.4 Å²	138.4	61%	0.607	75%	0.754	S	S	*	*				37.2	143	107.8	-59.8	-170.6	122.4	0	0	122.9
373	R	27.8	Very low	27.8	Very low	161 Å²	161	141.4 Å²	141.4	61%	0.608	76%	0.757	S	S	*	*			trans	82	122.7	156	-70.2	179.8	-151.2	77.1	14.4	119.7
374	E	27.9	Very low	27.6	Very low	169 Å²	169	142.4 Å²	142.4	79%	0.79	76%	0.758	S	S	*	*				61.4	143.9	128.2	-66.4	152.2	-157.6	0	0	120.1
375	S	28.5	Very low	27.8	Very low	94 Å²	94	141.6 Å²	141.6	66%	0.657	76%	0.76	S	S	*	*			cis	-165.8	158.1	-7.5	47.4	0	0	0	0	112.6
376	T	26.7	Very low	27.8	Very low	117 Å²	117	137.5 Å²	137.5	72%	0.718	75%	0.752	S	S	*	*			trans	37.6	110.8	148.2	54.4	0	0	0	0	122.2
377	S	25.6	Very low	27.7	Very low	92 Å²	92	136 Å²	136	64%	0.643	75%	0.753	S	S	*	*				48	132.9	125.8	70.2	0	0	0	0	121.1
378	N	26.8	Very low	27.9	Very low	135 Å²	135	138.7 Å²	138.7	72%	0.722	75%	0.753	S	S	*	*				-179.6	179	73.2	-95.6	-53.9	0	0	0	113.8
379	F	27.4	Very low	27.8	Very low	188 Å²	188	139.7 Å²	139.7	83%	0.825	75%	0.746	S	S	*	*			trans	88.5	106.9	157	-76.6	-75.2	0	0	0	121.7
380	S	28.2	Very low	28	Very low	96 Å²	96	138.3 Å²	138.3	67%	0.671	75%	0.745	S	S	*	*			trans	5.6	130.1	142.6	55.6	0	0	0	0	119.8
381	A	25.9	Very low	28.2	Very low	95 Å²	95	140.9 Å²	140.9	79%	0.785	75%	0.746	S	S	*	*			cis	81.8	107.3	49.6	0	0	0	0	0	115.4
382	V	31.7	Very low	28.2	Very low	131 Å²	131	141.5 Å²	141.5	79%	0.794	74%	0.744	S	S	*	*			trans	-142.2	110.7	162.1	175.8	0	0	0	0	109.4
383	E	30.9	Very low	28.4	Very low	185 Å²	185	140.8 Å²	140.8	86%	0.864	75%	0.745	S	S	*	*			trans	60.4	169.1	149.9	-58.2	-174.5	137.3	0	0	122.2
384	Q	28.1	Very low	28.8	Very low	183 Å²	183	140.6 Å²	140.6	86%	0.855	75%	0.748	S	S	*	*			trans	-123.8	-161.7	-161.1	-49.5	-171.5	-1.8	0	0	110
385	P	32.7	Very low	28.9	Very low	120 Å²	120	139.7 Å²	139.7	78%	0.779	75%	0.748	S	S	*	*			cis	-133.2	175.7	-10.9	38.8	-20.3	0	0	0	115.5
386	G	27	Very low	29.2	Very low	58 Å²	58	145 Å²	145	60%	0.598	76%	0.755	S	S	*	*			trans	172	57.8	173.8	0	0	0	0	0	120.2	F388	G386-F388 VanDerWaalsContact C-N 3.3Å; G386-F388 PolarHBondContact O-N 3.27Å
387	N	28.3	Very low	30.1	Very low	167 Å²	167	147.7 Å²	147.7	89%	0.893	76%	0.76	S	S	*	*	S	Bend	trans	46.5	-4.7	150.8	-72.3	-2.5	0	0	0	124.1
388	F	28	Very low	31.6	Very low	179 Å²	179	148.9 Å²	148.9	79%	0.785	75%	0.75	S	S	*	*			trans	-92.2	-18.8	-173.5	-91	-87.1	0	0	0	116.2	G386 N390	G386-F388 VanDerWaalsContact C-N 3.3Å; G386-F388 PolarHBondContact O-N 3.27Å; F388-N390 PolarHBondContact O-N 3.43Å
389	Y	27.2	Very low	33	Very low	193 Å²	193	146 Å²	146	76%	0.757	74%	0.74	S	S	*	*	H	α-helix	trans	-77.6	-19.5	-172.6	-90.9	-88	0	0	0	115.8	L391	Y389-L391 PolarHBondContact O-N 2.92Å
390	N	28.9	Very low	34.5	Very low	153 Å²	153	137.4 Å²	137.4	82%	0.818	70%	0.703	S	S	*	*	H	α-helix	trans	-82.3	-6.5	-173.2	-78.1	-10	0	0	0	115.4	F388	F388-N390 PolarHBondContact O-N 3.43Å
391	L	30.2	Very low	35.6	Very low	139 Å²	139	137.3 Å²	137.3	73%	0.728	70%	0.702	S	S	*	*	H	α-helix	trans	-97.8	-33.7	172.8	-91.2	152.6	0	0	0	112.5	Y389 N393 K394	Y389-L391 PolarHBondContact O-N 2.92Å; L391-N393 PolarHBondContact O-N 3.14Å; L391-K394 PolarHBondContact O-N 2.87Å
392	Y	28.2	Very low	37.2	Very low	187 Å²	187	134.8 Å²	134.8	73%	0.733	68%	0.679	S	S	*	*	H	α-helix	trans	-68.7	-36.7	-172.8	-124.3	-95.1	0	0	0	113.7	K394	Y392-K394 VanDerWaalsContact C-N 3.3Å; Y392-K394 PolarHBondContact O-N 3.46Å
393	N	30.9	Very low	38.9	Very low	115 Å²	115	133.9 Å²	133.9	62%	0.615	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-73.6	-18.6	177.1	-74.7	-3.5	0	0	0	113.5	L391 L395	L391-N393 PolarHBondContact O-N 3.14Å; N393-L395 PolarHBondContact O-N 2.86Å; N393-L395 VanDerWaalsContact O-N 3.15Å
394	K	34.6	Very low	40.6	Very low	157 Å²	157	133.1 Å²	133.1	68%	0.683	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-75	-5.3	-169.9	-145.3	176.9	-175.1	-176	0	114.4	L391 Y392	L391-K394 PolarHBondContact O-N 2.87Å; Y392-K394 VanDerWaalsContact C-N 3.3Å; Y392-K394 PolarHBondContact O-N 3.46Å
395	L	31.7	Very low	42.4	Very low	149 Å²	149	127.5 Å²	127.5	78%	0.78	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-109.3	-15.7	-176.9	-67.4	172.3	0	0	0	114.6	N393	N393-L395 PolarHBondContact O-N 2.86Å; N393-L395 VanDerWaalsContact O-N 3.15Å
396	Y	34.5	Very low	44.3	Very low	205 Å²	205	123.3 Å²	123.3	80%	0.804	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	-11.9	-167.1	-99.8	-85.3	0	0	0	116.5
397	E	45.9	Very low	46.5	Very low	175 Å²	175	123.3 Å²	123.3	82%	0.818	60%	0.596	S	S	*	*	S	Bend	trans	-89.7	-9.2	-179.3	-65.8	-169.8	131.2	0	0	114.6	S399	E397-S399 PolarHBondContact O-N 3.44Å
398	R	55.6	Low	48.7	Very low	116 Å²	116	119.3 Å²	119.3	44%	0.438	57%	0.574	S	S	.	*			trans	-89.7	62.2	-170.1	-84.6	-177	173.9	169.3	-8.4	113.6	C439 P441 H442	R398-C439 WeakPolarHBondContact CD-O 3.29Å; R398-C439 PolarHBondContact NE-O 2.9Å; R398-C439 VanDerWaalsContact NE-O 3.15Å; R398-C439 VanDerWaalsContact NH1-CB 3.33Å; R398-C439 PolarHBondContact NH1-O 2.82Å; R398-C439 PolarHBondContact NH1-SG 2.97Å; R398-P441 VanDerWaalsContact C-CB 3.46Å; R398-P441 HydrophobicContact CB-CB 3.86Å; R398-P441 HydrophobicContact CG-CB 4.2Å; R398-P441 CarbonylContact O-C 3.6Å; R398-P441 WeakPolarHBondContact O-CA 3.49Å; R398-P441 WeakPolarHBondContact O-CB 3.38Å; R398-H442 PolarHBondContact O-N 3.23Å
399	S	56.4	Low	50.9	Low	74 Å²	74	113.8 Å²	113.8	52%	0.517	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.2	142.4	173.9	72.1	0	0	0	0	113	E397 H442 C444	E397-S399 PolarHBondContact O-N 3.44Å; S399-H442 CarbonylContact C-O 3.57Å; S399-H442 VanDerWaalsContact CA-O 3.3Å; S399-H442 WeakPolarHBondContact CA-O 3.48Å; S399-C444 VanDerWaalsContact CB-SG 3.57Å
400	V	58.4	Low	53.2	Low	9 Å²	9	109.3 Å²	109.3	6%	0.055	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.7	-173.8	-158	0	0	0	0	112.5	S402 T405 L406 P441 H442 C444	V400-S402 VanDerWaalsContact C-N 3.28Å; V400-S402 WeakPolarHBondContact CG1-O 3.28Å; V400-S402 PolarHBondContact O-N 2.94Å; V400-T405 VanDerWaalsContact CG1-CB 3.48Å; V400-T405 HydrophobicContact CG1-CG2 3.71Å; V400-L406 HydrophobicContact CB-CB 4.41Å; V400-L406 HydrophobicContact CG1-CB 4.38Å; V400-L406 HydrophobicContact CG2-CB 4.26Å; V400-L406 HydrophobicContact CG2-CD1 4.44Å; V400-P441 HydrophobicContact CG2-CB 3.52Å; V400-P441 HydrophobicContact CG2-CG 3.38Å; V400-H442 PolarHBondContact N-O 2.9Å; V400-C444 PolarHBondContact N-SG 2.84Å; V400-C444 VanDerWaalsContact N-SG 3.44Å; V400-C444 PolarHBondContact O-N 2.98Å; V400-C444 PolarHBondContact O-SG 2.92Å
401	S	52.3	Low	55.6	Low	93 Å²	93	107.4 Å²	107.4	65%	0.65	52%	0.52	S	S	*	.	S	Bend	trans	-72.4	-12.2	-180	59.1	0	0	0	0	115.2
402	S	59.2	Low	57.8	Low	43 Å²	43	105.8 Å²	105.8	30%	0.301	51%	0.511	S	S	.	.			trans	-143.7	140.7	178.2	103.2	0	0	0	0	113.1	V400 R404 T405 L406	V400-S402 VanDerWaalsContact C-N 3.28Å; V400-S402 WeakPolarHBondContact CG1-O 3.28Å; V400-S402 PolarHBondContact O-N 2.94Å; S402-R404 PolarHBondContact O-N 3.4Å; S402-R404 PolarHBondContact OG-N 3.44Å; S402-T405 PolarHBondContact O-N 3.4Å; S402-T405 VanDerWaalsContact O-N 3.16Å; S402-T405 PolarHBondContact OG-N 3.42Å; S402-T405 VanDerWaalsContact OG-N 3.07Å; S402-T405 PolarHBondContact OG-OG1 3.48Å; S402-L406 PolarHBondContact O-N 2.9Å
403	L	67.1	Low	60.2	Low	111 Å²	111	98.3 Å²	98.3	58%	0.581	48%	0.484	S	S	*	.	H	α-helix	trans	-63.1	-30.6	176.1	-178.2	63.3	0	0	0	111.6	T405 L406 V407 L443	L403-T405 VanDerWaalsContact C-N 3.33Å; L403-T405 PolarHBondContact O-N 3.1Å; L403-L406 HydrophobicContact CD1-CD2 4.44Å; L403-L406 PolarHBondContact O-N 2.86Å; L403-V407 HydrophobicContact CD1-CG2 4.22Å; L403-V407 HydrophobicContact CG-CG2 4.25Å; L403-V407 WeakPolarHBondContact O-CB 3.49Å; L403-V407 VanDerWaalsContact O-CG2 3.26Å; L403-V407 WeakPolarHBondContact O-CG2 3.24Å; L403-V407 PolarHBondContact O-N 3.11Å; L403-L443 HydrophobicContact CB-CD1 4.14Å; L403-L443 HydrophobicContact CD1-CD1 4.39Å
404	R	67.3	Low	62.4	Low	169 Å²	169	94.9 Å²	94.9	64%	0.638	47%	0.465	S	S	*	.	H	α-helix	trans	-62.9	-41.6	175.8	-171.5	-177	-173.4	103.1	4.6	111.3	S402 V407 N408	S402-R404 PolarHBondContact O-N 3.4Å; S402-R404 PolarHBondContact OG-N 3.44Å; R404-V407 PolarHBondContact O-N 3.21Å; R404-N408 WeakPolarHBondContact O-CB 3.19Å; R404-N408 VanDerWaalsContact O-CG 3.25Å; R404-N408 PolarHBondContact O-N 3.06Å; R404-N408 PolarHBondContact O-OD1 2.92Å
405	T	66.6	Low	64.3	Low	65 Å²	65	92.3 Å²	92.3	40%	0.399	46%	0.459	S	S	.	.	H	α-helix	trans	-68	-41.2	178.3	-50.2	0	0	0	0	110.7	V400 S402 L403 N408 I409	V400-T405 VanDerWaalsContact CG1-CB 3.48Å; V400-T405 HydrophobicContact CG1-CG2 3.71Å; S402-T405 PolarHBondContact O-N 3.4Å; S402-T405 VanDerWaalsContact O-N 3.16Å; S402-T405 PolarHBondContact OG-N 3.42Å; S402-T405 VanDerWaalsContact OG-N 3.07Å; S402-T405 PolarHBondContact OG-OG1 3.48Å; L403-T405 VanDerWaalsContact C-N 3.33Å; L403-T405 PolarHBondContact O-N 3.1Å; T405-N408 PolarHBondContact O-N 3.31Å; T405-I409 HydrophobicContact CG2-CD1 4.25Å; T405-I409 VanDerWaalsContact O-CG1 3.29Å; T405-I409 WeakPolarHBondContact O-CG1 3.33Å; T405-I409 PolarHBondContact O-N 2.94Å
406	L	72.2	Confident	66.3	Low	33 Å²	33	87.6 Å²	87.6	17%	0.173	44%	0.438	C	S	.	.	H	α-helix	trans	-62.6	-45.4	174.2	177.1	53.4	0	0	0	112	V400 S402 L403 N408 I409 Y410 P441 L443	V400-L406 HydrophobicContact CB-CB 4.41Å; V400-L406 HydrophobicContact CG1-CB 4.38Å; V400-L406 HydrophobicContact CG2-CB 4.26Å; V400-L406 HydrophobicContact CG2-CD1 4.44Å; S402-L406 PolarHBondContact O-N 2.9Å; L403-L406 HydrophobicContact CD1-CD2 4.44Å; L403-L406 PolarHBondContact O-N 2.86Å; L406-N408 VanDerWaalsContact C-N 3.34Å; L406-N408 PolarHBondContact O-N 3.22Å; L406-I409 PolarHBondContact O-N 3.34Å; L406-Y410 WeakPolarHBondContact O-CB 3.43Å; L406-Y410 PolarHBondContact O-N 2.96Å; L406-P441 HydrophobicContact CD1-CG 4.26Å; L406-P441 WeakPolarHBondContact CD1-O 3.46Å; L406-L443 HydrophobicContact CB-CD1 4.48Å; L406-L443 HydrophobicContact CD2-CD1 4.2Å
407	V	73.7	Confident	67.9	Low	58 Å²	58	79.5 Å²	79.5	35%	0.352	41%	0.407	S	S	.	.	H	α-helix	trans	-63.8	-37.6	176.4	167.7	0	0	0	0	111.6	L403 R404 Y410 F411	L403-V407 HydrophobicContact CD1-CG2 4.22Å; L403-V407 HydrophobicContact CG-CG2 4.25Å; L403-V407 WeakPolarHBondContact O-CB 3.49Å; L403-V407 VanDerWaalsContact O-CG2 3.26Å; L403-V407 WeakPolarHBondContact O-CG2 3.24Å; L403-V407 PolarHBondContact O-N 3.11Å; R404-V407 PolarHBondContact O-N 3.21Å; V407-Y410 PolarHBondContact O-N 3.37Å; V407-F411 HydrophobicContact CG1-CD2 3.66Å; V407-F411 HydrophobicContact CG1-CE2 3.7Å; V407-F411 VanDerWaalsContact O-CD2 3.31Å; V407-F411 WeakPolarHBondContact O-CD2 3.23Å; V407-F411 PolarHBondContact O-N 3.02Å
408	N	72.7	Confident	69.1	Low	82 Å²	82	76.1 Å²	76.1	44%	0.439	39%	0.394	S	S	.	.	H	α-helix	trans	-64.8	-42.1	173.1	-76.8	9.7	0	0	0	112	R404 T405 L406 Y410 F411 N412	R404-N408 WeakPolarHBondContact O-CB 3.19Å; R404-N408 VanDerWaalsContact O-CG 3.25Å; R404-N408 PolarHBondContact O-N 3.06Å; R404-N408 PolarHBondContact O-OD1 2.92Å; T405-N408 PolarHBondContact O-N 3.31Å; L406-N408 VanDerWaalsContact C-N 3.34Å; L406-N408 PolarHBondContact O-N 3.22Å; N408-Y410 VanDerWaalsContact C-N 3.34Å; N408-F411 PolarHBondContact O-N 2.97Å; N408-N412 WeakPolarHBondContact O-CB 3.39Å; N408-N412 PolarHBondContact O-N 2.91Å; N408-N412 PolarHBondContact O-OD1 3.05Å
409	I	74.8	Confident	69.6	Low	63 Å²	63	74.5 Å²	74.5	32%	0.323	40%	0.401	S	S	.	.	H	α-helix	trans	-61.7	-44.8	175.5	-68	163.6	0	0	0	110	T405 L406 N412 L413 L440 P441	T405-I409 HydrophobicContact CG2-CD1 4.25Å; T405-I409 VanDerWaalsContact O-CG1 3.29Å; T405-I409 WeakPolarHBondContact O-CG1 3.33Å; T405-I409 PolarHBondContact O-N 2.94Å; L406-I409 PolarHBondContact O-N 3.34Å; I409-N412 PolarHBondContact O-N 3.31Å; I409-L413 WeakPolarHBondContact O-CB 3.28Å; I409-L413 PolarHBondContact O-N 2.65Å; I409-L440 HydrophobicContact CG2-CD2 3.89Å; I409-P441 HydrophobicContact CD1-CG 3.89Å
410	Y	76.6	Confident	69.7	Low	99 Å²	99	75.2 Å²	75.2	39%	0.388	40%	0.399	S	S	.	.	H	α-helix	trans	-60.4	-44.1	175.1	178.8	-107.1	0	0	0	113.2	L406 V407 N408 L413 I414 L437 L440	L406-Y410 WeakPolarHBondContact O-CB 3.43Å; L406-Y410 PolarHBondContact O-N 2.96Å; V407-Y410 PolarHBondContact O-N 3.37Å; N408-Y410 VanDerWaalsContact C-N 3.34Å; Y410-L413 WeakPolarHBondContact O-CB 3.4Å; Y410-L413 PolarHBondContact O-N 2.71Å; Y410-I414 HydrophobicContact CD1-CD1 3.92Å; Y410-I414 HydrophobicContact CE1-CD1 3.43Å; Y410-I414 VanDerWaalsContact CE1-CD1 3.43Å; Y410-I414 HydrophobicContact CE2-CD1 4.19Å; Y410-I414 HydrophobicContact CG-CD1 4.48Å; Y410-I414 WeakPolarHBondContact O-CG1 3.48Å; Y410-I414 PolarHBondContact O-N 3.22Å; Y410-L437 HydrophobicContact CD2-CD2 4.35Å; Y410-L437 HydrophobicContact CE2-CD2 3.77Å; Y410-L440 HydrophobicContact CD2-CD1 3.72Å; Y410-L440 HydrophobicContact CE2-CD1 4.38Å
411	F	78.8	Confident	69.5	Low	114 Å²	114	82.2 Å²	82.2	50%	0.5	43%	0.428	S	S	.	.	H	α-helix	trans	-66.1	-39.8	175.1	-89.8	-66.8	0	0	0	112.5	V407 N408 L413 I414 L415	V407-F411 HydrophobicContact CG1-CD2 3.66Å; V407-F411 HydrophobicContact CG1-CE2 3.7Å; V407-F411 VanDerWaalsContact O-CD2 3.31Å; V407-F411 WeakPolarHBondContact O-CD2 3.23Å; V407-F411 PolarHBondContact O-N 3.02Å; N408-F411 PolarHBondContact O-N 2.97Å; F411-L413 VanDerWaalsContact C-N 3.32Å; F411-L413 PolarHBondContact O-N 2.94Å; F411-I414 PolarHBondContact O-N 2.92Å; F411-L415 WeakPolarHBondContact O-CB 3.31Å; F411-L415 VanDerWaalsContact O-CG 3.27Å; F411-L415 WeakPolarHBondContact O-CG 3.48Å; F411-L415 PolarHBondContact O-N 2.99Å
412	N	76	Confident	69.4	Low	104 Å²	104	85.4 Å²	85.4	56%	0.556	44%	0.438	S	S	*	.	H	α-helix	trans	-62.9	-40.4	175.3	-70.2	-3.2	0	0	0	111.4	N408 I409 I414 L415 S416	N408-N412 WeakPolarHBondContact O-CB 3.39Å; N408-N412 PolarHBondContact O-N 2.91Å; N408-N412 PolarHBondContact O-OD1 3.05Å; I409-N412 PolarHBondContact O-N 3.31Å; N412-I414 VanDerWaalsContact C-N 3.34Å; N412-I414 PolarHBondContact O-N 2.98Å; N412-L415 PolarHBondContact O-N 2.78Å; N412-S416 PolarHBondContact O-N 3.33Å; N412-S416 PolarHBondContact O-OG 3.37Å
413	L	78.2	Confident	69	Low	31 Å²	31	91.2 Å²	91.2	16%	0.162	46%	0.46	C	S	.	.	H	α-helix	trans	-59.9	-41.7	174.4	-154.4	89.3	0	0	0	112.1	I409 Y410 F411 S416 H417 F433 E436 L440	I409-L413 WeakPolarHBondContact O-CB 3.28Å; I409-L413 PolarHBondContact O-N 2.65Å; Y410-L413 WeakPolarHBondContact O-CB 3.4Å; Y410-L413 PolarHBondContact O-N 2.71Å; F411-L413 VanDerWaalsContact C-N 3.32Å; F411-L413 PolarHBondContact O-N 2.94Å; L413-S416 PolarHBondContact O-OG 2.73Å; L413-H417 WeakPolarHBondContact O-CB 3.4Å; L413-H417 PolarHBondContact O-N 3.21Å; L413-F433 HydrophobicContact CD2-CE2 4.04Å; L413-F433 HydrophobicContact CG-CE2 4.47Å; L413-E436 HydrophobicContact CD1-CB 4.12Å; L413-E436 HydrophobicContact CD2-CB 4.04Å; L413-E436 HydrophobicContact CG-CB 4.31Å; L413-L440 HydrophobicContact CD2-CD2 4.22Å; L413-L440 HydrophobicContact CD2-CG 4.44Å
414	I	76.8	Confident	67.9	Low	42 Å²	42	91.9 Å²	91.9	22%	0.215	46%	0.463	C	S	.	.	H	α-helix	trans	-66.7	-43	174.3	-73	168.9	0	0	0	110.8	Y410 F411 N412 H417 I418 F433	Y410-I414 HydrophobicContact CD1-CD1 3.92Å; Y410-I414 HydrophobicContact CE1-CD1 3.43Å; Y410-I414 VanDerWaalsContact CE1-CD1 3.43Å; Y410-I414 HydrophobicContact CE2-CD1 4.19Å; Y410-I414 HydrophobicContact CG-CD1 4.48Å; Y410-I414 WeakPolarHBondContact O-CG1 3.48Å; Y410-I414 PolarHBondContact O-N 3.22Å; F411-I414 PolarHBondContact O-N 2.92Å; N412-I414 VanDerWaalsContact C-N 3.34Å; N412-I414 PolarHBondContact O-N 2.98Å; I414-H417 PolarHBondContact O-N 3.46Å; I414-I418 HydrophobicContact CG2-CD1 3.63Å; I414-I418 HydrophobicContact CG2-CG1 4.34Å; I414-I418 VanDerWaalsContact O-CG1 3.31Å; I414-I418 WeakPolarHBondContact O-CG1 3.5Å; I414-I418 PolarHBondContact O-N 3.04Å; I414-F433 HydrophobicContact CG1-CZ 4.14Å
415	L	76.1	Confident	66.6	Low	104 Å²	104	89.4 Å²	89.4	55%	0.545	47%	0.467	S	S	.	.	H	α-helix	trans	-66.5	-40.4	-177.8	-72.8	168.4	0	0	0	112.2	F411 N412 I418 S419	F411-L415 WeakPolarHBondContact O-CB 3.31Å; F411-L415 VanDerWaalsContact O-CG 3.27Å; F411-L415 WeakPolarHBondContact O-CG 3.48Å; F411-L415 PolarHBondContact O-N 2.99Å; N412-L415 PolarHBondContact O-N 2.78Å; L415-I418 PolarHBondContact O-N 3.35Å; L415-S419 WeakPolarHBondContact O-CB 3.21Å; L415-S419 PolarHBondContact O-N 3.35Å
416	S	73.5	Confident	65.4	Low	49 Å²	49	95.2 Å²	95.2	34%	0.343	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-43	171.8	50.7	0	0	0	0	111.9	N412 L413 I418 S419 N420	N412-S416 PolarHBondContact O-N 3.33Å; N412-S416 PolarHBondContact O-OG 3.37Å; L413-S416 PolarHBondContact O-OG 2.73Å; S416-I418 VanDerWaalsContact C-N 3.27Å; S416-I418 PolarHBondContact O-N 3.45Å; S416-S419 PolarHBondContact O-N 2.89Å; S416-N420 WeakPolarHBondContact O-CB 3.44Å; S416-N420 VanDerWaalsContact O-CG 3.27Å; S416-N420 PolarHBondContact O-N 3.44Å; S416-N420 PolarHBondContact O-OD1 2.98Å
417	H	68	Low	63.7	Low	35 Å²	35	99 Å²	99	16%	0.162	52%	0.518	C	S	.	.	H	α-helix	trans	-75	-11.9	179.6	-121.7	-66.9	0	0	0	114.8	L413 I414 T431 F433 E436	L413-H417 WeakPolarHBondContact O-CB 3.4Å; L413-H417 PolarHBondContact O-N 3.21Å; I414-H417 PolarHBondContact O-N 3.46Å; H417-T431 PolarHBondContact CE1-O 2.8Å; H417-T431 PolarHBondContact CE1-OG1 2.88Å; H417-T431 PolarHBondContact NE2-O 2.82Å; H417-T431 PolarHBondContact NE2-OG1 3.01Å; H417-F433 HydrophobicContact CB-CD2 4.06Å; H417-F433 HydrophobicContact CB-CE2 4.16Å; H417-F433 AromaticContact CD2-CD2 3.43Å; H417-F433 VanDerWaalsContact CD2-CD2 3.43Å; H417-F433 WeakPolarHBondContact CD2-CD2 3.48Å; H417-F433 AromaticContact CG-CD2 3.72Å; H417-E436 IonicContact CD2-OE2 2.71Å; H417-E436 PolarHBondContact CD2-OE2 3.05Å; H417-E436 IonicContact NE2-OE2 3.61Å
418	I	71.6	Confident	61.8	Low	104 Å²	104	105.1 Å²	105.1	53%	0.533	54%	0.543	S	S	.	.	H	α-helix	trans	-86.2	-50.3	166.3	-70.7	170	0	0	0	109.7	I414 L415 S416 N420 K421	I414-I418 HydrophobicContact CG2-CD1 3.63Å; I414-I418 HydrophobicContact CG2-CG1 4.34Å; I414-I418 VanDerWaalsContact O-CG1 3.31Å; I414-I418 WeakPolarHBondContact O-CG1 3.5Å; I414-I418 PolarHBondContact O-N 3.04Å; L415-I418 PolarHBondContact O-N 3.35Å; S416-I418 VanDerWaalsContact C-N 3.27Å; S416-I418 PolarHBondContact O-N 3.45Å; I418-N420 VanDerWaalsContact C-N 3.29Å; I418-N420 PolarHBondContact O-N 3.33Å; I418-K421 PolarHBondContact O-N 3Å; I418-K421 VanDerWaalsContact O-N 3.12Å
419	S	65.1	Low	60.2	Low	83 Å²	83	110 Å²	110	58%	0.58	56%	0.563	S	S	*	*	H	α-helix	trans	-59.7	-38.6	-177.7	-163.1	0	0	0	0	112.5	L415 S416 K421	L415-S419 WeakPolarHBondContact O-CB 3.21Å; L415-S419 PolarHBondContact O-N 3.35Å; S416-S419 PolarHBondContact O-N 2.89Å; S419-K421 PolarHBondContact O-N 3.37Å
420	N	58.4	Low	58.6	Low	89 Å²	89	112.6 Å²	112.6	48%	0.476	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.9	-6.3	-179	-69.6	4.3	0	0	0	113.8	S416 I418 I424	S416-N420 WeakPolarHBondContact O-CB 3.44Å; S416-N420 VanDerWaalsContact O-CG 3.27Å; S416-N420 PolarHBondContact O-N 3.44Å; S416-N420 PolarHBondContact O-OD1 2.98Å; I418-N420 VanDerWaalsContact C-N 3.29Å; I418-N420 PolarHBondContact O-N 3.33Å; N420-I424 VanDerWaalsContact O-CD1 3.28Å; N420-I424 WeakPolarHBondContact O-CD1 3.3Å; N420-I424 VanDerWaalsContact O-CG1 3.32Å; N420-I424 WeakPolarHBondContact O-CG1 3.45Å
421	K	54.3	Low	57.4	Low	156 Å²	156	112 Å²	112	68%	0.678	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-18.7	-178	-81.9	-176.5	174.9	-178.1	0	114.8	I418 S419	I418-K421 PolarHBondContact O-N 3Å; I418-K421 VanDerWaalsContact O-N 3.12Å; S419-K421 PolarHBondContact O-N 3.37Å
422	D	50.8	Low	56.4	Low	159 Å²	159	112.1 Å²	112.1	85%	0.85	60%	0.597	S	S	*	*	S	Bend	trans	-93.8	-9.4	-176.7	-68.6	-17.9	0	0	0	113.5
423	E	50.9	Low	55.7	Low	165 Å²	165	110.4 Å²	110.4	77%	0.771	59%	0.585	S	S	*	*	S	Bend	trans	-109.5	-7.2	-177	-65.9	-163	142	0	0	115.6	T425	E423-T425 VanDerWaalsContact C-N 3.35Å; E423-T425 PolarHBondContact O-N 3.47Å
424	I	43.2	Very low	54.9	Low	125 Å²	125	115.5 Å²	115.5	64%	0.641	61%	0.607	S	S	*	*			trans	-80.9	80.1	-175.5	-58.6	167.4	0	0	0	111.5	N420	N420-I424 VanDerWaalsContact O-CD1 3.28Å; N420-I424 WeakPolarHBondContact O-CD1 3.3Å; N420-I424 VanDerWaalsContact O-CG1 3.32Å; N420-I424 WeakPolarHBondContact O-CG1 3.45Å
425	T	41.4	Very low	54.1	Low	117 Å²	117	119.3 Å²	119.3	72%	0.718	62%	0.624	S	S	*	*			trans	-107	112.7	157.7	55.7	0	0	0	0	110.3	E423	E423-T425 VanDerWaalsContact C-N 3.35Å; E423-T425 PolarHBondContact O-N 3.47Å
426	H	39.7	Very low	53.6	Low	188 Å²	188	117.6 Å²	117.6	87%	0.87	61%	0.613	S	S	*	*	S	Bend	trans	67.2	65.4	166.6	-52.6	-68.7	0	0	0	118.9
427	S	37.2	Very low	53.2	Low	112 Å²	112	117.7 Å²	117.7	78%	0.783	61%	0.609	S	S	*	*			trans	-155.4	175.1	137.1	58.3	0	0	0	0	110.5
428	E	33	Very low	53	Low	186 Å²	186	123 Å²	123	87%	0.869	64%	0.635	S	S	*	*			trans	-94.2	161.7	-159.3	-60.9	179.5	129.3	0	0	114.9
429	Q	40.7	Very low	52.6	Low	185 Å²	185	119.7 Å²	119.7	86%	0.864	62%	0.62	S	S	*	*			trans	71.9	118.7	179.4	-54.4	-165.8	-5.5	0	0	116.4
430	P	40.7	Very low	52.7	Low	118 Å²	118	117.3 Å²	117.3	77%	0.766	60%	0.601	S	S	*	*			trans	-72.4	133.4	166.1	31.5	-32	0	0	0	109.6	D432	P430-D432 PolarHBondContact O-N 3.18Å
431	T	50.9	Low	53.1	Low	87 Å²	87	113.9 Å²	113.9	53%	0.534	58%	0.583	S	S	.	*			trans	-69.3	118.7	168.9	50	0	0	0	0	109.3	H417 F433	H417-T431 PolarHBondContact CE1-O 2.8Å; H417-T431 PolarHBondContact CE1-OG1 2.88Å; H417-T431 PolarHBondContact NE2-O 2.82Å; H417-T431 PolarHBondContact NE2-OG1 3.01Å; T431-F433 PolarHBondContact O-N 3.1Å
432	D	57.4	Low	53.5	Low	115 Å²	115	113.4 Å²	113.4	62%	0.615	58%	0.583	S	S	*	*			trans	-68.3	97.2	178.7	-94	-40.7	0	0	0	110.6	P430 H434 H435 E436	P430-D432 PolarHBondContact O-N 3.18Å; D432-H434 PolarHBondContact O-N 2.86Å; D432-H435 HydrophobicContact CB-CB 4.26Å; D432-H435 PolarHBondContact O-N 2.95Å; D432-E436 PolarHBondContact O-N 3.23Å
433	F	61.9	Low	53.9	Low	69 Å²	69	109.5 Å²	109.5	30%	0.303	56%	0.562	S	S	.	*	H	α-helix	trans	-50.8	-28.3	171	-176.3	-125.5	0	0	0	112.2	L413 I414 H417 T431 E436 L437	L413-F433 HydrophobicContact CD2-CE2 4.04Å; L413-F433 HydrophobicContact CG-CE2 4.47Å; I414-F433 HydrophobicContact CG1-CZ 4.14Å; H417-F433 HydrophobicContact CB-CD2 4.06Å; H417-F433 HydrophobicContact CB-CE2 4.16Å; H417-F433 AromaticContact CD2-CD2 3.43Å; H417-F433 VanDerWaalsContact CD2-CD2 3.43Å; H417-F433 WeakPolarHBondContact CD2-CD2 3.48Å; H417-F433 AromaticContact CG-CD2 3.72Å; T431-F433 PolarHBondContact O-N 3.1Å; F433-E436 PolarHBondContact O-N 3.11Å; F433-L437 HydrophobicContact CD1-CD1 3.73Å; F433-L437 HydrophobicContact CD1-CG 4.42Å; F433-L437 HydrophobicContact CE1-CD1 3.7Å; F433-L437 HydrophobicContact CE1-CG 4.25Å; F433-L437 HydrophobicContact CE2-CG 4.46Å; F433-L437 HydrophobicContact CG-CD1 4.28Å; F433-L437 HydrophobicContact CZ-CD1 4.22Å; F433-L437 HydrophobicContact CZ-CD2 4.4Å; F433-L437 HydrophobicContact CZ-CG 4.27Å; F433-L437 WeakPolarHBondContact O-CB 3.46Å; F433-L437 WeakPolarHBondContact O-CD1 3.37Å; F433-L437 VanDerWaalsContact O-CG 3.23Å; F433-L437 WeakPolarHBondContact O-CG 3.35Å; F433-L437 PolarHBondContact O-N 3.13Å
434	H	60.6	Low	54.1	Low	138 Å²	138	103.6 Å²	103.6	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-61.5	-43.5	171	-94.2	-82.4	0	0	0	113.5	D432 L437 E438	D432-H434 PolarHBondContact O-N 2.86Å; H434-L437 WeakPolarHBondContact O-CB 3.35Å; H434-L437 PolarHBondContact O-N 2.83Å; H434-E438 WeakPolarHBondContact O-CG 3.33Å; H434-E438 PolarHBondContact O-N 2.95Å
435	H	61.6	Low	54.5	Low	122 Å²	122	104.3 Å²	104.3	57%	0.565	55%	0.548	S	S	*	.	H	α-helix	trans	-73.7	-31.4	178.4	-163.1	36.6	0	0	0	111.4	D432 E438 C439	D432-H435 HydrophobicContact CB-CB 4.26Å; D432-H435 PolarHBondContact O-N 2.95Å; H435-E438 IonicContact ND1-OE2 3.16Å; H435-E438 PolarHBondContact O-N 2.9Å; H435-C439 VanDerWaalsContact O-CB 3.26Å; H435-C439 WeakPolarHBondContact O-CB 3.36Å; H435-C439 PolarHBondContact O-N 2.8Å; H435-C439 PolarHBondContact O-SG 2.87Å
436	E	63.8	Low	55.2	Low	68 Å²	68	102.3 Å²	102.3	32%	0.318	53%	0.528	S	S	.	.	H	α-helix	trans	-66.8	-36.3	169.9	-68.5	-158.8	163.6	0	0	112.9	L413 H417 D432 F433 C439	L413-E436 HydrophobicContact CD1-CB 4.12Å; L413-E436 HydrophobicContact CD2-CB 4.04Å; L413-E436 HydrophobicContact CG-CB 4.31Å; H417-E436 IonicContact CD2-OE2 2.71Å; H417-E436 PolarHBondContact CD2-OE2 3.05Å; H417-E436 IonicContact NE2-OE2 3.61Å; D432-E436 PolarHBondContact O-N 3.23Å; F433-E436 PolarHBondContact O-N 3.11Å; E436-C439 WeakPolarHBondContact O-CB 3.38Å; E436-C439 PolarHBondContact O-N 3.09Å
437	L	66.3	Low	55.6	Low	50 Å²	50	96.2 Å²	96.2	26%	0.262	50%	0.502	S	S	.	.	H	α-helix	trans	-65.3	-45.5	171.7	-80.5	162	0	0	0	112.1	Y410 F433 H434 C439 L440	Y410-L437 HydrophobicContact CD2-CD2 4.35Å; Y410-L437 HydrophobicContact CE2-CD2 3.77Å; F433-L437 HydrophobicContact CD1-CD1 3.73Å; F433-L437 HydrophobicContact CD1-CG 4.42Å; F433-L437 HydrophobicContact CE1-CD1 3.7Å; F433-L437 HydrophobicContact CE1-CG 4.25Å; F433-L437 HydrophobicContact CE2-CG 4.46Å; F433-L437 HydrophobicContact CG-CD1 4.28Å; F433-L437 HydrophobicContact CZ-CD1 4.22Å; F433-L437 HydrophobicContact CZ-CD2 4.4Å; F433-L437 HydrophobicContact CZ-CG 4.27Å; F433-L437 WeakPolarHBondContact O-CB 3.46Å; F433-L437 WeakPolarHBondContact O-CD1 3.37Å; F433-L437 VanDerWaalsContact O-CG 3.23Å; F433-L437 WeakPolarHBondContact O-CG 3.35Å; F433-L437 PolarHBondContact O-N 3.13Å; H434-L437 WeakPolarHBondContact O-CB 3.35Å; H434-L437 PolarHBondContact O-N 2.83Å; L437-C439 PolarHBondContact O-N 2.76Å; L437-L440 HydrophobicContact CD2-CD1 4Å; L437-L440 VanDerWaalsContact O-CB 3.29Å; L437-L440 WeakPolarHBondContact O-CB 3.43Å; L437-L440 WeakPolarHBondContact O-CD1 3.46Å; L437-L440 VanDerWaalsContact O-CG 3.25Å; L437-L440 WeakPolarHBondContact O-CG 3.5Å; L437-L440 PolarHBondContact O-N 3.24Å; L437-L440 VanDerWaalsContact O-N 3.12Å
438	E	63.6	Low	56.2	Low	148 Å²	148	99.1 Å²	99.1	69%	0.692	50%	0.503	S	S	*	.	H	α-helix	trans	-64.4	-25.5	173.3	-72.3	177.1	168.1	0	0	112.4	H434 H435 L440	H434-E438 WeakPolarHBondContact O-CG 3.33Å; H434-E438 PolarHBondContact O-N 2.95Å; H435-E438 IonicContact ND1-OE2 3.16Å; H435-E438 PolarHBondContact O-N 2.9Å; E438-L440 PolarHBondContact O-N 3.45Å
439	C	62.8	Low	56.7	Low	34 Å²	34	96.3 Å²	96.3	23%	0.23	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-1.1	173.5	-80.8	0	0	0	0	114.7	R398 H435 E436 L437	R398-C439 WeakPolarHBondContact CD-O 3.29Å; R398-C439 PolarHBondContact NE-O 2.9Å; R398-C439 VanDerWaalsContact NE-O 3.15Å; R398-C439 VanDerWaalsContact NH1-CB 3.33Å; R398-C439 PolarHBondContact NH1-O 2.82Å; R398-C439 PolarHBondContact NH1-SG 2.97Å; H435-C439 VanDerWaalsContact O-CB 3.26Å; H435-C439 WeakPolarHBondContact O-CB 3.36Å; H435-C439 PolarHBondContact O-N 2.8Å; H435-C439 PolarHBondContact O-SG 2.87Å; E436-C439 WeakPolarHBondContact O-CB 3.38Å; E436-C439 PolarHBondContact O-N 3.09Å; L437-C439 PolarHBondContact O-N 2.76Å
440	L	68.3	Low	57.4	Low	33 Å²	33	89.1 Å²	89.1	17%	0.173	46%	0.462	C	S	.	.	S	Bend	trans	-68.6	133.8	178.6	-71.7	168.1	0	0	0	112	I409 Y410 L413 L437 E438	I409-L440 HydrophobicContact CG2-CD2 3.89Å; Y410-L440 HydrophobicContact CD2-CD1 3.72Å; Y410-L440 HydrophobicContact CE2-CD1 4.38Å; L413-L440 HydrophobicContact CD2-CD2 4.22Å; L413-L440 HydrophobicContact CD2-CG 4.44Å; L437-L440 HydrophobicContact CD2-CD1 4Å; L437-L440 VanDerWaalsContact O-CB 3.29Å; L437-L440 WeakPolarHBondContact O-CB 3.43Å; L437-L440 WeakPolarHBondContact O-CD1 3.46Å; L437-L440 VanDerWaalsContact O-CG 3.25Å; L437-L440 WeakPolarHBondContact O-CG 3.5Å; L437-L440 PolarHBondContact O-N 3.24Å; L437-L440 VanDerWaalsContact O-N 3.12Å; E438-L440 PolarHBondContact O-N 3.45Å
441	P	66.6	Low	58.4	Low	16 Å²	16	86.7 Å²	86.7	10%	0.104	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-70.4	140.2	-177.5	28.3	-34.8	0	0	0	112.8	R398 V400 L406 I409	R398-P441 VanDerWaalsContact C-CB 3.46Å; R398-P441 HydrophobicContact CB-CB 3.86Å; R398-P441 HydrophobicContact CG-CB 4.2Å; R398-P441 CarbonylContact O-C 3.6Å; R398-P441 WeakPolarHBondContact O-CA 3.49Å; R398-P441 WeakPolarHBondContact O-CB 3.38Å; V400-P441 HydrophobicContact CG2-CB 3.52Å; V400-P441 HydrophobicContact CG2-CG 3.38Å; L406-P441 HydrophobicContact CD1-CG 4.26Å; L406-P441 WeakPolarHBondContact CD1-O 3.46Å; I409-P441 HydrophobicContact CD1-CG 3.89Å
442	H	62.3	Low	59.1	Low	146 Å²	146	83.3 Å²	83.3	68%	0.676	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	152.5	-179.2	-58.8	-41.5	0	0	0	111.5	R398 S399 V400	R398-H442 PolarHBondContact O-N 3.23Å; S399-H442 CarbonylContact C-O 3.57Å; S399-H442 VanDerWaalsContact CA-O 3.3Å; S399-H442 WeakPolarHBondContact CA-O 3.48Å; V400-H442 PolarHBondContact N-O 2.9Å
443	L	58.5	Low	59.4	Low	77 Å²	77	84.3 Å²	84.3	40%	0.403	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	133.9	171.6	-153.5	78.6	0	0	0	109.6	L403 L406 V445	L403-L443 HydrophobicContact CB-CD1 4.14Å; L403-L443 HydrophobicContact CD1-CD1 4.39Å; L406-L443 HydrophobicContact CB-CD1 4.48Å; L406-L443 HydrophobicContact CD2-CD1 4.2Å; L443-V445 PolarHBondContact O-N 3.27Å
444	C	56.3	Low	59.7	Low	42 Å²	42	83.6 Å²	83.6	28%	0.284	43%	0.428	S	S	.	.			trans	-61.2	110.4	176	-63.6	0	0	0	0	110.1	S399 V400	S399-C444 VanDerWaalsContact CB-SG 3.57Å; V400-C444 PolarHBondContact N-SG 2.84Å; V400-C444 VanDerWaalsContact N-SG 3.44Å; V400-C444 PolarHBondContact O-N 2.98Å; V400-C444 PolarHBondContact O-SG 2.92Å
445	V	52.2	Low	60.1	Low	140 Å²	140	79.3 Å²	79.3	85%	0.848	41%	0.413	S	S	*	.			trans	-70.1	133.7	165.3	-177	0	0	0	0	107.7	L443	L443-V445 PolarHBondContact O-N 3.27Å
446	Y	55	Low	60.5	Low	74 Å²	74	77.5 Å²	77.5	29%	0.29	41%	0.414	S	S	.	.			trans	-62.4	140.6	-173.6	-68.2	-85.7	0	0	0	111.6	L355 H448 S468 L469	L355-Y446 HydrophobicContact CD2-CD1 3.96Å; L355-Y446 HydrophobicContact CD2-CE1 3.79Å; Y446-H448 PolarHBondContact O-N 3.47Å; Y446-H448 VanDerWaalsContact O-N 3.07Å; Y446-S468 WeakPolarHBondContact CE1-OG 3.25Å; Y446-S468 WeakPolarHBondContact CE2-OG 3.47Å; Y446-S468 PolarHBondContact OH-OG 3.45Å; Y446-L469 HydrophobicContact CD1-CD2 3.83Å; Y446-L469 HydrophobicContact CD1-CG 4.16Å; Y446-L469 HydrophobicContact CE1-CG 4.49Å; Y446-L469 HydrophobicContact CG-CD2 4.41Å
447	N	48.8	Very low	60.8	Low	60 Å²	60	75.5 Å²	75.5	32%	0.321	41%	0.405	S	S	.	.			trans	-59.8	116	171.7	179.8	-5.3	0	0	0	108.5	L449 T450	N447-L449 PolarHBondContact O-N 2.87Å; N447-L449 WeakPolarHBondContact OD1-CB 3.49Å; N447-L449 WeakPolarHBondContact OD1-CG 3.32Å; N447-L449 PolarHBondContact OD1-N 3.26Å; N447-L449 VanDerWaalsContact OD1-N 3.08Å; N447-T450 HydrophobicContact CB-CG2 4.01Å; N447-T450 WeakPolarHBondContact O-CB 3.41Å; N447-T450 PolarHBondContact O-N 2.99Å; N447-T450 PolarHBondContact O-OG1 3.18Å
448	H	48.9	Very low	61.3	Low	173 Å²	173	73.5 Å²	73.5	80%	0.801	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-16.3	-176.5	57	-90.6	0	0	0	113.5	Y446 T450	Y446-H448 PolarHBondContact O-N 3.47Å; Y446-H448 VanDerWaalsContact O-N 3.07Å; H448-T450 VanDerWaalsContact C-N 3.31Å
449	L	42.9	Very low	61.7	Low	127 Å²	127	68 Å²	68	67%	0.665	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.5	173.8	-55.1	175.2	0	0	0	113.6	N447 S451	N447-L449 PolarHBondContact O-N 2.87Å; N447-L449 WeakPolarHBondContact OD1-CB 3.49Å; N447-L449 WeakPolarHBondContact OD1-CG 3.32Å; N447-L449 PolarHBondContact OD1-N 3.26Å; N447-L449 VanDerWaalsContact OD1-N 3.08Å; L449-S451 PolarHBondContact O-N 2.88Å; L449-S451 VanDerWaalsContact O-N 3.1Å
450	T	55.9	Low	62.2	Low	34 Å²	34	68.5 Å²	68.5	21%	0.209	37%	0.37	C	S	.	.			trans	-88	65.4	-174.7	58.1	0	0	0	0	113.5	N447 H448 L469	N447-T450 HydrophobicContact CB-CG2 4.01Å; N447-T450 WeakPolarHBondContact O-CB 3.41Å; N447-T450 PolarHBondContact O-N 2.99Å; N447-T450 PolarHBondContact O-OG1 3.18Å; H448-T450 VanDerWaalsContact C-N 3.31Å; T450-L469 WeakPolarHBondContact OG1-CD2 3.47Å
451	S	62.3	Low	62.4	Low	67 Å²	67	67 Å²	67	47%	0.469	36%	0.361	S	S	.	.			trans	-71.3	135.1	169.2	62.8	0	0	0	0	111.6	L449 Q453	L449-S451 PolarHBondContact O-N 2.88Å; L449-S451 VanDerWaalsContact O-N 3.1Å; S451-Q453 PolarHBondContact O-N 2.71Å; S451-Q453 WeakPolarHBondContact OG-CG 3.29Å; S451-Q453 PolarHBondContact OG-NE2 3.27Å; S451-Q453 VanDerWaalsContact OG-NE2 3.09Å
452	I	64.7	Low	62.8	Low	17 Å²	17	66.2 Å²	66.2	9%	0.087	36%	0.356	C	S	.	.			trans	-73.2	118.1	162.8	-57.7	174.6	0	0	0	107.2	E457 F458 A461 L469 V470 M473	I452-E457 HydrophobicContact CG2-CB 3.92Å; I452-F458 HydrophobicContact CD1-CD2 4.13Å; I452-F458 HydrophobicContact CG2-CB 3.84Å; I452-F458 HydrophobicContact CG2-CD2 4.36Å; I452-A461 HydrophobicContact CD1-CB 4.07Å; I452-L469 HydrophobicContact CD1-CB 4.23Å; I452-V470 HydrophobicContact CD1-CG2 4.2Å; I452-M473 HydrophobicContact CB-CE 4.31Å; I452-M473 HydrophobicContact CB-SD 3.86Å; I452-M473 HydrophobicContact CD1-CG 4.27Å; I452-M473 HydrophobicContact CD1-SD 4.47Å; I452-M473 HydrophobicContact CG1-SD 4.35Å
453	Q	64	Low	63.2	Low	135 Å²	135	63 Å²	63	63%	0.631	35%	0.345	S	S	*	.			trans	-105.6	-33.4	-175.9	-64.5	-175.9	-5.8	0	0	112.5	S451 E457	S451-Q453 PolarHBondContact O-N 2.71Å; S451-Q453 WeakPolarHBondContact OG-CG 3.29Å; S451-Q453 PolarHBondContact OG-NE2 3.27Å; S451-Q453 VanDerWaalsContact OG-NE2 3.09Å; Q453-E457 PolarHBondContact N-OE2 3Å
454	T	68.5	Low	63.7	Low	54 Å²	54	61.7 Å²	61.7	33%	0.331	34%	0.338	S	S	.	.	S	Bend	trans	-111.2	152.8	-175.1	61.3	0	0	0	0	112.9	S456 E457 F458	T454-S456 VanDerWaalsContact C-N 3.27Å; T454-S456 PolarHBondContact O-N 3.24Å; T454-S456 PolarHBondContact OG1-OG 3.06Å; T454-E457 PolarHBondContact N-OE2 3.43Å; T454-E457 PolarHBondContact O-N 3.4Å; T454-E457 WeakPolarHBondContact OG1-CB 3.44Å; T454-E457 WeakPolarHBondContact OG1-CG 3.35Å; T454-E457 PolarHBondContact OG1-N 2.94Å; T454-E457 PolarHBondContact OG1-OE2 3.45Å; T454-F458 PolarHBondContact O-N 3.34Å; T454-F458 VanDerWaalsContact O-N 3.15Å
455	P	69.7	Low	64.4	Low	49 Å²	49	64.6 Å²	64.6	32%	0.318	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-37.7	173.5	21.9	-32.2	0	0	0	112.4	F458 L459 F516	P455-F458 WeakPolarHBondContact O-CB 3.43Å; P455-F458 PolarHBondContact O-N 3.41Å; P455-L459 PolarHBondContact O-N 3.04Å; P455-F516 HydrophobicContact CB-CD1 3.94Å; P455-F516 HydrophobicContact CB-CD2 3.53Å; P455-F516 HydrophobicContact CB-CE1 3.72Å; P455-F516 HydrophobicContact CB-CE2 3.3Å; P455-F516 HydrophobicContact CB-CG 3.85Å; P455-F516 HydrophobicContact CB-CZ 3.4Å; P455-F516 WeakPolarHBondContact O-CE2 3.35Å
456	S	69.5	Low	65	Low	84 Å²	84	60.2 Å²	60.2	59%	0.587	32%	0.316	S	S	*	.	H	α-helix	trans	-64.9	-39.3	177	47.2	0	0	0	0	112.8	T454 F458 L459 N460	T454-S456 VanDerWaalsContact C-N 3.27Å; T454-S456 PolarHBondContact O-N 3.24Å; T454-S456 PolarHBondContact OG1-OG 3.06Å; S456-F458 VanDerWaalsContact C-N 3.32Å; S456-F458 PolarHBondContact O-N 3.2Å; S456-L459 PolarHBondContact O-N 2.99Å; S456-N460 VanDerWaalsContact O-CB 3.26Å; S456-N460 WeakPolarHBondContact O-CB 3.46Å; S456-N460 PolarHBondContact O-N 3.14Å
457	E	70.9	Confident	65.6	Low	26 Å²	26	59.5 Å²	59.5	12%	0.121	31%	0.312	C	S	.	.	H	α-helix	trans	-63.4	-36.1	171.7	-73.5	161.4	154.4	0	0	112.1	K350 V351 I452 Q453 T454 N460 A461	K350-E457 WeakPolarHBondContact CD-OE1 3.34Å; V351-E457 HydrophobicContact CG2-CB 3.89Å; V351-E457 HydrophobicContact CG2-CG 3.82Å; I452-E457 HydrophobicContact CG2-CB 3.92Å; Q453-E457 PolarHBondContact N-OE2 3Å; T454-E457 PolarHBondContact N-OE2 3.43Å; T454-E457 PolarHBondContact O-N 3.4Å; T454-E457 WeakPolarHBondContact OG1-CB 3.44Å; T454-E457 WeakPolarHBondContact OG1-CG 3.35Å; T454-E457 PolarHBondContact OG1-N 2.94Å; T454-E457 PolarHBondContact OG1-OE2 3.45Å; E457-N460 PolarHBondContact O-N 3Å; E457-A461 WeakPolarHBondContact O-CB 3.41Å; E457-A461 PolarHBondContact O-N 2.99Å
458	F	75.2	Confident	66.3	Low	7 Å²	7	58.2 Å²	58.2	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-65.2	-48.2	176	-172.4	-104.2	0	0	0	112	I452 T454 P455 S456 N460 A461 I462 V470 L478 F516 A520 L538	I452-F458 HydrophobicContact CD1-CD2 4.13Å; I452-F458 HydrophobicContact CG2-CB 3.84Å; I452-F458 HydrophobicContact CG2-CD2 4.36Å; T454-F458 PolarHBondContact O-N 3.34Å; T454-F458 VanDerWaalsContact O-N 3.15Å; P455-F458 WeakPolarHBondContact O-CB 3.43Å; P455-F458 PolarHBondContact O-N 3.41Å; S456-F458 VanDerWaalsContact C-N 3.32Å; S456-F458 PolarHBondContact O-N 3.2Å; F458-N460 VanDerWaalsContact C-N 3.33Å; F458-N460 PolarHBondContact O-N 3.07Å; F458-A461 PolarHBondContact O-N 2.93Å; F458-I462 HydrophobicContact CD1-CD1 3.66Å; F458-I462 HydrophobicContact CE1-CD1 3.37Å; F458-I462 HydrophobicContact CE1-CG1 4.49Å; F458-I462 HydrophobicContact CG-CD1 4.44Å; F458-I462 HydrophobicContact CZ-CD1 3.93Å; F458-I462 WeakPolarHBondContact O-CG1 3.24Å; F458-I462 PolarHBondContact O-N 2.92Å; F458-V470 HydrophobicContact CE2-CG1 3.84Å; F458-V470 HydrophobicContact CE2-CG2 4.36Å; F458-V470 HydrophobicContact CZ-CG1 4.24Å; F458-L478 HydrophobicContact CE2-CD2 4.29Å; F458-L478 HydrophobicContact CZ-CD2 4.33Å; F458-F516 HydrophobicContact CB-CZ 4.22Å; F458-F516 HydrophobicContact CD1-CE2 4.44Å; F458-F516 AromaticContact CD1-CZ 3.8Å; F458-F516 HydrophobicContact CD1-CZ 3.8Å; F458-F516 HydrophobicContact CG-CZ 4.38Å; F458-A520 HydrophobicContact CE1-CB 4.21Å; F458-L538 HydrophobicContact CE1-CD2 4.29Å; F458-L538 HydrophobicContact CZ-CD2 4.19Å
459	L	73.6	Confident	67.1	Low	32 Å²	32	50.3 Å²	50.3	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-61.1	-41.5	173.7	-89.4	167.5	0	0	0	111.9	P455 S456 I462 N463 F516 D519 A523	P455-L459 PolarHBondContact O-N 3.04Å; S456-L459 PolarHBondContact O-N 2.99Å; L459-I462 PolarHBondContact O-N 3.45Å; L459-N463 WeakPolarHBondContact O-CB 3.28Å; L459-N463 VanDerWaalsContact O-CG 3.29Å; L459-N463 PolarHBondContact O-N 2.87Å; L459-N463 PolarHBondContact O-ND2 2.89Å; L459-F516 HydrophobicContact CD1-CD2 3.66Å; L459-F516 HydrophobicContact CD1-CE2 3.72Å; L459-F516 HydrophobicContact CG-CD2 4.22Å; L459-F516 HydrophobicContact CG-CE2 3.78Å; L459-D519 HydrophobicContact CD1-CB 4.06Å; L459-D519 HydrophobicContact CD2-CB 4.1Å; L459-A523 HydrophobicContact CD2-CB 3.77Å
460	N	71.9	Confident	68.3	Low	46 Å²	46	44.3 Å²	44.3	25%	0.246	24%	0.24	C	C	.	.	H	α-helix	trans	-64.3	-40.7	176.4	-166.5	35.6	0	0	0	111.7	S349 V351 S456 E457 F458 N463 N464	S349-N460 PolarHBondContact OG-ND2 3.25Å; V351-N460 HydrophobicContact CG2-CB 4.49Å; S456-N460 VanDerWaalsContact O-CB 3.26Å; S456-N460 WeakPolarHBondContact O-CB 3.46Å; S456-N460 PolarHBondContact O-N 3.14Å; E457-N460 PolarHBondContact O-N 3Å; F458-N460 VanDerWaalsContact C-N 3.33Å; F458-N460 PolarHBondContact O-N 3.07Å; N460-N463 PolarHBondContact O-N 3.48Å; N460-N464 VanDerWaalsContact O-CB 3.23Å; N460-N464 WeakPolarHBondContact O-CB 3.41Å; N460-N464 VanDerWaalsContact O-CG 3.28Å; N460-N464 PolarHBondContact O-N 3.47Å; N460-N464 PolarHBondContact OD1-ND2 3.45Å
461	A	73.7	Confident	68.7	Low	0 Å²	0	45 Å²	45	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.7	-39.1	173.8	0	0	0	0	0	112.5	V351 I452 E457 F458 Q465 R466 V470	V351-A461 HydrophobicContact CG1-CB 4.27Å; I452-A461 HydrophobicContact CD1-CB 4.07Å; E457-A461 WeakPolarHBondContact O-CB 3.41Å; E457-A461 PolarHBondContact O-N 2.99Å; F458-A461 PolarHBondContact O-N 2.93Å; A461-Q465 PolarHBondContact O-N 3.3Å; A461-Q465 VanDerWaalsContact O-N 3.13Å; A461-R466 HydrophobicContact CB-CB 4.34Å; A461-R466 PolarHBondContact O-N 2.86Å; A461-V470 HydrophobicContact CB-CG2 4.16Å
462	I	73.9	Confident	68.9	Low	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.4	-47.8	174.1	-71.6	170.1	0	0	0	110.8	F458 L459 Q465 W467 V470 A523 R531	F458-I462 HydrophobicContact CD1-CD1 3.66Å; F458-I462 HydrophobicContact CE1-CD1 3.37Å; F458-I462 HydrophobicContact CE1-CG1 4.49Å; F458-I462 HydrophobicContact CG-CD1 4.44Å; F458-I462 HydrophobicContact CZ-CD1 3.93Å; F458-I462 WeakPolarHBondContact O-CG1 3.24Å; F458-I462 PolarHBondContact O-N 2.92Å; L459-I462 PolarHBondContact O-N 3.45Å; I462-Q465 PolarHBondContact O-N 3.19Å; I462-W467 HydrophobicContact CB-CH2 4.12Å; I462-W467 HydrophobicContact CG1-CH2 3.99Å; I462-W467 HydrophobicContact CG2-CH2 4.03Å; I462-W467 WeakPolarHBondContact O-CZ2 3.13Å; I462-V470 HydrophobicContact CG1-CG2 4.41Å; I462-A523 HydrophobicContact CB-CB 4.45Å; I462-A523 VanDerWaalsContact CG2-C 3.45Å; I462-A523 HydrophobicContact CG2-CB 3.47Å; I462-A523 VanDerWaalsContact CG2-CB 3.47Å; I462-R531 PolarHBondContact O-NH1 3.21Å; I462-R531 PolarHBondContact O-NH2 2.89Å
463	N	71.3	Confident	68.9	Low	80 Å²	80	46.8 Å²	46.8	43%	0.428	26%	0.257	S	S	.	.	H	α-helix	trans	-63.8	-46.3	179.9	-71.5	-26	0	0	0	111.2	L459 N460 Q465	L459-N463 WeakPolarHBondContact O-CB 3.28Å; L459-N463 VanDerWaalsContact O-CG 3.29Å; L459-N463 PolarHBondContact O-N 2.87Å; L459-N463 PolarHBondContact O-ND2 2.89Å; N460-N463 PolarHBondContact O-N 3.48Å; N463-Q465 WeakPolarHBondContact O-CG 3.34Å; N463-Q465 PolarHBondContact O-N 3.49Å
464	N	68.9	Low	68.8	Low	48 Å²	48	44.3 Å²	44.3	26%	0.257	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	12.2	-179.9	-59.6	-14	0	0	0	114	N460 R466	N460-N464 VanDerWaalsContact O-CB 3.23Å; N460-N464 WeakPolarHBondContact O-CB 3.41Å; N460-N464 VanDerWaalsContact O-CG 3.28Å; N460-N464 PolarHBondContact O-N 3.47Å; N460-N464 PolarHBondContact OD1-ND2 3.45Å; N464-R466 PolarHBondContact O-N 3.31Å
465	Q	70.1	Confident	68.2	Low	104 Å²	104	46.1 Å²	46.1	49%	0.486	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	32.4	167.4	-35.4	-139.7	43.4	0	0	115.7	A461 I462 N463 W467 R531	A461-Q465 PolarHBondContact O-N 3.3Å; A461-Q465 VanDerWaalsContact O-N 3.13Å; I462-Q465 PolarHBondContact O-N 3.19Å; N463-Q465 WeakPolarHBondContact O-CG 3.34Å; N463-Q465 PolarHBondContact O-N 3.49Å; Q465-W467 PolarHBondContact O-N 3.36Å; Q465-W467 PolarHBondContact O-NE1 2.91Å; Q465-R531 VanDerWaalsContact CD-NH2 3.3Å; Q465-R531 VanDerWaalsContact CG-NH2 3.3Å
466	R	66.2	Low	67.4	Low	48 Å²	48	47.1 Å²	47.1	18%	0.181	29%	0.287	C	S	.	.			trans	-95.2	62.3	-173.8	-61.1	-174.3	176.8	147	13.8	113.2	V351 D352 A461 N464 S468 L469 V470	V351-R466 PolarHBondContact O-NH1 2.86Å; D352-R466 IonicContact OD1-CZ 3.47Å; D352-R466 IonicContact OD1-NH1 3.71Å; D352-R466 PolarHBondContact OD1-NH1 2.95Å; D352-R466 IonicContact OD1-NH2 3.79Å; D352-R466 PolarHBondContact OD1-NH2 3.2Å; A461-R466 HydrophobicContact CB-CB 4.34Å; A461-R466 PolarHBondContact O-N 2.86Å; N464-R466 PolarHBondContact O-N 3.31Å; R466-S468 PolarHBondContact O-N 3.11Å; R466-S468 VanDerWaalsContact O-N 3.15Å; R466-L469 HydrophobicContact CB-CB 4.46Å; R466-L469 HydrophobicContact CB-CD1 4.14Å; R466-L469 HydrophobicContact CB-CG 4.5Å; R466-L469 PolarHBondContact O-N 3.36Å; R466-L469 VanDerWaalsContact O-N 3.16Å; R466-V470 PolarHBondContact O-N 2.92Å
467	W	67.3	Low	66.7	Low	58 Å²	58	48.2 Å²	48.2	22%	0.22	29%	0.286	C	S	.	.	H	α-helix	trans	-54.6	-32.3	-175.9	-59.1	98.3	0	0	0	114.9	I462 Q465 A471 R531 V534	I462-W467 HydrophobicContact CB-CH2 4.12Å; I462-W467 HydrophobicContact CG1-CH2 3.99Å; I462-W467 HydrophobicContact CG2-CH2 4.03Å; I462-W467 WeakPolarHBondContact O-CZ2 3.13Å; Q465-W467 PolarHBondContact O-N 3.36Å; Q465-W467 PolarHBondContact O-NE1 2.91Å; W467-A471 WeakPolarHBondContact O-CB 3.5Å; W467-A471 PolarHBondContact O-N 3Å; W467-R531 HydrophobicContact CD2-CG 3.93Å; W467-R531 HydrophobicContact CE3-CB 4.29Å; W467-R531 HydrophobicContact CE3-CG 4.01Å; W467-R531 HydrophobicContact CH2-CG 4.13Å; W467-R531 HydrophobicContact CZ2-CG 4.03Å; W467-R531 HydrophobicContact CZ3-CB 4.28Å; W467-R531 HydrophobicContact CZ3-CG 4.07Å; W467-V534 HydrophobicContact CE3-CB 4.09Å; W467-V534 HydrophobicContact CE3-CG2 3.6Å; W467-V534 HydrophobicContact CZ3-CB 3.82Å; W467-V534 HydrophobicContact CZ3-CG1 3.99Å; W467-V534 HydrophobicContact CZ3-CG2 3.76Å
468	S	63.3	Low	66	Low	33 Å²	33	47.3 Å²	47.3	23%	0.231	28%	0.282	C	S	.	.	H	α-helix	trans	-65.2	-50.6	176.2	31.7	0	0	0	0	113.3	Y446 R466 V470 A471 T472	Y446-S468 WeakPolarHBondContact CE1-OG 3.25Å; Y446-S468 WeakPolarHBondContact CE2-OG 3.47Å; Y446-S468 PolarHBondContact OH-OG 3.45Å; R466-S468 PolarHBondContact O-N 3.11Å; R466-S468 VanDerWaalsContact O-N 3.15Å; S468-V470 PolarHBondContact O-N 3.39Å; S468-A471 WeakPolarHBondContact O-CB 3.32Å; S468-A471 PolarHBondContact O-N 3.34Å; S468-T472 PolarHBondContact O-N 3.1Å; S468-T472 PolarHBondContact O-OG1 3.21Å; S468-T472 VanDerWaalsContact O-OG1 3.13Å
469	L	66.3	Low	65.2	Low	7 Å²	7	49 Å²	49	4%	0.037	29%	0.289	C	S	.	.	H	α-helix	trans	-61.9	-33.6	176.1	-68.8	176.5	0	0	0	111.8	V351 Y446 T450 I452 R466 T472	V351-L469 HydrophobicContact CG1-CD1 3.97Å; Y446-L469 HydrophobicContact CD1-CD2 3.83Å; Y446-L469 HydrophobicContact CD1-CG 4.16Å; Y446-L469 HydrophobicContact CE1-CG 4.49Å; Y446-L469 HydrophobicContact CG-CD2 4.41Å; T450-L469 WeakPolarHBondContact OG1-CD2 3.47Å; I452-L469 HydrophobicContact CD1-CB 4.23Å; R466-L469 HydrophobicContact CB-CB 4.46Å; R466-L469 HydrophobicContact CB-CD1 4.14Å; R466-L469 HydrophobicContact CB-CG 4.5Å; R466-L469 PolarHBondContact O-N 3.36Å; R466-L469 VanDerWaalsContact O-N 3.16Å; L469-T472 WeakPolarHBondContact CA-OG1 3.44Å; L469-T472 PolarHBondContact O-OG1 2.95Å
470	V	67.8	Low	64	Low	1 Å²	1	49.9 Å²	49.9	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-74.3	-34.6	173.2	-179.8	0	0	0	0	111.7	I452 F458 A461 I462 R466 S468 T472 M473 V534	I452-V470 HydrophobicContact CD1-CG2 4.2Å; F458-V470 HydrophobicContact CE2-CG1 3.84Å; F458-V470 HydrophobicContact CE2-CG2 4.36Å; F458-V470 HydrophobicContact CZ-CG1 4.24Å; A461-V470 HydrophobicContact CB-CG2 4.16Å; I462-V470 HydrophobicContact CG1-CG2 4.41Å; R466-V470 PolarHBondContact O-N 2.92Å; S468-V470 PolarHBondContact O-N 3.39Å; V470-T472 VanDerWaalsContact C-N 3.35Å; V470-M473 WeakPolarHBondContact O-CB 3.43Å; V470-M473 PolarHBondContact O-N 3.38Å; V470-V534 HydrophobicContact CB-CG2 4.35Å; V470-V534 HydrophobicContact CG1-CB 4.34Å; V470-V534 HydrophobicContact CG1-CG1 3.67Å; V470-V534 HydrophobicContact CG1-CG2 3.65Å
471	A	64	Low	62.4	Low	48 Å²	48	55.1 Å²	55.1	40%	0.397	32%	0.32	S	S	.	.	H	α-helix	trans	-70.3	-29.4	178.8	0	0	0	0	0	113.2	W467 S468 M473 R537	W467-A471 WeakPolarHBondContact O-CB 3.5Å; W467-A471 PolarHBondContact O-N 3Å; S468-A471 WeakPolarHBondContact O-CB 3.32Å; S468-A471 PolarHBondContact O-N 3.34Å; A471-M473 VanDerWaalsContact C-N 3.29Å; A471-R537 PolarHBondContact O-NH1 3.44Å
472	T	65.6	Low	60.4	Low	93 Å²	93	63.1 Å²	63.1	57%	0.571	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.5	173.9	41.3	0	0	0	0	114.4	S468 L469 V470	S468-T472 PolarHBondContact O-N 3.1Å; S468-T472 PolarHBondContact O-OG1 3.21Å; S468-T472 VanDerWaalsContact O-OG1 3.13Å; L469-T472 WeakPolarHBondContact CA-OG1 3.44Å; L469-T472 PolarHBondContact O-OG1 2.95Å; V470-T472 VanDerWaalsContact C-N 3.35Å
473	M	64.9	Low	58.4	Low	29 Å²	29	66.9 Å²	66.9	14%	0.143	39%	0.389	C	S	.	.	S	Bend	trans	-67.7	131.7	175.6	-67.4	-60.9	-73.7	0	0	111.2	I452 V470 A471 S475 L478	I452-M473 HydrophobicContact CB-CE 4.31Å; I452-M473 HydrophobicContact CB-SD 3.86Å; I452-M473 HydrophobicContact CD1-CG 4.27Å; I452-M473 HydrophobicContact CD1-SD 4.47Å; I452-M473 HydrophobicContact CG1-SD 4.35Å; V470-M473 WeakPolarHBondContact O-CB 3.43Å; V470-M473 PolarHBondContact O-N 3.38Å; A471-M473 VanDerWaalsContact C-N 3.29Å; M473-S475 PolarHBondContact O-N 3.11Å; M473-L478 HydrophobicContact CB-CD2 4.3Å
474	P	61.5	Low	56.4	Low	84 Å²	84	72.9 Å²	72.9	55%	0.545	42%	0.415	S	S	.	.			trans	-59.7	135.8	173	-22.8	33.4	0	0	0	111.3	G476 N477	P474-G476 PolarHBondContact O-N 3.27Å; P474-N477 PolarHBondContact O-N 2.93Å
475	S	56.4	Low	54.5	Low	91 Å²	91	74.4 Å²	74.4	64%	0.636	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-15.1	-174.5	-49.6	0	0	0	0	115.3	M473	M473-S475 PolarHBondContact O-N 3.11Å
476	G	54.1	Low	52.5	Low	71 Å²	71	78.2 Å²	78.2	73%	0.732	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-19.5	173.9	0	0	0	0	0	115	P474	P474-G476 PolarHBondContact O-N 3.27Å
477	N	54.3	Low	50.7	Low	106 Å²	106	85.3 Å²	85.3	57%	0.567	48%	0.484	S	S	*	.			trans	-114.8	32.8	-169.4	-70.4	43.1	0	0	0	112.5	P474 F479	P474-N477 PolarHBondContact O-N 2.93Å; N477-F479 PolarHBondContact O-N 3.46Å
478	L	56.7	Low	48.9	Very low	8 Å²	8	87 Å²	87	4%	0.042	50%	0.504	C	S	.	.	S	Bend	trans	-70.3	-15.8	175.4	-70.5	170.2	0	0	0	113.2	F458 M473 R537	F458-L478 HydrophobicContact CE2-CD2 4.29Å; F458-L478 HydrophobicContact CZ-CD2 4.33Å; M473-L478 HydrophobicContact CB-CD2 4.3Å; L478-R537 HydrophobicContact CD1-CB 4.03Å
479	F	56.8	Low	47.1	Very low	42 Å²	42	90.1 Å²	90.1	18%	0.184	53%	0.526	C	S	.	.	S	Bend	trans	-120.9	120.2	166.6	-47.8	-55.1	0	0	0	107.9	N477 E481 F516 K517 L538 S541 L543	N477-F479 PolarHBondContact O-N 3.46Å; F479-E481 PolarHBondContact O-N 3.38Å; F479-F516 HydrophobicContact CD1-CE1 4.33Å; F479-K517 HydrophobicContact CD1-CG 3.96Å; F479-K517 HydrophobicContact CE1-CD 4.35Å; F479-K517 HydrophobicContact CE1-CG 3.61Å; F479-K517 HydrophobicContact CZ-CD 4.36Å; F479-K517 HydrophobicContact CZ-CG 4.02Å; F479-L538 HydrophobicContact CE1-CD2 4.32Å; F479-S541 WeakPolarHBondContact CE2-OG 3.27Å; F479-S541 WeakPolarHBondContact CZ-OG 3.43Å; F479-L543 HydrophobicContact CZ-CD1 4Å; F479-L543 HydrophobicContact CZ-CD2 3.91Å; F479-L543 HydrophobicContact CZ-CG 4.08Å
480	P	49.2	Very low	45.2	Very low	51 Å²	51	95.5 Å²	95.5	33%	0.331	56%	0.559	S	S	.	*			trans	-70.7	115.5	169.1	28	-30.8	0	0	0	108.6	N482	P480-N482 PolarHBondContact O-N 3.37Å
481	E	38.2	Very low	43.1	Very low	155 Å²	155	101 Å²	101	72%	0.724	60%	0.597	S	S	*	*			trans	-73.6	124.9	168.2	-71.4	-163.8	168.6	0	0	110.1	F479 S483	F479-E481 PolarHBondContact O-N 3.38Å; E481-S483 WeakPolarHBondContact CB-OG 3.35Å; E481-S483 PolarHBondContact O-N 3.19Å; E481-S483 PolarHBondContact OE2-OG 3.38Å
482	N	32.6	Very low	41.3	Very low	168 Å²	168	103.4 Å²	103.4	90%	0.898	61%	0.611	S	S	*	*			trans	-77.1	64.9	168.1	-75.4	-13.8	0	0	0	110.3	P480	P480-N482 PolarHBondContact O-N 3.37Å
483	S	31.6	Very low	39.4	Very low	80 Å²	80	108.7 Å²	108.7	56%	0.559	63%	0.626	S	S	*	*			trans	-116.2	94.3	179.5	46.4	0	0	0	0	111.2	E481 A485	E481-S483 WeakPolarHBondContact CB-OG 3.35Å; E481-S483 PolarHBondContact O-N 3.19Å; E481-S483 PolarHBondContact OE2-OG 3.38Å; S483-A485 PolarHBondContact O-N 3.37Å
484	Q	29.2	Very low	37.6	Very low	205 Å²	205	110.8 Å²	110.8	96%	0.958	64%	0.644	S	S	*	*			trans	-63.6	115.4	172.3	-70	-178.4	-11.1	0	0	110.8
485	A	28.3	Very low	36.2	Very low	80 Å²	80	114 Å²	114	66%	0.661	66%	0.655	S	S	*	*			trans	-157.6	105.6	157.8	0	0	0	0	0	111.2	S483 K487	S483-A485 PolarHBondContact O-N 3.37Å; A485-K487 PolarHBondContact O-N 3.43Å
486	Q	28.2	Very low	34.9	Very low	184 Å²	184	115.6 Å²	115.6	86%	0.86	65%	0.653	S	S	*	*			trans	-64.2	108.3	162.4	-77.3	177.6	-33.9	0	0	109
487	K	27.8	Very low	33.9	Very low	198 Å²	198	119.9 Å²	119.9	86%	0.861	65%	0.651	S	S	*	*			trans	-105	41.3	158.6	-73.1	-172.5	176.6	177.7	0	111	A485 S489	A485-K487 PolarHBondContact O-N 3.43Å; K487-S489 PolarHBondContact O-N 3.48Å
488	S	29.1	Very low	32.8	Very low	92 Å²	92	120.9 Å²	120.9	64%	0.643	66%	0.661	S	S	*	*			trans	-60.3	118.3	152.9	46.1	0	0	0	0	108
489	S	27.2	Very low	31.7	Very low	100 Å²	100	125.9 Å²	125.9	70%	0.699	69%	0.694	S	S	*	*			trans	-62.2	156.8	174.2	51.3	0	0	0	0	112.2	K487	K487-S489 PolarHBondContact O-N 3.48Å
490	T	25.7	Very low	30.3	Very low	119 Å²	119	132.4 Å²	132.4	73%	0.73	73%	0.726	S	S	*	*			trans	82.1	104.2	155.5	-46	0	0	0	0	117.3
491	C	24.1	Very low	29.3	Very low	118 Å²	118	134.9 Å²	134.9	80%	0.797	74%	0.744	S	S	*	*			trans	67.4	153.3	152.3	-64.5	0	0	0	0	118.4
492	S	25.5	Very low	29.1	Very low	97 Å²	97	139.5 Å²	139.5	68%	0.678	76%	0.755	S	S	*	*			cis	-173.7	152.7	-18.5	48.8	0	0	0	0	109.8
493	F	26.1	Very low	29	Very low	204 Å²	204	141.4 Å²	141.4	90%	0.895	76%	0.755	S	S	*	*			trans	65.7	155.9	172	-99.5	-127.8	0	0	0	115.9
494	S	26.9	Very low	28.9	Very low	74 Å²	74	141.9 Å²	141.9	52%	0.517	76%	0.758	S	S	.	*			cis	-177.1	153.8	-30.1	-100.9	0	0	0	0	109.2
495	L	31.3	Very low	29	Very low	151 Å²	151	139 Å²	139	79%	0.791	75%	0.75	S	S	*	*			trans	64	150.2	169.4	-86.5	72.8	0	0	0	116.4
496	E	29.5	Very low	29.2	Very low	124 Å²	124	142.9 Å²	142.9	58%	0.579	76%	0.759	S	S	*	*			cis	-167.2	151.4	-25.8	-133.4	-168.7	164.1	0	0	109.5
497	K	32.8	Very low	29.9	Very low	162 Å²	162	143 Å²	143	70%	0.704	76%	0.757	S	S	*	*			trans	61.8	145.8	157.2	-70.6	156.7	-175.9	152.1	0	117.8
498	T	32.4	Very low	30.5	Very low	126 Å²	126	137.2 Å²	137.2	77%	0.773	74%	0.74	S	S	*	*			cis	-140	157.6	-4.5	30.2	0	0	0	0	110
499	P	33.3	Very low	31.3	Very low	113 Å²	113	138.6 Å²	138.6	73%	0.734	74%	0.74	S	S	*	*			trans	-88.4	147.5	165.2	35.8	-31.9	0	0	0	111.9
500	E	26.8	Very low	32.5	Very low	180 Å²	180	140.4 Å²	140.4	84%	0.841	74%	0.741	S	S	*	*				173	148.2	126.3	-99.3	179.8	-158.8	0	0	114.7
501	S	29.2	Very low	33.8	Very low	103 Å²	103	140.3 Å²	140.3	72%	0.72	73%	0.732	S	S	*	*			trans	62	99.5	159.7	73.6	0	0	0	0	120.2
502	R	33.4	Very low	35.4	Very low	251 Å²	251	140.9 Å²	140.9	95%	0.947	72%	0.723	S	S	*	*				-168.2	141.7	123.8	-98.7	151.8	-155.4	-145.5	3.3	110.1
503	K	29.5	Very low	37	Very low	209 Å²	209	139.2 Å²	139.2	91%	0.909	71%	0.707	S	S	*	*			trans	-109.5	122.4	177.6	-65.1	176.6	179.3	176.7	0	109.2
504	S	29.8	Very low	38.8	Very low	89 Å²	89	133 Å²	133	62%	0.622	68%	0.683	S	S	*	*			trans	-170.1	112	162.8	51.2	0	0	0	0	112.2
505	D	31.4	Very low	40.8	Very low	146 Å²	146	135.4 Å²	135.4	78%	0.781	68%	0.68	S	S	*	*			trans	64.2	51.8	133.1	-45.8	-40.8	0	0	0	122	K507	D505-K507 PolarHBondContact O-N 3.2Å
506	N	33.1	Very low	42.5	Very low	161 Å²	161	129.2 Å²	129.2	86%	0.861	65%	0.647	S	S	*	*			trans	-72.3	84.6	159.6	-71.8	2.2	0	0	0	111.2
507	K	43.5	Very low	44.5	Very low	186 Å²	186	125.5 Å²	125.5	81%	0.809	63%	0.629	S	S	*	*			trans	-144.3	-15.4	177.5	-134.3	178.1	-176.8	-178.1	0	119.9	D505	D505-K507 PolarHBondContact O-N 3.2Å
508	P	40.9	Very low	46.4	Very low	77 Å²	77	120.7 Å²	120.7	50%	0.5	61%	0.609	S	S	.	*	S	Bend	trans	-77.4	-35.4	-173.1	28.2	-31.1	0	0	0	114.3	L510 E511	P508-L510 PolarHBondContact O-N 3.39Å; P508-E511 PolarHBondContact O-N 3.25Å; P508-E511 VanDerWaalsContact O-N 3.08Å
509	D	46	Very low	48.3	Very low	121 Å²	121	118.5 Å²	118.5	65%	0.647	59%	0.593	S	S	*	*	H	α-helix	trans	-56.2	-29.6	-166.1	-46.3	-16.3	0	0	0	114.8
510	L	50.9	Low	50.3	Low	138 Å²	138	113.1 Å²	113.1	72%	0.723	56%	0.558	S	S	*	*	H	α-helix	trans	-73.5	-27.2	-176.5	-136.5	81.7	0	0	0	113	P508 N514	P508-L510 PolarHBondContact O-N 3.39Å; L510-N514 PolarHBondContact O-ND2 2.83Å; L510-N514 VanDerWaalsContact O-ND2 3.09Å
511	E	52.6	Low	52.8	Low	117 Å²	117	104.7 Å²	104.7	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-81.1	-37.4	-179.7	-70.1	-157.7	166.8	0	0	112.7	P508 N513 N514 R515	P508-E511 PolarHBondContact O-N 3.25Å; P508-E511 VanDerWaalsContact O-N 3.08Å; E511-N513 PolarHBondContact O-N 2.98Å; E511-N514 PolarHBondContact O-N 2.72Å; E511-R515 PolarHBondContact O-N 3.32Å; E511-R515 IonicContact OE2-CZ 3.48Å; E511-R515 IonicContact OE2-NH1 2.72Å; E511-R515 PolarHBondContact OE2-NH1 3.36Å; E511-R515 IonicContact OE2-NH2 3.33Å; E511-R515 PolarHBondContact OE2-NH2 3.46Å
512	E	57.5	Low	55.2	Low	130 Å²	130	101.3 Å²	101.3	61%	0.607	49%	0.492	S	S	*	.	H	α-helix	trans	-66.3	-39.9	-177.1	-59.3	-160.9	149.8	0	0	112	N514 R515 F516	E512-N514 VanDerWaalsContact C-N 3.29Å; E512-N514 PolarHBondContact O-N 3.3Å; E512-R515 PolarHBondContact O-N 3.2Å; E512-F516 WeakPolarHBondContact O-CB 3.44Å; E512-F516 PolarHBondContact O-N 3.28Å
513	N	60.2	Low	57.1	Low	62 Å²	62	89.6 Å²	89.6	33%	0.332	45%	0.449	S	S	.	.	H	α-helix	trans	-63.9	-34.2	175.6	-165.1	-20	0	0	0	111.9	E511 K517	E511-N513 PolarHBondContact O-N 2.98Å; N513-K517 WeakPolarHBondContact O-CD 3.46Å; N513-K517 VanDerWaalsContact O-CG 3.31Å; N513-K517 WeakPolarHBondContact O-CG 3.4Å; N513-K517 PolarHBondContact O-N 2.89Å; N513-K517 VanDerWaalsContact OD1-CE 3.22Å; N513-K517 WeakPolarHBondContact OD1-CE 3.39Å; N513-K517 PolarHBondContact OD1-NZ 3.19Å
514	N	64.1	Low	59.5	Low	74 Å²	74	79.8 Å²	79.8	40%	0.396	41%	0.407	S	S	.	.	H	α-helix	trans	-75.4	-42.9	175.2	-72.2	-29.4	0	0	0	112.4	L510 E511 E512 F516 K517 E518	L510-N514 PolarHBondContact O-ND2 2.83Å; L510-N514 VanDerWaalsContact O-ND2 3.09Å; E511-N514 PolarHBondContact O-N 2.72Å; E512-N514 VanDerWaalsContact C-N 3.29Å; E512-N514 PolarHBondContact O-N 3.3Å; N514-F516 VanDerWaalsContact C-N 3.31Å; N514-F516 PolarHBondContact O-N 3.02Å; N514-K517 PolarHBondContact O-N 3.18Å; N514-E518 WeakPolarHBondContact O-CG 3.44Å; N514-E518 PolarHBondContact O-N 2.69Å; N514-E518 VanDerWaalsContact O-N 3.14Å
515	R	67.7	Low	61.8	Low	123 Å²	123	75.6 Å²	75.6	46%	0.464	38%	0.377	S	S	.	.	H	α-helix	trans	-55.5	-46.2	171.5	-77	-170.3	-83.5	-90.3	1.8	111.4	E511 E512 K517 E518 D519	E511-R515 PolarHBondContact O-N 3.32Å; E511-R515 IonicContact OE2-CZ 3.48Å; E511-R515 IonicContact OE2-NH1 2.72Å; E511-R515 PolarHBondContact OE2-NH1 3.36Å; E511-R515 IonicContact OE2-NH2 3.33Å; E511-R515 PolarHBondContact OE2-NH2 3.46Å; E512-R515 PolarHBondContact O-N 3.2Å; R515-K517 PolarHBondContact O-N 3.38Å; R515-E518 PolarHBondContact O-N 2.95Å; R515-E518 VanDerWaalsContact O-N 3.15Å; R515-D519 PolarHBondContact O-N 3.02Å
516	F	68.3	Low	64	Low	22 Å²	22	71.2 Å²	71.2	10%	0.096	36%	0.356	C	S	.	.	H	α-helix	trans	-57.5	-43.1	176.9	172.5	-112	0	0	0	113.7	P455 F458 L459 F479 E512 N514 E518 D519 A520	P455-F516 HydrophobicContact CB-CD1 3.94Å; P455-F516 HydrophobicContact CB-CD2 3.53Å; P455-F516 HydrophobicContact CB-CE1 3.72Å; P455-F516 HydrophobicContact CB-CE2 3.3Å; P455-F516 HydrophobicContact CB-CG 3.85Å; P455-F516 HydrophobicContact CB-CZ 3.4Å; P455-F516 WeakPolarHBondContact O-CE2 3.35Å; F458-F516 HydrophobicContact CB-CZ 4.22Å; F458-F516 HydrophobicContact CD1-CE2 4.44Å; F458-F516 AromaticContact CD1-CZ 3.8Å; F458-F516 HydrophobicContact CD1-CZ 3.8Å; F458-F516 HydrophobicContact CG-CZ 4.38Å; L459-F516 HydrophobicContact CD1-CD2 3.66Å; L459-F516 HydrophobicContact CD1-CE2 3.72Å; L459-F516 HydrophobicContact CG-CD2 4.22Å; L459-F516 HydrophobicContact CG-CE2 3.78Å; F479-F516 HydrophobicContact CD1-CE1 4.33Å; E512-F516 WeakPolarHBondContact O-CB 3.44Å; E512-F516 PolarHBondContact O-N 3.28Å; N514-F516 VanDerWaalsContact C-N 3.31Å; N514-F516 PolarHBondContact O-N 3.02Å; F516-E518 VanDerWaalsContact C-N 3.32Å; F516-E518 PolarHBondContact O-N 2.87Å; F516-D519 PolarHBondContact O-N 3.33Å; F516-A520 WeakPolarHBondContact O-CB 3.24Å; F516-A520 PolarHBondContact O-N 3.1Å
517	K	71.7	Confident	65.6	Low	46 Å²	46	64.1 Å²	64.1	20%	0.2	32%	0.321	C	S	.	.	H	α-helix	trans	-62.6	-39.3	176.9	-74.4	165.5	-179.9	171.6	0	112.3	F479 N513 N514 R515 L521 L543	F479-K517 HydrophobicContact CD1-CG 3.96Å; F479-K517 HydrophobicContact CE1-CD 4.35Å; F479-K517 HydrophobicContact CE1-CG 3.61Å; F479-K517 HydrophobicContact CZ-CD 4.36Å; F479-K517 HydrophobicContact CZ-CG 4.02Å; N513-K517 WeakPolarHBondContact O-CD 3.46Å; N513-K517 VanDerWaalsContact O-CG 3.31Å; N513-K517 WeakPolarHBondContact O-CG 3.4Å; N513-K517 PolarHBondContact O-N 2.89Å; N513-K517 VanDerWaalsContact OD1-CE 3.22Å; N513-K517 WeakPolarHBondContact OD1-CE 3.39Å; N513-K517 PolarHBondContact OD1-NZ 3.19Å; N514-K517 PolarHBondContact O-N 3.18Å; R515-K517 PolarHBondContact O-N 3.38Å; K517-L521 PolarHBondContact O-N 2.87Å; K517-L543 HydrophobicContact CB-CD2 3.96Å; K517-L543 HydrophobicContact CD-CD2 3.94Å; K517-L543 HydrophobicContact CG-CD2 4.05Å
518	E	71.2	Confident	66.5	Low	61 Å²	61	56.4 Å²	56.4	29%	0.285	29%	0.294	S	S	.	.	H	α-helix	trans	-71.4	-43.4	179.2	-68	171	-147.9	0	0	111.3	N514 R515 F516 A520 L521 L522 K547	N514-E518 WeakPolarHBondContact O-CG 3.44Å; N514-E518 PolarHBondContact O-N 2.69Å; N514-E518 VanDerWaalsContact O-N 3.14Å; R515-E518 PolarHBondContact O-N 2.95Å; R515-E518 VanDerWaalsContact O-N 3.15Å; F516-E518 VanDerWaalsContact C-N 3.32Å; F516-E518 PolarHBondContact O-N 2.87Å; E518-A520 VanDerWaalsContact C-N 3.34Å; E518-A520 PolarHBondContact O-N 3.1Å; E518-L521 PolarHBondContact O-N 2.99Å; E518-L522 WeakPolarHBondContact O-CB 3.45Å; E518-L522 PolarHBondContact O-N 3.03Å; E518-K547 HydrophobicContact CG-CD 4.47Å; E518-K547 HydrophobicContact CG-CG 4.36Å; E518-K547 WeakPolarHBondContact OE1-CE 3.36Å; E518-K547 IonicContact OE1-NZ 3.22Å; E518-K547 PolarHBondContact OE1-NZ 3.33Å; E518-K547 WeakPolarHBondContact OE2-CE 3.46Å; E518-K547 IonicContact OE2-NZ 3.9Å; E518-K547 PolarHBondContact OE2-NZ 2.9Å; E518-K547 VanDerWaalsContact OE2-NZ 3.15Å
519	D	72.4	Confident	67.3	Low	79 Å²	79	57.4 Å²	57.4	42%	0.422	31%	0.309	S	S	.	.	H	α-helix	trans	-60.9	-40.2	172.8	-75.5	-32.3	0	0	0	111.9	L459 R515 F516 L522 A523	L459-D519 HydrophobicContact CD1-CB 4.06Å; L459-D519 HydrophobicContact CD2-CB 4.1Å; R515-D519 PolarHBondContact O-N 3.02Å; F516-D519 PolarHBondContact O-N 3.33Å; D519-L522 PolarHBondContact O-N 3.18Å; D519-A523 WeakPolarHBondContact O-CB 3.35Å; D519-A523 PolarHBondContact O-N 2.91Å
520	A	76.7	Confident	67.7	Low	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-41.3	178.5	0	0	0	0	0	112.7	F458 F516 E518 C524	F458-A520 HydrophobicContact CE1-CB 4.21Å; F516-A520 WeakPolarHBondContact O-CB 3.24Å; F516-A520 PolarHBondContact O-N 3.1Å; E518-A520 VanDerWaalsContact C-N 3.34Å; E518-A520 PolarHBondContact O-N 3.1Å; A520-C524 PolarHBondContact O-N 2.92Å; A520-C524 PolarHBondContact O-SG 3.29Å
521	L	78.8	Confident	68.2	Low	4 Å²	4	49 Å²	49	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-63.5	-47.2	171.6	-73.7	174.5	0	0	0	111.6	K517 E518 A523 C524 I525 L535 L538 L539 L543 L557	K517-L521 PolarHBondContact O-N 2.87Å; E518-L521 PolarHBondContact O-N 2.99Å; L521-A523 VanDerWaalsContact C-N 3.32Å; L521-A523 PolarHBondContact O-N 3.21Å; L521-C524 PolarHBondContact O-N 2.87Å; L521-I525 WeakPolarHBondContact O-CG1 3.19Å; L521-I525 PolarHBondContact O-N 3.37Å; L521-L535 HydrophobicContact CD2-CD1 3.65Å; L521-L538 HydrophobicContact CD2-CB 4.2Å; L521-L539 HydrophobicContact CD2-CD2 4.21Å; L521-L543 HydrophobicContact CD1-CB 4.06Å; L521-L543 HydrophobicContact CD1-CD1 3.84Å; L521-L543 HydrophobicContact CD2-CD1 3.91Å; L521-L543 HydrophobicContact CG-CD1 3.76Å; L521-L557 HydrophobicContact CB-CD1 4.41Å; L521-L557 HydrophobicContact CD1-CD1 3.98Å
522	L	78.7	Confident	69.1	Low	31 Å²	31	45 Å²	45	16%	0.162	26%	0.264	C	S	.	.	H	α-helix	trans	-60.8	-41.8	178.7	-178.1	58.7	0	0	0	111.2	E518 D519 I525 T526 T549 L560	E518-L522 WeakPolarHBondContact O-CB 3.45Å; E518-L522 PolarHBondContact O-N 3.03Å; D519-L522 PolarHBondContact O-N 3.18Å; L522-I525 CarbonylContact O-C 3.48Å; L522-I525 PolarHBondContact O-N 3.13Å; L522-I525 VanDerWaalsContact O-N 3.16Å; L522-T526 HydrophobicContact CD1-CG2 3.81Å; L522-T526 HydrophobicContact CG-CG2 4.32Å; L522-T526 WeakPolarHBondContact O-CB 3.47Å; L522-T526 WeakPolarHBondContact O-CG2 3.35Å; L522-T526 PolarHBondContact O-N 2.91Å; L522-T526 PolarHBondContact O-OG1 3.48Å; L522-T549 HydrophobicContact CD1-CG2 3.94Å; L522-L560 HydrophobicContact CD1-CD2 3.51Å
523	A	74.8	Confident	69.8	Low	6 Å²	6	45.1 Å²	45.1	5%	0.05	27%	0.268	C	S	.	.	H	α-helix	trans	-67.4	-32.5	177.1	0	0	0	0	0	112.7	L459 I462 D519 L521 T526 G527 R531	L459-A523 HydrophobicContact CD2-CB 3.77Å; I462-A523 HydrophobicContact CB-CB 4.45Å; I462-A523 VanDerWaalsContact CG2-C 3.45Å; I462-A523 HydrophobicContact CG2-CB 3.47Å; I462-A523 VanDerWaalsContact CG2-CB 3.47Å; D519-A523 WeakPolarHBondContact O-CB 3.35Å; D519-A523 PolarHBondContact O-N 2.91Å; L521-A523 VanDerWaalsContact C-N 3.32Å; L521-A523 PolarHBondContact O-N 3.21Å; A523-T526 WeakPolarHBondContact CA-OG1 3.47Å; A523-G527 PolarHBondContact O-N 2.84Å; A523-R531 PolarHBondContact O-NH1 3.35Å
524	C	78.8	Confident	70.6	Confident	3 Å²	3	42.6 Å²	42.6	2%	0.02	26%	0.255	C	S	.	.	H	α-helix	trans	-68.6	-35.3	169.8	-70.5	0	0	0	0	112.6	A520 L521 L535 R566	A520-C524 PolarHBondContact O-N 2.92Å; A520-C524 PolarHBondContact O-SG 3.29Å; L521-C524 PolarHBondContact O-N 2.87Å; C524-L535 HydrophobicContact CB-CD1 4.48Å; C524-R566 PolarHBondContact O-NH1 2.94Å
525	I	79.5	Confident	71.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-85	-15.5	-179.8	-66.7	161.2	0	0	0	112.4	L521 L522 L535 L557 L560 A561 L564 R566 L573	L521-I525 WeakPolarHBondContact O-CG1 3.19Å; L521-I525 PolarHBondContact O-N 3.37Å; L522-I525 CarbonylContact O-C 3.48Å; L522-I525 PolarHBondContact O-N 3.13Å; L522-I525 VanDerWaalsContact O-N 3.16Å; I525-L535 HydrophobicContact CD1-CD1 4.45Å; I525-L535 HydrophobicContact CD1-CD2 4.48Å; I525-L535 HydrophobicContact CG1-CD2 4.08Å; I525-L557 HydrophobicContact CD1-CB 3.98Å; I525-L557 HydrophobicContact CD1-CD1 4.42Å; I525-L557 HydrophobicContact CD1-CD2 3.94Å; I525-L557 HydrophobicContact CD1-CG 4.33Å; I525-L560 HydrophobicContact CG2-CB 4.41Å; I525-L560 HydrophobicContact CG2-CD2 3.94Å; I525-L560 HydrophobicContact CG2-CG 3.99Å; I525-A561 HydrophobicContact CG2-CB 4.15Å; I525-L564 HydrophobicContact CG2-CD1 4.49Å; I525-L564 VanDerWaalsContact O-CD1 3.22Å; I525-L564 WeakPolarHBondContact O-CD1 3.33Å; I525-R566 VanDerWaalsContact C-NH1 3.35Å; I525-R566 WeakPolarHBondContact O-CD 3.36Å; I525-R566 PolarHBondContact O-NE 2.84Å; I525-R566 PolarHBondContact O-NH1 3.17Å; I525-L573 HydrophobicContact CD1-CD1 3.98Å
526	T	77.3	Confident	72	Confident	55 Å²	55	36.3 Å²	36.3	34%	0.337	23%	0.23	S	C	.	.	H	α-helix	trans	-111	-37.1	-179.7	54.6	0	0	0	0	114.8	L522 A523 L560 L564 R566	L522-T526 HydrophobicContact CD1-CG2 3.81Å; L522-T526 HydrophobicContact CG-CG2 4.32Å; L522-T526 WeakPolarHBondContact O-CB 3.47Å; L522-T526 WeakPolarHBondContact O-CG2 3.35Å; L522-T526 PolarHBondContact O-N 2.91Å; L522-T526 PolarHBondContact O-OG1 3.48Å; A523-T526 WeakPolarHBondContact CA-OG1 3.47Å; T526-L560 HydrophobicContact CG2-CD2 4.3Å; T526-L564 HydrophobicContact CG2-CD1 4.39Å; T526-R566 VanDerWaalsContact C-NH2 3.31Å; T526-R566 PolarHBondContact O-NH2 3.29Å
527	G	66.2	Low	72.2	Confident	12 Å²	12	39.4 Å²	39.4	12%	0.124	24%	0.241	C	C	.	.	S	Bend	trans	-66.3	149.8	170.9	0	0	0	0	0	111.7	A523 R531 R566	A523-G527 PolarHBondContact O-N 2.84Å; G527-R531 PolarHBondContact O-NE 2.82Å; G527-R566 PolarHBondContact O-NH1 2.9Å; G527-R566 PolarHBondContact O-NH2 2.9Å
528	G	63.2	Low	72.5	Confident	23 Å²	23	37.2 Å²	37.2	24%	0.237	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-51.1	167.4	-159.9	0	0	0	0	0	120	R531	G528-R531 WeakPolarHBondContact O-CD 3.49Å; G528-R531 PolarHBondContact O-NE 2.94Å
529	A	55.7	Low	72.9	Confident	98 Å²	98	35 Å²	35	81%	0.81	22%	0.222	S	C	*	.	S	Bend	trans	-57	145.7	-173.1	0	0	0	0	0	114.7
530	G	54.5	Low	73.1	Confident	67 Å²	67	35.5 Å²	35.5	69%	0.691	24%	0.236	S	C	*	.			trans	118.1	25	171.2	0	0	0	0	0	117.1
531	R	61.9	Low	72.8	Confident	15 Å²	15	37.9 Å²	37.9	6%	0.057	25%	0.253	C	S	.	.			trans	-121.4	21.5	-163.9	-50.3	175.8	-175.2	-152.2	-10.1	118.7	I462 Q465 W467 A523 G527 G528 L533 V534 L535	I462-R531 PolarHBondContact O-NH1 3.21Å; I462-R531 PolarHBondContact O-NH2 2.89Å; Q465-R531 VanDerWaalsContact CD-NH2 3.3Å; Q465-R531 VanDerWaalsContact CG-NH2 3.3Å; W467-R531 HydrophobicContact CD2-CG 3.93Å; W467-R531 HydrophobicContact CE3-CB 4.29Å; W467-R531 HydrophobicContact CE3-CG 4.01Å; W467-R531 HydrophobicContact CH2-CG 4.13Å; W467-R531 HydrophobicContact CZ2-CG 4.03Å; W467-R531 HydrophobicContact CZ3-CB 4.28Å; W467-R531 HydrophobicContact CZ3-CG 4.07Å; A523-R531 PolarHBondContact O-NH1 3.35Å; G527-R531 PolarHBondContact O-NE 2.82Å; G528-R531 WeakPolarHBondContact O-CD 3.49Å; G528-R531 PolarHBondContact O-NE 2.94Å; R531-L533 VanDerWaalsContact C-N 3.33Å; R531-L533 PolarHBondContact O-N 3.37Å; R531-V534 PolarHBondContact O-N 2.82Å; R531-L535 PolarHBondContact O-N 2.92Å
532	P	71.3	Confident	72.4	Confident	35 Å²	35	40.9 Å²	40.9	23%	0.227	29%	0.285	C	S	.	.	H	α-helix	trans	-56.1	-47.4	-178.1	25.2	-33.2	0	0	0	111.3	V534 L535 D536 H568	P532-V534 PolarHBondContact O-N 3.1Å; P532-L535 CarbonylContact O-C 3.59Å; P532-L535 WeakPolarHBondContact O-CA 3.2Å; P532-L535 WeakPolarHBondContact O-CB 3.38Å; P532-L535 PolarHBondContact O-N 3.2Å; P532-D536 PolarHBondContact O-N 2.91Å; P532-D536 VanDerWaalsContact O-OD2 3.06Å; P532-H568 HydrophobicContact CB-CB 4.17Å; P532-H568 HydrophobicContact CG-CB 4.04Å
533	L	73.3	Confident	72.3	Confident	132 Å²	132	40.6 Å²	40.6	69%	0.691	28%	0.283	S	S	*	.	H	α-helix	trans	-56.3	-27.2	-174.8	-62.5	173.7	0	0	0	116.1	R531 D536 R537	R531-L533 VanDerWaalsContact C-N 3.33Å; R531-L533 PolarHBondContact O-N 3.37Å; L533-D536 WeakPolarHBondContact CA-OD2 3.45Å; L533-D536 PolarHBondContact N-OD2 2.88Å; L533-R537 VanDerWaalsContact O-CG 3.3Å; L533-R537 WeakPolarHBondContact O-CG 3.22Å; L533-R537 PolarHBondContact O-N 3.41Å
534	V	75.6	Confident	72.4	Confident	9 Å²	9	45.8 Å²	45.8	6%	0.055	31%	0.311	C	S	.	.	H	α-helix	trans	-87.3	-37.1	174.2	172	0	0	0	0	111.1	W467 V470 R531 P532 D536 R537 L538	W467-V534 HydrophobicContact CE3-CB 4.09Å; W467-V534 HydrophobicContact CE3-CG2 3.6Å; W467-V534 HydrophobicContact CZ3-CB 3.82Å; W467-V534 HydrophobicContact CZ3-CG1 3.99Å; W467-V534 HydrophobicContact CZ3-CG2 3.76Å; V470-V534 HydrophobicContact CB-CG2 4.35Å; V470-V534 HydrophobicContact CG1-CB 4.34Å; V470-V534 HydrophobicContact CG1-CG1 3.67Å; V470-V534 HydrophobicContact CG1-CG2 3.65Å; R531-V534 PolarHBondContact O-N 2.82Å; P532-V534 PolarHBondContact O-N 3.1Å; V534-D536 VanDerWaalsContact C-N 3.31Å; V534-R537 PolarHBondContact O-N 3.42Å; V534-L538 HydrophobicContact CG1-CD1 4.06Å; V534-L538 HydrophobicContact CG1-CG 4.42Å; V534-L538 WeakPolarHBondContact O-CB 3.39Å; V534-L538 WeakPolarHBondContact O-CG 3.31Å; V534-L538 PolarHBondContact O-N 3.43Å
535	L	81.9	Confident	72.5	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-62.7	-40.5	172	-175.4	55.6	0	0	0	110.8	L521 C524 I525 R531 P532 L538 L539 A569 A572 L573	L521-L535 HydrophobicContact CD2-CD1 3.65Å; C524-L535 HydrophobicContact CB-CD1 4.48Å; I525-L535 HydrophobicContact CD1-CD1 4.45Å; I525-L535 HydrophobicContact CD1-CD2 4.48Å; I525-L535 HydrophobicContact CG1-CD2 4.08Å; R531-L535 PolarHBondContact O-N 2.92Å; P532-L535 CarbonylContact O-C 3.59Å; P532-L535 WeakPolarHBondContact O-CA 3.2Å; P532-L535 WeakPolarHBondContact O-CB 3.38Å; P532-L535 PolarHBondContact O-N 3.2Å; L535-L538 PolarHBondContact O-N 2.98Å; L535-L539 HydrophobicContact CD1-CD1 3.94Å; L535-L539 HydrophobicContact CD1-CG 4.13Å; L535-L539 HydrophobicContact CG-CD1 3.82Å; L535-L539 HydrophobicContact CG-CG 4.44Å; L535-L539 WeakPolarHBondContact O-CB 3.33Å; L535-L539 WeakPolarHBondContact O-CG 3.46Å; L535-L539 PolarHBondContact O-N 2.9Å; L535-A569 HydrophobicContact CD2-CB 3.87Å; L535-A572 HydrophobicContact CB-CB 4.47Å; L535-A572 HydrophobicContact CD2-CB 4.01Å; L535-A572 HydrophobicContact CG-CB 4.13Å; L535-L573 HydrophobicContact CD2-CG 4.32Å
536	D	79.3	Confident	72.5	Confident	62 Å²	62	49.5 Å²	49.5	33%	0.332	33%	0.331	S	S	.	.	H	α-helix	trans	-59	-46.1	172.4	-61.2	-37.6	0	0	0	111.3	P532 L533 V534 L539 A540 A572	P532-D536 PolarHBondContact O-N 2.91Å; P532-D536 VanDerWaalsContact O-OD2 3.06Å; L533-D536 WeakPolarHBondContact CA-OD2 3.45Å; L533-D536 PolarHBondContact N-OD2 2.88Å; V534-D536 VanDerWaalsContact C-N 3.31Å; D536-L539 PolarHBondContact O-N 3.43Å; D536-A540 WeakPolarHBondContact O-CB 3.33Å; D536-A540 PolarHBondContact O-N 2.93Å; D536-A572 WeakPolarHBondContact OD1-CB 3.21Å
537	R	73.4	Confident	72.4	Confident	88 Å²	88	50.7 Å²	50.7	33%	0.332	33%	0.331	S	S	.	.	H	α-helix	trans	-63.9	-39	176.1	-78.8	178.7	-175.9	-158.8	5.6	112.7	A471 L478 L533 V534 S541	A471-R537 PolarHBondContact O-NH1 3.44Å; L478-R537 HydrophobicContact CD1-CB 4.03Å; L533-R537 VanDerWaalsContact O-CG 3.3Å; L533-R537 WeakPolarHBondContact O-CG 3.22Å; L533-R537 PolarHBondContact O-N 3.41Å; V534-R537 PolarHBondContact O-N 3.42Å; R537-S541 PolarHBondContact O-N 3.39Å
538	L	77.1	Confident	72.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-73.7	-35.2	177.7	-73.5	171.9	0	0	0	112.6	F458 F479 L521 V534 L535 S541 L543	F458-L538 HydrophobicContact CE1-CD2 4.29Å; F458-L538 HydrophobicContact CZ-CD2 4.19Å; F479-L538 HydrophobicContact CE1-CD2 4.32Å; L521-L538 HydrophobicContact CD2-CB 4.2Å; V534-L538 HydrophobicContact CG1-CD1 4.06Å; V534-L538 HydrophobicContact CG1-CG 4.42Å; V534-L538 WeakPolarHBondContact O-CB 3.39Å; V534-L538 WeakPolarHBondContact O-CG 3.31Å; V534-L538 PolarHBondContact O-N 3.43Å; L535-L538 PolarHBondContact O-N 2.98Å; L538-S541 PolarHBondContact O-N 3.13Å; L538-S541 PolarHBondContact O-OG 3.41Å; L538-L543 HydrophobicContact CB-CD1 4.22Å; L538-L543 WeakPolarHBondContact O-CD1 3.36Å; L538-L543 VanDerWaalsContact O-CG 3.3Å; L538-L543 WeakPolarHBondContact O-CG 3.43Å
539	L	80.7	Confident	73.2	Confident	15 Å²	15	52.3 Å²	52.3	8%	0.079	33%	0.334	C	S	.	.	H	α-helix	trans	-73.4	-35.1	174.4	-67.9	168	0	0	0	110.9	L521 L535 D536 S541 G542 P545 L573 A576	L521-L539 HydrophobicContact CD2-CD2 4.21Å; L535-L539 HydrophobicContact CD1-CD1 3.94Å; L535-L539 HydrophobicContact CD1-CG 4.13Å; L535-L539 HydrophobicContact CG-CD1 3.82Å; L535-L539 HydrophobicContact CG-CG 4.44Å; L535-L539 WeakPolarHBondContact O-CB 3.33Å; L535-L539 WeakPolarHBondContact O-CG 3.46Å; L535-L539 PolarHBondContact O-N 2.9Å; D536-L539 PolarHBondContact O-N 3.43Å; L539-S541 PolarHBondContact O-N 2.9Å; L539-G542 PolarHBondContact O-N 2.86Å; L539-G542 VanDerWaalsContact O-N 3.11Å; L539-P545 HydrophobicContact CD2-CB 4.04Å; L539-L573 HydrophobicContact CD1-CD2 3.97Å; L539-L573 HydrophobicContact CD1-CG 4.47Å; L539-L573 HydrophobicContact CD2-CD2 4.3Å; L539-A576 HydrophobicContact CB-CB 3.9Å; L539-A576 HydrophobicContact CD1-CB 3.72Å; L539-A576 HydrophobicContact CD2-CB 4.45Å; L539-A576 HydrophobicContact CG-CB 4.23Å
540	A	77.1	Confident	73.6	Confident	88 Å²	88	51.9 Å²	51.9	73%	0.727	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.5	174.1	0	0	0	0	0	114.4	D536 G542	D536-A540 WeakPolarHBondContact O-CB 3.33Å; D536-A540 PolarHBondContact O-N 2.93Å; A540-G542 PolarHBondContact O-N 2.79Å
541	S	70.2	Confident	73.7	Confident	51 Å²	51	52.8 Å²	52.8	36%	0.357	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	10.3	172.1	68.1	0	0	0	0	114	F479 R537 L538 L539	F479-S541 WeakPolarHBondContact CE2-OG 3.27Å; F479-S541 WeakPolarHBondContact CZ-OG 3.43Å; R537-S541 PolarHBondContact O-N 3.39Å; L538-S541 PolarHBondContact O-N 3.13Å; L538-S541 PolarHBondContact O-OG 3.41Å; L539-S541 PolarHBondContact O-N 2.9Å
542	G	70.4	Confident	73.4	Confident	67 Å²	67	56.2 Å²	56.2	69%	0.691	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	21.4	171.7	0	0	0	0	0	115.1	L539 A540	L539-G542 PolarHBondContact O-N 2.86Å; L539-G542 VanDerWaalsContact O-N 3.11Å; A540-G542 PolarHBondContact O-N 2.79Å
543	L	75.7	Confident	72.9	Confident	24 Å²	24	55.9 Å²	55.9	13%	0.126	33%	0.327	C	S	.	.			trans	-79.1	138.3	175.4	-60.5	-177.7	0	0	0	112.1	F479 K517 L521 L538 P545	F479-L543 HydrophobicContact CZ-CD1 4Å; F479-L543 HydrophobicContact CZ-CD2 3.91Å; F479-L543 HydrophobicContact CZ-CG 4.08Å; K517-L543 HydrophobicContact CB-CD2 3.96Å; K517-L543 HydrophobicContact CD-CD2 3.94Å; K517-L543 HydrophobicContact CG-CD2 4.05Å; L521-L543 HydrophobicContact CD1-CB 4.06Å; L521-L543 HydrophobicContact CD1-CD1 3.84Å; L521-L543 HydrophobicContact CD2-CD1 3.91Å; L521-L543 HydrophobicContact CG-CD1 3.76Å; L538-L543 HydrophobicContact CB-CD1 4.22Å; L538-L543 WeakPolarHBondContact O-CD1 3.36Å; L538-L543 VanDerWaalsContact O-CG 3.3Å; L538-L543 WeakPolarHBondContact O-CG 3.43Å; L543-P545 VanDerWaalsContact O-CD 3.23Å; L543-P545 WeakPolarHBondContact O-CD 3.41Å
544	D	77.9	Confident	73	Confident	116 Å²	116	55.6 Å²	55.6	62%	0.62	32%	0.32	S	S	*	.			trans	-64.5	111.4	-179.1	-85.1	-45.5	0	0	0	113.1	N546 K547	D544-N546 PolarHBondContact O-N 3.17Å; D544-N546 VanDerWaalsContact O-N 3.09Å; D544-K547 PolarHBondContact O-N 2.76Å
545	P	79.5	Confident	73.3	Confident	17 Å²	17	55.4 Å²	55.4	11%	0.11	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-8.1	176.9	31.7	-37.1	0	0	0	112.8	L539 L543 L573 A576 A578	L539-P545 HydrophobicContact CD2-CB 4.04Å; L543-P545 VanDerWaalsContact O-CD 3.23Å; L543-P545 WeakPolarHBondContact O-CD 3.41Å; P545-L573 HydrophobicContact CB-CD2 4.2Å; P545-A576 HydrophobicContact CB-CB 4.17Å; P545-A576 HydrophobicContact CG-CB 4.42Å; P545-A578 HydrophobicContact CB-CB 4.21Å
546	N	80.2	Confident	73.5	Confident	63 Å²	63	56.3 Å²	56.3	34%	0.337	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	8.9	-180	-68.9	-69.7	0	0	0	113.1	D544 G577 K579	D544-N546 PolarHBondContact O-N 3.17Å; D544-N546 VanDerWaalsContact O-N 3.09Å; N546-G577 PolarHBondContact ND2-O 2.83Å; N546-K579 WeakPolarHBondContact OD1-CB 3.22Å; N546-K579 VanDerWaalsContact OD1-CG 3.31Å; N546-K579 WeakPolarHBondContact OD1-CG 3.35Å; N546-K579 PolarHBondContact OD1-N 2.96Å
547	K	76.2	Confident	73.8	Confident	80 Å²	80	53.6 Å²	53.6	35%	0.348	31%	0.31	S	S	.	.			trans	-59.1	151.4	175.9	-165.7	76.2	-165	-147.9	0	111	E518 D544 L557	E518-K547 HydrophobicContact CG-CD 4.47Å; E518-K547 HydrophobicContact CG-CG 4.36Å; E518-K547 WeakPolarHBondContact OE1-CE 3.36Å; E518-K547 IonicContact OE1-NZ 3.22Å; E518-K547 PolarHBondContact OE1-NZ 3.33Å; E518-K547 WeakPolarHBondContact OE2-CE 3.46Å; E518-K547 IonicContact OE2-NZ 3.9Å; E518-K547 PolarHBondContact OE2-NZ 2.9Å; E518-K547 VanDerWaalsContact OE2-NZ 3.15Å; D544-K547 PolarHBondContact O-N 2.76Å; K547-L557 HydrophobicContact CB-CD1 4.02Å; K547-L557 HydrophobicContact CB-CG 4.44Å; K547-L557 PolarHBondContact O-N 3.08Å
548	V	75.9	Confident	74.5	Confident	51 Å²	51	49.6 Å²	49.6	31%	0.309	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.6	177.2	174.9	0	0	0	0	108.4	K554 W555	V548-K554 VanDerWaalsContact CG1-C 3.43Å; V548-K554 HydrophobicContact CG1-CB 3.62Å; V548-K554 HydrophobicContact CG1-CG 4.28Å; V548-W555 CarbonylContact C-O 3.56Å; V548-W555 WeakPolarHBondContact CA-O 3.44Å
549	T	70.3	Confident	75	Confident	18 Å²	18	49.6 Å²	49.6	11%	0.11	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	124.1	179.1	60.2	0	0	0	0	111.1	L522 S553 K554 W555 L557 L560	L522-T549 HydrophobicContact CD1-CG2 3.94Å; T549-S553 CarbonylContact O-C 3.47Å; T549-S553 PolarHBondContact OG1-O 3.46Å; T549-K554 WeakPolarHBondContact O-CA 3.2Å; T549-W555 PolarHBondContact N-O 3.23Å; T549-W555 PolarHBondContact OG1-N 2.9Å; T549-W555 PolarHBondContact OG1-O 2.98Å; T549-L557 HydrophobicContact CG2-CD2 3.84Å; T549-L560 HydrophobicContact CG2-CD2 4.25Å
550	E	64.1	Low	75.3	Confident	90 Å²	90	49.2 Å²	49.2	42%	0.421	29%	0.293	S	S	.	.			trans	-103.5	166.4	168.5	-65.9	-64.1	178.4	0	0	108.8	K554	E550-K554 VanDerWaalsContact OE1-CE 3.31Å; E550-K554 WeakPolarHBondContact OE1-CE 3.24Å; E550-K554 IonicContact OE1-NZ 2.7Å; E550-K554 PolarHBondContact OE1-NZ 3.43Å; E550-K554 IonicContact OE2-NZ 2.7Å
551	P	56.1	Low	75.8	Confident	85 Å²	85	45 Å²	45	55%	0.552	26%	0.259	S	S	*	.	S	Bend	cis	-100	-17.4	4.6	37	-33.6	0	0	0	115.7
552	N	55	Low	76.8	Confident	88 Å²	88	42.8 Å²	42.8	47%	0.471	24%	0.243	S	C	.	.	S	Bend	trans	-105.4	-9.5	-163.7	-73.4	-9.1	0	0	0	115	N711	N552-N711 PolarHBondContact ND2-OD1 3.34Å; N552-N711 VanDerWaalsContact ND2-OD1 3.12Å
553	S	61.3	Low	77.6	Confident	28 Å²	28	41.5 Å²	41.5	20%	0.196	22%	0.223	C	C	.	.			trans	-162.3	105.1	-173.8	58	0	0	0	0	110.4	T549 W555 N714	T549-S553 CarbonylContact O-C 3.47Å; T549-S553 PolarHBondContact OG1-O 3.46Å; S553-W555 PolarHBondContact O-N 3.01Å; S553-N714 WeakPolarHBondContact CB-OD1 3.4Å
554	K	76.2	Confident	78	Confident	126 Å²	126	44 Å²	44	55%	0.548	24%	0.236	S	C	.	.			trans	-74.4	62	-170.5	-63.1	-167.1	-175.5	-122.8	0	113.7	V548 T549 E550 P585	V548-K554 VanDerWaalsContact CG1-C 3.43Å; V548-K554 HydrophobicContact CG1-CB 3.62Å; V548-K554 HydrophobicContact CG1-CG 4.28Å; T549-K554 WeakPolarHBondContact O-CA 3.2Å; E550-K554 VanDerWaalsContact OE1-CE 3.31Å; E550-K554 WeakPolarHBondContact OE1-CE 3.24Å; E550-K554 IonicContact OE1-NZ 2.7Å; E550-K554 PolarHBondContact OE1-NZ 3.43Å; E550-K554 IonicContact OE2-NZ 2.7Å; K554-P585 HydrophobicContact CB-CB 4.29Å; K554-P585 WeakPolarHBondContact O-CG 3.48Å
555	W	80.3	Confident	78.4	Confident	4 Å²	4	40.6 Å²	40.6	2%	0.015	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	128.3	177.7	-71.1	86.2	0	0	0	111.2	V548 T549 S553 A559 L560 C563 E584 P585 N586 L595 I717	V548-W555 CarbonylContact C-O 3.56Å; V548-W555 WeakPolarHBondContact CA-O 3.44Å; T549-W555 PolarHBondContact N-O 3.23Å; T549-W555 PolarHBondContact OG1-N 2.9Å; T549-W555 PolarHBondContact OG1-O 2.98Å; S553-W555 PolarHBondContact O-N 3.01Å; W555-A559 HydrophobicContact CE3-CB 3.8Å; W555-A559 HydrophobicContact CZ3-CB 4.24Å; W555-L560 HydrophobicContact CB-CB 4.41Å; W555-C563 VanDerWaalsContact CH2-SG 3.6Å; W555-C563 HydrophobicContact CZ3-CB 4.42Å; W555-C563 WeakPolarHBondContact CZ3-SG 3.39Å; W555-E584 HydrophobicContact CE3-CB 4.21Å; W555-E584 HydrophobicContact CH2-CB 3.78Å; W555-E584 HydrophobicContact CZ3-CB 3.6Å; W555-P585 HydrophobicContact CD2-CG 4Å; W555-P585 HydrophobicContact CG-CG 3.91Å; W555-N586 WeakPolarHBondContact CH2-ND2 3.3Å; W555-N586 WeakPolarHBondContact CZ2-ND2 3.48Å; W555-L595 HydrophobicContact CZ3-CD1 3.92Å; W555-L595 HydrophobicContact CZ3-CD2 4.48Å; W555-I717 HydrophobicContact CH2-CG2 4.2Å; W555-I717 HydrophobicContact CZ2-CG2 3.78Å
556	P	86.3	Confident	78.8	Confident	22 Å²	22	41.9 Å²	41.9	14%	0.143	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	139	160.3	-22.7	33.6	0	0	0	110.5	L558 A559 L560 C582 V583	P556-L558 PolarHBondContact O-N 2.69Å; P556-L558 VanDerWaalsContact O-N 3.11Å; P556-A559 HydrophobicContact CB-CB 4.21Å; P556-A559 HydrophobicContact CG-CB 4.35Å; P556-A559 WeakPolarHBondContact O-CB 3.4Å; P556-A559 PolarHBondContact O-N 3.24Å; P556-L560 PolarHBondContact O-N 2.96Å; P556-C582 HydrophobicContact CB-CB 3.82Å; P556-C582 HydrophobicContact CG-CB 3.92Å; P556-V583 WeakPolarHBondContact CD-O 3.27Å; P556-V583 WeakPolarHBondContact CG-O 3.48Å
557	L	85.6	Confident	79.2	Confident	5 Å²	5	41 Å²	41	3%	0.026	23%	0.227	C	C	.	.	H	α-helix	trans	-51.6	-38.2	-179.9	-69.1	177.8	0	0	0	113.1	L521 I525 K547 T549 L560 A561 L573	L521-L557 HydrophobicContact CB-CD1 4.41Å; L521-L557 HydrophobicContact CD1-CD1 3.98Å; I525-L557 HydrophobicContact CD1-CB 3.98Å; I525-L557 HydrophobicContact CD1-CD1 4.42Å; I525-L557 HydrophobicContact CD1-CD2 3.94Å; I525-L557 HydrophobicContact CD1-CG 4.33Å; K547-L557 HydrophobicContact CB-CD1 4.02Å; K547-L557 HydrophobicContact CB-CG 4.44Å; K547-L557 PolarHBondContact O-N 3.08Å; T549-L557 HydrophobicContact CG2-CD2 3.84Å; L557-L560 PolarHBondContact O-N 2.83Å; L557-A561 PolarHBondContact O-N 3.16Å; L557-L573 HydrophobicContact CB-CD1 4.22Å; L557-L573 HydrophobicContact CB-CD2 4.25Å
558	L	88.2	Confident	79.8	Confident	3 Å²	3	43 Å²	43	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-65.8	-42.8	175.8	178.2	62.5	0	0	0	112.7	P556 L560 A561 V562 A570 L573 L574 A578 L608	P556-L558 PolarHBondContact O-N 2.69Å; P556-L558 VanDerWaalsContact O-N 3.11Å; L558-L560 VanDerWaalsContact C-N 3.32Å; L558-L560 PolarHBondContact O-N 3.29Å; L558-A561 PolarHBondContact O-N 2.99Å; L558-V562 HydrophobicContact CD1-CG2 4.41Å; L558-V562 VanDerWaalsContact O-CG2 3.31Å; L558-V562 WeakPolarHBondContact O-CG2 3.46Å; L558-V562 PolarHBondContact O-N 3.13Å; L558-A570 HydrophobicContact CD1-CB 3.83Å; L558-L573 HydrophobicContact CB-CD1 4.42Å; L558-L573 HydrophobicContact CD1-CB 4.34Å; L558-L574 HydrophobicContact CD1-CD1 4.22Å; L558-L574 HydrophobicContact CD1-CD2 4.33Å; L558-L574 HydrophobicContact CD1-CG 3.92Å; L558-L574 HydrophobicContact CD2-CD2 3.64Å; L558-L574 HydrophobicContact CD2-CG 4.16Å; L558-A578 HydrophobicContact CB-CB 4.25Å; L558-A578 HydrophobicContact CD2-CB 4.05Å; L558-L608 HydrophobicContact CD2-CD2 4.48Å
559	A	88.4	Confident	80.4	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-37.4	177.9	0	0	0	0	0	111.4	W555 P556 V562 C563 L595	W555-A559 HydrophobicContact CE3-CB 3.8Å; W555-A559 HydrophobicContact CZ3-CB 4.24Å; P556-A559 HydrophobicContact CB-CB 4.21Å; P556-A559 HydrophobicContact CG-CB 4.35Å; P556-A559 WeakPolarHBondContact O-CB 3.4Å; P556-A559 PolarHBondContact O-N 3.24Å; A559-V562 PolarHBondContact O-N 3.3Å; A559-C563 WeakPolarHBondContact O-CB 3.2Å; A559-C563 PolarHBondContact O-N 3.03Å; A559-L595 HydrophobicContact CB-CD1 3.92Å
560	L	86.1	Confident	81.3	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.037	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-45.6	172.3	-177.5	63.7	0	0	0	111.7	L522 I525 T526 T549 W555 P556 L557 L558 V562 C563 L564 I717	L522-L560 HydrophobicContact CD1-CD2 3.51Å; I525-L560 HydrophobicContact CG2-CB 4.41Å; I525-L560 HydrophobicContact CG2-CD2 3.94Å; I525-L560 HydrophobicContact CG2-CG 3.99Å; T526-L560 HydrophobicContact CG2-CD2 4.3Å; T549-L560 HydrophobicContact CG2-CD2 4.25Å; W555-L560 HydrophobicContact CB-CB 4.41Å; P556-L560 PolarHBondContact O-N 2.96Å; L557-L560 PolarHBondContact O-N 2.83Å; L558-L560 VanDerWaalsContact C-N 3.32Å; L558-L560 PolarHBondContact O-N 3.29Å; L560-V562 VanDerWaalsContact C-N 3.3Å; L560-V562 PolarHBondContact O-N 3.33Å; L560-C563 PolarHBondContact O-N 3.16Å; L560-L564 HydrophobicContact CD1-CD1 4Å; L560-L564 HydrophobicContact CD1-CG 4.33Å; L560-L564 HydrophobicContact CG-CD1 3.99Å; L560-L564 WeakPolarHBondContact O-CB 3.39Å; L560-L564 VanDerWaalsContact O-CG 3.31Å; L560-L564 WeakPolarHBondContact O-CG 3.48Å; L560-L564 PolarHBondContact O-N 3.23Å; L560-I717 HydrophobicContact CD1-CD1 4.11Å
561	A	88.3	Confident	82.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.3	-38.7	176.5	0	0	0	0	0	112.4	I525 L557 L558 L564 G565 R566 A569 A570 L573	I525-A561 HydrophobicContact CG2-CB 4.15Å; L557-A561 PolarHBondContact O-N 3.16Å; L558-A561 PolarHBondContact O-N 2.99Å; A561-L564 PolarHBondContact O-N 3.24Å; A561-G565 PolarHBondContact O-N 3.14Å; A561-R566 WeakPolarHBondContact O-CB 3.16Å; A561-R566 PolarHBondContact O-N 3.28Å; A561-A569 HydrophobicContact CB-CB 4.48Å; A561-A570 HydrophobicContact CB-CB 4.32Å; A561-L573 HydrophobicContact CB-CD1 4.03Å
562	V	90.2	Very high	84	Confident	4 Å²	4	35.4 Å²	35.4	2%	0.024	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-48.6	174.5	173.2	0	0	0	0	111.6	L558 A559 L560 L564 G565 A570 A592 L595 A596 M604 L608	L558-V562 HydrophobicContact CD1-CG2 4.41Å; L558-V562 VanDerWaalsContact O-CG2 3.31Å; L558-V562 WeakPolarHBondContact O-CG2 3.46Å; L558-V562 PolarHBondContact O-N 3.13Å; A559-V562 PolarHBondContact O-N 3.3Å; L560-V562 VanDerWaalsContact C-N 3.3Å; L560-V562 PolarHBondContact O-N 3.33Å; V562-L564 PolarHBondContact O-N 3.31Å; V562-L564 VanDerWaalsContact O-N 3.16Å; V562-G565 PolarHBondContact O-N 3.13Å; V562-A570 HydrophobicContact CG2-CB 4.4Å; V562-A592 HydrophobicContact CG2-CB 4.32Å; V562-L595 HydrophobicContact CG1-CB 3.67Å; V562-A596 HydrophobicContact CG1-CB 4.15Å; V562-M604 HydrophobicContact CB-SD 4.5Å; V562-M604 HydrophobicContact CG1-CG 4.1Å; V562-M604 HydrophobicContact CG2-CG 4.11Å; V562-M604 HydrophobicContact CG2-SD 3.81Å; V562-L608 HydrophobicContact CG2-CD1 4.17Å
563	C	86.8	Confident	85.5	Confident	41 Å²	41	31.2 Å²	31.2	28%	0.277	17%	0.17	S	C	.	.	H	α-helix	trans	-60	-24.7	177	-90.9	0	0	0	0	114	W555 A559 L560	W555-C563 VanDerWaalsContact CH2-SG 3.6Å; W555-C563 HydrophobicContact CZ3-CB 4.42Å; W555-C563 WeakPolarHBondContact CZ3-SG 3.39Å; A559-C563 WeakPolarHBondContact O-CB 3.2Å; A559-C563 PolarHBondContact O-N 3.03Å; L560-C563 PolarHBondContact O-N 3.16Å
564	L	85	Confident	86.8	Confident	75 Å²	75	30 Å²	30	39%	0.393	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	4	176.1	-64.8	173.4	0	0	0	113.6	I525 T526 L560 A561 V562 R566	I525-L564 HydrophobicContact CG2-CD1 4.49Å; I525-L564 VanDerWaalsContact O-CD1 3.22Å; I525-L564 WeakPolarHBondContact O-CD1 3.33Å; T526-L564 HydrophobicContact CG2-CD1 4.39Å; L560-L564 HydrophobicContact CD1-CD1 4Å; L560-L564 HydrophobicContact CD1-CG 4.33Å; L560-L564 HydrophobicContact CG-CD1 3.99Å; L560-L564 WeakPolarHBondContact O-CB 3.39Å; L560-L564 VanDerWaalsContact O-CG 3.31Å; L560-L564 WeakPolarHBondContact O-CG 3.48Å; L560-L564 PolarHBondContact O-N 3.23Å; A561-L564 PolarHBondContact O-N 3.24Å; V562-L564 PolarHBondContact O-N 3.31Å; V562-L564 VanDerWaalsContact O-N 3.16Å; L564-R566 VanDerWaalsContact C-N 3.34Å; L564-R566 HydrophobicContact CB-CG 3.8Å; L564-R566 WeakPolarHBondContact O-CG 3.33Å; L564-R566 PolarHBondContact O-N 2.8Å
565	G	86.8	Confident	87.2	Confident	46 Å²	46	28.8 Å²	28.8	47%	0.474	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	26.2	179.1	0	0	0	0	0	114.4	A561 V562 L567	A561-G565 PolarHBondContact O-N 3.14Å; V562-G565 PolarHBondContact O-N 3.13Å; G565-L567 PolarHBondContact O-N 3.37Å
566	R	87.3	Confident	87.3	Confident	43 Å²	43	30.2 Å²	30.2	16%	0.162	17%	0.173	C	C	.	.			trans	-95.6	66.8	-167	-61.8	177.1	166.7	-121	-3	112.9	C524 I525 T526 G527 A561 L564 H568 A569 A570	C524-R566 PolarHBondContact O-NH1 2.94Å; I525-R566 VanDerWaalsContact C-NH1 3.35Å; I525-R566 WeakPolarHBondContact O-CD 3.36Å; I525-R566 PolarHBondContact O-NE 2.84Å; I525-R566 PolarHBondContact O-NH1 3.17Å; T526-R566 VanDerWaalsContact C-NH2 3.31Å; T526-R566 PolarHBondContact O-NH2 3.29Å; G527-R566 PolarHBondContact O-NH1 2.9Å; G527-R566 PolarHBondContact O-NH2 2.9Å; A561-R566 WeakPolarHBondContact O-CB 3.16Å; A561-R566 PolarHBondContact O-N 3.28Å; L564-R566 VanDerWaalsContact C-N 3.34Å; L564-R566 HydrophobicContact CB-CG 3.8Å; L564-R566 WeakPolarHBondContact O-CG 3.33Å; L564-R566 PolarHBondContact O-N 2.8Å; R566-H568 VanDerWaalsContact C-N 3.3Å; R566-H568 PolarHBondContact O-N 2.89Å; R566-H568 VanDerWaalsContact O-N 3.12Å; R566-A569 HydrophobicContact CB-CB 3.88Å; R566-A569 PolarHBondContact O-N 2.97Å; R566-A570 PolarHBondContact O-N 3.27Å
567	L	89.3	Confident	87	Confident	45 Å²	45	30.2 Å²	30.2	24%	0.236	18%	0.177	C	C	.	.	H	α-helix	trans	-41	-53.4	-176.8	-173.3	66.4	0	0	0	113.6	G565 A569 A570 Q571 D603 M604 M607	G565-L567 PolarHBondContact O-N 3.37Å; L567-A569 PolarHBondContact O-N 3.38Å; L567-A570 PolarHBondContact O-N 2.82Å; L567-Q571 WeakPolarHBondContact O-CB 3.44Å; L567-Q571 PolarHBondContact O-N 2.73Å; L567-D603 HydrophobicContact CD1-CB 4.16Å; L567-D603 HydrophobicContact CD2-CB 3.93Å; L567-M604 HydrophobicContact CB-CE 4.45Å; L567-M604 HydrophobicContact CD1-CB 4.25Å; L567-M604 HydrophobicContact CD1-SD 4.29Å; L567-M607 HydrophobicContact CD1-CB 4.27Å; L567-M607 HydrophobicContact CD1-CG 3.8Å
568	H	88.3	Confident	87	Confident	121 Å²	121	30 Å²	30	56%	0.56	18%	0.176	S	C	*	.	H	α-helix	trans	-68.4	-30	-178.7	-61.6	95.4	0	0	0	114.3	P532 R566 A572	P532-H568 HydrophobicContact CB-CB 4.17Å; P532-H568 HydrophobicContact CG-CB 4.04Å; R566-H568 VanDerWaalsContact C-N 3.3Å; R566-H568 PolarHBondContact O-N 2.89Å; R566-H568 VanDerWaalsContact O-N 3.12Å; H568-A572 PolarHBondContact O-N 2.94Å
569	A	87.8	Confident	86.8	Confident	11 Å²	11	34.4 Å²	34.4	9%	0.091	20%	0.195	C	C	.	.	H	α-helix	trans	-80.1	-35.9	176.6	0	0	0	0	0	111.5	L535 A561 R566 L567 Q571 A572 L573	L535-A569 HydrophobicContact CD2-CB 3.87Å; A561-A569 HydrophobicContact CB-CB 4.48Å; R566-A569 HydrophobicContact CB-CB 3.88Å; R566-A569 PolarHBondContact O-N 2.97Å; L567-A569 PolarHBondContact O-N 3.38Å; A569-Q571 VanDerWaalsContact C-N 3.31Å; A569-A572 PolarHBondContact O-N 3.34Å; A569-L573 WeakPolarHBondContact O-CG 3.34Å; A569-L573 PolarHBondContact O-N 2.82Å; A569-L573 VanDerWaalsContact O-N 3.08Å
570	A	90.4	Very high	86.6	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-62.4	-40.8	168.9	0	0	0	0	0	110.8	L558 A561 V562 R566 L567 L573 L574 M604	L558-A570 HydrophobicContact CD1-CB 3.83Å; A561-A570 HydrophobicContact CB-CB 4.32Å; V562-A570 HydrophobicContact CG2-CB 4.4Å; R566-A570 PolarHBondContact O-N 3.27Å; L567-A570 PolarHBondContact O-N 2.82Å; A570-L573 PolarHBondContact O-N 3.38Å; A570-L574 WeakPolarHBondContact O-CB 3.31Å; A570-L574 WeakPolarHBondContact O-CD1 3.24Å; A570-L574 WeakPolarHBondContact O-CG 3.47Å; A570-L574 PolarHBondContact O-N 2.93Å; A570-M604 HydrophobicContact CB-CE 4.33Å; A570-M604 HydrophobicContact CB-SD 3.56Å; A570-M604 VanDerWaalsContact CB-SD 3.56Å
571	Q	88.8	Confident	86.5	Confident	71 Å²	71	35.4 Å²	35.4	33%	0.332	20%	0.201	S	C	.	.	H	α-helix	trans	-59.2	-53.6	172.3	-179.4	176.3	-8.7	0	0	112	L567 A569 L573 L574 D575 M607	L567-Q571 WeakPolarHBondContact O-CB 3.44Å; L567-Q571 PolarHBondContact O-N 2.73Å; A569-Q571 VanDerWaalsContact C-N 3.31Å; Q571-L573 VanDerWaalsContact C-N 3.27Å; Q571-L573 PolarHBondContact O-N 2.76Å; Q571-L574 CarbonylContact O-C 3.49Å; Q571-L574 PolarHBondContact O-N 2.67Å; Q571-D575 VanDerWaalsContact CG-OD2 3.26Å; Q571-D575 WeakPolarHBondContact CG-OD2 3.37Å; Q571-D575 PolarHBondContact NE2-OD2 2.86Å; Q571-D575 WeakPolarHBondContact O-CB 3.08Å; Q571-D575 PolarHBondContact O-N 3.2Å; Q571-M607 HydrophobicContact CB-CE 3.99Å; Q571-M607 HydrophobicContact CG-CE 3.69Å
572	A	86.5	Confident	86.4	Confident	3 Å²	3	36.1 Å²	36.1	3%	0.025	21%	0.205	C	C	.	.	H	α-helix	trans	-51.6	-45.3	177.7	0	0	0	0	0	112.4	L535 D536 H568 A569 A576	L535-A572 HydrophobicContact CB-CB 4.47Å; L535-A572 HydrophobicContact CD2-CB 4.01Å; L535-A572 HydrophobicContact CG-CB 4.13Å; D536-A572 WeakPolarHBondContact OD1-CB 3.21Å; H568-A572 PolarHBondContact O-N 2.94Å; A569-A572 PolarHBondContact O-N 3.34Å; A572-A576 VanDerWaalsContact O-CB 3.29Å; A572-A576 WeakPolarHBondContact O-CB 3.32Å; A572-A576 PolarHBondContact O-N 3.05Å
573	L	87.9	Confident	86.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-43.1	175.2	-71.4	165.2	0	0	0	112.6	I525 L535 L539 P545 L557 L558 A561 A569 A570 Q571 A576 G577 A578	I525-L573 HydrophobicContact CD1-CD1 3.98Å; L535-L573 HydrophobicContact CD2-CG 4.32Å; L539-L573 HydrophobicContact CD1-CD2 3.97Å; L539-L573 HydrophobicContact CD1-CG 4.47Å; L539-L573 HydrophobicContact CD2-CD2 4.3Å; P545-L573 HydrophobicContact CB-CD2 4.2Å; L557-L573 HydrophobicContact CB-CD1 4.22Å; L557-L573 HydrophobicContact CB-CD2 4.25Å; L558-L573 HydrophobicContact CB-CD1 4.42Å; L558-L573 HydrophobicContact CD1-CB 4.34Å; A561-L573 HydrophobicContact CB-CD1 4.03Å; A569-L573 WeakPolarHBondContact O-CG 3.34Å; A569-L573 PolarHBondContact O-N 2.82Å; A569-L573 VanDerWaalsContact O-N 3.08Å; A570-L573 PolarHBondContact O-N 3.38Å; Q571-L573 VanDerWaalsContact C-N 3.27Å; Q571-L573 PolarHBondContact O-N 2.76Å; L573-A576 PolarHBondContact O-N 3.15Å; L573-G577 PolarHBondContact O-N 3.19Å; L573-G577 VanDerWaalsContact O-N 3.15Å; L573-A578 HydrophobicContact CB-CB 4.01Å; L573-A578 WeakPolarHBondContact O-CB 3.45Å; L573-A578 PolarHBondContact O-N 2.84Å
574	L	87.8	Confident	86.1	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-35.2	179.4	-73.7	164.3	0	0	0	112.7	L558 A570 Q571 G577 P580 L608 R776	L558-L574 HydrophobicContact CD1-CD1 4.22Å; L558-L574 HydrophobicContact CD1-CD2 4.33Å; L558-L574 HydrophobicContact CD1-CG 3.92Å; L558-L574 HydrophobicContact CD2-CD2 3.64Å; L558-L574 HydrophobicContact CD2-CG 4.16Å; A570-L574 WeakPolarHBondContact O-CB 3.31Å; A570-L574 WeakPolarHBondContact O-CD1 3.24Å; A570-L574 WeakPolarHBondContact O-CG 3.47Å; A570-L574 PolarHBondContact O-N 2.93Å; Q571-L574 CarbonylContact O-C 3.49Å; Q571-L574 PolarHBondContact O-N 2.67Å; L574-G577 PolarHBondContact O-N 2.97Å; L574-P580 HydrophobicContact CD2-CB 3.96Å; L574-L608 HydrophobicContact CD1-CD2 3.95Å; L574-L608 HydrophobicContact CD2-CD2 4.44Å; L574-R776 VanDerWaalsContact O-CZ 3.3Å; L574-R776 PolarHBondContact O-NH1 2.83Å; L574-R776 PolarHBondContact O-NH2 3.25Å
575	D	84.2	Confident	85.9	Confident	101 Å²	101	37 Å²	37	54%	0.54	21%	0.212	S	C	.	.	H	α-helix	trans	-73.8	-34.9	175.6	-73.1	-23.6	0	0	0	111.1	Q571 G577	Q571-D575 VanDerWaalsContact CG-OD2 3.26Å; Q571-D575 WeakPolarHBondContact CG-OD2 3.37Å; Q571-D575 PolarHBondContact NE2-OD2 2.86Å; Q571-D575 WeakPolarHBondContact O-CB 3.08Å; Q571-D575 PolarHBondContact O-N 3.2Å; D575-G577 PolarHBondContact O-N 2.99Å
576	A	83.4	Confident	85.3	Confident	34 Å²	34	37.9 Å²	37.9	28%	0.281	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-10.9	170.2	0	0	0	0	0	114.7	L539 P545 A572 L573	L539-A576 HydrophobicContact CB-CB 3.9Å; L539-A576 HydrophobicContact CD1-CB 3.72Å; L539-A576 HydrophobicContact CD2-CB 4.45Å; L539-A576 HydrophobicContact CG-CB 4.23Å; P545-A576 HydrophobicContact CB-CB 4.17Å; P545-A576 HydrophobicContact CG-CB 4.42Å; A572-A576 VanDerWaalsContact O-CB 3.29Å; A572-A576 WeakPolarHBondContact O-CB 3.32Å; A572-A576 PolarHBondContact O-N 3.05Å; L573-A576 PolarHBondContact O-N 3.15Å
577	G	79.6	Confident	84.4	Confident	22 Å²	22	48.2 Å²	48.2	23%	0.227	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	106.9	19.3	175.1	0	0	0	0	0	116.4	N546 L573 L574 D575	N546-G577 PolarHBondContact ND2-O 2.83Å; L573-G577 PolarHBondContact O-N 3.19Å; L573-G577 VanDerWaalsContact O-N 3.15Å; L574-G577 PolarHBondContact O-N 2.97Å; D575-G577 PolarHBondContact O-N 2.99Å
578	A	85.4	Confident	83.8	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.008	26%	0.258	C	S	.	.			trans	-56	142.3	169.8	0	0	0	0	0	111.8	P545 L558 L573 P580 R776	P545-A578 HydrophobicContact CB-CB 4.21Å; L558-A578 HydrophobicContact CB-CB 4.25Å; L558-A578 HydrophobicContact CD2-CB 4.05Å; L573-A578 HydrophobicContact CB-CB 4.01Å; L573-A578 WeakPolarHBondContact O-CB 3.45Å; L573-A578 PolarHBondContact O-N 2.84Å; A578-P580 WeakPolarHBondContact O-CD 3.44Å; A578-R776 PolarHBondContact O-NH1 3.15Å
579	K	84.2	Confident	83.5	Confident	95 Å²	95	52.1 Å²	52.1	41%	0.413	26%	0.257	S	S	.	.			trans	-71.4	114.5	177.7	-72.7	167.3	-178.7	175.2	0	109.6	N546 N581 C582	N546-K579 WeakPolarHBondContact OD1-CB 3.22Å; N546-K579 VanDerWaalsContact OD1-CG 3.31Å; N546-K579 WeakPolarHBondContact OD1-CG 3.35Å; N546-K579 PolarHBondContact OD1-N 2.96Å; K579-N581 PolarHBondContact O-N 3.14Å; K579-C582 WeakPolarHBondContact O-CB 3.33Å; K579-C582 PolarHBondContact O-N 3.42Å; K579-C582 VanDerWaalsContact O-N 3.17Å
580	P	84.5	Confident	83.5	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.013	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.9	-176.1	29.1	-36.6	0	0	0	113	L574 A578 C582 G612 A613	L574-P580 HydrophobicContact CD2-CB 3.96Å; A578-P580 WeakPolarHBondContact O-CD 3.44Å; P580-C582 PolarHBondContact O-N 3.35Å; P580-G612 WeakPolarHBondContact CG-O 3.42Å; P580-A613 HydrophobicContact CB-CB 4.06Å
581	N	84.9	Confident	83.4	Confident	26 Å²	26	53.1 Å²	53.1	14%	0.139	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	28.7	174.5	-61.5	-11.1	0	0	0	112.2	K579 A613 N614 Q777	K579-N581 PolarHBondContact O-N 3.14Å; N581-A613 WeakPolarHBondContact OD1-CA 3.47Å; N581-N614 PolarHBondContact OD1-N 3.03Å; N581-Q777 PolarHBondContact ND2-OE1 2.9Å
582	C	85.4	Confident	83.5	Confident	14 Å²	14	49.7 Å²	49.7	10%	0.095	24%	0.244	C	C	.	.			trans	-71.3	143.9	175.4	71.7	0	0	0	0	111	P556 K579 P580 S591 A592	P556-C582 HydrophobicContact CB-CB 3.82Å; P556-C582 HydrophobicContact CG-CB 3.92Å; K579-C582 WeakPolarHBondContact O-CB 3.33Å; K579-C582 PolarHBondContact O-N 3.42Å; K579-C582 VanDerWaalsContact O-N 3.17Å; P580-C582 PolarHBondContact O-N 3.35Å; C582-S591 CarbonylContact O-C 3.51Å; C582-S591 VanDerWaalsContact O-CA 3.29Å; C582-S591 WeakPolarHBondContact O-CA 3.22Å; C582-A592 PolarHBondContact O-N 3.37Å
583	V	86.2	Confident	83.7	Confident	67 Å²	67	49.6 Å²	49.6	41%	0.406	24%	0.242	S	C	.	.	B	Isolated β-bridge	trans	-113.6	143.1	-171.3	179.5	0	0	0	0	110.7	P556 Q589 R590	P556-V583 WeakPolarHBondContact CD-O 3.27Å; P556-V583 WeakPolarHBondContact CG-O 3.48Å; V583-Q589 HydrophobicContact CG1-CB 3.78Å; V583-Q589 HydrophobicContact CG1-CG 4.38Å; V583-Q589 WeakPolarHBondContact CG1-O 3.33Å; V583-R590 CarbonylContact C-O 3.49Å; V583-R590 WeakPolarHBondContact CA-O 3.45Å
584	E	85	Confident	83.9	Confident	12 Å²	12	49.6 Å²	49.6	6%	0.056	24%	0.242	C	C	.	.			trans	-69.2	146.5	173.1	68.9	179.7	160.8	0	0	112	W555 N586 R588 R590 L595	W555-E584 HydrophobicContact CE3-CB 4.21Å; W555-E584 HydrophobicContact CH2-CB 3.78Å; W555-E584 HydrophobicContact CZ3-CB 3.6Å; E584-N586 HydrophobicContact CG-CB 3.95Å; E584-N586 PolarHBondContact O-N 2.98Å; E584-N586 WeakPolarHBondContact OE2-CB 3.25Å; E584-N586 PolarHBondContact OE2-ND2 2.86Å; E584-R588 WeakPolarHBondContact OE1-CB 3.5Å; E584-R590 HydrophobicContact CG-CB 4.16Å; E584-R590 PolarHBondContact N-O 2.92Å; E584-R590 VanDerWaalsContact OE1-CB 3.24Å; E584-R590 WeakPolarHBondContact OE1-CB 3.21Å; E584-R590 WeakPolarHBondContact OE1-CD 3.43Å; E584-R590 WeakPolarHBondContact OE1-CG 3.34Å; E584-R590 PolarHBondContact OE1-N 3.49Å; E584-R590 VanDerWaalsContact OE1-N 3.08Å; E584-L595 HydrophobicContact CB-CD1 4.41Å; E584-L595 HydrophobicContact CB-CD2 4.36Å; E584-L595 HydrophobicContact CG-CD2 4.48Å; E584-L595 WeakPolarHBondContact OE2-CD2 3.47Å
585	P	79.4	Confident	84	Confident	59 Å²	59	50.1 Å²	50.1	38%	0.383	25%	0.245	S	C	.	.	S	Bend	trans	-74	-3.1	175	32.6	-38.4	0	0	0	113.8	K554 W555	K554-P585 HydrophobicContact CB-CB 4.29Å; K554-P585 WeakPolarHBondContact O-CG 3.48Å; W555-P585 HydrophobicContact CD2-CG 4Å; W555-P585 HydrophobicContact CG-CG 3.91Å
586	N	74.9	Confident	84.3	Confident	66 Å²	66	45.4 Å²	45.4	35%	0.353	22%	0.22	S	C	.	.	S	Bend	trans	-72.4	161.3	-178.7	-67.5	-35.6	0	0	0	112.4	W555 E584 R588 Q589	W555-N586 WeakPolarHBondContact CH2-ND2 3.3Å; W555-N586 WeakPolarHBondContact CZ2-ND2 3.48Å; E584-N586 HydrophobicContact CG-CB 3.95Å; E584-N586 PolarHBondContact O-N 2.98Å; E584-N586 WeakPolarHBondContact OE2-CB 3.25Å; E584-N586 PolarHBondContact OE2-ND2 2.86Å; N586-R588 PolarHBondContact O-N 3Å; N586-Q589 PolarHBondContact O-N 3.4Å
587	R	69.3	Low	84.8	Confident	260 Å²	260	43.8 Å²	43.8	98%	0.981	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-16.2	176.3	-66.2	-171.4	-180	-164	0.5	116.1
588	R	75	Confident	85.2	Confident	133 Å²	133	43.6 Å²	43.6	50%	0.502	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-18.5	178.7	-70.6	-177.4	-179.6	147.4	-1.9	113.8	E584 N586 R590	E584-R588 WeakPolarHBondContact OE1-CB 3.5Å; N586-R588 PolarHBondContact O-N 3Å; R588-R590 HydrophobicContact CB-CG 4.38Å; R588-R590 PolarHBondContact O-N 2.9Å
589	Q	83.3	Confident	85.4	Confident	114 Å²	114	46.8 Å²	46.8	53%	0.533	23%	0.23	S	C	.	.			trans	45.4	46.1	179.9	-64.6	-176.3	-3.7	0	0	113.6	V583 N586 P620	V583-Q589 HydrophobicContact CG1-CB 3.78Å; V583-Q589 HydrophobicContact CG1-CG 4.38Å; V583-Q589 WeakPolarHBondContact CG1-O 3.33Å; N586-Q589 PolarHBondContact O-N 3.4Å; Q589-P620 HydrophobicContact CB-CG 4.26Å; Q589-P620 WeakPolarHBondContact O-CD 3.28Å
590	R	87.2	Confident	85.7	Confident	25 Å²	25	42.9 Å²	42.9	9%	0.094	22%	0.216	C	C	.	.			trans	-66.8	138	171.1	-73.3	162.5	177.1	-173.1	-6.2	112	V583 E584 R588 L595 V618 E619	V583-R590 CarbonylContact C-O 3.49Å; V583-R590 WeakPolarHBondContact CA-O 3.45Å; E584-R590 HydrophobicContact CG-CB 4.16Å; E584-R590 PolarHBondContact N-O 2.92Å; E584-R590 VanDerWaalsContact OE1-CB 3.24Å; E584-R590 WeakPolarHBondContact OE1-CB 3.21Å; E584-R590 WeakPolarHBondContact OE1-CD 3.43Å; E584-R590 WeakPolarHBondContact OE1-CG 3.34Å; E584-R590 PolarHBondContact OE1-N 3.49Å; E584-R590 VanDerWaalsContact OE1-N 3.08Å; R588-R590 HydrophobicContact CB-CG 4.38Å; R588-R590 PolarHBondContact O-N 2.9Å; R590-L595 HydrophobicContact CB-CD2 4.03Å; R590-L595 HydrophobicContact CB-CG 4.17Å; R590-V618 CarbonylContact C-O 3.58Å; R590-V618 VanDerWaalsContact CA-O 3.29Å; R590-V618 WeakPolarHBondContact CA-O 2.94Å; R590-E619 HydrophobicContact CG-CG 3.89Å; R590-E619 IonicContact CZ-OE1 2.98Å; R590-E619 VanDerWaalsContact CZ-OE1 3.23Å; R590-E619 IonicContact NE-OE1 2.6Å; R590-E619 PolarHBondContact NE-OE1 3.36Å; R590-E619 IonicContact NH2-OE1 3.15Å; R590-E619 PolarHBondContact NH2-OE1 3.36Å
591	S	89.4	Confident	85.9	Confident	8 Å²	8	44.7 Å²	44.7	6%	0.056	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-65.9	165.1	161.3	72.2	0	0	0	0	110.8	C582 L593 G594 L595 V618	C582-S591 CarbonylContact O-C 3.51Å; C582-S591 VanDerWaalsContact O-CA 3.29Å; C582-S591 WeakPolarHBondContact O-CA 3.22Å; S591-L593 PolarHBondContact O-N 2.64Å; S591-L593 VanDerWaalsContact O-N 3.13Å; S591-L593 PolarHBondContact OG-N 2.91Å; S591-G594 WeakPolarHBondContact O-CA 3.36Å; S591-G594 PolarHBondContact O-N 3.34Å; S591-G594 PolarHBondContact OG-N 2.93Å; S591-L595 PolarHBondContact O-N 3.35Å; S591-V618 PolarHBondContact N-O 2.99Å
592	A	90.1	Very high	86.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-49.2	-38.4	171.5	0	0	0	0	0	112.7	V562 C582 L595 A596 L608	V562-A592 HydrophobicContact CG2-CB 4.32Å; C582-A592 PolarHBondContact O-N 3.37Å; A592-L595 PolarHBondContact O-N 3.34Å; A592-A596 PolarHBondContact O-N 2.97Å; A592-L608 HydrophobicContact CB-CD1 4.1Å; A592-L608 HydrophobicContact CB-CD2 3.86Å; A592-L608 WeakPolarHBondContact O-CD1 3.42Å
593	L	91.2	Very high	86.6	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-68.1	-35.1	175.9	-175	61.6	0	0	0	112.2	S591 A596 I597 A605 L608 I609 A613 F615 V618	S591-L593 PolarHBondContact O-N 2.64Å; S591-L593 VanDerWaalsContact O-N 3.13Å; S591-L593 PolarHBondContact OG-N 2.91Å; L593-A596 PolarHBondContact O-N 3.29Å; L593-I597 HydrophobicContact CD1-CD1 4.38Å; L593-I597 HydrophobicContact CG-CD1 3.97Å; L593-I597 WeakPolarHBondContact O-CB 3.48Å; L593-I597 WeakPolarHBondContact O-CD1 3.23Å; L593-I597 VanDerWaalsContact O-CG1 3.25Å; L593-I597 WeakPolarHBondContact O-CG1 3.41Å; L593-I597 PolarHBondContact O-N 3.48Å; L593-A605 HydrophobicContact CD1-CB 3.87Å; L593-L608 HydrophobicContact CD1-CB 4.3Å; L593-I609 HydrophobicContact CD1-CD1 4.22Å; L593-I609 HydrophobicContact CD1-CG1 3.99Å; L593-I609 HydrophobicContact CD2-CG1 4.09Å; L593-A613 HydrophobicContact CB-CB 4.36Å; L593-A613 HydrophobicContact CD2-CB 4.47Å; L593-F615 HydrophobicContact CD2-CB 3.55Å; L593-V618 HydrophobicContact CD2-CG2 4.36Å
594	G	91	Very high	86.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.5	-32.7	174.8	0	0	0	0	0	113.5	S591 A598	S591-G594 WeakPolarHBondContact O-CA 3.36Å; S591-G594 PolarHBondContact O-N 3.34Å; S591-G594 PolarHBondContact OG-N 2.93Å; G594-A598 VanDerWaalsContact O-CB 3.23Å; G594-A598 WeakPolarHBondContact O-CB 3.41Å; G594-A598 PolarHBondContact O-N 3.06Å
595	L	90.3	Very high	87.2	Confident	14 Å²	14	46.3 Å²	46.3	7%	0.073	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-47.6	170.5	-62.7	173.5	0	0	0	111.2	W555 A559 V562 E584 R590 S591 A592 I597 A598 A599	W555-L595 HydrophobicContact CZ3-CD1 3.92Å; W555-L595 HydrophobicContact CZ3-CD2 4.48Å; A559-L595 HydrophobicContact CB-CD1 3.92Å; V562-L595 HydrophobicContact CG1-CB 3.67Å; E584-L595 HydrophobicContact CB-CD1 4.41Å; E584-L595 HydrophobicContact CB-CD2 4.36Å; E584-L595 HydrophobicContact CG-CD2 4.48Å; E584-L595 WeakPolarHBondContact OE2-CD2 3.47Å; R590-L595 HydrophobicContact CB-CD2 4.03Å; R590-L595 HydrophobicContact CB-CG 4.17Å; S591-L595 PolarHBondContact O-N 3.35Å; A592-L595 PolarHBondContact O-N 3.34Å; L595-I597 PolarHBondContact O-N 2.91Å; L595-A598 PolarHBondContact O-N 3.43Å; L595-A599 WeakPolarHBondContact O-CB 3.28Å; L595-A599 PolarHBondContact O-N 3.36Å
596	A	91.7	Very high	87.7	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-43.2	177.1	0	0	0	0	0	112.5	V562 A592 L593 A599 G600 D601 M604 A605 L608	V562-A596 HydrophobicContact CG1-CB 4.15Å; A592-A596 PolarHBondContact O-N 2.97Å; L593-A596 PolarHBondContact O-N 3.29Å; A596-A599 PolarHBondContact O-N 3Å; A596-G600 PolarHBondContact O-N 2.85Å; A596-D601 PolarHBondContact O-N 3.39Å; A596-M604 HydrophobicContact CB-CB 4.13Å; A596-M604 HydrophobicContact CB-CG 3.87Å; A596-A605 HydrophobicContact CB-CB 4.21Å; A596-L608 HydrophobicContact CB-CD1 4Å
597	I	92.3	Very high	88.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-62.3	-42.4	174.8	-72.5	165.6	0	0	0	111.5	L593 L595 G600 V618 A624 L627 I628 L631 I737	L593-I597 HydrophobicContact CD1-CD1 4.38Å; L593-I597 HydrophobicContact CG-CD1 3.97Å; L593-I597 WeakPolarHBondContact O-CB 3.48Å; L593-I597 WeakPolarHBondContact O-CD1 3.23Å; L593-I597 VanDerWaalsContact O-CG1 3.25Å; L593-I597 WeakPolarHBondContact O-CG1 3.41Å; L593-I597 PolarHBondContact O-N 3.48Å; L595-I597 PolarHBondContact O-N 2.91Å; I597-G600 PolarHBondContact O-N 3.38Å; I597-V618 HydrophobicContact CD1-CG1 4.24Å; I597-A624 HydrophobicContact CD1-CB 3.78Å; I597-L627 HydrophobicContact CB-CD2 4.21Å; I597-L627 HydrophobicContact CG2-CD2 3.79Å; I597-L627 HydrophobicContact CG2-CG 3.92Å; I597-I628 HydrophobicContact CD1-CD1 4.44Å; I597-I628 HydrophobicContact CG2-CD1 4.36Å; I597-I628 HydrophobicContact CG2-CG1 3.6Å; I597-L631 HydrophobicContact CG2-CD1 3.91Å; I597-I737 HydrophobicContact CD1-CD1 3.97Å; I597-I737 HydrophobicContact CG1-CD1 4.49Å
598	A	89.5	Confident	89.5	Confident	19 Å²	19	32.3 Å²	32.3	16%	0.157	17%	0.169	C	C	.	.	H	α-helix	trans	-68.8	-33.2	178.1	0	0	0	0	0	113.1	G594 L595 G600 P725	G594-A598 VanDerWaalsContact O-CB 3.23Å; G594-A598 WeakPolarHBondContact O-CB 3.41Å; G594-A598 PolarHBondContact O-N 3.06Å; L595-A598 PolarHBondContact O-N 3.43Å; A598-G600 VanDerWaalsContact C-N 3.32Å; A598-P725 WeakPolarHBondContact O-CD 3.35Å; A598-P725 WeakPolarHBondContact O-CG 3.47Å
599	A	88.8	Confident	90.1	Very high	68 Å²	68	26 Å²	26	56%	0.562	15%	0.145	S	C	*	.	H	α-helix	trans	-74.9	-21.1	172.5	0	0	0	0	0	113.1	L595 A596	L595-A599 WeakPolarHBondContact O-CB 3.28Å; L595-A599 PolarHBondContact O-N 3.36Å; A596-A599 PolarHBondContact O-N 3Å
600	G	89.8	Confident	90.2	Very high	12 Å²	12	22.5 Å²	22.5	12%	0.124	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	19.2	-174.2	0	0	0	0	0	113.9	A596 I597 A598 F602 P725 S729	A596-G600 PolarHBondContact O-N 2.85Å; I597-G600 PolarHBondContact O-N 3.38Å; A598-G600 VanDerWaalsContact C-N 3.32Å; G600-F602 PolarHBondContact O-N 3.13Å; G600-P725 VanDerWaalsContact CA-CB 3.48Å; G600-S729 VanDerWaalsContact O-CB 3.3Å; G600-S729 WeakPolarHBondContact O-CB 3.47Å; G600-S729 PolarHBondContact O-OG 3.19Å
601	D	90.4	Very high	90	Very high	41 Å²	41	22 Å²	22	22%	0.219	13%	0.13	C	C	.	.			trans	-83.8	102.6	-178	-170.7	-25.2	0	0	0	110.4	A596 D603 M604 A605	A596-D601 PolarHBondContact O-N 3.39Å; D601-D603 PolarHBondContact OD1-N 3.22Å; D601-D603 VanDerWaalsContact OD1-N 3.17Å; D601-M604 HydrophobicContact CB-CB 3.84Å; D601-M604 WeakPolarHBondContact OD1-CB 3.46Å; D601-M604 PolarHBondContact OD1-N 2.88Å; D601-M604 WeakPolarHBondContact OD2-CB 3.16Å; D601-A605 WeakPolarHBondContact O-CB 3.38Å; D601-A605 PolarHBondContact O-N 3.03Å; D601-A605 VanDerWaalsContact O-N 3.13Å
602	F	91.5	Very high	89.5	Confident	64 Å²	64	21.9 Å²	21.9	28%	0.281	13%	0.13	S	C	.	.	H	α-helix	trans	-66.7	-43.4	-179.2	175.1	-91.7	0	0	0	112.7	G600 A605 N606 R732 L736	G600-F602 PolarHBondContact O-N 3.13Å; F602-A605 PolarHBondContact O-N 3.48Å; F602-N606 VanDerWaalsContact O-CB 3.32Å; F602-N606 WeakPolarHBondContact O-CB 3.1Å; F602-N606 PolarHBondContact O-N 2.9Å; F602-R732 HydrophobicContact CD2-CB 3.67Å; F602-R732 HydrophobicContact CE2-CB 3.94Å; F602-L736 HydrophobicContact CD2-CD2 4.33Å; F602-L736 HydrophobicContact CE2-CB 4Å; F602-L736 HydrophobicContact CE2-CD1 4.43Å; F602-L736 HydrophobicContact CE2-CD2 4.04Å; F602-L736 HydrophobicContact CE2-CG 4.39Å; F602-L736 HydrophobicContact CZ-CD1 4.39Å
603	D	91.8	Very high	89.3	Confident	88 Å²	88	22.2 Å²	22.2	47%	0.471	13%	0.133	S	C	.	.	H	α-helix	trans	-74.1	-37.5	-174.4	-66.4	-54.8	0	0	0	110.7	L567 D601 N606 M607	L567-D603 HydrophobicContact CD1-CB 4.16Å; L567-D603 HydrophobicContact CD2-CB 3.93Å; D601-D603 PolarHBondContact OD1-N 3.22Å; D601-D603 VanDerWaalsContact OD1-N 3.17Å; D603-N606 PolarHBondContact O-N 3.12Å; D603-M607 WeakPolarHBondContact O-CB 3.37Å; D603-M607 WeakPolarHBondContact O-CG 3.44Å; D603-M607 PolarHBondContact O-N 3.31Å
604	M	91.8	Very high	88.9	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-62.9	-45	171.3	-170.7	78.7	72.4	0	0	111.9	V562 L567 A570 A596 D601 M607 L608	V562-M604 HydrophobicContact CB-SD 4.5Å; V562-M604 HydrophobicContact CG1-CG 4.1Å; V562-M604 HydrophobicContact CG2-CG 4.11Å; V562-M604 HydrophobicContact CG2-SD 3.81Å; L567-M604 HydrophobicContact CB-CE 4.45Å; L567-M604 HydrophobicContact CD1-CB 4.25Å; L567-M604 HydrophobicContact CD1-SD 4.29Å; A570-M604 HydrophobicContact CB-CE 4.33Å; A570-M604 HydrophobicContact CB-SD 3.56Å; A570-M604 VanDerWaalsContact CB-SD 3.56Å; A596-M604 HydrophobicContact CB-CB 4.13Å; A596-M604 HydrophobicContact CB-CG 3.87Å; D601-M604 HydrophobicContact CB-CB 3.84Å; D601-M604 WeakPolarHBondContact OD1-CB 3.46Å; D601-M604 PolarHBondContact OD1-N 2.88Å; D601-M604 WeakPolarHBondContact OD2-CB 3.16Å; M604-M607 PolarHBondContact O-N 3.24Å; M604-L608 HydrophobicContact CG-CD1 4.01Å; M604-L608 WeakPolarHBondContact O-CB 3.43Å; M604-L608 VanDerWaalsContact O-CG 3.31Å; M604-L608 WeakPolarHBondContact O-CG 3.24Å; M604-L608 PolarHBondContact O-N 2.81Å
605	A	92.5	Very high	88.7	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63.3	-42.3	177.3	0	0	0	0	0	111.9	L593 A596 D601 F602 L608 I609 L733	L593-A605 HydrophobicContact CD1-CB 3.87Å; A596-A605 HydrophobicContact CB-CB 4.21Å; D601-A605 WeakPolarHBondContact O-CB 3.38Å; D601-A605 PolarHBondContact O-N 3.03Å; D601-A605 VanDerWaalsContact O-N 3.13Å; F602-A605 PolarHBondContact O-N 3.48Å; A605-L608 PolarHBondContact O-N 2.95Å; A605-I609 WeakPolarHBondContact O-CD1 3.26Å; A605-I609 VanDerWaalsContact O-CG1 3.22Å; A605-I609 WeakPolarHBondContact O-CG1 3.16Å; A605-I609 PolarHBondContact O-N 3.34Å; A605-L733 HydrophobicContact CB-CD2 3.37Å
606	N	91	Very high	88.3	Confident	43 Å²	43	24.2 Å²	24.2	23%	0.23	14%	0.141	C	C	.	.	H	α-helix	trans	-61.6	-46.9	175.2	-176.3	31.3	0	0	0	111.8	F602 D603 I609 L610 L736	F602-N606 VanDerWaalsContact O-CB 3.32Å; F602-N606 WeakPolarHBondContact O-CB 3.1Å; F602-N606 PolarHBondContact O-N 2.9Å; D603-N606 PolarHBondContact O-N 3.12Å; N606-I609 PolarHBondContact O-N 2.9Å; N606-L610 WeakPolarHBondContact O-CB 3.46Å; N606-L610 VanDerWaalsContact O-CG 3.31Å; N606-L610 WeakPolarHBondContact O-CG 3.15Å; N606-L610 PolarHBondContact O-N 2.76Å; N606-L736 HydrophobicContact CB-CD2 3.97Å
607	M	90.1	Very high	87.9	Confident	47 Å²	47	29.7 Å²	29.7	23%	0.232	17%	0.166	C	C	.	.	H	α-helix	trans	-60	-46.9	175.4	-76.5	-62	-70.4	0	0	112.1	L567 Q571 D603 M604 I609 L610 S611	L567-M607 HydrophobicContact CD1-CB 4.27Å; L567-M607 HydrophobicContact CD1-CG 3.8Å; Q571-M607 HydrophobicContact CB-CE 3.99Å; Q571-M607 HydrophobicContact CG-CE 3.69Å; D603-M607 WeakPolarHBondContact O-CB 3.37Å; D603-M607 WeakPolarHBondContact O-CG 3.44Å; D603-M607 PolarHBondContact O-N 3.31Å; M604-M607 PolarHBondContact O-N 3.24Å; M607-I609 PolarHBondContact O-N 2.99Å; M607-L610 PolarHBondContact O-N 3.35Å; M607-S611 PolarHBondContact O-N 3.3Å; M607-S611 PolarHBondContact O-OG 3.05Å
608	L	90.4	Very high	87.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.9	-43.3	177.3	-75.2	164.7	0	0	0	112.3	L558 V562 L574 A592 L593 A596 M604 A605 S611 G612 A613	L558-L608 HydrophobicContact CD2-CD2 4.48Å; V562-L608 HydrophobicContact CG2-CD1 4.17Å; L574-L608 HydrophobicContact CD1-CD2 3.95Å; L574-L608 HydrophobicContact CD2-CD2 4.44Å; A592-L608 HydrophobicContact CB-CD1 4.1Å; A592-L608 HydrophobicContact CB-CD2 3.86Å; A592-L608 WeakPolarHBondContact O-CD1 3.42Å; L593-L608 HydrophobicContact CD1-CB 4.3Å; A596-L608 HydrophobicContact CB-CD1 4Å; M604-L608 HydrophobicContact CG-CD1 4.01Å; M604-L608 WeakPolarHBondContact O-CB 3.43Å; M604-L608 VanDerWaalsContact O-CG 3.31Å; M604-L608 WeakPolarHBondContact O-CG 3.24Å; M604-L608 PolarHBondContact O-N 2.81Å; A605-L608 PolarHBondContact O-N 2.95Å; L608-S611 PolarHBondContact O-N 2.99Å; L608-G612 PolarHBondContact O-N 2.93Å; L608-A613 HydrophobicContact CB-CB 4.06Å; L608-A613 WeakPolarHBondContact O-CB 3.19Å; L608-A613 PolarHBondContact O-N 3.5Å
609	I	88.3	Confident	87.5	Confident	2 Å²	2	30 Å²	30	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-65.2	-40.7	176.7	-66.5	164	0	0	0	111	L593 A605 N606 M607 G612 L736 I737 H740	L593-I609 HydrophobicContact CD1-CD1 4.22Å; L593-I609 HydrophobicContact CD1-CG1 3.99Å; L593-I609 HydrophobicContact CD2-CG1 4.09Å; A605-I609 WeakPolarHBondContact O-CD1 3.26Å; A605-I609 VanDerWaalsContact O-CG1 3.22Å; A605-I609 WeakPolarHBondContact O-CG1 3.16Å; A605-I609 PolarHBondContact O-N 3.34Å; N606-I609 PolarHBondContact O-N 2.9Å; M607-I609 PolarHBondContact O-N 2.99Å; I609-G612 PolarHBondContact O-N 3.12Å; I609-G612 VanDerWaalsContact O-N 3.1Å; I609-L736 HydrophobicContact CD1-CD2 4.14Å; I609-L736 HydrophobicContact CD1-CG 4.42Å; I609-I737 HydrophobicContact CD1-CG1 3.94Å; I609-H740 VanDerWaalsContact CG2-CE1 3.41Å; I609-H740 WeakPolarHBondContact CG2-CE1 3.35Å; I609-H740 VanDerWaalsContact CG2-ND1 3.34Å; I609-H740 WeakPolarHBondContact CG2-ND1 3.16Å
610	L	84.9	Confident	87.1	Confident	40 Å²	40	30.7 Å²	30.7	21%	0.209	16%	0.163	C	C	.	.	H	α-helix	trans	-67.5	-33.8	176.6	-71.3	170.2	0	0	0	112.9	N606 M607 G612 I812 A816 P885	N606-L610 WeakPolarHBondContact O-CB 3.46Å; N606-L610 VanDerWaalsContact O-CG 3.31Å; N606-L610 WeakPolarHBondContact O-CG 3.15Å; N606-L610 PolarHBondContact O-N 2.76Å; M607-L610 PolarHBondContact O-N 3.35Å; L610-G612 PolarHBondContact O-N 2.99Å; L610-I812 HydrophobicContact CD2-CG2 4.5Å; L610-A816 HydrophobicContact CD2-CB 4.28Å; L610-P885 WeakPolarHBondContact O-CG 3.38Å
611	S	82.9	Confident	86.6	Confident	14 Å²	14	34 Å²	34	10%	0.098	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-2	171	-58.8	0	0	0	0	114	M607 L608	M607-S611 PolarHBondContact O-N 3.3Å; M607-S611 PolarHBondContact O-OG 3.05Å; L608-S611 PolarHBondContact O-N 2.99Å
612	G	79.5	Confident	86.4	Confident	5 Å²	5	32.8 Å²	32.8	5%	0.052	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	38.1	175.4	0	0	0	0	0	115	P580 L608 I609 L610 S774	P580-G612 WeakPolarHBondContact CG-O 3.42Å; L608-G612 PolarHBondContact O-N 2.93Å; I609-G612 PolarHBondContact O-N 3.12Å; I609-G612 VanDerWaalsContact O-N 3.1Å; L610-G612 PolarHBondContact O-N 2.99Å; G612-S774 VanDerWaalsContact O-CB 3.24Å; G612-S774 WeakPolarHBondContact O-CB 3.37Å; G612-S774 PolarHBondContact O-OG 2.89Å; G612-S774 VanDerWaalsContact O-OG 3.05Å
613	A	85.8	Confident	86.2	Confident	7 Å²	7	32.3 Å²	32.3	6%	0.058	19%	0.194	C	C	.	.			trans	-68.6	138.3	164.7	0	0	0	0	0	111.6	P580 N581 L593 L608 F615	P580-A613 HydrophobicContact CB-CB 4.06Å; N581-A613 WeakPolarHBondContact OD1-CA 3.47Å; L593-A613 HydrophobicContact CB-CB 4.36Å; L593-A613 HydrophobicContact CD2-CB 4.47Å; L608-A613 HydrophobicContact CB-CB 4.06Å; L608-A613 WeakPolarHBondContact O-CB 3.19Å; L608-A613 PolarHBondContact O-N 3.5Å; A613-F615 PolarHBondContact O-N 3.2Å
614	N	83	Confident	86.1	Confident	11 Å²	11	28.1 Å²	28.1	6%	0.059	17%	0.172	C	C	.	.			trans	-73.1	119.3	173.5	-174.7	6.1	0	0	0	110	N581 Y616 E617 W772	N581-N614 PolarHBondContact OD1-N 3.03Å; N614-Y616 WeakPolarHBondContact OD1-CB 3.41Å; N614-Y616 PolarHBondContact OD1-N 2.99Å; N614-E617 VanDerWaalsContact ND2-CB 3.33Å; N614-E617 WeakPolarHBondContact ND2-CB 3.48Å; N614-W772 VanDerWaalsContact CG-O 3.31Å; N614-W772 PolarHBondContact OD1-O 3.46Å
615	F	86.5	Confident	86	Confident	11 Å²	11	30.4 Å²	30.4	5%	0.048	18%	0.183	C	C	.	.	S	Bend	trans	-98.4	0.9	175.9	63.1	-98	0	0	0	113.6	L593 A613 A624 I737 H740 H741 L744	L593-F615 HydrophobicContact CD2-CB 3.55Å; A613-F615 PolarHBondContact O-N 3.2Å; F615-A624 HydrophobicContact CB-CB 3.98Å; F615-A624 VanDerWaalsContact O-CB 3.24Å; F615-A624 WeakPolarHBondContact O-CB 3.31Å; F615-A624 PolarHBondContact O-N 3.21Å; F615-I737 HydrophobicContact CD2-CG2 4.02Å; F615-H740 HydrophobicContact CE1-CB 4.5Å; F615-H741 HydrophobicContact CE2-CB 3.96Å; F615-H741 HydrophobicContact CZ-CB 4.34Å; F615-L744 HydrophobicContact CE1-CD2 3.85Å; F615-L744 HydrophobicContact CZ-CD2 3.56Å
616	Y	82.3	Confident	85.8	Confident	34 Å²	34	33.8 Å²	33.8	13%	0.133	20%	0.202	C	C	.	.	S	Bend	trans	-86	-16.9	169	-60.7	-88.5	0	0	0	112.4	N614 T623 H741 L744 C770 W772	N614-Y616 WeakPolarHBondContact OD1-CB 3.41Å; N614-Y616 PolarHBondContact OD1-N 2.99Å; Y616-T623 WeakPolarHBondContact O-CA 3.39Å; Y616-T623 WeakPolarHBondContact O-CG2 3.38Å; Y616-H741 AromaticContact CE1-CD2 3.6Å; Y616-H741 AromaticContact CE1-NE2 3.77Å; Y616-H741 AromaticContact CZ-CD2 3.65Å; Y616-H741 PolarHBondContact OH-CD2 3.38Å; Y616-H741 PolarHBondContact OH-NE2 3.13Å; Y616-L744 HydrophobicContact CE2-CD2 4.35Å; Y616-C770 WeakPolarHBondContact CE1-O 3.36Å; Y616-C770 WeakPolarHBondContact CE2-O 3.4Å; Y616-W772 HydrophobicContact CD2-CB 4.2Å; Y616-W772 HydrophobicContact CE2-CB 4.01Å; Y616-W772 AromaticContact CE2-CD1 3.76Å; Y616-W772 HydrophobicContact CE2-CG 4.19Å
617	E	84.1	Confident	85.8	Confident	116 Å²	116	31.9 Å²	31.9	54%	0.542	19%	0.191	S	C	.	.			trans	-134.4	103.4	-178.5	-173.9	-178.6	-157.8	0	0	109.7	N614	N614-E617 VanDerWaalsContact ND2-CB 3.33Å; N614-E617 WeakPolarHBondContact ND2-CB 3.48Å
618	V	86.5	Confident	85.8	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.012	18%	0.18	C	C	.	.	S	Bend	trans	-127.6	-39.2	-167.4	177.7	0	0	0	0	113	R590 S591 L593 I597 T622 A624 L627	R590-V618 CarbonylContact C-O 3.58Å; R590-V618 VanDerWaalsContact CA-O 3.29Å; R590-V618 WeakPolarHBondContact CA-O 2.94Å; S591-V618 PolarHBondContact N-O 2.99Å; L593-V618 HydrophobicContact CD2-CG2 4.36Å; I597-V618 HydrophobicContact CD1-CG1 4.24Å; V618-T622 PolarHBondContact N-O 3.21Å; V618-A624 HydrophobicContact CG2-CB 3.75Å; V618-L627 HydrophobicContact CG1-CD2 3.59Å
619	E	85.4	Confident	85.7	Confident	25 Å²	25	33.6 Å²	33.6	12%	0.117	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-122.9	153.6	153	-40.2	177.5	131.4	0	0	105	R590 G621 T622 L627 K630	R590-E619 HydrophobicContact CG-CG 3.89Å; R590-E619 IonicContact CZ-OE1 2.98Å; R590-E619 VanDerWaalsContact CZ-OE1 3.23Å; R590-E619 IonicContact NE-OE1 2.6Å; R590-E619 PolarHBondContact NE-OE1 3.36Å; R590-E619 IonicContact NH2-OE1 3.15Å; R590-E619 PolarHBondContact NH2-OE1 3.36Å; E619-G621 PolarHBondContact O-N 3.43Å; E619-G621 VanDerWaalsContact O-N 3.16Å; E619-T622 WeakPolarHBondContact CA-OG1 3.31Å; E619-T622 HydrophobicContact CB-CG2 4.18Å; E619-T622 WeakPolarHBondContact CB-OG1 3.49Å; E619-T622 PolarHBondContact N-OG1 2.81Å; E619-T622 VanDerWaalsContact N-OG1 3.08Å; E619-T622 PolarHBondContact O-N 2.96Å; E619-T622 PolarHBondContact O-OG1 3.25Å; E619-L627 HydrophobicContact CG-CD1 4.44Å; E619-L627 HydrophobicContact CG-CD2 4.35Å; E619-K630 IonicContact OE2-NZ 2.72Å; E619-K630 PolarHBondContact OE2-NZ 3.44Å; E619-K630 VanDerWaalsContact OE2-NZ 3.13Å
620	P	81.9	Confident	85.8	Confident	82 Å²	82	37.7 Å²	37.7	53%	0.532	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	123.5	178.6	17.4	-31.6	0	0	0	112	Q589	Q589-P620 HydrophobicContact CB-CG 4.26Å; Q589-P620 WeakPolarHBondContact O-CD 3.28Å
621	G	78.9	Confident	85.9	Confident	82 Å²	82	36.7 Å²	36.7	85%	0.845	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	75	14	-176	0	0	0	0	0	116	E619	E619-G621 PolarHBondContact O-N 3.43Å; E619-G621 VanDerWaalsContact O-N 3.16Å
622	T	85.1	Confident	86.2	Confident	15 Å²	15	37.9 Å²	37.9	9%	0.092	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-134.9	136.4	-176.5	79.2	0	0	0	0	113.6	V618 E619 K630	V618-T622 PolarHBondContact N-O 3.21Å; E619-T622 WeakPolarHBondContact CA-OG1 3.31Å; E619-T622 HydrophobicContact CB-CG2 4.18Å; E619-T622 WeakPolarHBondContact CB-OG1 3.49Å; E619-T622 PolarHBondContact N-OG1 2.81Å; E619-T622 VanDerWaalsContact N-OG1 3.08Å; E619-T622 PolarHBondContact O-N 2.96Å; E619-T622 PolarHBondContact O-OG1 3.25Å; T622-K630 VanDerWaalsContact CG2-NZ 3.33Å
623	T	88	Confident	86.5	Confident	54 Å²	54	41.8 Å²	41.8	33%	0.331	24%	0.237	S	C	.	.			trans	-83.3	159.3	172.3	66.1	0	0	0	0	111.4	Y616 L625 N626 L627	Y616-T623 WeakPolarHBondContact O-CA 3.39Å; Y616-T623 WeakPolarHBondContact O-CG2 3.38Å; T623-L625 PolarHBondContact O-N 2.86Å; T623-N626 PolarHBondContact O-N 2.76Å; T623-N626 VanDerWaalsContact O-N 3.07Å; T623-N626 WeakPolarHBondContact OG1-CB 3.38Å; T623-N626 PolarHBondContact OG1-N 2.83Å; T623-L627 PolarHBondContact O-N 3.32Å
624	A	89.1	Confident	86.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-54.8	-39.7	174.7	0	0	0	0	0	112.6	I597 F615 V618 L627 I628 I737	I597-A624 HydrophobicContact CD1-CB 3.78Å; F615-A624 HydrophobicContact CB-CB 3.98Å; F615-A624 VanDerWaalsContact O-CB 3.24Å; F615-A624 WeakPolarHBondContact O-CB 3.31Å; F615-A624 PolarHBondContact O-N 3.21Å; V618-A624 HydrophobicContact CG2-CB 3.75Å; A624-L627 PolarHBondContact O-N 3Å; A624-I628 WeakPolarHBondContact O-CG1 3.32Å; A624-I628 PolarHBondContact O-N 3.36Å; A624-I737 HydrophobicContact CB-CD1 3.71Å; A624-I737 HydrophobicContact CB-CG1 4.39Å; A624-I737 HydrophobicContact CB-CG2 4.06Å
625	L	90.3	Very high	86.3	Confident	48 Å²	48	43.3 Å²	43.3	25%	0.251	25%	0.248	S	C	.	.	H	α-helix	trans	-65.6	-42	176.7	-64.6	176.7	0	0	0	111.8	T623 I628 M629 I737 V738	T623-L625 PolarHBondContact O-N 2.86Å; L625-I628 PolarHBondContact O-N 3.15Å; L625-M629 WeakPolarHBondContact O-CG 3.35Å; L625-M629 PolarHBondContact O-N 2.79Å; L625-I737 HydrophobicContact CD2-CB 4.05Å; L625-I737 HydrophobicContact CD2-CG2 3.58Å; L625-I737 HydrophobicContact CG-CG2 3.78Å; L625-V738 HydrophobicContact CD1-CG2 4.36Å; L625-V738 HydrophobicContact CD2-CG2 3.74Å
626	N	88.9	Confident	86.1	Confident	72 Å²	72	47 Å²	47	39%	0.385	27%	0.269	S	S	.	.	H	α-helix	trans	-63.6	-43.2	175.9	-169	2.7	0	0	0	110.8	T623 I628 M629 K630	T623-N626 PolarHBondContact O-N 2.76Å; T623-N626 VanDerWaalsContact O-N 3.07Å; T623-N626 WeakPolarHBondContact OG1-CB 3.38Å; T623-N626 PolarHBondContact OG1-N 2.83Å; N626-I628 PolarHBondContact O-N 3.45Å; N626-M629 PolarHBondContact O-N 3.33Å; N626-K630 WeakPolarHBondContact O-CG 3.42Å; N626-K630 PolarHBondContact O-N 3.19Å
627	L	89.2	Confident	85.8	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-60.3	-43.7	174.9	179.7	57.8	0	0	0	112.4	I597 V618 E619 T623 A624 K630 L631	I597-L627 HydrophobicContact CB-CD2 4.21Å; I597-L627 HydrophobicContact CG2-CD2 3.79Å; I597-L627 HydrophobicContact CG2-CG 3.92Å; V618-L627 HydrophobicContact CG1-CD2 3.59Å; E619-L627 HydrophobicContact CG-CD1 4.44Å; E619-L627 HydrophobicContact CG-CD2 4.35Å; T623-L627 PolarHBondContact O-N 3.32Å; A624-L627 PolarHBondContact O-N 3Å; L627-K630 WeakPolarHBondContact O-CB 3.29Å; L627-K630 PolarHBondContact O-N 3.05Å; L627-L631 HydrophobicContact CD1-CD1 4.29Å; L627-L631 HydrophobicContact CD1-CG 4.35Å; L627-L631 HydrophobicContact CG-CD1 4.21Å; L627-L631 WeakPolarHBondContact O-CG 3.44Å; L627-L631 PolarHBondContact O-N 2.88Å
628	I	90.8	Very high	85.2	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-41.8	177.3	-68.4	163.7	0	0	0	111.1	I597 A624 L625 N626 K630 L631 L632 L730 L733 H734 I737	I597-I628 HydrophobicContact CD1-CD1 4.44Å; I597-I628 HydrophobicContact CG2-CD1 4.36Å; I597-I628 HydrophobicContact CG2-CG1 3.6Å; A624-I628 WeakPolarHBondContact O-CG1 3.32Å; A624-I628 PolarHBondContact O-N 3.36Å; L625-I628 PolarHBondContact O-N 3.15Å; N626-I628 PolarHBondContact O-N 3.45Å; I628-K630 PolarHBondContact O-N 2.82Å; I628-L631 PolarHBondContact O-N 2.95Å; I628-L632 HydrophobicContact CG2-CD1 3.91Å; I628-L632 HydrophobicContact CG2-CG 4.34Å; I628-L632 WeakPolarHBondContact O-CG 3.23Å; I628-L632 PolarHBondContact O-N 3.45Å; I628-L730 HydrophobicContact CG2-CB 4.4Å; I628-L730 HydrophobicContact CG2-CD2 4.33Å; I628-L733 HydrophobicContact CD1-CB 3.82Å; I628-H734 HydrophobicContact CG2-CB 4.1Å; I628-I737 HydrophobicContact CD1-CD1 3.47Å; I628-I737 VanDerWaalsContact CD1-CD1 3.47Å
629	M	89.3	Confident	84.1	Confident	83 Å²	83	51.3 Å²	51.3	41%	0.409	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-38.1	175	-69.5	-55.3	-59.9	0	0	112.4	L625 N626 L631 L632 N633	L625-M629 WeakPolarHBondContact O-CG 3.35Å; L625-M629 PolarHBondContact O-N 2.79Å; N626-M629 PolarHBondContact O-N 3.33Å; M629-L631 VanDerWaalsContact C-N 3.35Å; M629-L631 PolarHBondContact O-N 3.03Å; M629-L632 PolarHBondContact O-N 2.89Å; M629-L632 HydrophobicContact SD-CD1 4.1Å; M629-N633 VanDerWaalsContact O-CB 3.31Å; M629-N633 WeakPolarHBondContact O-CB 3.38Å; M629-N633 PolarHBondContact O-N 3.44Å; M629-N633 PolarHBondContact O-ND2 2.86Å; M629-N633 PolarHBondContact O-OD1 2.92Å
630	K	88.5	Confident	82.8	Confident	88 Å²	88	57.3 Å²	57.3	38%	0.383	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-43.8	170.8	-71.2	174.8	-173	-178.9	0	111.7	E619 T622 N626 L627 I628 N633 A634	E619-K630 IonicContact OE2-NZ 2.72Å; E619-K630 PolarHBondContact OE2-NZ 3.44Å; E619-K630 VanDerWaalsContact OE2-NZ 3.13Å; T622-K630 VanDerWaalsContact CG2-NZ 3.33Å; N626-K630 WeakPolarHBondContact O-CG 3.42Å; N626-K630 PolarHBondContact O-N 3.19Å; L627-K630 WeakPolarHBondContact O-CB 3.29Å; L627-K630 PolarHBondContact O-N 3.05Å; I628-K630 PolarHBondContact O-N 2.82Å; K630-N633 PolarHBondContact O-N 3.45Å; K630-A634 WeakPolarHBondContact O-CB 3.43Å; K630-A634 PolarHBondContact O-N 3.29Å
631	L	88.8	Confident	81.2	Confident	20 Å²	20	59.2 Å²	59.2	11%	0.105	34%	0.339	C	S	.	.	H	α-helix	trans	-69.5	-38.5	179.7	-68.5	169.2	0	0	0	112.4	I597 L627 I628 M629 A634 H635 L724 P725 L730	I597-L631 HydrophobicContact CG2-CD1 3.91Å; L627-L631 HydrophobicContact CD1-CD1 4.29Å; L627-L631 HydrophobicContact CD1-CG 4.35Å; L627-L631 HydrophobicContact CG-CD1 4.21Å; L627-L631 WeakPolarHBondContact O-CG 3.44Å; L627-L631 PolarHBondContact O-N 2.88Å; I628-L631 PolarHBondContact O-N 2.95Å; M629-L631 VanDerWaalsContact C-N 3.35Å; M629-L631 PolarHBondContact O-N 3.03Å; L631-A634 PolarHBondContact O-N 3.24Å; L631-H635 PolarHBondContact O-CD2 3.38Å; L631-H635 VanDerWaalsContact O-CD2 3.31Å; L631-H635 PolarHBondContact O-N 3.42Å; L631-H635 VanDerWaalsContact O-N 3.11Å; L631-L724 HydrophobicContact CD2-CD2 4.32Å; L631-P725 HydrophobicContact CD1-CG 4.47Å; L631-L730 HydrophobicContact CB-CD1 3.91Å; L631-L730 HydrophobicContact CB-CD2 3.94Å; L631-L730 HydrophobicContact CD1-CD2 3.89Å
632	L	88.3	Confident	79.9	Confident	38 Å²	38	58.9 Å²	58.9	20%	0.199	32%	0.322	C	S	.	.	H	α-helix	trans	-65.4	-41.8	172.6	-71.7	169.8	0	0	0	111.7	I628 M629 A634 H635 L636 V727 L730	I628-L632 HydrophobicContact CG2-CD1 3.91Å; I628-L632 HydrophobicContact CG2-CG 4.34Å; I628-L632 WeakPolarHBondContact O-CG 3.23Å; I628-L632 PolarHBondContact O-N 3.45Å; M629-L632 PolarHBondContact O-N 2.89Å; M629-L632 HydrophobicContact SD-CD1 4.1Å; L632-A634 VanDerWaalsContact C-N 3.31Å; L632-A634 PolarHBondContact O-N 3.45Å; L632-H635 WeakPolarHBondContact O-CB 3.38Å; L632-H635 PolarHBondContact O-N 2.88Å; L632-L636 WeakPolarHBondContact O-CG 3.42Å; L632-L636 PolarHBondContact O-N 2.91Å; L632-L636 VanDerWaalsContact O-N 3.1Å; L632-V727 HydrophobicContact CD2-CG1 4.19Å; L632-L730 HydrophobicContact CD2-CB 3.8Å; L632-L730 HydrophobicContact CD2-CD1 3.84Å; L632-L730 HydrophobicContact CD2-CG 4.49Å; L632-L730 HydrophobicContact CG-CB 4.22Å; L632-L730 HydrophobicContact CG-CD1 4.14Å
633	N	86.3	Confident	78.1	Confident	88 Å²	88	67.6 Å²	67.6	47%	0.471	36%	0.358	S	S	.	.	H	α-helix	trans	-66.3	-32.9	175.1	-69.2	-9.2	0	0	0	112.2	M629 K630 L636 S637	M629-N633 VanDerWaalsContact O-CB 3.31Å; M629-N633 WeakPolarHBondContact O-CB 3.38Å; M629-N633 PolarHBondContact O-N 3.44Å; M629-N633 PolarHBondContact O-ND2 2.86Å; M629-N633 PolarHBondContact O-OD1 2.92Å; K630-N633 PolarHBondContact O-N 3.45Å; N633-L636 PolarHBondContact O-N 3.17Å; N633-S637 PolarHBondContact O-N 3.23Å; N633-S637 PolarHBondContact O-OG 2.82Å
634	A	85	Confident	76	Confident	34 Å²	34	72 Å²	72	28%	0.281	38%	0.378	S	S	.	.	H	α-helix	trans	-67	-33.9	172.9	0	0	0	0	0	112.8	K630 L631 L632 S637 A638 L724	K630-A634 WeakPolarHBondContact O-CB 3.43Å; K630-A634 PolarHBondContact O-N 3.29Å; L631-A634 PolarHBondContact O-N 3.24Å; L632-A634 VanDerWaalsContact C-N 3.31Å; L632-A634 PolarHBondContact O-N 3.45Å; A634-S637 PolarHBondContact O-OG 2.91Å; A634-A638 VanDerWaalsContact O-CB 3.28Å; A634-A638 WeakPolarHBondContact O-CB 3.4Å; A634-A638 PolarHBondContact O-N 3.12Å; A634-L724 HydrophobicContact CB-CD2 4.28Å
635	H	80.3	Confident	73.5	Confident	15 Å²	15	76.4 Å²	76.4	7%	0.069	40%	0.402	C	S	.	.	H	α-helix	trans	-64.9	-45.2	169.5	-84.2	-71	0	0	0	112.2	L631 L632 S637 A638 Q639 P725 V727	L631-H635 PolarHBondContact O-CD2 3.38Å; L631-H635 VanDerWaalsContact O-CD2 3.31Å; L631-H635 PolarHBondContact O-N 3.42Å; L631-H635 VanDerWaalsContact O-N 3.11Å; L632-H635 WeakPolarHBondContact O-CB 3.38Å; L632-H635 PolarHBondContact O-N 2.88Å; H635-S637 PolarHBondContact O-N 3.36Å; H635-A638 PolarHBondContact O-N 3.05Å; H635-Q639 WeakPolarHBondContact O-CG 3.26Å; H635-Q639 PolarHBondContact O-N 3.23Å; H635-P725 PolarHBondContact CE1-O 3.41Å; H635-P725 VanDerWaalsContact CE1-O 3.29Å; H635-P725 PolarHBondContact NE2-O 3.31Å; H635-V727 HydrophobicContact CB-CG2 4.37Å
636	L	80.7	Confident	70.9	Confident	90 Å²	90	79.7 Å²	79.7	47%	0.471	42%	0.416	S	S	.	.	H	α-helix	trans	-61.6	-42.2	178.9	-67.6	171.5	0	0	0	111.7	L632 N633 Q639 Q640	L632-L636 WeakPolarHBondContact O-CG 3.42Å; L632-L636 PolarHBondContact O-N 2.91Å; L632-L636 VanDerWaalsContact O-N 3.1Å; N633-L636 PolarHBondContact O-N 3.17Å; L636-Q639 PolarHBondContact O-N 3.27Å; L636-Q640 WeakPolarHBondContact O-CG 3.43Å; L636-Q640 PolarHBondContact O-N 3.41Å; L636-Q640 VanDerWaalsContact O-N 3.11Å
637	S	77.4	Confident	68.4	Low	62 Å²	62	88.2 Å²	88.2	43%	0.434	44%	0.442	S	S	.	.	H	α-helix	trans	-71.1	-32.8	176.7	66.8	0	0	0	0	113.3	N633 A634 H635 Q640 N641	N633-S637 PolarHBondContact O-N 3.23Å; N633-S637 PolarHBondContact O-OG 2.82Å; A634-S637 PolarHBondContact O-OG 2.91Å; H635-S637 PolarHBondContact O-N 3.36Å; S637-Q640 PolarHBondContact O-N 2.95Å; S637-N641 PolarHBondContact O-N 3.46Å
638	A	70.8	Confident	66.3	Low	49 Å²	49	96.6 Å²	96.6	41%	0.405	48%	0.481	S	S	.	.	H	α-helix	trans	-66.3	-36.7	172.2	0	0	0	0	0	112.5	A634 H635	A634-A638 VanDerWaalsContact O-CB 3.28Å; A634-A638 WeakPolarHBondContact O-CB 3.4Å; A634-A638 PolarHBondContact O-N 3.12Å; H635-A638 PolarHBondContact O-N 3.05Å
639	Q	62.7	Low	63.9	Low	130 Å²	130	100.6 Å²	100.6	61%	0.607	50%	0.502	S	S	*	.	H	α-helix	trans	-68.8	-33.1	174.3	-73.1	175.6	-6.7	0	0	112.7	H635 L636 N641	H635-Q639 WeakPolarHBondContact O-CG 3.26Å; H635-Q639 PolarHBondContact O-N 3.23Å; L636-Q639 PolarHBondContact O-N 3.27Å; Q639-N641 VanDerWaalsContact C-N 3.35Å
640	Q	59.6	Low	61.3	Low	152 Å²	152	100.1 Å²	100.1	71%	0.71	50%	0.501	S	S	*	.	H	α-helix	trans	-75.8	-17.1	179.7	-73.3	173	-1.8	0	0	114.2	L636 S637 P642	L636-Q640 WeakPolarHBondContact O-CG 3.43Å; L636-Q640 PolarHBondContact O-N 3.41Å; L636-Q640 VanDerWaalsContact O-N 3.11Å; S637-Q640 PolarHBondContact O-N 2.95Å; Q640-P642 VanDerWaalsContact C-CD 3.45Å; Q640-P642 VanDerWaalsContact O-CD 3.27Å; Q640-P642 WeakPolarHBondContact O-CD 3.46Å
641	N	48.2	Very low	58.9	Low	122 Å²	122	105.3 Å²	105.3	65%	0.652	52%	0.524	S	S	*	.			trans	-118.4	71.2	-179	-91.4	-54.7	0	0	0	113.2	S637 Q639 K643	S637-N641 PolarHBondContact O-N 3.46Å; Q639-N641 VanDerWaalsContact C-N 3.35Å; N641-K643 PolarHBondContact O-N 2.9Å; N641-K643 VanDerWaalsContact O-N 3.14Å
642	P	51.1	Low	56.8	Low	75 Å²	75	107.6 Å²	107.6	49%	0.487	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-13.8	-176	27	-35.7	0	0	0	114.8	Q640 I644 H646	Q640-P642 VanDerWaalsContact C-CD 3.45Å; Q640-P642 VanDerWaalsContact O-CD 3.27Å; Q640-P642 WeakPolarHBondContact O-CD 3.46Å; P642-I644 PolarHBondContact O-N 3.22Å; P642-H646 PolarHBondContact O-CD2 3.18Å
643	K	46.2	Very low	54.4	Low	198 Å²	198	110.6 Å²	110.6	86%	0.861	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-3.6	-163.2	-67.9	-171.9	176.4	-179	0	116.9	N641	N641-K643 PolarHBondContact O-N 2.9Å; N641-K643 VanDerWaalsContact O-N 3.14Å
644	I	45.3	Very low	52.1	Low	147 Å²	147	110.8 Å²	110.8	75%	0.754	55%	0.551	S	S	*	*	S	Bend	trans	-120.9	-36.6	-170.3	-61.6	-177.8	0	0	0	114.9	P642	P642-I644 PolarHBondContact O-N 3.22Å
645	N	36.9	Very low	50.1	Low	92 Å²	92	111.1 Å²	111.1	49%	0.492	55%	0.554	S	S	.	*			trans	-107.2	11.9	-164.8	-71.8	-26.9	0	0	0	117	R647 Q648 I649	N645-R647 PolarHBondContact O-N 2.94Å; N645-Q648 PolarHBondContact O-N 2.98Å; N645-I649 HydrophobicContact CB-CD1 3.62Å; N645-I649 HydrophobicContact CB-CG1 4.25Å
646	H	34.1	Very low	48.1	Very low	117 Å²	117	114.9 Å²	114.9	54%	0.542	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59.6	-17.6	-171.3	-97.9	-58.1	0	0	0	116.6	P642 N650	P642-H646 PolarHBondContact O-CD2 3.18Å; H646-N650 PolarHBondContact ND1-ND2 3.21Å
647	R	36.5	Very low	46.2	Very low	250 Å²	250	112.8 Å²	112.8	94%	0.943	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-11.1	-178.1	-78.5	-173.9	172.5	-179.7	-1.9	115.9	N645	N645-R647 PolarHBondContact O-N 2.94Å
648	Q	44.6	Very low	44.5	Very low	178 Å²	178	114.8 Å²	114.8	83%	0.832	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	-26.8	-178.3	-79.8	175.2	-30.8	0	0	114.6	N645	N645-Q648 PolarHBondContact O-N 2.98Å
649	I	42.2	Very low	43.2	Very low	85 Å²	85	115.1 Å²	115.1	44%	0.436	57%	0.567	S	S	.	*	S	Bend	trans	-82.3	-27.2	-176.1	-61	179.7	0	0	0	112.5	N645 K651	N645-I649 HydrophobicContact CB-CD1 3.62Å; N645-I649 HydrophobicContact CB-CG1 4.25Å; I649-K651 PolarHBondContact O-N 2.88Å
650	N	34.1	Very low	42.4	Very low	73 Å²	73	114.1 Å²	114.1	39%	0.39	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.7	8.9	-163.5	-76.4	18	0	0	0	116.8	H646	H646-N650 PolarHBondContact ND1-ND2 3.21Å
651	K	38.6	Very low	41.5	Very low	196 Å²	196	112 Å²	112	85%	0.852	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-6	-179.6	-81.9	-167.1	173.2	-172.3	0	116.3	I649	I649-K651 PolarHBondContact O-N 2.88Å
652	S	43.1	Very low	41.2	Very low	68 Å²	68	112.2 Å²	112.2	48%	0.476	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-131.7	-36.1	177.7	54.5	0	0	0	0	113.8	L656	S652-L656 PolarHBondContact O-N 3.48Å
653	Y	38.8	Very low	40.8	Very low	101 Å²	101	115.6 Å²	115.6	40%	0.396	56%	0.564	S	S	.	*	H	α-helix	trans	-68.3	-48.2	-168.5	-151.6	-92.9	0	0	0	113.6	A657	Y653-A657 PolarHBondContact O-N 3.48Å
654	L	38.4	Very low	40.5	Very low	92 Å²	92	114.9 Å²	114.9	48%	0.482	56%	0.556	S	S	.	*	H	α-helix	trans	-70	-43.3	-179.5	-72.4	168	0	0	0	112.4	L656 A657 E658	L654-L656 VanDerWaalsContact C-N 3.29Å; L654-L656 PolarHBondContact O-N 3.26Å; L654-A657 PolarHBondContact O-N 2.93Å; L654-E658 PolarHBondContact O-N 3.31Å
655	A	42	Very low	40.1	Very low	42 Å²	42	111.9 Å²	111.9	35%	0.347	55%	0.549	S	S	.	.	H	α-helix	trans	-61.7	-34.6	-178.7	0	0	0	0	0	113.1	L659	A655-L659 WeakPolarHBondContact O-CB 3.18Å; A655-L659 WeakPolarHBondContact O-CD1 3.44Å; A655-L659 VanDerWaalsContact O-CG 3.23Å; A655-L659 WeakPolarHBondContact O-CG 3.43Å; A655-L659 PolarHBondContact O-N 2.9Å
656	L	39	Very low	39.9	Very low	93 Å²	93	116.4 Å²	116.4	49%	0.487	57%	0.569	S	S	.	*	H	α-helix	trans	-79.1	-35.7	176.6	-72.9	171.3	0	0	0	112.9	S652 L654 Q660	S652-L656 PolarHBondContact O-N 3.48Å; L654-L656 VanDerWaalsContact C-N 3.29Å; L654-L656 PolarHBondContact O-N 3.26Å; L656-Q660 WeakPolarHBondContact O-CB 3.23Å; L656-Q660 WeakPolarHBondContact O-CG 3.35Å; L656-Q660 PolarHBondContact O-N 2.94Å
657	A	41.2	Very low	39.8	Very low	46 Å²	46	114.3 Å²	114.3	38%	0.38	58%	0.579	S	S	.	*	H	α-helix	trans	-64.3	-50	173.9	0	0	0	0	0	111.2	Y653 L654 L659 Q660 D661	Y653-A657 PolarHBondContact O-N 3.48Å; L654-A657 PolarHBondContact O-N 2.93Å; A657-L659 VanDerWaalsContact C-N 3.32Å; A657-L659 PolarHBondContact O-N 3.46Å; A657-Q660 PolarHBondContact O-N 2.96Å; A657-Q660 VanDerWaalsContact O-N 3.14Å; A657-D661 PolarHBondContact O-N 3.38Å
658	E	41.8	Very low	39.8	Very low	105 Å²	105	108.3 Å²	108.3	49%	0.491	58%	0.575	S	S	.	*	H	α-helix	trans	-62	-37.1	177.7	-73.8	-170.3	-155.3	0	0	113	L654 K662	L654-E658 PolarHBondContact O-N 3.31Å; E658-K662 VanDerWaalsContact O-CB 3.22Å; E658-K662 WeakPolarHBondContact O-CB 3.47Å; E658-K662 WeakPolarHBondContact O-CD 3.17Å; E658-K662 WeakPolarHBondContact O-CG 3.38Å; E658-K662 PolarHBondContact O-N 3.16Å; E658-K662 IonicContact OE2-NZ 3.87Å; E658-K662 PolarHBondContact OE2-NZ 3.44Å
659	L	42.7	Very low	39.2	Very low	56 Å²	56	108.5 Å²	108.5	29%	0.293	58%	0.576	S	S	.	*	H	α-helix	trans	-69.1	-37	174.5	-77.7	170.6	0	0	0	112.1	A655 A657 L663	A655-L659 WeakPolarHBondContact O-CB 3.18Å; A655-L659 WeakPolarHBondContact O-CD1 3.44Å; A655-L659 VanDerWaalsContact O-CG 3.23Å; A655-L659 WeakPolarHBondContact O-CG 3.43Å; A655-L659 PolarHBondContact O-N 2.9Å; A657-L659 VanDerWaalsContact C-N 3.32Å; A657-L659 PolarHBondContact O-N 3.46Å; L659-L663 WeakPolarHBondContact O-CB 3.35Å; L659-L663 WeakPolarHBondContact O-CD1 3.31Å; L659-L663 WeakPolarHBondContact O-CG 3.34Å; L659-L663 PolarHBondContact O-N 3.47Å
660	Q	46.9	Very low	39	Very low	109 Å²	109	114.5 Å²	114.5	51%	0.509	60%	0.599	S	S	.	*	H	α-helix	trans	-72.4	-29.5	178.8	-76	-171.8	-10.2	0	0	113.7	L656 A657 R664	L656-Q660 WeakPolarHBondContact O-CB 3.23Å; L656-Q660 WeakPolarHBondContact O-CG 3.35Å; L656-Q660 PolarHBondContact O-N 2.94Å; A657-Q660 PolarHBondContact O-N 2.96Å; A657-Q660 VanDerWaalsContact O-N 3.14Å; Q660-R664 WeakPolarHBondContact O-CB 3.41Å; Q660-R664 WeakPolarHBondContact O-CD 3.43Å; Q660-R664 VanDerWaalsContact O-CG 3.28Å; Q660-R664 WeakPolarHBondContact O-CG 3.45Å
661	D	39.3	Very low	38.9	Very low	108 Å²	108	116.6 Å²	116.6	58%	0.578	62%	0.617	S	S	*	*	H	α-helix	trans	-78.9	-42.9	170.8	-80.8	-21.7	0	0	0	111.9	A657 L663 R664 S665	A657-D661 PolarHBondContact O-N 3.38Å; D661-L663 VanDerWaalsContact C-N 3.32Å; D661-L663 PolarHBondContact O-N 3.31Å; D661-R664 PolarHBondContact O-N 2.88Å; D661-S665 PolarHBondContact O-N 2.74Å; D661-S665 PolarHBondContact O-OG 2.93Å
662	K	41.7	Very low	39	Very low	125 Å²	125	113.1 Å²	113.1	54%	0.543	61%	0.614	S	S	.	*	H	α-helix	trans	-62.5	-37	176.8	-73.4	168.4	-179.1	161.9	0	112.1	E658 R664	E658-K662 VanDerWaalsContact O-CB 3.22Å; E658-K662 WeakPolarHBondContact O-CB 3.47Å; E658-K662 WeakPolarHBondContact O-CD 3.17Å; E658-K662 WeakPolarHBondContact O-CG 3.38Å; E658-K662 PolarHBondContact O-N 3.16Å; E658-K662 IonicContact OE2-NZ 3.87Å; E658-K662 PolarHBondContact OE2-NZ 3.44Å; K662-R664 PolarHBondContact O-N 3.39Å
663	L	43.8	Very low	38.7	Very low	147 Å²	147	116.4 Å²	116.4	77%	0.77	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-0.1	173.3	-67.1	170.8	0	0	0	114.3	L659 D661	L659-L663 WeakPolarHBondContact O-CB 3.35Å; L659-L663 WeakPolarHBondContact O-CD1 3.31Å; L659-L663 WeakPolarHBondContact O-CG 3.34Å; L659-L663 PolarHBondContact O-N 3.47Å; D661-L663 VanDerWaalsContact C-N 3.32Å; D661-L663 PolarHBondContact O-N 3.31Å
664	R	40.4	Very low	38.7	Very low	182 Å²	182	117.1 Å²	117.1	69%	0.687	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-4.1	174	-79	178.2	172.2	154.2	-0	114.7	Q660 D661 K662	Q660-R664 WeakPolarHBondContact O-CB 3.41Å; Q660-R664 WeakPolarHBondContact O-CD 3.43Å; Q660-R664 VanDerWaalsContact O-CG 3.28Å; Q660-R664 WeakPolarHBondContact O-CG 3.45Å; D661-R664 PolarHBondContact O-N 2.88Å; K662-R664 PolarHBondContact O-N 3.39Å
665	S	36.2	Very low	38.5	Very low	85 Å²	85	118.3 Å²	118.3	59%	0.594	66%	0.664	S	S	*	*			trans	-135.3	27.3	-166.7	56.9	0	0	0	0	116	D661 G667	D661-S665 PolarHBondContact O-N 2.74Å; D661-S665 PolarHBondContact O-OG 2.93Å; S665-G667 PolarHBondContact O-N 3.08Å
666	M	32.8	Very low	38.2	Very low	187 Å²	187	122.3 Å²	122.3	92%	0.921	69%	0.687	S	S	*	*			trans	-83.3	93.8	165.3	-81.5	-66.3	-73.6	0	0	110.7
667	G	32.8	Very low	38.5	Very low	72 Å²	72	123.1 Å²	123.1	74%	0.742	70%	0.7	S	S	*	*			trans	-166.6	8.1	-171.2	0	0	0	0	0	120	S665	S665-G667 PolarHBondContact O-N 3.08Å
668	S	35.5	Very low	38.8	Very low	125 Å²	125	126.4 Å²	126.4	87%	0.874	72%	0.718	S	S	*	*			trans	-170.6	150.3	157.3	42.9	0	0	0	0	111.7
669	Q	33.1	Very low	39	Very low	182 Å²	182	127.5 Å²	127.5	85%	0.85	73%	0.734	S	S	*	*			trans	-99.5	145	-175.8	-61.1	163.8	-21.1	0	0	111.3
670	F	36.3	Very low	39	Very low	210 Å²	210	131.2 Å²	131.2	92%	0.921	76%	0.764	S	S	*	*			trans	-158.6	141.2	136.7	-90.9	-64.4	0	0	0	109.6
671	P	33.6	Very low	38.8	Very low	118 Å²	118	129.6 Å²	129.6	77%	0.766	78%	0.777	S	S	*	*			trans	-105.2	154.4	-168.3	38.6	-34.1	0	0	0	115.1
672	P	40	Very low	38.7	Very low	122 Å²	122	132.4 Å²	132.4	79%	0.792	79%	0.791	S	S	*	*			trans	-119.5	127.3	165.1	35	-22.3	0	0	0	115.1
673	V	36.6	Very low	38.5	Very low	138 Å²	138	134.5 Å²	134.5	84%	0.836	81%	0.809	S	S	*	*			trans	-6.6	138.9	157.9	-171	0	0	0	0	119.5
674	P	39.7	Very low	38.2	Very low	115 Å²	115	133.6 Å²	133.6	75%	0.747	81%	0.809	S	S	*	*			trans	-98.1	157.5	-177.6	38.9	-36.3	0	0	0	116.2
675	S	33.9	Very low	38.2	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	81%	0.813	S	S	*	*			trans	160.2	163.6	144.1	49.2	0	0	0	0	111.2
676	P	35.5	Very low	38.2	Very low	126 Å²	126	132 Å²	132	82%	0.818	82%	0.823	S	S	*	*			cis	-114.7	167.2	-13.8	39.3	-27.9	0	0	0	113.2
677	S	45.7	Very low	38.2	Very low	110 Å²	110	131.1 Å²	131.1	77%	0.769	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-90.2	146.2	174.5	52.3	0	0	0	0	113.1
678	P	46	Very low	38.2	Very low	116 Å²	116	133.1 Å²	133.1	75%	0.753	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-73.1	162.4	173.2	31.9	-35.6	0	0	0	112.7
679	P	47.7	Very low	38.1	Very low	128 Å²	128	136.4 Å²	136.4	83%	0.831	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-73.1	156.4	-175.4	-17.6	32.9	0	0	0	114.9
680	S	40.7	Very low	37.9	Very low	133 Å²	133	132 Å²	132	93%	0.93	81%	0.812	S	S	*	*	S	Bend	trans	-61.1	134.9	177.8	-43.4	0	0	0	0	113.3
681	G	44.3	Very low	37.7	Very low	76 Å²	76	128.8 Å²	128.8	78%	0.784	80%	0.799	S	S	*	*			trans	153.2	-14.7	163.9	0	0	0	0	0	118.1
682	L	37	Very low	37.7	Very low	166 Å²	166	130.4 Å²	130.4	87%	0.869	80%	0.8	S	S	*	*			trans	-125.7	119.2	-174.5	-80.1	164.4	0	0	0	112.7
683	N	36.7	Very low	37.2	Very low	170 Å²	170	131.6 Å²	131.6	91%	0.909	79%	0.793	S	S	*	*			trans	-77.5	127.3	170.4	-72.4	-49.2	0	0	0	110.4
684	V	38.3	Very low	37.1	Very low	128 Å²	128	130.1 Å²	130.1	78%	0.776	78%	0.78	S	S	*	*			trans	-130.8	130.8	168.3	-176.4	0	0	0	0	107.8
685	P	40.6	Very low	36.7	Very low	120 Å²	120	129 Å²	129	78%	0.779	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-64.8	151.2	-172.7	-23.9	34.9	0	0	0	114.7
686	S	35.9	Very low	36.6	Very low	114 Å²	114	126.7 Å²	126.7	80%	0.797	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-71	147.1	177.2	41.3	0	0	0	0	113.3
687	L	31.4	Very low	36.5	Very low	168 Å²	168	124.6 Å²	124.6	88%	0.88	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-80.9	141.8	166.5	-73.1	83.9	0	0	0	110.7
688	P	33.7	Very low	35.9	Very low	113 Å²	113	125.2 Å²	125.2	73%	0.734	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-102.5	135.7	151.4	-3.9	24.4	0	0	0	112
689	E	33.5	Very low	35.2	Very low	195 Å²	195	124.2 Å²	124.2	91%	0.911	74%	0.74	S	S	*	*			trans	43.7	106.3	148.2	-52.8	-161.2	132.3	0	0	120.6
690	S	28.7	Very low	34.3	Very low	90 Å²	90	122.3 Å²	122.3	63%	0.629	73%	0.73	S	S	*	*			trans	-96.1	165.6	173.1	47.9	0	0	0	0	113.9
691	H	31.7	Very low	33.8	Very low	141 Å²	141	122.8 Å²	122.8	65%	0.653	72%	0.719	S	S	*	*	S	Bend	trans	95.1	25.7	157.9	-47.3	-60.3	0	0	0	122.3
692	I	33.8	Very low	33	Very low	153 Å²	153	127.3 Å²	127.3	79%	0.785	71%	0.712	S	S	*	*	S	Bend	trans	-111.8	-12	165.4	-62.1	-179.4	0	0	0	113.7
693	F	30.9	Very low	32.6	Very low	146 Å²	146	125.8 Å²	125.8	64%	0.64	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-83	-28.6	-150.4	-148.5	-127.6	0	0	0	117.9	A695 L696 I697	F693-A695 VanDerWaalsContact C-N 3.31Å; F693-A695 PolarHBondContact O-N 3.18Å; F693-A695 VanDerWaalsContact O-N 3.12Å; F693-L696 PolarHBondContact O-N 2.96Å; F693-I697 HydrophobicContact CD1-CD1 3.6Å; F693-I697 HydrophobicContact CD1-CG1 4.06Å; F693-I697 HydrophobicContact CE1-CD1 3.74Å; F693-I697 HydrophobicContact CE1-CG1 3.98Å; F693-I697 HydrophobicContact CG-CD1 4.45Å; F693-I697 HydrophobicContact CZ-CG1 4.49Å
694	N	32.6	Very low	32.1	Very low	108 Å²	108	126.1 Å²	126.1	58%	0.578	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-72.4	-10.1	-162.4	-78	-6.9	0	0	0	116.8
695	A	31.6	Very low	31.5	Very low	90 Å²	90	123.9 Å²	123.9	74%	0.744	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-97.7	-9.4	179.7	0	0	0	0	0	114.4	F693	F693-A695 VanDerWaalsContact C-N 3.31Å; F693-A695 PolarHBondContact O-N 3.18Å; F693-A695 VanDerWaalsContact O-N 3.12Å
696	L	32.4	Very low	30.8	Very low	69 Å²	69	123.8 Å²	123.8	36%	0.361	68%	0.684	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.8	-21.5	-170.6	-72.7	161.7	0	0	0	114.1	F693 S699 S700	F693-L696 PolarHBondContact O-N 2.96Å; L696-S699 PolarHBondContact O-OG 3.12Å; L696-S700 WeakPolarHBondContact O-CB 3.46Å; L696-S700 PolarHBondContact O-N 3.28Å
697	I	33.7	Very low	30.3	Very low	83 Å²	83	124.8 Å²	124.8	43%	0.426	69%	0.691	S	S	.	*	H	α-helix	trans	-70.4	-40.6	-168.6	-53.9	172.1	0	0	0	112.2	F693 S699	F693-I697 HydrophobicContact CD1-CD1 3.6Å; F693-I697 HydrophobicContact CD1-CG1 4.06Å; F693-I697 HydrophobicContact CE1-CD1 3.74Å; F693-I697 HydrophobicContact CE1-CG1 3.98Å; F693-I697 HydrophobicContact CG-CD1 4.45Å; F693-I697 HydrophobicContact CZ-CG1 4.49Å; I697-S699 VanDerWaalsContact C-N 3.27Å; I697-S699 PolarHBondContact O-N 3.36Å
698	S	32.7	Very low	30.3	Very low	122 Å²	122	120.1 Å²	120.1	85%	0.853	67%	0.672	S	S	*	*	H	α-helix	trans	-72.7	-14.7	-174	-54.8	0	0	0	0	114.8
699	S	31.1	Very low	30.2	Very low	96 Å²	96	120.3 Å²	120.3	67%	0.671	66%	0.663	S	S	*	*	H	α-helix	trans	-116.1	-17.3	-172.4	54.8	0	0	0	0	114.4	L696 I697	L696-S699 PolarHBondContact O-OG 3.12Å; I697-S699 VanDerWaalsContact C-N 3.27Å; I697-S699 PolarHBondContact O-N 3.36Å
700	S	30	Very low	30.1	Very low	88 Å²	88	116 Å²	116	62%	0.615	65%	0.646	S	S	*	*	H	α-helix	trans	-111.2	3.2	-169	-159.1	0	0	0	0	115.3	L696	L696-S700 WeakPolarHBondContact O-CB 3.46Å; L696-S700 PolarHBondContact O-N 3.28Å
701	M	28.5	Very low	30.3	Very low	143 Å²	143	116.8 Å²	116.8	70%	0.704	64%	0.643	S	S	*	*			trans	-127.8	50.9	-176.5	-64.6	-66.7	-78.3	0	0	112.5
702	R	27.8	Very low	30.3	Very low	170 Å²	170	113.7 Å²	113.7	64%	0.642	63%	0.631	S	S	*	*			trans	-111	89.4	159.1	-76.5	-167.1	179.6	-160.5	-0.4	108.3	N716	R702-N716 PolarHBondContact NH2-ND2 3.34Å
703	N	28.2	Very low	30.6	Very low	135 Å²	135	109.2 Å²	109.2	72%	0.722	61%	0.609	S	S	*	*			trans	-65.1	158.7	176	-69.6	-2.4	0	0	0	110.9	S705	N703-S705 PolarHBondContact O-N 3.4Å
704	H	26.6	Very low	31	Very low	176 Å²	176	105 Å²	105	82%	0.815	59%	0.593	S	S	*	*	S	Bend	trans	-75.7	116.3	-177.3	-62.3	-109	0	0	0	111.4
705	S	25.5	Very low	30.8	Very low	81 Å²	81	104 Å²	104	57%	0.566	59%	0.588	S	S	*	*			trans	-169.7	168.4	143.7	69.4	0	0	0	0	111.7	N703	N703-S705 PolarHBondContact O-N 3.4Å
706	D	26.2	Very low	31.1	Very low	119 Å²	119	103 Å²	103	64%	0.636	57%	0.569	S	S	*	*			trans	63.7	93.5	151.5	-47.1	-36.7	0	0	0	120.4	S708	D706-S708 PolarHBondContact O-N 2.95Å; D706-S708 PolarHBondContact O-OG 3.33Å; D706-S708 VanDerWaalsContact O-OG 3.08Å
707	S	26.9	Very low	31.9	Very low	135 Å²	135	100.8 Å²	100.8	94%	0.944	56%	0.558	S	S	*	*	S	Bend	trans	-30.9	83.7	157.6	42.6	0	0	0	0	116.5
708	S	31.3	Very low	32.1	Very low	70 Å²	70	100 Å²	100	49%	0.49	56%	0.56	S	S	.	*			trans	-153.3	0.1	176.3	59.5	0	0	0	0	115.8	D706 L710	D706-S708 PolarHBondContact O-N 2.95Å; D706-S708 PolarHBondContact O-OG 3.33Å; D706-S708 VanDerWaalsContact O-OG 3.08Å; S708-L710 PolarHBondContact O-N 2.9Å
709	Q	31.3	Very low	32.4	Very low	116 Å²	116	101.4 Å²	101.4	54%	0.542	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	-17.8	-150.5	-60.8	-152.9	21.8	0	0	117.2	N711 N712	Q709-N711 PolarHBondContact O-N 3.38Å; Q709-N712 PolarHBondContact O-N 2.74Å
710	L	31.2	Very low	32.9	Very low	104 Å²	104	100.3 Å²	100.3	55%	0.545	54%	0.543	S	S	.	.	H	α-helix	trans	-56.5	-34.7	177.8	-83.2	165.1	0	0	0	113	S708	S708-L710 PolarHBondContact O-N 2.9Å
711	N	31.6	Very low	33.5	Very low	108 Å²	108	98.2 Å²	98.2	58%	0.578	54%	0.535	S	S	*	.	H	α-helix	trans	-80.7	-18.9	179.5	-70	-20.5	0	0	0	113.5	N552 Q709	N552-N711 PolarHBondContact ND2-OD1 3.34Å; N552-N711 VanDerWaalsContact ND2-OD1 3.12Å; Q709-N711 PolarHBondContact O-N 3.38Å
712	N	33	Very low	34.5	Very low	75 Å²	75	97.5 Å²	97.5	40%	0.401	53%	0.534	S	S	.	.	H	α-helix	trans	-86.6	-10.4	-177.2	-102.7	-37.9	0	0	0	113.9	Q709 N716	Q709-N712 PolarHBondContact O-N 2.74Å; N712-N716 PolarHBondContact O-N 2.95Å; N712-N716 PolarHBondContact O-ND2 3.29Å
713	I	40.6	Very low	36.2	Very low	60 Å²	60	93.2 Å²	93.2	31%	0.308	54%	0.535	S	S	.	.	H	α-helix	trans	-66.5	-49.6	175.7	-66.1	172.9	0	0	0	110.2	N715 N716 I717	I713-N715 VanDerWaalsContact C-N 3.29Å; I713-N715 PolarHBondContact O-N 3.11Å; I713-N716 PolarHBondContact O-N 3.49Å; I713-I717 HydrophobicContact CG2-CD1 3.57Å; I713-I717 HydrophobicContact CG2-CG1 4.19Å; I713-I717 WeakPolarHBondContact O-CG1 3.47Å; I713-I717 PolarHBondContact O-N 3.08Å
714	N	37.6	Very low	38.4	Very low	57 Å²	57	90.4 Å²	90.4	31%	0.305	52%	0.519	S	S	.	.	H	α-helix	trans	-56.5	-40.4	177.2	-76.2	-18.8	0	0	0	112.7	S553 N716 S718	S553-N714 WeakPolarHBondContact CB-OD1 3.4Å; N714-N716 VanDerWaalsContact C-N 3.31Å; N714-N716 PolarHBondContact O-N 3.12Å; N714-S718 WeakPolarHBondContact O-CB 3.31Å; N714-S718 PolarHBondContact O-N 3.41Å; N714-S718 VanDerWaalsContact O-N 3.15Å; N714-S718 PolarHBondContact O-OG 3Å
715	N	29	Very low	41.1	Very low	88 Å²	88	82.5 Å²	82.5	47%	0.471	48%	0.483	S	S	.	.	H	α-helix	trans	-74	-15.2	178.4	-79.4	-22.8	0	0	0	114.6	I713 K719	I713-N715 VanDerWaalsContact C-N 3.29Å; I713-N715 PolarHBondContact O-N 3.11Å; N715-K719 WeakPolarHBondContact O-CD 3.27Å; N715-K719 VanDerWaalsContact O-CG 3.23Å; N715-K719 WeakPolarHBondContact O-CG 3.29Å
716	N	38.9	Very low	44	Very low	67 Å²	67	81.3 Å²	81.3	36%	0.358	48%	0.475	S	S	.	.	H	α-helix	trans	-97.4	-40.7	175.5	-77.3	-65.7	0	0	0	111.8	R702 N712 I713 N714 S718 K719 S720	R702-N716 PolarHBondContact NH2-ND2 3.34Å; N712-N716 PolarHBondContact O-N 2.95Å; N712-N716 PolarHBondContact O-ND2 3.29Å; I713-N716 PolarHBondContact O-N 3.49Å; N714-N716 VanDerWaalsContact C-N 3.31Å; N714-N716 PolarHBondContact O-N 3.12Å; N716-S718 VanDerWaalsContact C-N 3.34Å; N716-S718 PolarHBondContact O-N 2.91Å; N716-K719 PolarHBondContact O-N 3.35Å; N716-K719 VanDerWaalsContact O-N 3.16Å; N716-S720 PolarHBondContact O-N 3.46Å; N716-S720 PolarHBondContact O-OG 2.86Å
717	I	48.2	Very low	46.9	Very low	23 Å²	23	77.6 Å²	77.6	12%	0.118	46%	0.457	C	S	.	.	H	α-helix	trans	-62	-41.9	174.5	-65.3	176.8	0	0	0	110.9	W555 L560 I713 K719 S720 G721	W555-I717 HydrophobicContact CH2-CG2 4.2Å; W555-I717 HydrophobicContact CZ2-CG2 3.78Å; L560-I717 HydrophobicContact CD1-CD1 4.11Å; I713-I717 HydrophobicContact CG2-CD1 3.57Å; I713-I717 HydrophobicContact CG2-CG1 4.19Å; I713-I717 WeakPolarHBondContact O-CG1 3.47Å; I713-I717 PolarHBondContact O-N 3.08Å; I717-K719 VanDerWaalsContact C-N 3.27Å; I717-K719 PolarHBondContact O-N 3.09Å; I717-S720 PolarHBondContact O-N 3.33Å; I717-S720 PolarHBondContact O-OG 3.23Å; I717-S720 VanDerWaalsContact O-OG 3.08Å; I717-G721 PolarHBondContact O-N 3.25Å
718	S	38.7	Very low	49.8	Very low	67 Å²	67	75 Å²	75	47%	0.469	43%	0.432	S	S	.	.	H	α-helix	trans	-66.7	-25.4	175.8	54.3	0	0	0	0	113.9	N714 N716	N714-S718 WeakPolarHBondContact O-CB 3.31Å; N714-S718 PolarHBondContact O-N 3.41Å; N714-S718 VanDerWaalsContact O-N 3.15Å; N714-S718 PolarHBondContact O-OG 3Å; N716-S718 VanDerWaalsContact C-N 3.34Å; N716-S718 PolarHBondContact O-N 2.91Å
719	K	37.7	Very low	52.5	Low	151 Å²	151	72.5 Å²	72.5	66%	0.657	42%	0.415	S	S	*	.	H	α-helix	trans	-85.8	-32.3	177	-72.8	178.5	-171.3	173.6	0	113.2	N715 N716 I717	N715-K719 WeakPolarHBondContact O-CD 3.27Å; N715-K719 VanDerWaalsContact O-CG 3.23Å; N715-K719 WeakPolarHBondContact O-CG 3.29Å; N716-K719 PolarHBondContact O-N 3.35Å; N716-K719 VanDerWaalsContact O-N 3.16Å; I717-K719 VanDerWaalsContact C-N 3.27Å; I717-K719 PolarHBondContact O-N 3.09Å
720	S	43	Very low	55.4	Low	74 Å²	74	67 Å²	67	52%	0.517	39%	0.389	S	S	.	.	H	α-helix	trans	-70.5	-34.9	175.5	61	0	0	0	0	112.5	N716 I717 N722 A723	N716-S720 PolarHBondContact O-N 3.46Å; N716-S720 PolarHBondContact O-OG 2.86Å; I717-S720 PolarHBondContact O-N 3.33Å; I717-S720 PolarHBondContact O-OG 3.23Å; I717-S720 VanDerWaalsContact O-OG 3.08Å; S720-N722 PolarHBondContact O-N 2.89Å; S720-A723 PolarHBondContact O-N 3.47Å
721	G	41.6	Very low	58.2	Low	43 Å²	43	68.3 Å²	68.3	44%	0.443	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	8.8	-178	0	0	0	0	0	117.5	I717	I717-G721 PolarHBondContact O-N 3.25Å
722	N	49.8	Very low	61	Low	129 Å²	129	70 Å²	70	69%	0.69	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-5.5	-179.9	-74.2	-19.7	0	0	0	114.3	S720	S720-N722 PolarHBondContact O-N 2.89Å
723	A	63.1	Low	63.8	Low	79 Å²	79	66.4 Å²	66.4	65%	0.653	37%	0.366	S	S	*	.	S	Bend	trans	-77.9	124.8	169.3	0	0	0	0	0	109.9	S720	S720-A723 PolarHBondContact O-N 3.47Å
724	L	75.6	Confident	66.3	Low	76 Å²	76	66.7 Å²	66.7	40%	0.398	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-72.3	132.1	170.6	-74.8	166.6	0	0	0	109.7	L631 A634	L631-L724 HydrophobicContact CD2-CD2 4.32Å; A634-L724 HydrophobicContact CB-CD2 4.28Å
725	P	83.5	Confident	68.8	Low	10 Å²	10	69.5 Å²	69.5	7%	0.065	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-68	155.2	179.1	28.9	-35.3	0	0	0	111.3	A598 G600 L631 H635 L730	A598-P725 WeakPolarHBondContact O-CD 3.35Å; A598-P725 WeakPolarHBondContact O-CG 3.47Å; G600-P725 VanDerWaalsContact CA-CB 3.48Å; L631-P725 HydrophobicContact CD1-CG 4.47Å; H635-P725 PolarHBondContact CE1-O 3.41Å; H635-P725 VanDerWaalsContact CE1-O 3.29Å; H635-P725 PolarHBondContact NE2-O 3.31Å; P725-L730 HydrophobicContact CG-CD1 4.14Å; P725-L730 HydrophobicContact CG-CD2 3.82Å; P725-L730 HydrophobicContact CG-CG 3.97Å
726	S	85.5	Confident	71.8	Confident	56 Å²	56	66.3 Å²	66.3	39%	0.392	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-63.7	147.5	-174.7	73.3	0	0	0	0	112.8	D728 S729 L730	S726-D728 PolarHBondContact O-N 3.49Å; S726-S729 PolarHBondContact N-OG 3.06Å; S726-S729 PolarHBondContact O-N 3.47Å; S726-S729 PolarHBondContact O-OG 3.36Å; S726-S729 WeakPolarHBondContact OG-CB 3.47Å; S726-S729 PolarHBondContact OG-N 2.93Å; S726-S729 PolarHBondContact OG-OG 2.94Å; S726-L730 PolarHBondContact O-N 3.05Å
727	V	87.2	Confident	74.2	Confident	42 Å²	42	63.2 Å²	63.2	26%	0.255	34%	0.343	S	S	.	.	H	α-helix	trans	-60	-34.4	-179.5	178.5	0	0	0	0	111.6	L632 H635 R731	L632-V727 HydrophobicContact CD2-CG1 4.19Å; H635-V727 HydrophobicContact CB-CG2 4.37Å; V727-R731 WeakPolarHBondContact O-CB 3.47Å; V727-R731 PolarHBondContact O-N 3.41Å
728	D	87.3	Confident	76.1	Confident	80 Å²	80	65 Å²	65	43%	0.428	36%	0.355	S	S	.	.	H	α-helix	trans	-71.3	-34.1	174.9	-75.6	-43.2	0	0	0	113.4	S726 R731 R732	S726-D728 PolarHBondContact O-N 3.49Å; D728-R731 PolarHBondContact O-N 3.37Å; D728-R731 IonicContact OD1-NH1 2.76Å; D728-R731 PolarHBondContact OD1-NH1 2.99Å; D728-R732 WeakPolarHBondContact O-CG 3.47Å; D728-R732 PolarHBondContact O-N 3.28Å
729	S	89.5	Confident	78.4	Confident	17 Å²	17	63.8 Å²	63.8	12%	0.119	35%	0.35	C	S	.	.	H	α-helix	trans	-70	-40.3	174.1	73.5	0	0	0	0	111.1	G600 S726 R731 R732 L733	G600-S729 VanDerWaalsContact O-CB 3.3Å; G600-S729 WeakPolarHBondContact O-CB 3.47Å; G600-S729 PolarHBondContact O-OG 3.19Å; S726-S729 PolarHBondContact N-OG 3.06Å; S726-S729 PolarHBondContact O-N 3.47Å; S726-S729 PolarHBondContact O-OG 3.36Å; S726-S729 WeakPolarHBondContact OG-CB 3.47Å; S726-S729 PolarHBondContact OG-N 2.93Å; S726-S729 PolarHBondContact OG-OG 2.94Å; S729-R731 VanDerWaalsContact C-N 3.33Å; S729-R731 PolarHBondContact O-N 3.11Å; S729-R732 PolarHBondContact O-N 2.88Å; S729-L733 WeakPolarHBondContact O-CB 3.24Å; S729-L733 VanDerWaalsContact O-CG 3.27Å; S729-L733 WeakPolarHBondContact O-CG 3.41Å; S729-L733 PolarHBondContact O-N 3.23Å
730	L	90.7	Very high	80.6	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-40.4	170.9	-70.6	174.3	0	0	0	112.4	I628 L631 L632 P725 S726 L733 H734	I628-L730 HydrophobicContact CG2-CB 4.4Å; I628-L730 HydrophobicContact CG2-CD2 4.33Å; L631-L730 HydrophobicContact CB-CD1 3.91Å; L631-L730 HydrophobicContact CB-CD2 3.94Å; L631-L730 HydrophobicContact CD1-CD2 3.89Å; L632-L730 HydrophobicContact CD2-CB 3.8Å; L632-L730 HydrophobicContact CD2-CD1 3.84Å; L632-L730 HydrophobicContact CD2-CG 4.49Å; L632-L730 HydrophobicContact CG-CB 4.22Å; L632-L730 HydrophobicContact CG-CD1 4.14Å; P725-L730 HydrophobicContact CG-CD1 4.14Å; P725-L730 HydrophobicContact CG-CD2 3.82Å; P725-L730 HydrophobicContact CG-CG 3.97Å; S726-L730 PolarHBondContact O-N 3.05Å; L730-L733 PolarHBondContact O-N 3.08Å; L730-H734 WeakPolarHBondContact O-CB 3.14Å; L730-H734 PolarHBondContact O-N 3.48Å
731	R	90.5	Very high	82.5	Confident	133 Å²	133	56.8 Å²	56.8	50%	0.502	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-46.4	174.7	-174.9	-178.3	-69.1	146.5	-4.3	111.9	V727 D728 S729 H734 E735	V727-R731 WeakPolarHBondContact O-CB 3.47Å; V727-R731 PolarHBondContact O-N 3.41Å; D728-R731 PolarHBondContact O-N 3.37Å; D728-R731 IonicContact OD1-NH1 2.76Å; D728-R731 PolarHBondContact OD1-NH1 2.99Å; S729-R731 VanDerWaalsContact C-N 3.33Å; S729-R731 PolarHBondContact O-N 3.11Å; R731-H734 WeakPolarHBondContact O-CB 3.39Å; R731-H734 PolarHBondContact O-N 2.97Å; R731-E735 WeakPolarHBondContact CG-OE1 3.29Å; R731-E735 WeakPolarHBondContact O-CG 3.41Å; R731-E735 PolarHBondContact O-N 3.15Å
732	R	90.8	Very high	84.4	Confident	142 Å²	142	57.1 Å²	57.1	54%	0.536	31%	0.31	S	S	.	.	H	α-helix	trans	-63.7	-40.3	176.8	-69.5	177.2	-171.1	-173.6	4.9	112.5	F602 D728 S729 E735 L736	F602-R732 HydrophobicContact CD2-CB 3.67Å; F602-R732 HydrophobicContact CE2-CB 3.94Å; D728-R732 WeakPolarHBondContact O-CG 3.47Å; D728-R732 PolarHBondContact O-N 3.28Å; S729-R732 PolarHBondContact O-N 2.88Å; R732-E735 PolarHBondContact O-N 3.37Å; R732-L736 VanDerWaalsContact O-CB 3.32Å; R732-L736 WeakPolarHBondContact O-CB 3.13Å; R732-L736 PolarHBondContact O-N 3.16Å
733	L	91.8	Very high	85.9	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.4	-42.8	174.3	-74.6	167.2	0	0	0	111.3	A605 I628 S729 L730 L736 I737	A605-L733 HydrophobicContact CB-CD2 3.37Å; I628-L733 HydrophobicContact CD1-CB 3.82Å; S729-L733 WeakPolarHBondContact O-CB 3.24Å; S729-L733 VanDerWaalsContact O-CG 3.27Å; S729-L733 WeakPolarHBondContact O-CG 3.41Å; S729-L733 PolarHBondContact O-N 3.23Å; L730-L733 PolarHBondContact O-N 3.08Å; L733-L736 PolarHBondContact O-N 3.39Å; L733-I737 WeakPolarHBondContact O-CD1 3.42Å; L733-I737 WeakPolarHBondContact O-CG1 3.36Å; L733-I737 PolarHBondContact O-N 3.47Å
734	H	91.7	Very high	86.6	Confident	67 Å²	67	53.2 Å²	53.2	31%	0.31	27%	0.268	S	S	.	.	H	α-helix	trans	-60.5	-50.6	174.3	178.4	-91.4	0	0	0	111.6	I628 L730 R731 L736 I737 V738	I628-H734 HydrophobicContact CG2-CB 4.1Å; L730-H734 WeakPolarHBondContact O-CB 3.14Å; L730-H734 PolarHBondContact O-N 3.48Å; R731-H734 WeakPolarHBondContact O-CB 3.39Å; R731-H734 PolarHBondContact O-N 2.97Å; H734-L736 VanDerWaalsContact C-N 3.33Å; H734-L736 PolarHBondContact O-N 3.47Å; H734-I737 PolarHBondContact O-N 3.48Å; H734-V738 WeakPolarHBondContact O-CB 3.38Å; H734-V738 VanDerWaalsContact O-CG2 3.31Å; H734-V738 WeakPolarHBondContact O-CG2 3.25Å; H734-V738 PolarHBondContact O-N 3.48Å
735	E	91.9	Very high	86.8	Confident	116 Å²	116	51.5 Å²	51.5	54%	0.542	26%	0.262	S	S	.	.	H	α-helix	trans	-58.4	-42.7	177.6	-73.5	171.1	-164.4	0	0	112.4	R731 R732 A739	R731-E735 WeakPolarHBondContact CG-OE1 3.29Å; R731-E735 WeakPolarHBondContact O-CG 3.41Å; R731-E735 PolarHBondContact O-N 3.15Å; R732-E735 PolarHBondContact O-N 3.37Å; E735-A739 VanDerWaalsContact O-CB 3.23Å; E735-A739 WeakPolarHBondContact O-CB 3.29Å; E735-A739 PolarHBondContact O-N 3.39Å
736	L	90.3	Very high	86.6	Confident	21 Å²	21	55.8 Å²	55.8	11%	0.11	28%	0.283	C	S	.	.	H	α-helix	trans	-58.2	-57	174.6	179.9	69.2	0	0	0	111.2	F602 N606 I609 R732 L733 H734 V738 A739 H740	F602-L736 HydrophobicContact CD2-CD2 4.33Å; F602-L736 HydrophobicContact CE2-CB 4Å; F602-L736 HydrophobicContact CE2-CD1 4.43Å; F602-L736 HydrophobicContact CE2-CD2 4.04Å; F602-L736 HydrophobicContact CE2-CG 4.39Å; F602-L736 HydrophobicContact CZ-CD1 4.39Å; N606-L736 HydrophobicContact CB-CD2 3.97Å; I609-L736 HydrophobicContact CD1-CD2 4.14Å; I609-L736 HydrophobicContact CD1-CG 4.42Å; R732-L736 VanDerWaalsContact O-CB 3.32Å; R732-L736 WeakPolarHBondContact O-CB 3.13Å; R732-L736 PolarHBondContact O-N 3.16Å; L733-L736 PolarHBondContact O-N 3.39Å; H734-L736 VanDerWaalsContact C-N 3.33Å; H734-L736 PolarHBondContact O-N 3.47Å; L736-V738 PolarHBondContact O-N 2.88Å; L736-A739 PolarHBondContact O-N 3.44Å; L736-A739 VanDerWaalsContact O-N 3.14Å; L736-H740 PolarHBondContact O-CD2 3.26Å; L736-H740 VanDerWaalsContact O-CD2 3.27Å; L736-H740 PolarHBondContact O-N 3.11Å
737	I	89.3	Confident	86.3	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-38.5	-175	-70.4	154.4	0	0	0	111.3	I597 I609 F615 A624 L625 I628 L733 H734 H740 H741	I597-I737 HydrophobicContact CD1-CD1 3.97Å; I597-I737 HydrophobicContact CG1-CD1 4.49Å; I609-I737 HydrophobicContact CD1-CG1 3.94Å; F615-I737 HydrophobicContact CD2-CG2 4.02Å; A624-I737 HydrophobicContact CB-CD1 3.71Å; A624-I737 HydrophobicContact CB-CG1 4.39Å; A624-I737 HydrophobicContact CB-CG2 4.06Å; L625-I737 HydrophobicContact CD2-CB 4.05Å; L625-I737 HydrophobicContact CD2-CG2 3.58Å; L625-I737 HydrophobicContact CG-CG2 3.78Å; I628-I737 HydrophobicContact CD1-CD1 3.47Å; I628-I737 VanDerWaalsContact CD1-CD1 3.47Å; L733-I737 WeakPolarHBondContact O-CD1 3.42Å; L733-I737 WeakPolarHBondContact O-CG1 3.36Å; L733-I737 PolarHBondContact O-N 3.47Å; H734-I737 PolarHBondContact O-N 3.48Å; I737-H740 PolarHBondContact O-N 3.37Å; I737-H741 VanDerWaalsContact O-CB 3.24Å; I737-H741 WeakPolarHBondContact O-CB 3.26Å; I737-H741 PolarHBondContact O-N 3.27Å
738	V	88.2	Confident	85.9	Confident	60 Å²	60	52.5 Å²	52.5	36%	0.364	26%	0.262	S	S	.	.	H	α-helix	trans	-62.8	-42.1	172.7	171.6	0	0	0	0	111.2	L625 H734 L736 H741 A742	L625-V738 HydrophobicContact CD1-CG2 4.36Å; L625-V738 HydrophobicContact CD2-CG2 3.74Å; H734-V738 WeakPolarHBondContact O-CB 3.38Å; H734-V738 VanDerWaalsContact O-CG2 3.31Å; H734-V738 WeakPolarHBondContact O-CG2 3.25Å; H734-V738 PolarHBondContact O-N 3.48Å; L736-V738 PolarHBondContact O-N 2.88Å; V738-H741 PolarHBondContact O-N 2.82Å; V738-A742 VanDerWaalsContact O-CB 3.23Å; V738-A742 WeakPolarHBondContact O-CB 3.31Å; V738-A742 PolarHBondContact O-N 3.46Å
739	A	86.9	Confident	85.7	Confident	43 Å²	43	50.4 Å²	50.4	36%	0.355	25%	0.252	S	S	.	.	H	α-helix	trans	-65.3	-41.1	178	0	0	0	0	0	112.5	E735 L736 R743	E735-A739 VanDerWaalsContact O-CB 3.23Å; E735-A739 WeakPolarHBondContact O-CB 3.29Å; E735-A739 PolarHBondContact O-N 3.39Å; L736-A739 PolarHBondContact O-N 3.44Å; L736-A739 VanDerWaalsContact O-N 3.14Å; A739-R743 VanDerWaalsContact O-CG 3.28Å; A739-R743 WeakPolarHBondContact O-CG 3.36Å; A739-R743 PolarHBondContact O-N 3.15Å
740	H	84	Confident	85.4	Confident	10 Å²	10	52.3 Å²	52.3	5%	0.046	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-53.8	172.5	-83.5	-96.8	0	0	0	111.1	I609 F615 L736 I737 A742 R743 L744 A816 Y818	I609-H740 VanDerWaalsContact CG2-CE1 3.41Å; I609-H740 WeakPolarHBondContact CG2-CE1 3.35Å; I609-H740 VanDerWaalsContact CG2-ND1 3.34Å; I609-H740 WeakPolarHBondContact CG2-ND1 3.16Å; F615-H740 HydrophobicContact CE1-CB 4.5Å; L736-H740 PolarHBondContact O-CD2 3.26Å; L736-H740 VanDerWaalsContact O-CD2 3.27Å; L736-H740 PolarHBondContact O-N 3.11Å; I737-H740 PolarHBondContact O-N 3.37Å; H740-A742 VanDerWaalsContact C-N 3.31Å; H740-A742 PolarHBondContact O-N 3.28Å; H740-R743 PolarHBondContact O-N 2.92Å; H740-L744 WeakPolarHBondContact O-CB 3.32Å; H740-L744 PolarHBondContact O-N 2.91Å; H740-A816 WeakPolarHBondContact CE1-CB 3.49Å; H740-Y818 AromaticContact ND1-CZ 3.98Å; H740-Y818 PolarHBondContact ND1-OH 3.03Å
741	H	83.7	Confident	84.9	Confident	67 Å²	67	53.7 Å²	53.7	31%	0.31	27%	0.268	S	S	.	.	H	α-helix	trans	-52.9	-45.5	177.8	-178.5	-86.5	0	0	0	112.6	F615 Y616 I737 V738 L744 S745	F615-H741 HydrophobicContact CE2-CB 3.96Å; F615-H741 HydrophobicContact CZ-CB 4.34Å; Y616-H741 AromaticContact CE1-CD2 3.6Å; Y616-H741 AromaticContact CE1-NE2 3.77Å; Y616-H741 AromaticContact CZ-CD2 3.65Å; Y616-H741 PolarHBondContact OH-CD2 3.38Å; Y616-H741 PolarHBondContact OH-NE2 3.13Å; I737-H741 VanDerWaalsContact O-CB 3.24Å; I737-H741 WeakPolarHBondContact O-CB 3.26Å; I737-H741 PolarHBondContact O-N 3.27Å; V738-H741 PolarHBondContact O-N 2.82Å; H741-L744 PolarHBondContact O-N 3.22Å; H741-S745 WeakPolarHBondContact O-CB 3.26Å; H741-S745 PolarHBondContact O-N 3.2Å
742	A	82.1	Confident	84.5	Confident	51 Å²	51	47.5 Å²	47.5	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-45.1	-178.8	0	0	0	0	0	112.8	V738 H740 L744 M746	V738-A742 VanDerWaalsContact O-CB 3.23Å; V738-A742 WeakPolarHBondContact O-CB 3.31Å; V738-A742 PolarHBondContact O-N 3.46Å; H740-A742 VanDerWaalsContact C-N 3.31Å; H740-A742 PolarHBondContact O-N 3.28Å; A742-L744 VanDerWaalsContact C-N 3.33Å; A742-M746 WeakPolarHBondContact O-CB 3.4Å; A742-M746 PolarHBondContact O-N 2.96Å; A742-M746 VanDerWaalsContact O-N 3.07Å
743	R	80	Confident	84	Confident	125 Å²	125	46.6 Å²	46.6	47%	0.472	24%	0.242	S	C	.	.	H	α-helix	trans	-59.7	-47.2	174.6	-70.2	172.8	-174.3	-160.6	9.1	110.8	A739 H740 M746 S747 P815 A816 Y818	A739-R743 VanDerWaalsContact O-CG 3.28Å; A739-R743 WeakPolarHBondContact O-CG 3.36Å; A739-R743 PolarHBondContact O-N 3.15Å; H740-R743 PolarHBondContact O-N 2.92Å; R743-M746 PolarHBondContact O-N 3.07Å; R743-S747 PolarHBondContact O-N 3.05Å; R743-S747 PolarHBondContact O-OG 2.75Å; R743-P815 PolarHBondContact NH1-O 2.78Å; R743-A816 PolarHBondContact NH1-O 3.32Å; R743-Y818 HydrophobicContact CB-CD2 4.46Å; R743-Y818 HydrophobicContact CB-CE2 4.5Å
744	L	78.2	Confident	83.6	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-63.8	-53.2	-175.2	-162.5	64.3	0	0	0	112.3	F615 Y616 H740 H741 A742 M746 S747 V748 W772 Y818	F615-L744 HydrophobicContact CE1-CD2 3.85Å; F615-L744 HydrophobicContact CZ-CD2 3.56Å; Y616-L744 HydrophobicContact CE2-CD2 4.35Å; H740-L744 WeakPolarHBondContact O-CB 3.32Å; H740-L744 PolarHBondContact O-N 2.91Å; H741-L744 PolarHBondContact O-N 3.22Å; A742-L744 VanDerWaalsContact C-N 3.33Å; L744-M746 VanDerWaalsContact C-N 3.34Å; L744-M746 PolarHBondContact O-N 3.16Å; L744-S747 PolarHBondContact O-N 3.2Å; L744-V748 WeakPolarHBondContact O-CG2 3.49Å; L744-V748 PolarHBondContact O-N 3.38Å; L744-W772 HydrophobicContact CD1-CD2 3.83Å; L744-W772 HydrophobicContact CD1-CE3 4.01Å; L744-W772 HydrophobicContact CD1-CH2 3.44Å; L744-W772 VanDerWaalsContact CD1-CH2 3.44Å; L744-W772 HydrophobicContact CD1-CZ2 3.18Å; L744-W772 HydrophobicContact CD1-CZ3 3.84Å; L744-W772 HydrophobicContact CD2-CD2 3.71Å; L744-W772 HydrophobicContact CD2-CE3 4.44Å; L744-W772 HydrophobicContact CD2-CG 3.68Å; L744-W772 HydrophobicContact CD2-CZ2 4.32Å; L744-W772 HydrophobicContact CG-CD2 3.96Å; L744-W772 HydrophobicContact CG-CG 4.35Å; L744-W772 HydrophobicContact CG-CH2 4.35Å; L744-W772 HydrophobicContact CG-CZ2 3.61Å; L744-Y818 HydrophobicContact CB-CE2 4.44Å; L744-Y818 HydrophobicContact CD1-CD1 3.36Å; L744-Y818 HydrophobicContact CD1-CD2 3.79Å; L744-Y818 HydrophobicContact CD1-CE1 3.44Å; L744-Y818 VanDerWaalsContact CD1-CE1 3.44Å; L744-Y818 HydrophobicContact CD1-CE2 3.87Å; L744-Y818 HydrophobicContact CD1-CG 3.54Å
745	S	79.5	Confident	83.1	Confident	39 Å²	39	48.5 Å²	48.5	27%	0.273	25%	0.253	S	S	.	.	H	α-helix	trans	-59.2	-43	176	172.9	0	0	0	0	111.7	H741 S747 V748 T749	H741-S745 WeakPolarHBondContact O-CB 3.26Å; H741-S745 PolarHBondContact O-N 3.2Å; S745-S747 PolarHBondContact O-N 2.75Å; S745-V748 PolarHBondContact O-N 2.83Å; S745-T749 WeakPolarHBondContact O-CB 3.48Å; S745-T749 PolarHBondContact O-N 2.69Å; S745-T749 PolarHBondContact O-OG1 3.03Å
746	M	79.3	Confident	82.5	Confident	101 Å²	101	43.1 Å²	43.1	50%	0.498	23%	0.228	S	C	.	.	H	α-helix	trans	-63.4	-40.8	177.7	-169.1	61.9	55.2	0	0	111.9	A742 R743 L744 N750	A742-M746 WeakPolarHBondContact O-CB 3.4Å; A742-M746 PolarHBondContact O-N 2.96Å; A742-M746 VanDerWaalsContact O-N 3.07Å; R743-M746 PolarHBondContact O-N 3.07Å; L744-M746 VanDerWaalsContact C-N 3.34Å; L744-M746 PolarHBondContact O-N 3.16Å; M746-N750 VanDerWaalsContact O-CB 3.29Å; M746-N750 WeakPolarHBondContact O-CB 3.44Å; M746-N750 PolarHBondContact O-N 2.89Å; M746-N750 PolarHBondContact O-ND2 3Å; M746-N750 PolarHBondContact SD-ND2 3.2Å; M746-N750 VanDerWaalsContact SD-ND2 3.36Å
747	S	78.7	Confident	82.1	Confident	29 Å²	29	46.6 Å²	46.6	20%	0.203	25%	0.251	C	S	.	.	H	α-helix	trans	-65.1	-48.4	176.6	-61.3	0	0	0	0	112.3	R743 L744 S745 L751	R743-S747 PolarHBondContact O-N 3.05Å; R743-S747 PolarHBondContact O-OG 2.75Å; L744-S747 PolarHBondContact O-N 3.2Å; S745-S747 PolarHBondContact O-N 2.75Å; S747-L751 WeakPolarHBondContact O-CB 3.17Å; S747-L751 PolarHBondContact O-N 3.41Å
748	V	80.2	Confident	81.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-66.1	-54.2	179.2	174.2	0	0	0	0	111.3	L744 S745 N750 L751 V752 W772 V808 V820 A889 M891	L744-V748 WeakPolarHBondContact O-CG2 3.49Å; L744-V748 PolarHBondContact O-N 3.38Å; S745-V748 PolarHBondContact O-N 2.83Å; V748-N750 VanDerWaalsContact C-N 3.29Å; V748-N750 PolarHBondContact O-N 2.83Å; V748-L751 PolarHBondContact O-N 3.43Å; V748-L751 VanDerWaalsContact O-N 3.08Å; V748-V752 HydrophobicContact CG1-CG2 4.03Å; V748-V752 WeakPolarHBondContact O-CG2 3.4Å; V748-V752 PolarHBondContact O-N 2.87Å; V748-W772 HydrophobicContact CG2-CZ2 3.53Å; V748-V808 HydrophobicContact CG1-CG2 4.22Å; V748-V820 HydrophobicContact CG2-CG1 4.46Å; V748-A889 HydrophobicContact CG2-CB 3.99Å; V748-M891 HydrophobicContact CG1-CE 4.25Å
749	T	82.1	Confident	81.2	Confident	36 Å²	36	53.3 Å²	53.3	22%	0.221	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-37.1	-173.5	-53.1	0	0	0	0	111.7	S745 R753	S745-T749 WeakPolarHBondContact O-CB 3.48Å; S745-T749 PolarHBondContact O-N 2.69Å; S745-T749 PolarHBondContact O-OG1 3.03Å; T749-R753 WeakPolarHBondContact O-CB 3.31Å; T749-R753 PolarHBondContact O-N 3.33Å
750	N	82.7	Confident	80.9	Confident	57 Å²	57	56.6 Å²	56.6	31%	0.305	29%	0.29	S	S	.	.	H	α-helix	trans	-68.8	-42.6	175.4	-70.9	-25.9	0	0	0	112	M746 V748 R753 T754	M746-N750 VanDerWaalsContact O-CB 3.29Å; M746-N750 WeakPolarHBondContact O-CB 3.44Å; M746-N750 PolarHBondContact O-N 2.89Å; M746-N750 PolarHBondContact O-ND2 3Å; M746-N750 PolarHBondContact SD-ND2 3.2Å; M746-N750 VanDerWaalsContact SD-ND2 3.36Å; V748-N750 VanDerWaalsContact C-N 3.29Å; V748-N750 PolarHBondContact O-N 2.83Å; N750-R753 PolarHBondContact O-N 3.16Å; N750-R753 PolarHBondContact OD1-NH1 2.91Å; N750-T754 PolarHBondContact O-N 2.79Å; N750-T754 PolarHBondContact O-OG1 2.77Å; N750-T754 VanDerWaalsContact O-OG1 3.08Å
751	L	81.4	Confident	80.7	Confident	29 Å²	29	57.7 Å²	57.7	15%	0.152	30%	0.296	C	S	.	.	H	α-helix	trans	-67.1	-44.3	-179.6	-171.8	148.5	0	0	0	111.7	S747 V748 T754 W755 V808 V820 M822	S747-L751 WeakPolarHBondContact O-CB 3.17Å; S747-L751 PolarHBondContact O-N 3.41Å; V748-L751 PolarHBondContact O-N 3.43Å; V748-L751 VanDerWaalsContact O-N 3.08Å; L751-T754 PolarHBondContact O-N 3.38Å; L751-W755 PolarHBondContact O-N 2.94Å; L751-V808 HydrophobicContact CD2-CG1 4.18Å; L751-V820 HydrophobicContact CD1-CB 4.37Å; L751-V820 HydrophobicContact CD1-CG1 4.15Å; L751-V820 VanDerWaalsContact CD1-O 3.3Å; L751-V820 WeakPolarHBondContact CD1-O 3.5Å; L751-M822 HydrophobicContact CD2-CB 3.75Å; L751-M822 HydrophobicContact CD2-CG 3.5Å; L751-M822 VanDerWaalsContact CD2-CG 3.5Å; L751-M822 HydrophobicContact CD2-SD 3.42Å; L751-M822 WeakPolarHBondContact CD2-SD 3.49Å
752	V	80.9	Confident	80.6	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-39.8	175.4	175.5	0	0	0	0	111.6	V748 T754 W755 L756 I806 V808 M822 M891	V748-V752 HydrophobicContact CG1-CG2 4.03Å; V748-V752 WeakPolarHBondContact O-CG2 3.4Å; V748-V752 PolarHBondContact O-N 2.87Å; V752-T754 VanDerWaalsContact C-N 3.33Å; V752-T754 PolarHBondContact O-N 3.4Å; V752-W755 PolarHBondContact O-N 3.03Å; V752-L756 HydrophobicContact CG1-CD1 4Å; V752-L756 HydrophobicContact CG1-CG 4.28Å; V752-L756 WeakPolarHBondContact O-CG 3.22Å; V752-L756 PolarHBondContact O-N 3.27Å; V752-I806 HydrophobicContact CG1-CD1 3.58Å; V752-I806 HydrophobicContact CG1-CG2 4.22Å; V752-I806 HydrophobicContact CG2-CG2 3.79Å; V752-V808 HydrophobicContact CG2-CG2 3.74Å; V752-M822 HydrophobicContact CG2-SD 3.85Å; V752-M891 HydrophobicContact CB-CE 3.94Å; V752-M891 HydrophobicContact CG1-CE 3.69Å; V752-M891 HydrophobicContact CG2-CE 3.75Å
753	R	81.7	Confident	80.5	Confident	124 Å²	124	58.6 Å²	58.6	47%	0.468	30%	0.296	S	S	.	.	H	α-helix	trans	-60.1	-44.3	173.1	-171.2	-175.3	-59.8	106.9	-2.5	111.2	T749 N750 W755 L756 T757	T749-R753 WeakPolarHBondContact O-CB 3.31Å; T749-R753 PolarHBondContact O-N 3.33Å; N750-R753 PolarHBondContact O-N 3.16Å; N750-R753 PolarHBondContact OD1-NH1 2.91Å; R753-W755 VanDerWaalsContact C-N 3.32Å; R753-W755 PolarHBondContact O-N 3.29Å; R753-L756 PolarHBondContact O-N 3.42Å; R753-T757 WeakPolarHBondContact O-CG2 3.41Å; R753-T757 PolarHBondContact O-N 2.82Å; R753-T757 PolarHBondContact O-OG1 3.49Å; R753-T757 VanDerWaalsContact O-OG1 3.05Å
754	T	82.4	Confident	80.4	Confident	66 Å²	66	56 Å²	56	41%	0.405	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-36.2	175.2	-61.6	0	0	0	0	112.5	N750 L751 V752 T757 R758	N750-T754 PolarHBondContact O-N 2.79Å; N750-T754 PolarHBondContact O-OG1 2.77Å; N750-T754 VanDerWaalsContact O-OG1 3.08Å; L751-T754 PolarHBondContact O-N 3.38Å; V752-T754 VanDerWaalsContact C-N 3.33Å; V752-T754 PolarHBondContact O-N 3.4Å; T754-T757 WeakPolarHBondContact CA-OG1 3.25Å; T754-T757 PolarHBondContact O-OG1 2.96Å; T754-R758 WeakPolarHBondContact O-CD 3.23Å; T754-R758 VanDerWaalsContact O-CG 3.27Å; T754-R758 WeakPolarHBondContact O-CG 3.32Å; T754-R758 PolarHBondContact O-N 3.3Å
755	W	81.5	Confident	80.2	Confident	40 Å²	40	57 Å²	57	15%	0.152	30%	0.304	C	S	.	.	H	α-helix	trans	-66.6	-49.2	174.2	-176.7	88.5	0	0	0	111.7	L751 V752 R753 T757 R758 A759 L761 M822 T851	L751-W755 PolarHBondContact O-N 2.94Å; V752-W755 PolarHBondContact O-N 3.03Å; R753-W755 VanDerWaalsContact C-N 3.32Å; R753-W755 PolarHBondContact O-N 3.29Å; W755-T757 PolarHBondContact O-N 2.67Å; W755-R758 WeakPolarHBondContact O-CB 3.38Å; W755-R758 PolarHBondContact O-N 3.32Å; W755-A759 PolarHBondContact O-N 2.87Å; W755-L761 HydrophobicContact CH2-CD1 4.45Å; W755-L761 HydrophobicContact CZ3-CD1 4.28Å; W755-M822 HydrophobicContact CB-CE 4Å; W755-M822 HydrophobicContact CB-SD 4.27Å; W755-M822 HydrophobicContact CD2-CE 3.62Å; W755-M822 HydrophobicContact CE3-CE 4.21Å; W755-M822 HydrophobicContact CG-CE 3.46Å; W755-M822 VanDerWaalsContact CG-CE 3.46Å; W755-M822 HydrophobicContact CG-SD 4.34Å; W755-T851 HydrophobicContact CD2-CG2 4.24Å; W755-T851 HydrophobicContact CE3-CG2 4.15Å; W755-T851 HydrophobicContact CH2-CG2 3.56Å; W755-T851 VanDerWaalsContact CH2-OG1 3.29Å; W755-T851 WeakPolarHBondContact CH2-OG1 3.49Å; W755-T851 HydrophobicContact CZ2-CG2 3.61Å; W755-T851 WeakPolarHBondContact CZ2-OG1 3.47Å; W755-T851 HydrophobicContact CZ3-CG2 3.82Å
756	L	80.1	Confident	79.9	Confident	4 Å²	4	59.7 Å²	59.7	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-57.2	-45.6	176.9	-72.1	169.6	0	0	0	111.9	V752 R753 R758 A759 D760 L761 Q763 V895	V752-L756 HydrophobicContact CG1-CD1 4Å; V752-L756 HydrophobicContact CG1-CG 4.28Å; V752-L756 WeakPolarHBondContact O-CG 3.22Å; V752-L756 PolarHBondContact O-N 3.27Å; R753-L756 PolarHBondContact O-N 3.42Å; L756-R758 PolarHBondContact O-N 3.01Å; L756-A759 PolarHBondContact O-N 2.93Å; L756-D760 PolarHBondContact O-N 2.91Å; L756-L761 CarbonylContact C-O 3.56Å; L756-L761 HydrophobicContact CB-CB 4.37Å; L756-L761 HydrophobicContact CD2-CB 3.77Å; L756-L761 HydrophobicContact CD2-CD1 4.21Å; L756-L761 PolarHBondContact O-N 3.28Å; L756-Q763 HydrophobicContact CD1-CB 4.07Å; L756-V895 HydrophobicContact CD2-CG1 3.92Å; L756-V895 HydrophobicContact CD2-CG2 4.1Å
757	T	82.1	Confident	79.4	Confident	94 Å²	94	56.4 Å²	56.4	58%	0.577	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-7.4	177.6	56.4	0	0	0	0	114.9	R753 T754 W755	R753-T757 WeakPolarHBondContact O-CG2 3.41Å; R753-T757 PolarHBondContact O-N 2.82Å; R753-T757 PolarHBondContact O-OG1 3.49Å; R753-T757 VanDerWaalsContact O-OG1 3.05Å; T754-T757 WeakPolarHBondContact CA-OG1 3.25Å; T754-T757 PolarHBondContact O-OG1 2.96Å; W755-T757 PolarHBondContact O-N 2.67Å
758	R	80.5	Confident	78.9	Confident	158 Å²	158	55.5 Å²	55.5	60%	0.596	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-14.9	170	-71.7	165.6	176	175.9	-3.6	113	T754 W755 L756 D823	T754-R758 WeakPolarHBondContact O-CD 3.23Å; T754-R758 VanDerWaalsContact O-CG 3.27Å; T754-R758 WeakPolarHBondContact O-CG 3.32Å; T754-R758 PolarHBondContact O-N 3.3Å; W755-R758 WeakPolarHBondContact O-CB 3.38Å; W755-R758 PolarHBondContact O-N 3.32Å; L756-R758 PolarHBondContact O-N 3.01Å; R758-D823 IonicContact CZ-OD2 3.37Å; R758-D823 IonicContact NH1-OD1 3.74Å; R758-D823 IonicContact NH1-OD2 2.76Å; R758-D823 PolarHBondContact NH1-OD2 3.47Å
759	A	76.5	Confident	78.3	Confident	43 Å²	43	59.4 Å²	59.4	36%	0.355	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	10	179.3	0	0	0	0	0	112.1	W755 L756 L761	W755-A759 PolarHBondContact O-N 2.87Å; L756-A759 PolarHBondContact O-N 2.93Å; A759-L761 HydrophobicContact CB-CB 4.43Å; A759-L761 HydrophobicContact CB-CD1 3.87Å; A759-L761 HydrophobicContact CB-CG 4.07Å; A759-L761 WeakPolarHBondContact O-CG 3.3Å; A759-L761 PolarHBondContact O-N 3.04Å
760	D	81.5	Confident	77.7	Confident	112 Å²	112	58.4 Å²	58.4	60%	0.599	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	37	-170.7	-64.5	-51.2	0	0	0	113.8	L756 S898	L756-D760 PolarHBondContact O-N 2.91Å; D760-S898 VanDerWaalsContact O-CB 3.23Å; D760-S898 WeakPolarHBondContact O-CB 3.26Å; D760-S898 PolarHBondContact O-N 3.01Å
761	L	80.7	Confident	77.3	Confident	33 Å²	33	58.4 Å²	58.4	17%	0.173	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	141.9	-179.1	-71.9	174.9	0	0	0	111.8	W755 L756 A759 I804 V895 L897	W755-L761 HydrophobicContact CH2-CD1 4.45Å; W755-L761 HydrophobicContact CZ3-CD1 4.28Å; L756-L761 CarbonylContact C-O 3.56Å; L756-L761 HydrophobicContact CB-CB 4.37Å; L756-L761 HydrophobicContact CD2-CB 3.77Å; L756-L761 HydrophobicContact CD2-CD1 4.21Å; L756-L761 PolarHBondContact O-N 3.28Å; A759-L761 HydrophobicContact CB-CB 4.43Å; A759-L761 HydrophobicContact CB-CD1 3.87Å; A759-L761 HydrophobicContact CB-CG 4.07Å; A759-L761 WeakPolarHBondContact O-CG 3.3Å; A759-L761 PolarHBondContact O-N 3.04Å; L761-I804 HydrophobicContact CD1-CD1 3.86Å; L761-V895 HydrophobicContact CB-CG1 3.59Å; L761-V895 HydrophobicContact CD1-CG1 4.14Å; L761-V895 HydrophobicContact CD2-CG1 3.78Å; L761-V895 HydrophobicContact CG-CG1 4.02Å; L761-L897 HydrophobicContact CD2-CD2 4.04Å
762	V	80.9	Confident	76.8	Confident	61 Å²	61	57.7 Å²	57.7	37%	0.37	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.5	178.9	-177.9	0	0	0	0	109.6	V764 V895 A896	V762-V764 PolarHBondContact O-N 3.31Å; V762-V895 WeakPolarHBondContact O-CA 3.16Å; V762-V895 WeakPolarHBondContact O-CG1 3.35Å; V762-A896 PolarHBondContact N-O 2.81Å; V762-A896 PolarHBondContact O-N 3.01Å
763	Q	80.3	Confident	76.4	Confident	76 Å²	76	58.1 Å²	58.1	36%	0.355	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	119.6	170.6	175.4	168.9	20.3	0	0	110.1	L756 G765 V893	L756-Q763 HydrophobicContact CD1-CB 4.07Å; Q763-G765 WeakPolarHBondContact CG-O 3.49Å; Q763-G765 PolarHBondContact NE2-O 3.34Å; Q763-V893 HydrophobicContact CB-CG1 4.07Å; Q763-V893 HydrophobicContact CG-CG1 3.56Å
764	V	78.2	Confident	75.7	Confident	72 Å²	72	52.3 Å²	52.3	44%	0.436	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-33.4	174.3	-174.4	0	0	0	0	110.7	V762 L790 V801 A894 A896	V762-V764 PolarHBondContact O-N 3.31Å; V764-L790 HydrophobicContact CG1-CD2 3.94Å; V764-V801 HydrophobicContact CB-CG1 4.28Å; V764-V801 HydrophobicContact CG1-CG2 4.5Å; V764-V801 HydrophobicContact CG2-CG1 4.31Å; V764-V801 HydrophobicContact CG2-CG2 4.36Å; V764-A894 PolarHBondContact N-O 3.16Å; V764-A896 HydrophobicContact CG2-CB 3.59Å
765	G	73.4	Confident	75	Confident	21 Å²	21	49.5 Å²	49.5	22%	0.216	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	177.3	-179.6	0	0	0	0	0	113.7	Q763 V893 A894	Q763-G765 WeakPolarHBondContact CG-O 3.49Å; Q763-G765 PolarHBondContact NE2-O 3.34Å; G765-V893 WeakPolarHBondContact O-CG1 3.26Å; G765-A894 PolarHBondContact N-O 3.22Å; G765-A894 VanDerWaalsContact N-O 3.13Å; G765-A894 PolarHBondContact O-N 2.95Å
766	L	73.2	Confident	74.2	Confident	96 Å²	96	50.8 Å²	50.8	50%	0.503	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	122.4	174	-177.4	67.7	0	0	0	107.7	S768 M891	L766-S768 WeakPolarHBondContact CD1-O 3.19Å; L766-M891 HydrophobicContact CD1-CG 3.63Å; L766-M891 HydrophobicContact CD1-SD 3.59Å; L766-M891 VanDerWaalsContact CD1-SD 3.59Å
767	V	68.7	Low	73.5	Confident	31 Å²	31	53.5 Å²	53.5	19%	0.188	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-43.6	-176.7	-169.6	0	0	0	0	110.4	F784 W786 I892 A894	V767-F784 HydrophobicContact CG1-CD2 4.04Å; V767-W786 HydrophobicContact CG1-CE3 4.07Å; V767-W786 HydrophobicContact CG2-CE3 3.77Å; V767-W786 HydrophobicContact CG2-CZ3 3.48Å; V767-W786 VanDerWaalsContact CG2-CZ3 3.48Å; V767-I892 HydrophobicContact CB-CB 4.06Å; V767-I892 HydrophobicContact CB-CG2 3.78Å; V767-I892 WeakPolarHBondContact CB-O 3.34Å; V767-I892 HydrophobicContact CG1-CG2 4.22Å; V767-I892 HydrophobicContact CG2-CG2 3.98Å; V767-I892 PolarHBondContact N-O 2.86Å; V767-A894 HydrophobicContact CG2-CB 4.13Å
768	S	68.7	Low	72.8	Confident	10 Å²	10	52.8 Å²	52.8	7%	0.07	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	133.2	178.3	-174.8	0	0	0	0	110.1	L766 I892	L766-S768 WeakPolarHBondContact CD1-O 3.19Å; S768-I892 PolarHBondContact N-O 3Å
769	P	66.5	Low	72.5	Confident	82 Å²	82	48.3 Å²	48.3	53%	0.532	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	155.9	176.6	29.2	-35.8	0	0	0	111.3	Q771	P769-Q771 PolarHBondContact O-N 3.15Å
770	C	70.1	Confident	72.5	Confident	15 Å²	15	47.1 Å²	47.1	10%	0.101	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	99.3	-178.4	-56.2	0	0	0	0	112.1	Y616 I890 M891	Y616-C770 WeakPolarHBondContact CE1-O 3.36Å; Y616-C770 WeakPolarHBondContact CE2-O 3.4Å; C770-I890 CarbonylContact C-O 3.58Å; C770-I890 WeakPolarHBondContact CA-O 3.2Å; C770-M891 PolarHBondContact SG-SD 3.13Å
771	Q	73.1	Confident	72.4	Confident	58 Å²	58	44.6 Å²	44.6	27%	0.271	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	141.1	172	-65.8	-173.1	-3.9	0	0	109.8	P769 A889 I890	P769-Q771 PolarHBondContact O-N 3.15Å; Q771-A889 CarbonylContact O-C 3.56Å; Q771-A889 WeakPolarHBondContact O-CA 3.39Å; Q771-I890 PolarHBondContact N-O 2.54Å; Q771-I890 PolarHBondContact O-N 3.07Å
772	W	72.6	Confident	72.2	Confident	13 Å²	13	43.2 Å²	43.2	5%	0.049	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	113.5	-177.7	-88.5	74	0	0	0	111.6	N614 Y616 L744 V748 Y818 V820 C887 A889	N614-W772 VanDerWaalsContact CG-O 3.31Å; N614-W772 PolarHBondContact OD1-O 3.46Å; Y616-W772 HydrophobicContact CD2-CB 4.2Å; Y616-W772 HydrophobicContact CE2-CB 4.01Å; Y616-W772 AromaticContact CE2-CD1 3.76Å; Y616-W772 HydrophobicContact CE2-CG 4.19Å; L744-W772 HydrophobicContact CD1-CD2 3.83Å; L744-W772 HydrophobicContact CD1-CE3 4.01Å; L744-W772 HydrophobicContact CD1-CH2 3.44Å; L744-W772 VanDerWaalsContact CD1-CH2 3.44Å; L744-W772 HydrophobicContact CD1-CZ2 3.18Å; L744-W772 HydrophobicContact CD1-CZ3 3.84Å; L744-W772 HydrophobicContact CD2-CD2 3.71Å; L744-W772 HydrophobicContact CD2-CE3 4.44Å; L744-W772 HydrophobicContact CD2-CG 3.68Å; L744-W772 HydrophobicContact CD2-CZ2 4.32Å; L744-W772 HydrophobicContact CG-CD2 3.96Å; L744-W772 HydrophobicContact CG-CG 4.35Å; L744-W772 HydrophobicContact CG-CH2 4.35Å; L744-W772 HydrophobicContact CG-CZ2 3.61Å; V748-W772 HydrophobicContact CG2-CZ2 3.53Å; W772-Y818 HydrophobicContact CH2-CD1 4.47Å; W772-Y818 HydrophobicContact CZ3-CD1 4.39Å; W772-V820 HydrophobicContact CH2-CG2 4.33Å; W772-C887 HydrophobicContact CE3-CB 3.62Å; W772-C887 HydrophobicContact CZ3-CB 3.71Å; W772-A889 HydrophobicContact CD2-CB 4Å; W772-A889 HydrophobicContact CG-CB 4.39Å; W772-A889 HydrophobicContact CH2-CB 4.31Å; W772-A889 HydrophobicContact CZ2-CB 3.53Å
773	I	70.8	Confident	72.1	Confident	12 Å²	12	45.9 Å²	45.9	6%	0.062	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.3	-173.5	-56.5	-151.5	0	0	0	110.2	A780 V782 F872 C887 V888 I890	I773-A780 HydrophobicContact CD1-CB 3.49Å; I773-A780 VanDerWaalsContact CD1-CB 3.49Å; I773-A780 HydrophobicContact CG2-CB 3.68Å; I773-V782 HydrophobicContact CD1-CG2 4.19Å; I773-F872 HydrophobicContact CG2-CE2 4.22Å; I773-F872 HydrophobicContact CG2-CZ 4.05Å; I773-C887 CarbonylContact O-C 3.49Å; I773-C887 WeakPolarHBondContact O-CA 3.39Å; I773-C887 WeakPolarHBondContact O-CB 3.33Å; I773-V888 PolarHBondContact N-O 3.08Å; I773-V888 PolarHBondContact O-N 3.33Å; I773-I890 HydrophobicContact CD1-CD1 3.41Å; I773-I890 VanDerWaalsContact CD1-CD1 3.41Å; I773-I890 HydrophobicContact CG1-CD1 3.75Å
774	S	69	Low	71.9	Confident	2 Å²	2	43 Å²	43	1%	0.014	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.3	-179.3	-159.9	0	0	0	0	110	G612 R776 Q777	G612-S774 VanDerWaalsContact O-CB 3.24Å; G612-S774 WeakPolarHBondContact O-CB 3.37Å; G612-S774 PolarHBondContact O-OG 2.89Å; G612-S774 VanDerWaalsContact O-OG 3.05Å; S774-R776 PolarHBondContact O-N 3.32Å; S774-Q777 PolarHBondContact O-N 3.44Å
775	V	66.7	Low	71.6	Confident	6 Å²	6	42.6 Å²	42.6	4%	0.036	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-5	-177.3	174	0	0	0	0	112.7	Q777 V829 T886 V888	V775-Q777 PolarHBondContact O-N 2.8Å; V775-Q777 VanDerWaalsContact O-N 3.15Å; V775-V829 HydrophobicContact CB-CG1 4.29Å; V775-V829 HydrophobicContact CG1-CG1 3.45Å; V775-V829 VanDerWaalsContact CG1-CG1 3.45Å; V775-V829 HydrophobicContact CG2-CG1 3.75Å; V775-T886 WeakPolarHBondContact CB-O 3.23Å; V775-T886 WeakPolarHBondContact CB-OG1 3.43Å; V775-T886 WeakPolarHBondContact CG2-O 3.42Å; V775-T886 PolarHBondContact N-O 2.72Å; V775-T886 VanDerWaalsContact N-O 3.13Å; V775-V888 HydrophobicContact CG2-CG2 4.35Å
776	R	64.7	Low	71.3	Confident	68 Å²	68	44.5 Å²	44.5	26%	0.257	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-1	168.9	-67.1	-177.4	173	-162.9	-1	113.9	L574 A578 S774	L574-R776 VanDerWaalsContact O-CZ 3.3Å; L574-R776 PolarHBondContact O-NH1 2.83Å; L574-R776 PolarHBondContact O-NH2 3.25Å; A578-R776 PolarHBondContact O-NH1 3.15Å; S774-R776 PolarHBondContact O-N 3.32Å
777	Q	64.4	Low	70.8	Confident	60 Å²	60	43 Å²	43	28%	0.28	24%	0.243	S	C	.	.	S	Bend	trans	-105.3	136.4	170.3	-64.4	169.5	-64.8	0	0	109.1	N581 S774 V775 S779 F872	N581-Q777 PolarHBondContact ND2-OE1 2.9Å; S774-Q777 PolarHBondContact O-N 3.44Å; V775-Q777 PolarHBondContact O-N 2.8Å; V775-Q777 VanDerWaalsContact O-N 3.15Å; Q777-S779 VanDerWaalsContact C-N 3.29Å; Q777-S779 PolarHBondContact O-N 3.25Å; Q777-F872 WeakPolarHBondContact O-CD2 3.41Å
778	C	68.3	Low	70.1	Confident	79 Å²	79	45.1 Å²	45.1	53%	0.534	25%	0.253	S	S	.	.	S	Bend	trans	-69.9	-29.2	-178.6	-50.8	0	0	0	0	112.7	F872 I877	C778-F872 PolarHBondContact O-N 3.12Å; C778-I877 HydrophobicContact CB-CD1 4.3Å
779	S	75.1	Confident	69.3	Low	64 Å²	64	52.3 Å²	52.3	45%	0.448	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	165.4	172	59.5	0	0	0	0	110	Q777 I870 N871	Q777-S779 VanDerWaalsContact C-N 3.29Å; Q777-S779 PolarHBondContact O-N 3.25Å; S779-I870 CarbonylContact C-O 3.55Å; S779-I870 WeakPolarHBondContact CA-O 3.41Å; S779-I870 VanDerWaalsContact CB-O 3.26Å; S779-I870 WeakPolarHBondContact CB-O 3.45Å; S779-N871 WeakPolarHBondContact CB-OD1 3.47Å
780	A	76.4	Confident	68.6	Low	19 Å²	19	52 Å²	52	16%	0.157	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	154.6	169.1	0	0	0	0	0	110.2	I773 I870 F872	I773-A780 HydrophobicContact CD1-CB 3.49Å; I773-A780 VanDerWaalsContact CD1-CB 3.49Å; I773-A780 HydrophobicContact CG2-CB 3.68Å; A780-I870 PolarHBondContact N-O 2.71Å; A780-I870 PolarHBondContact O-N 3.2Å; A780-F872 HydrophobicContact CB-CE2 4.33Å
781	S	77.9	Confident	67.2	Low	59 Å²	59	56.2 Å²	56.2	41%	0.413	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	154.3	173.3	66.3	0	0	0	0	113.1	E867 V868	S781-E867 WeakPolarHBondContact CB-OE1 3.38Å; S781-E867 PolarHBondContact OG-OE1 3.29Å; S781-V868 CarbonylContact C-O 3.54Å; S781-V868 WeakPolarHBondContact CA-O 3.31Å; S781-V868 VanDerWaalsContact CB-O 3.24Å; S781-V868 WeakPolarHBondContact CB-O 3.48Å
782	V	77.2	Confident	65.5	Low	3 Å²	3	59.8 Å²	59.8	2%	0.018	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	121.2	-179.2	177.6	0	0	0	0	108.5	I773 V868 I890	I773-V782 HydrophobicContact CD1-CG2 4.19Å; V782-V868 PolarHBondContact N-O 3.4Å; V782-V868 PolarHBondContact O-N 3.1Å; V782-I890 HydrophobicContact CG2-CD1 3.52Å; V782-I890 HydrophobicContact CG2-CG2 4.18Å
783	K	77.8	Confident	63.7	Low	117 Å²	117	64.2 Å²	64.2	51%	0.509	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	139.7	174.3	-60.5	-167.9	176.9	-152.6	0	110.7	H866 E867	K783-H866 WeakPolarHBondContact CA-O 3.3Å; K783-E867 WeakPolarHBondContact CE-OE1 3.35Å; K783-E867 WeakPolarHBondContact CE-OE2 3.39Å; K783-E867 HydrophobicContact CG-CB 4.21Å; K783-E867 HydrophobicContact CG-CG 4.17Å; K783-E867 IonicContact NZ-OE2 2.62Å; K783-E867 PolarHBondContact NZ-OE2 3.49Å
784	F	76.4	Confident	62.4	Low	17 Å²	17	72.8 Å²	72.8	8%	0.075	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	152.2	172.9	74.7	-79	0	0	0	110.8	V767 L835 Y854 E865 H866 V868 I892	V767-F784 HydrophobicContact CG1-CD2 4.04Å; F784-L835 HydrophobicContact CE1-CD1 3.88Å; F784-L835 HydrophobicContact CZ-CD1 4.18Å; F784-Y854 HydrophobicContact CZ-CD1 4.19Å; F784-Y854 AromaticContact CZ-CE1 3.99Å; F784-Y854 HydrophobicContact CZ-CE1 3.99Å; F784-E865 WeakPolarHBondContact O-CA 3.23Å; F784-H866 HydrophobicContact CD1-CB 4.09Å; F784-H866 HydrophobicContact CE1-CB 3.55Å; F784-H866 HydrophobicContact CE2-CB 4.45Å; F784-H866 HydrophobicContact CZ-CB 3.76Å; F784-H866 PolarHBondContact N-O 3.06Å; F784-H866 PolarHBondContact O-N 3.23Å; F784-V868 HydrophobicContact CD1-CG2 4.2Å; F784-V868 HydrophobicContact CE1-CG2 3.82Å; F784-I892 HydrophobicContact CB-CD1 3.88Å; F784-I892 HydrophobicContact CD1-CD1 3.3Å; F784-I892 HydrophobicContact CD2-CD1 3.9Å; F784-I892 HydrophobicContact CD2-CG2 4.5Å; F784-I892 HydrophobicContact CE1-CD1 3.7Å; F784-I892 HydrophobicContact CE2-CD1 4.25Å; F784-I892 HydrophobicContact CE2-CG2 4.44Å; F784-I892 HydrophobicContact CG-CD1 3.4Å; F784-I892 VanDerWaalsContact CG-CD1 3.4Å; F784-I892 HydrophobicContact CZ-CD1 4.15Å
785	S	72.3	Confident	61.1	Low	62 Å²	62	79.2 Å²	79.2	43%	0.434	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.2	167.8	52	0	0	0	0	109.7	Q864	S785-Q864 WeakPolarHBondContact CA-O 3.41Å
786	W	68.2	Low	59.8	Low	61 Å²	61	85.4 Å²	85.4	23%	0.231	46%	0.461	C	S	.	.			trans	-95.4	127	177	177.5	-92.4	0	0	0	110.7	V767 V801 P803 A894	V767-W786 HydrophobicContact CG1-CE3 4.07Å; V767-W786 HydrophobicContact CG2-CE3 3.77Å; V767-W786 HydrophobicContact CG2-CZ3 3.48Å; V767-W786 VanDerWaalsContact CG2-CZ3 3.48Å; W786-V801 HydrophobicContact CH2-CG1 4.29Å; W786-P803 HydrophobicContact CE3-CB 4.02Å; W786-P803 HydrophobicContact CE3-CG 4.44Å; W786-P803 HydrophobicContact CZ3-CB 3.72Å; W786-P803 HydrophobicContact CZ3-CG 4.3Å; W786-A894 HydrophobicContact CH2-CB 3.63Å; W786-A894 HydrophobicContact CZ3-CB 3.9Å
787	P	61.6	Low	59	Low	66 Å²	66	89 Å²	89	43%	0.429	49%	0.494	S	S	.	.			trans	-81.3	127.5	177	31.3	-32.7	0	0	0	111.6	E789 L790	P787-E789 PolarHBondContact O-N 2.93Å; P787-L790 HydrophobicContact CG-CD1 4.39Å
788	N	53.3	Low	58.5	Low	74 Å²	74	90 Å²	90	40%	0.396	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-66.5	-15.9	178.3	-71.7	-4.9	0	0	0	114.1	L790 L861	N788-L790 PolarHBondContact O-N 2.62Å; N788-L861 PolarHBondContact ND2-O 3.37Å
789	E	52.1	Low	58.1	Low	161 Å²	161	91.1 Å²	91.1	75%	0.752	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-94.1	28.2	-162.8	-58.5	-169.6	156.1	0	0	115.7	P787 S791	P787-E789 PolarHBondContact O-N 2.93Å; E789-S791 PolarHBondContact O-N 3.45Å
790	L	51.8	Low	57.7	Low	77 Å²	77	94 Å²	94	40%	0.403	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-70	-2.5	167.3	-101.3	72.3	0	0	0	113.2	V764 P787 N788 N792 V801 A894	V764-L790 HydrophobicContact CG1-CD2 3.94Å; P787-L790 HydrophobicContact CG-CD1 4.39Å; N788-L790 PolarHBondContact O-N 2.62Å; L790-N792 PolarHBondContact O-N 3.15Å; L790-V801 HydrophobicContact CD2-CG1 3.92Å; L790-A894 HydrophobicContact CD2-CB 4.01Å
791	S	40.6	Very low	57.4	Low	103 Å²	103	95.4 Å²	95.4	72%	0.72	52%	0.521	S	S	*	.			trans	-75.1	33.3	179.5	51.4	0	0	0	0	114.9	E789 S793	E789-S791 PolarHBondContact O-N 3.45Å; S791-S793 PolarHBondContact O-N 3.48Å
792	N	38.3	Very low	57.1	Low	133 Å²	133	94.4 Å²	94.4	71%	0.711	52%	0.517	S	S	*	.			trans	-80.7	60.9	-172.6	-129.7	-37.5	0	0	0	114.2	L790 K794	L790-N792 PolarHBondContact O-N 3.15Å; N792-K794 VanDerWaalsContact C-N 3.28Å; N792-K794 PolarHBondContact O-N 2.86Å
793	S	34.9	Very low	57	Low	106 Å²	106	95.4 Å²	95.4	74%	0.741	52%	0.523	S	S	*	.	S	Bend	trans	46.5	0.5	147.1	67.8	0	0	0	0	123	S791	S791-S793 PolarHBondContact O-N 3.48Å
794	K	43.4	Very low	56.9	Low	192 Å²	192	90.1 Å²	90.1	84%	0.835	50%	0.501	S	S	*	.	S	Bend	trans	-130.2	4.1	-178	-73.4	-171.4	176.5	179.4	0	116.4	N792	N792-K794 VanDerWaalsContact C-N 3.28Å; N792-K794 PolarHBondContact O-N 2.86Å
795	L	41.8	Very low	57	Low	137 Å²	137	89.6 Å²	89.6	72%	0.717	50%	0.499	S	S	*	.	S	Bend	trans	-119.7	153.9	166.7	-79	87	0	0	0	110.1
796	Q	40	Very low	57.2	Low	135 Å²	135	86.6 Å²	86.6	63%	0.631	48%	0.478	S	S	*	.			trans	-61.2	143.2	-166	-71	-175.7	-16.5	0	0	113.9	S798	Q796-S798 PolarHBondContact O-N 3.13Å
797	P	48.2	Very low	57.7	Low	144 Å²	144	83.8 Å²	83.8	94%	0.935	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	19.7	-171.3	33.2	-38.8	0	0	0	115.2
798	S	53.2	Low	58.5	Low	81 Å²	81	80.7 Å²	80.7	57%	0.566	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	1.8	-173.4	62.9	0	0	0	0	114.9	Q796	Q796-S798 PolarHBondContact O-N 3.13Å
799	R	59.6	Low	59.7	Low	102 Å²	102	77.3 Å²	77.3	39%	0.385	43%	0.429	S	S	.	.			trans	-91.3	106.9	-178.5	-68.9	-172.5	177.5	-173.5	0.6	111.3	V801	R799-V801 PolarHBondContact O-N 3.19Å
800	V	66.7	Low	60.9	Low	124 Å²	124	69.7 Å²	69.7	75%	0.752	39%	0.394	S	S	*	.			trans	-62.3	123.6	166.2	-178.4	0	0	0	0	108.7	A896	V800-A896 WeakPolarHBondContact O-CB 3.45Å
801	V	70.2	Confident	62.1	Low	49 Å²	49	70 Å²	70	30%	0.297	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.6	174.8	-172.4	0	0	0	0	108.5	V764 W786 L790 R799 A894 V895 A896	V764-V801 HydrophobicContact CB-CG1 4.28Å; V764-V801 HydrophobicContact CG1-CG2 4.5Å; V764-V801 HydrophobicContact CG2-CG1 4.31Å; V764-V801 HydrophobicContact CG2-CG2 4.36Å; W786-V801 HydrophobicContact CH2-CG1 4.29Å; L790-V801 HydrophobicContact CD2-CG1 3.92Å; R799-V801 PolarHBondContact O-N 3.19Å; V801-A894 HydrophobicContact CG1-CB 3.99Å; V801-V895 CarbonylContact C-O 3.58Å; V801-V895 WeakPolarHBondContact CA-O 3.41Å; V801-A896 HydrophobicContact CG2-CB 4.38Å
802	A	71.7	Confident	63.8	Low	39 Å²	39	65.6 Å²	65.6	32%	0.322	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.3	-179.8	0	0	0	0	0	111.9	V895	A802-V895 PolarHBondContact N-O 2.93Å; A802-V895 PolarHBondContact O-N 2.93Å
803	P	74.7	Confident	65.3	Low	23 Å²	23	59.6 Å²	59.6	15%	0.149	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	131	165.5	28.6	-32.4	0	0	0	111.1	W786 Y854 I892 V893	W786-P803 HydrophobicContact CE3-CB 4.02Å; W786-P803 HydrophobicContact CE3-CG 4.44Å; W786-P803 HydrophobicContact CZ3-CB 3.72Å; W786-P803 HydrophobicContact CZ3-CG 4.3Å; P803-Y854 HydrophobicContact CB-CD1 4.39Å; P803-Y854 HydrophobicContact CG-CD1 3.84Å; P803-Y854 PolarHBondContact O-N 2.89Å; P803-I892 HydrophobicContact CB-CG2 4.47Å; P803-V893 WeakPolarHBondContact CA-O 3.38Å
804	I	75.8	Confident	66.6	Low	7 Å²	7	59.4 Å²	59.4	4%	0.036	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.2	170.1	-50.1	-169.9	0	0	0	108.8	L761 I806 V853 I892 V893 V895	L761-I804 HydrophobicContact CD1-CD1 3.86Å; I804-I806 HydrophobicContact CB-CG1 4.36Å; I804-I806 HydrophobicContact CG2-CD1 4.37Å; I804-I806 HydrophobicContact CG2-CG1 3.84Å; I804-V853 HydrophobicContact CD1-CG2 4.06Å; I804-V853 HydrophobicContact CG1-CG2 4.08Å; I804-V853 HydrophobicContact CG2-CG2 4.12Å; I804-I892 WeakPolarHBondContact O-CA 3.09Å; I804-V893 PolarHBondContact N-O 3.36Å; I804-V893 PolarHBondContact O-N 2.89Å; I804-V895 HydrophobicContact CB-CG2 4.35Å; I804-V895 HydrophobicContact CD1-CB 3.88Å; I804-V895 HydrophobicContact CD1-CG1 4.04Å; I804-V895 HydrophobicContact CD1-CG2 3.87Å; I804-V895 HydrophobicContact CG1-CB 4.13Å; I804-V895 HydrophobicContact CG1-CG2 3.94Å
805	L	77.9	Confident	67.3	Low	5 Å²	5	55.2 Å²	55.2	3%	0.026	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.9	168.7	175.6	64.1	0	0	0	108.7	L807 V833 T852 V868 I890 I892	L805-L807 HydrophobicContact CD1-CD2 3.89Å; L805-L807 HydrophobicContact CD2-CD1 4.42Å; L805-L807 HydrophobicContact CD2-CD2 4.38Å; L805-L807 HydrophobicContact CG-CD2 4Å; L805-L807 HydrophobicContact CG-CG 4.15Å; L805-V833 HydrophobicContact CD2-CG1 3.87Å; L805-T852 WeakPolarHBondContact CB-O 3.35Å; L805-T852 WeakPolarHBondContact CD2-OG1 3.29Å; L805-T852 PolarHBondContact N-O 3.33Å; L805-T852 PolarHBondContact O-N 3.4Å; L805-V868 HydrophobicContact CD2-CB 4.46Å; L805-V868 HydrophobicContact CD2-CG1 3.55Å; L805-V868 HydrophobicContact CD2-CG2 4.03Å; L805-I890 HydrophobicContact CD1-CG2 3.72Å; L805-I892 HydrophobicContact CD1-CD1 4.3Å; L805-I892 HydrophobicContact CD1-CG1 3.73Å
806	I	77.4	Confident	68.2	Low	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.2	-174.4	-56.2	-172.4	0	0	0	108.2	V752 I804 V808 M822 T851 M891 V893	V752-I806 HydrophobicContact CG1-CD1 3.58Å; V752-I806 HydrophobicContact CG1-CG2 4.22Å; V752-I806 HydrophobicContact CG2-CG2 3.79Å; I804-I806 HydrophobicContact CB-CG1 4.36Å; I804-I806 HydrophobicContact CG2-CD1 4.37Å; I804-I806 HydrophobicContact CG2-CG1 3.84Å; I806-V808 HydrophobicContact CG2-CG2 3.81Å; I806-M822 HydrophobicContact CG2-CE 3.74Å; I806-M822 HydrophobicContact CG2-SD 3.93Å; I806-T851 HydrophobicContact CB-CG2 4.28Å; I806-T851 HydrophobicContact CG1-CG2 3.93Å; I806-T851 HydrophobicContact CG2-CG2 4.05Å; I806-M891 PolarHBondContact N-O 2.84Å; I806-M891 PolarHBondContact O-N 3.39Å; I806-V893 HydrophobicContact CD1-CB 4.27Å; I806-V893 HydrophobicContact CD1-CG2 3.81Å; I806-V893 HydrophobicContact CG1-CG2 4.45Å
807	L	78.5	Confident	69.1	Low	2 Å²	2	45.4 Å²	45.4	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	102.2	-172.2	-59.1	179.7	0	0	0	108.9	L805 I830 V833 I870 V888 I890	L805-L807 HydrophobicContact CD1-CD2 3.89Å; L805-L807 HydrophobicContact CD2-CD1 4.42Å; L805-L807 HydrophobicContact CD2-CD2 4.38Å; L805-L807 HydrophobicContact CG-CD2 4Å; L805-L807 HydrophobicContact CG-CG 4.15Å; L807-I830 HydrophobicContact CB-CD1 3.77Å; L807-I830 HydrophobicContact CD1-CD1 3.78Å; L807-I830 HydrophobicContact CG-CD1 4.37Å; L807-V833 HydrophobicContact CD1-CG2 3.61Å; L807-I870 HydrophobicContact CD1-CD1 4.05Å; L807-I870 HydrophobicContact CD2-CD1 3.59Å; L807-V888 HydrophobicContact CB-CG1 4.36Å; L807-I890 HydrophobicContact CD2-CB 4.24Å; L807-I890 HydrophobicContact CD2-CG1 3.9Å; L807-I890 HydrophobicContact CD2-CG2 3.93Å
808	V	78	Confident	70.3	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117	-168.9	-172.7	0	0	0	0	109	V748 L751 V752 I806 V820 M822 V888 A889	V748-V808 HydrophobicContact CG1-CG2 4.22Å; L751-V808 HydrophobicContact CD2-CG1 4.18Å; V752-V808 HydrophobicContact CG2-CG2 3.74Å; I806-V808 HydrophobicContact CG2-CG2 3.81Å; V808-V820 HydrophobicContact CG1-CG1 3.22Å; V808-M822 HydrophobicContact CB-CG 4.3Å; V808-M822 HydrophobicContact CG1-CG 4.08Å; V808-M822 HydrophobicContact CG2-CG 4.01Å; V808-M822 HydrophobicContact CG2-SD 3.87Å; V808-V888 CarbonylContact O-C 3.43Å; V808-V888 WeakPolarHBondContact O-CA 3.35Å; V808-A889 HydrophobicContact CB-CB 4.03Å; V808-A889 PolarHBondContact N-O 3.06Å; V808-A889 PolarHBondContact O-N 3.1Å
809	H	79.2	Confident	71.3	Confident	3 Å²	3	37.8 Å²	37.8	1%	0.014	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	145	-178.5	-68	84.1	0	0	0	110.9	V820 W821 V829	H809-V820 CarbonylContact O-C 3.51Å; H809-V820 WeakPolarHBondContact O-CA 3.38Å; H809-W821 HydrophobicContact CB-CD2 3.83Å; H809-W821 HydrophobicContact CB-CG 4.14Å; H809-W821 HydrophobicContact CB-CH2 4.36Å; H809-W821 HydrophobicContact CB-CZ2 3.66Å; H809-W821 AromaticContact CG-NE1 3.89Å; H809-W821 PolarHBondContact N-O 2.91Å; H809-W821 PolarHBondContact O-N 2.66Å; H809-V829 PolarHBondContact NE2-N 3.49Å
810	G	77.4	Confident	72.2	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157.4	-178.2	0	0	0	0	0	114.5	D819 T886 C887	G810-D819 CarbonylContact C-O 3.56Å; G810-D819 VanDerWaalsContact CA-O 3.29Å; G810-D819 WeakPolarHBondContact CA-O 3.49Å; G810-T886 WeakPolarHBondContact O-CA 3.14Å; G810-C887 PolarHBondContact N-O 2.86Å; G810-C887 PolarHBondContact O-N 2.91Å
811	R	77	Confident	72.7	Confident	84 Å²	84	28.8 Å²	28.8	32%	0.317	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.2	165.7	-83.1	166.4	175.7	178.6	-3.9	110	Y818 D819 W821 P885 T886	R811-Y818 WeakPolarHBondContact O-CA 3.47Å; R811-D819 HydrophobicContact CB-CB 4.22Å; R811-D819 PolarHBondContact N-O 3.36Å; R811-D819 PolarHBondContact O-N 3.07Å; R811-W821 HydrophobicContact CB-CZ3 4.23Å; R811-W821 HydrophobicContact CG-CH2 3.85Å; R811-W821 HydrophobicContact CG-CZ3 3.97Å; R811-P885 WeakPolarHBondContact CA-O 3.36Å; R811-T886 HydrophobicContact CG-CG2 3.62Å
812	I	75.1	Confident	72.7	Confident	9 Å²	9	26.9 Å²	26.9	5%	0.046	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	129.2	170.5	-39.6	-173.2	0	0	0	108	L610 Y818 P885	L610-I812 HydrophobicContact CD2-CG2 4.5Å; I812-Y818 HydrophobicContact CB-CD1 4.49Å; I812-Y818 HydrophobicContact CB-CE1 4.27Å; I812-Y818 HydrophobicContact CD1-CE1 3.98Å; I812-Y818 HydrophobicContact CG1-CD1 4.08Å; I812-Y818 HydrophobicContact CG1-CE1 3.74Å; I812-Y818 HydrophobicContact CG2-CD1 4.37Å; I812-Y818 HydrophobicContact CG2-CE1 3.89Å; I812-P885 HydrophobicContact CB-CG 4.06Å; I812-P885 HydrophobicContact CD1-CG 4.41Å; I812-P885 HydrophobicContact CG1-CG 4.25Å; I812-P885 PolarHBondContact N-O 3.49Å
813	A	70	Confident	72.2	Confident	7 Å²	7	28 Å²	28	6%	0.058	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	137.2	167.4	0	0	0	0	0	109.3	A816 C817	A813-A816 CarbonylContact O-C 3.44Å; A813-A816 WeakPolarHBondContact O-CA 3.41Å; A813-A816 PolarHBondContact O-N 2.69Å; A813-C817 PolarHBondContact N-O 2.71Å; A813-C817 PolarHBondContact O-N 2.94Å
814	P	62.9	Low	71.4	Confident	103 Å²	103	32.8 Å²	32.8	67%	0.669	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	140.8	169.7	26.5	-33.4	0	0	0	109.9
815	P	58.2	Low	70.6	Confident	103 Å²	103	37.1 Å²	37.1	67%	0.669	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	cis	-96.4	72.6	4.6	37.7	-33.6	0	0	0	112.3	R743	R743-P815 PolarHBondContact NH1-O 2.78Å
816	A	61.6	Low	70	Confident	5 Å²	5	38.2 Å²	38.2	4%	0.041	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	50.1	-173.4	0	0	0	0	0	113.7	L610 H740 R743 A813 Y818	L610-A816 HydrophobicContact CD2-CB 4.28Å; H740-A816 WeakPolarHBondContact CE1-CB 3.49Å; R743-A816 PolarHBondContact NH1-O 3.32Å; A813-A816 CarbonylContact O-C 3.44Å; A813-A816 WeakPolarHBondContact O-CA 3.41Å; A813-A816 PolarHBondContact O-N 2.69Å; A816-Y818 HydrophobicContact CB-CE2 4.25Å
817	C	57.5	Low	69.6	Low	61 Å²	61	41.3 Å²	41.3	41%	0.412	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.2	157.8	-66	0	0	0	0	108.4	A813	A813-C817 PolarHBondContact N-O 2.71Å; A813-C817 PolarHBondContact O-N 2.94Å
818	Y	74.1	Confident	69.2	Low	24 Å²	24	42.8 Å²	42.8	9%	0.094	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	108.1	176.5	-64.5	-84.4	0	0	0	109	H740 R743 L744 W772 R811 I812 A816 V820	H740-Y818 AromaticContact ND1-CZ 3.98Å; H740-Y818 PolarHBondContact ND1-OH 3.03Å; R743-Y818 HydrophobicContact CB-CD2 4.46Å; R743-Y818 HydrophobicContact CB-CE2 4.5Å; L744-Y818 HydrophobicContact CB-CE2 4.44Å; L744-Y818 HydrophobicContact CD1-CD1 3.36Å; L744-Y818 HydrophobicContact CD1-CD2 3.79Å; L744-Y818 HydrophobicContact CD1-CE1 3.44Å; L744-Y818 VanDerWaalsContact CD1-CE1 3.44Å; L744-Y818 HydrophobicContact CD1-CE2 3.87Å; L744-Y818 HydrophobicContact CD1-CG 3.54Å; W772-Y818 HydrophobicContact CH2-CD1 4.47Å; W772-Y818 HydrophobicContact CZ3-CD1 4.39Å; R811-Y818 WeakPolarHBondContact O-CA 3.47Å; I812-Y818 HydrophobicContact CB-CD1 4.49Å; I812-Y818 HydrophobicContact CB-CE1 4.27Å; I812-Y818 HydrophobicContact CD1-CE1 3.98Å; I812-Y818 HydrophobicContact CG1-CD1 4.08Å; I812-Y818 HydrophobicContact CG1-CE1 3.74Å; I812-Y818 HydrophobicContact CG2-CD1 4.37Å; I812-Y818 HydrophobicContact CG2-CE1 3.89Å; A816-Y818 HydrophobicContact CB-CE2 4.25Å; Y818-V820 PolarHBondContact O-N 3.2Å
819	D	74.6	Confident	69	Low	41 Å²	41	43.2 Å²	43.2	22%	0.219	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	102.5	169.1	-86	-34.4	0	0	0	107.1	G810 R811 W821 R884	G810-D819 CarbonylContact C-O 3.56Å; G810-D819 VanDerWaalsContact CA-O 3.29Å; G810-D819 WeakPolarHBondContact CA-O 3.49Å; R811-D819 HydrophobicContact CB-CB 4.22Å; R811-D819 PolarHBondContact N-O 3.36Å; R811-D819 PolarHBondContact O-N 3.07Å; D819-W821 WeakPolarHBondContact O-CZ3 3.21Å; D819-R884 IonicContact OD2-NH1 3.64Å
820	V	78.3	Confident	68.8	Low	21 Å²	21	43 Å²	43	13%	0.127	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136.2	-172.3	-172	0	0	0	0	111.2	V748 L751 W772 V808 H809 Y818	V748-V820 HydrophobicContact CG2-CG1 4.46Å; L751-V820 HydrophobicContact CD1-CB 4.37Å; L751-V820 HydrophobicContact CD1-CG1 4.15Å; L751-V820 VanDerWaalsContact CD1-O 3.3Å; L751-V820 WeakPolarHBondContact CD1-O 3.5Å; W772-V820 HydrophobicContact CH2-CG2 4.33Å; V808-V820 HydrophobicContact CG1-CG1 3.22Å; H809-V820 CarbonylContact O-C 3.51Å; H809-V820 WeakPolarHBondContact O-CA 3.38Å; Y818-V820 PolarHBondContact O-N 3.2Å
821	W	75.8	Confident	68.7	Low	16 Å²	16	46.5 Å²	46.5	6%	0.061	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	161.6	178.8	68.3	96.9	0	0	0	113.7	H809 R811 D819 D825 G826 P827	H809-W821 HydrophobicContact CB-CD2 3.83Å; H809-W821 HydrophobicContact CB-CG 4.14Å; H809-W821 HydrophobicContact CB-CH2 4.36Å; H809-W821 HydrophobicContact CB-CZ2 3.66Å; H809-W821 AromaticContact CG-NE1 3.89Å; H809-W821 PolarHBondContact N-O 2.91Å; H809-W821 PolarHBondContact O-N 2.66Å; R811-W821 HydrophobicContact CB-CZ3 4.23Å; R811-W821 HydrophobicContact CG-CH2 3.85Å; R811-W821 HydrophobicContact CG-CZ3 3.97Å; D819-W821 WeakPolarHBondContact O-CZ3 3.21Å; W821-D825 HydrophobicContact CB-CB 4.42Å; W821-G826 VanDerWaalsContact NE1-C 3.27Å; W821-P827 HydrophobicContact CZ2-CG 3.96Å; W821-P827 WeakPolarHBondContact CZ2-O 3.41Å; W821-P827 PolarHBondContact NE1-O 2.85Å
822	M	71	Confident	68.7	Low	10 Å²	10	48.5 Å²	48.5	5%	0.049	28%	0.275	C	S	.	.	S	Bend	trans	-132.7	-55.2	172.5	-90.2	176.8	71.4	0	0	109.3	L751 V752 W755 I806 V808 V850 T851	L751-M822 HydrophobicContact CD2-CB 3.75Å; L751-M822 HydrophobicContact CD2-CG 3.5Å; L751-M822 VanDerWaalsContact CD2-CG 3.5Å; L751-M822 HydrophobicContact CD2-SD 3.42Å; L751-M822 WeakPolarHBondContact CD2-SD 3.49Å; V752-M822 HydrophobicContact CG2-SD 3.85Å; W755-M822 HydrophobicContact CB-CE 4Å; W755-M822 HydrophobicContact CB-SD 4.27Å; W755-M822 HydrophobicContact CD2-CE 3.62Å; W755-M822 HydrophobicContact CE3-CE 4.21Å; W755-M822 HydrophobicContact CG-CE 3.46Å; W755-M822 VanDerWaalsContact CG-CE 3.46Å; W755-M822 HydrophobicContact CG-SD 4.34Å; I806-M822 HydrophobicContact CG2-CE 3.74Å; I806-M822 HydrophobicContact CG2-SD 3.93Å; V808-M822 HydrophobicContact CB-CG 4.3Å; V808-M822 HydrophobicContact CG1-CG 4.08Å; V808-M822 HydrophobicContact CG2-CG 4.01Å; V808-M822 HydrophobicContact CG2-SD 3.87Å; M822-V850 HydrophobicContact CB-CG1 3.84Å; M822-V850 HydrophobicContact CE-CG1 3.78Å; M822-V850 HydrophobicContact CG-CG1 4.46Å; M822-T851 HydrophobicContact CE-CG2 3.55Å
823	D	62.4	Low	68.8	Low	63 Å²	63	48 Å²	48	34%	0.337	27%	0.273	S	S	.	.	S	Bend	trans	-65.8	-179.7	175.4	-41.5	-31.6	0	0	0	112.6	R758 D825	R758-D823 IonicContact CZ-OD2 3.37Å; R758-D823 IonicContact NH1-OD1 3.74Å; R758-D823 IonicContact NH1-OD2 2.76Å; R758-D823 PolarHBondContact NH1-OD2 3.47Å; D823-D825 PolarHBondContact O-N 3.09Å
824	D	56.3	Low	69.1	Low	123 Å²	123	48.6 Å²	48.6	66%	0.658	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	12.2	-178.8	-61	-40.6	0	0	0	117.1	G826 M847	D824-G826 VanDerWaalsContact C-N 3.25Å; D824-G826 PolarHBondContact O-N 3.25Å; D824-M847 WeakPolarHBondContact OD1-CG 3.33Å
825	D	60.4	Low	69.7	Low	97 Å²	97	43.7 Å²	43.7	52%	0.519	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	1.4	-177.8	-124	-27.6	0	0	0	113.5	R17 W821 D823	R17-D825 PolarHBondContact NH1-O 3.47Å; R17-D825 IonicContact NH1-OD1 3.23Å; R17-D825 PolarHBondContact NH1-OD1 3.43Å; R17-D825 PolarHBondContact NH2-O 2.98Å; W821-D825 HydrophobicContact CB-CB 4.42Å; D823-D825 PolarHBondContact O-N 3.09Å
826	G	64.9	Low	70.5	Confident	29 Å²	29	40.8 Å²	40.8	30%	0.299	22%	0.223	S	C	.	.	S	Bend	trans	-169.1	172	179.5	0	0	0	0	0	114.2	W821 D824	W821-G826 VanDerWaalsContact NE1-C 3.27Å; D824-G826 VanDerWaalsContact C-N 3.25Å; D824-G826 PolarHBondContact O-N 3.25Å
827	P	68.8	Low	71.1	Confident	65 Å²	65	48.4 Å²	48.4	42%	0.422	26%	0.258	S	S	.	.			trans	-70.2	137.7	-176.7	28.5	-34.5	0	0	0	112.4	W821	W821-P827 HydrophobicContact CZ2-CG 3.96Å; W821-P827 WeakPolarHBondContact CZ2-O 3.41Å; W821-P827 PolarHBondContact NE1-O 2.85Å
828	C	70.2	Confident	71.5	Confident	33 Å²	33	50.2 Å²	50.2	22%	0.223	27%	0.267	C	S	.	.			trans	-84.4	122.1	170.4	169.3	0	0	0	0	110.8	P848 K873	C828-P848 HydrophobicContact CB-CG 4.15Å; C828-P848 PolarHBondContact SG-O 3.46Å; C828-K873 PolarHBondContact O-NZ 3.15Å
829	V	73.5	Confident	71.3	Confident	9 Å²	9	55.1 Å²	55.1	6%	0.055	29%	0.286	C	S	.	.			trans	-96.2	-24.2	-172.6	178.8	0	0	0	0	112.3	V775 H809 F872 K873	V775-V829 HydrophobicContact CB-CG1 4.29Å; V775-V829 HydrophobicContact CG1-CG1 3.45Å; V775-V829 VanDerWaalsContact CG1-CG1 3.45Å; V775-V829 HydrophobicContact CG2-CG1 3.75Å; H809-V829 PolarHBondContact NE2-N 3.49Å; V829-F872 HydrophobicContact CG1-CB 4.4Å; V829-F872 HydrophobicContact CG1-CD1 4Å; V829-K873 PolarHBondContact O-N 2.97Å
830	I	75.8	Confident	71.2	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	134.3	-176.2	-60.7	157	0	0	0	110.2	L807 V833 F849 I870 F872 K873 V888	L807-I830 HydrophobicContact CB-CD1 3.77Å; L807-I830 HydrophobicContact CD1-CD1 3.78Å; L807-I830 HydrophobicContact CG-CD1 4.37Å; I830-V833 HydrophobicContact CG2-CG2 3.86Å; I830-F849 HydrophobicContact CG2-CD2 4.43Å; I830-I870 HydrophobicContact CG1-CG2 4.14Å; I830-I870 HydrophobicContact CG2-CG2 3.98Å; I830-F872 HydrophobicContact CG1-CD1 4.33Å; I830-F872 HydrophobicContact CG1-CE1 4.31Å; I830-K873 WeakPolarHBondContact O-CE 3.32Å; I830-V888 HydrophobicContact CD1-CG1 4.45Å
831	E	75.1	Confident	70.7	Confident	73 Å²	73	58.2 Å²	58.2	34%	0.341	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-53	170.7	-165	-157.9	135.6	0	0	111	F849 N871 K873	E831-F849 WeakPolarHBondContact O-CE2 3.41Å; E831-N871 PolarHBondContact N-O 2.97Å; E831-K873 HydrophobicContact CB-CG 3.86Å; E831-K873 HydrophobicContact CG-CG 4.33Å
832	R	76.3	Confident	70.1	Confident	126 Å²	126	68 Å²	68	48%	0.475	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	152.8	-176.3	-52.6	-174.7	-157.3	-156.6	0.5	111.1	N871	R832-N871 PolarHBondContact N-O 3.43Å; R832-N871 PolarHBondContact O-N 3.42Å
833	V	78	Confident	69.7	Low	0 Å²	0	69 Å²	69	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	122.8	167.8	-173.6	0	0	0	0	107.5	L805 L807 I830 Q841 V868 S869 I870	L805-V833 HydrophobicContact CD2-CG1 3.87Å; L807-V833 HydrophobicContact CD1-CG2 3.61Å; I830-V833 HydrophobicContact CG2-CG2 3.86Å; V833-Q841 HydrophobicContact CB-CB 4.41Å; V833-Q841 VanDerWaalsContact CG1-OE1 3.22Å; V833-Q841 PolarHBondContact O-N 3.43Å; V833-V868 HydrophobicContact CG1-CG1 3.71Å; V833-S869 WeakPolarHBondContact CA-O 3.39Å; V833-I870 HydrophobicContact CG1-CG1 4.29Å; V833-I870 HydrophobicContact CG2-CG1 4.46Å
834	C	76.6	Confident	69.3	Low	18 Å²	18	71.2 Å²	71.2	12%	0.122	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	154.6	174.4	-57.8	0	0	0	0	108.9	Y839 V868 S869	C834-Y839 CarbonylContact C-O 3.54Å; C834-Y839 WeakPolarHBondContact CA-O 3.4Å; C834-V868 CarbonylContact O-C 3.59Å; C834-V868 WeakPolarHBondContact O-CA 3.3Å; C834-S869 PolarHBondContact N-O 2.89Å; C834-S869 PolarHBondContact O-N 3.26Å
835	L	75.5	Confident	69.1	Low	1 Å²	1	68.5 Å²	68.5	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142.5	167.8	-179.2	145.7	0	0	0	110.7	F784 Q837 T838 Y839 Y854 L856 H866 E867 V868	F784-L835 HydrophobicContact CE1-CD1 3.88Å; F784-L835 HydrophobicContact CZ-CD1 4.18Å; L835-Q837 PolarHBondContact O-N 3.47Å; L835-T838 PolarHBondContact O-N 3Å; L835-T838 PolarHBondContact O-OG1 3.28Å; L835-Y839 PolarHBondContact N-O 3.48Å; L835-Y839 PolarHBondContact O-N 2.84Å; L835-Y854 HydrophobicContact CB-CE2 4.29Å; L835-Y854 HydrophobicContact CD1-CD2 3.8Å; L835-Y854 HydrophobicContact CD1-CE1 4.11Å; L835-Y854 HydrophobicContact CD1-CE2 3.28Å; L835-Y854 HydrophobicContact CD1-CG 4.42Å; L835-Y854 VanDerWaalsContact CD1-CZ 3.43Å; L835-Y854 HydrophobicContact CD2-CE2 3.56Å; L835-Y854 WeakPolarHBondContact CD2-OH 3.1Å; L835-Y854 HydrophobicContact CG-CE2 3.88Å; L835-L856 HydrophobicContact CD2-CD1 4.07Å; L835-H866 HydrophobicContact CD1-CB 3.97Å; L835-H866 HydrophobicContact CD2-CB 4.29Å; L835-H866 HydrophobicContact CG-CB 4.33Å; L835-E867 WeakPolarHBondContact CA-O 3.35Å; L835-V868 HydrophobicContact CD1-CG2 3.99Å
836	D	74.9	Confident	68.3	Low	41 Å²	41	76.1 Å²	76.1	22%	0.219	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	47.6	32.2	-176.8	-62	-7.3	0	0	0	111.9	T838 H866 E867	D836-T838 WeakPolarHBondContact O-CG2 3.36Å; D836-T838 PolarHBondContact O-N 2.96Å; D836-T838 PolarHBondContact O-OG1 3.47Å; D836-H866 WeakPolarHBondContact OD1-CA 3.49Å; D836-H866 IonicContact OD1-ND1 3.14Å; D836-H866 IonicContact OD2-CE1 3.65Å; D836-H866 IonicContact OD2-CG 2.71Å; D836-H866 IonicContact OD2-ND1 3.64Å; D836-H866 PolarHBondContact OD2-ND1 3.08Å; D836-E867 PolarHBondContact N-O 3.09Å; D836-E867 PolarHBondContact OD1-N 3.02Å
837	Q	73.3	Confident	67.5	Low	165 Å²	165	79.2 Å²	79.2	77%	0.771	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	2.9	-174.1	-50.9	-178.2	18.1	0	0	115.5	L835	L835-Q837 PolarHBondContact O-N 3.47Å
838	T	66.9	Low	66.4	Low	99 Å²	99	79 Å²	79	61%	0.607	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-36.7	-167.5	39.5	0	0	0	0	112.7	L835 D836	L835-T838 PolarHBondContact O-N 3Å; L835-T838 PolarHBondContact O-OG1 3.28Å; D836-T838 WeakPolarHBondContact O-CG2 3.36Å; D836-T838 PolarHBondContact O-N 2.96Å; D836-T838 PolarHBondContact O-OG1 3.47Å
839	Y	69	Low	65.6	Low	128 Å²	128	78.7 Å²	78.7	50%	0.502	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	102.9	-175.3	-65.3	-84.2	0	0	0	111.9	C834 L835 Q841 L856	C834-Y839 CarbonylContact C-O 3.54Å; C834-Y839 WeakPolarHBondContact CA-O 3.4Å; L835-Y839 PolarHBondContact N-O 3.48Å; L835-Y839 PolarHBondContact O-N 2.84Å; Y839-Q841 PolarHBondContact O-N 3.46Å; Y839-L856 HydrophobicContact CD1-CD2 3.79Å; Y839-L856 HydrophobicContact CD2-CD1 3.57Å; Y839-L856 HydrophobicContact CD2-CD2 3.9Å; Y839-L856 HydrophobicContact CD2-CG 4.27Å; Y839-L856 HydrophobicContact CE1-CD2 3.65Å; Y839-L856 HydrophobicContact CE2-CD1 3.5Å; Y839-L856 HydrophobicContact CE2-CD2 3.76Å; Y839-L856 HydrophobicContact CE2-CG 4.31Å; Y839-L856 HydrophobicContact CG-CD1 4.29Å; Y839-L856 HydrophobicContact CG-CD2 3.9Å
840	I	72.9	Confident	64.6	Low	110 Å²	110	79.5 Å²	79.5	56%	0.564	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	110.4	170.8	-51.2	-178.7	0	0	0	108.6
841	Q	68.4	Low	63.6	Low	17 Å²	17	79.7 Å²	79.7	8%	0.079	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	138	178.5	-63.1	-169.8	-64.8	0	0	110.8	V833 Y839 F849 T852 V853	V833-Q841 HydrophobicContact CB-CB 4.41Å; V833-Q841 VanDerWaalsContact CG1-OE1 3.22Å; V833-Q841 PolarHBondContact O-N 3.43Å; Y839-Q841 PolarHBondContact O-N 3.46Å; Q841-F849 WeakPolarHBondContact O-CE1 3.37Å; Q841-T852 HydrophobicContact CB-CG2 3.82Å; Q841-T852 VanDerWaalsContact CD-CB 3.48Å; Q841-T852 VanDerWaalsContact OE1-CB 3.23Å; Q841-T852 PolarHBondContact OE1-OG1 2.88Å; Q841-V853 PolarHBondContact NE2-O 3.37Å; Q841-V853 VanDerWaalsContact NE2-O 3.09Å
842	R	62.4	Low	62.6	Low	221 Å²	221	76.2 Å²	76.2	83%	0.834	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-95.3	147.9	174	-64.3	-178	-179.8	178.8	-0.1	110.3
843	A	61.8	Low	61.5	Low	30 Å²	30	72.8 Å²	72.8	25%	0.248	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-68	139.1	173.2	0	0	0	0	0	110.4	S845 F849	A843-S845 PolarHBondContact O-N 3.15Å; A843-S845 VanDerWaalsContact O-N 3.13Å; A843-F849 HydrophobicContact CB-CD1 3.75Å; A843-F849 HydrophobicContact CB-CE1 3.85Å; A843-F849 HydrophobicContact CB-CG 4.13Å; A843-F849 HydrophobicContact CB-CZ 4.29Å; A843-F849 VanDerWaalsContact N-CE1 3.3Å
844	L	55.4	Low	60.6	Low	110 Å²	110	73.9 Å²	73.9	58%	0.576	36%	0.359	S	S	*	.	S	Bend	trans	-75.5	7.9	180	-65.7	166.9	0	0	0	114.2	V853	L844-V853 HydrophobicContact CD1-CB 3.94Å; L844-V853 HydrophobicContact CD1-CG2 3.6Å; L844-V853 HydrophobicContact CD2-CB 4.33Å
845	S	51.5	Low	59.3	Low	67 Å²	67	78.2 Å²	78.2	47%	0.469	39%	0.387	S	S	.	.	S	Bend	trans	-150	172.4	-174.2	86.4	0	0	0	0	111.7	A843 M847	A843-S845 PolarHBondContact O-N 3.15Å; A843-S845 VanDerWaalsContact O-N 3.13Å; S845-M847 PolarHBondContact O-N 3.37Å; S845-M847 PolarHBondContact OG-N 3.21Å; S845-M847 PolarHBondContact OG-O 3.14Å
846	R	44.2	Very low	58.1	Low	257 Å²	257	80.6 Å²	80.6	97%	0.97	40%	0.399	S	S	*	.	S	Bend	trans	-66.2	-7.9	171.2	-69.6	-175.5	176.1	-178.6	-1.3	113.9
847	M	47.6	Very low	56.9	Low	94 Å²	94	81.7 Å²	81.7	46%	0.463	42%	0.42	S	S	.	.	S	Bend	trans	-105.2	143.2	174.6	-61.6	-59.2	-165.8	0	0	111.2	D824 S845 F849	D824-M847 WeakPolarHBondContact OD1-CG 3.33Å; S845-M847 PolarHBondContact O-N 3.37Å; S845-M847 PolarHBondContact OG-N 3.21Å; S845-M847 PolarHBondContact OG-O 3.14Å; M847-F849 PolarHBondContact O-N 2.9Å; M847-F849 VanDerWaalsContact O-N 3.1Å
848	P	46.3	Very low	55.9	Low	59 Å²	59	84.7 Å²	84.7	38%	0.383	43%	0.425	S	S	.	.	S	Bend	trans	-68.4	109.7	-178.1	27.1	-34	0	0	0	111.9	C828	C828-P848 HydrophobicContact CB-CG 4.15Å; C828-P848 PolarHBondContact SG-O 3.46Å
849	F	52.3	Low	54.8	Low	27 Å²	27	85.4 Å²	85.4	12%	0.118	42%	0.424	C	S	.	.			trans	57.1	81.3	158.3	-52.9	-72.8	0	0	0	117.2	I830 E831 Q841 A843 M847 T852	I830-F849 HydrophobicContact CG2-CD2 4.43Å; E831-F849 WeakPolarHBondContact O-CE2 3.41Å; Q841-F849 WeakPolarHBondContact O-CE1 3.37Å; A843-F849 HydrophobicContact CB-CD1 3.75Å; A843-F849 HydrophobicContact CB-CE1 3.85Å; A843-F849 HydrophobicContact CB-CG 4.13Å; A843-F849 HydrophobicContact CB-CZ 4.29Å; A843-F849 VanDerWaalsContact N-CE1 3.3Å; M847-F849 PolarHBondContact O-N 2.9Å; M847-F849 VanDerWaalsContact O-N 3.1Å; F849-T852 HydrophobicContact CD1-CG2 3.6Å; F849-T852 HydrophobicContact CE1-CG2 3.99Å
850	V	52.8	Low	53.9	Low	26 Å²	26	82 Å²	82	16%	0.158	42%	0.42	C	S	.	.	S	Bend	trans	-90.8	-42	163.1	-177	0	0	0	0	111.2	M822	M822-V850 HydrophobicContact CB-CG1 3.84Å; M822-V850 HydrophobicContact CE-CG1 3.78Å; M822-V850 HydrophobicContact CG-CG1 4.46Å
851	T	54.2	Low	52.8	Low	5 Å²	5	84.5 Å²	84.5	3%	0.031	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	154	170	50	0	0	0	0	109.2	W755 I806 M822	W755-T851 HydrophobicContact CD2-CG2 4.24Å; W755-T851 HydrophobicContact CE3-CG2 4.15Å; W755-T851 HydrophobicContact CH2-CG2 3.56Å; W755-T851 VanDerWaalsContact CH2-OG1 3.29Å; W755-T851 WeakPolarHBondContact CH2-OG1 3.49Å; W755-T851 HydrophobicContact CZ2-CG2 3.61Å; W755-T851 WeakPolarHBondContact CZ2-OG1 3.47Å; W755-T851 HydrophobicContact CZ3-CG2 3.82Å; I806-T851 HydrophobicContact CB-CG2 4.28Å; I806-T851 HydrophobicContact CG1-CG2 3.93Å; I806-T851 HydrophobicContact CG2-CG2 4.05Å; M822-T851 HydrophobicContact CE-CG2 3.55Å
852	T	55.2	Low	52.3	Low	0 Å²	0	91.5 Å²	91.5	0%	0	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	107.2	166.9	48.9	0	0	0	0	108.8	L805 Q841 F849	L805-T852 WeakPolarHBondContact CB-O 3.35Å; L805-T852 WeakPolarHBondContact CD2-OG1 3.29Å; L805-T852 PolarHBondContact N-O 3.33Å; L805-T852 PolarHBondContact O-N 3.4Å; Q841-T852 HydrophobicContact CB-CG2 3.82Å; Q841-T852 VanDerWaalsContact CD-CB 3.48Å; Q841-T852 VanDerWaalsContact OE1-CB 3.23Å; Q841-T852 PolarHBondContact OE1-OG1 2.88Å; F849-T852 HydrophobicContact CD1-CG2 3.6Å; F849-T852 HydrophobicContact CE1-CG2 3.99Å
853	V	53.1	Low	52.4	Low	54 Å²	54	85.2 Å²	85.2	33%	0.327	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	143.7	165.4	162.2	0	0	0	0	108	I804 Q841 L844 P855	I804-V853 HydrophobicContact CD1-CG2 4.06Å; I804-V853 HydrophobicContact CG1-CG2 4.08Å; I804-V853 HydrophobicContact CG2-CG2 4.12Å; Q841-V853 PolarHBondContact NE2-O 3.37Å; Q841-V853 VanDerWaalsContact NE2-O 3.09Å; L844-V853 HydrophobicContact CD1-CB 3.94Å; L844-V853 HydrophobicContact CD1-CG2 3.6Å; L844-V853 HydrophobicContact CD2-CB 4.33Å; V853-P855 VanDerWaalsContact O-CD 3.24Å; V853-P855 WeakPolarHBondContact O-CD 3.38Å
854	Y	58.3	Low	52.7	Low	23 Å²	23	88.7 Å²	88.7	9%	0.09	46%	0.462	C	S	.	.			trans	-115.6	91	-173.7	176.4	-121.1	0	0	0	111.4	F784 P803 L835 L856 H866	F784-Y854 HydrophobicContact CZ-CD1 4.19Å; F784-Y854 AromaticContact CZ-CE1 3.99Å; F784-Y854 HydrophobicContact CZ-CE1 3.99Å; P803-Y854 HydrophobicContact CB-CD1 4.39Å; P803-Y854 HydrophobicContact CG-CD1 3.84Å; P803-Y854 PolarHBondContact O-N 2.89Å; L835-Y854 HydrophobicContact CB-CE2 4.29Å; L835-Y854 HydrophobicContact CD1-CD2 3.8Å; L835-Y854 HydrophobicContact CD1-CE1 4.11Å; L835-Y854 HydrophobicContact CD1-CE2 3.28Å; L835-Y854 HydrophobicContact CD1-CG 4.42Å; L835-Y854 VanDerWaalsContact CD1-CZ 3.43Å; L835-Y854 HydrophobicContact CD2-CE2 3.56Å; L835-Y854 WeakPolarHBondContact CD2-OH 3.1Å; L835-Y854 HydrophobicContact CG-CE2 3.88Å; Y854-L856 HydrophobicContact CE1-CB 4.37Å; Y854-L856 HydrophobicContact CE2-CB 3.99Å; Y854-L856 HydrophobicContact CE2-CD1 4.04Å; Y854-L856 HydrophobicContact CE2-CG 3.56Å; Y854-L856 PolarHBondContact O-N 2.7Å; Y854-L856 WeakPolarHBondContact OH-CB 3.49Å; Y854-L856 VanDerWaalsContact OH-CD1 3.25Å; Y854-L856 WeakPolarHBondContact OH-CD1 3.18Å; Y854-L856 WeakPolarHBondContact OH-CG 3.44Å; Y854-H866 PolarHBondContact OH-CE1 2.88Å; Y854-H866 VanDerWaalsContact OH-CE1 3.23Å; Y854-H866 PolarHBondContact OH-ND1 2.7Å; Y854-H866 PolarHBondContact OH-NE2 3.3Å
855	P	50.3	Low	53.5	Low	109 Å²	109	90.1 Å²	90.1	71%	0.708	47%	0.466	S	S	*	.			trans	-98.4	68.2	-178.4	38.8	-34.9	0	0	0	112	V853	V853-P855 VanDerWaalsContact O-CD 3.24Å; V853-P855 WeakPolarHBondContact O-CD 3.38Å
856	L	49.3	Very low	54.7	Low	50 Å²	50	88.3 Å²	88.3	26%	0.262	45%	0.45	S	S	.	.	S	Bend	trans	-97	171.5	156.1	-68.9	-159.5	0	0	0	111	L835 Y839 Y854 W858	L835-L856 HydrophobicContact CD2-CD1 4.07Å; Y839-L856 HydrophobicContact CD1-CD2 3.79Å; Y839-L856 HydrophobicContact CD2-CD1 3.57Å; Y839-L856 HydrophobicContact CD2-CD2 3.9Å; Y839-L856 HydrophobicContact CD2-CG 4.27Å; Y839-L856 HydrophobicContact CE1-CD2 3.65Å; Y839-L856 HydrophobicContact CE2-CD1 3.5Å; Y839-L856 HydrophobicContact CE2-CD2 3.76Å; Y839-L856 HydrophobicContact CE2-CG 4.31Å; Y839-L856 HydrophobicContact CG-CD1 4.29Å; Y839-L856 HydrophobicContact CG-CD2 3.9Å; Y854-L856 HydrophobicContact CE1-CB 4.37Å; Y854-L856 HydrophobicContact CE2-CB 3.99Å; Y854-L856 HydrophobicContact CE2-CD1 4.04Å; Y854-L856 HydrophobicContact CE2-CG 3.56Å; Y854-L856 PolarHBondContact O-N 2.7Å; Y854-L856 WeakPolarHBondContact OH-CB 3.49Å; Y854-L856 VanDerWaalsContact OH-CD1 3.25Å; Y854-L856 WeakPolarHBondContact OH-CD1 3.18Å; Y854-L856 WeakPolarHBondContact OH-CG 3.44Å; L856-W858 PolarHBondContact O-N 3.29Å
857	G	49.9	Very low	56.4	Low	64 Å²	64	78.3 Å²	78.3	66%	0.66	41%	0.414	S	S	*	.			trans	-59.4	97.1	-168	0	0	0	0	0	114.7	N859	G857-N859 PolarHBondContact O-N 2.91Å
858	W	52.2	Low	57.9	Low	229 Å²	229	73.9 Å²	73.9	87%	0.867	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-8.5	169.8	61.6	-66.2	0	0	0	116.8	L856	L856-W858 PolarHBondContact O-N 3.29Å
859	N	44.6	Very low	59.6	Low	113 Å²	113	72.5 Å²	72.5	60%	0.604	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	22.3	-172	-72.2	-18.6	0	0	0	114.7	G857 L861	G857-N859 PolarHBondContact O-N 2.91Å; N859-L861 PolarHBondContact O-N 3.21Å
860	S	49.3	Very low	60.9	Low	57 Å²	57	71.2 Å²	71.2	40%	0.399	38%	0.379	S	S	.	.			trans	-80	112.3	169.6	-175.1	0	0	0	0	111.2	K862	S860-K862 PolarHBondContact O-N 3.12Å; S860-K862 VanDerWaalsContact O-N 3.11Å; S860-K862 PolarHBondContact OG-N 3.44Å; S860-K862 PolarHBondContact OG-O 3.08Å
861	L	50	Low	62.2	Low	163 Å²	163	72.7 Å²	72.7	85%	0.853	39%	0.386	S	S	*	.	S	Bend	trans	-65.1	-5.2	168.3	-81.5	130.5	0	0	0	113.6	N788 N859	N788-L861 PolarHBondContact ND2-O 3.37Å; N859-L861 PolarHBondContact O-N 3.21Å
862	K	58.1	Low	63.3	Low	164 Å²	164	72.9 Å²	72.9	71%	0.713	39%	0.386	S	S	*	.	S	Bend	trans	-115.3	130.7	177.4	-63.4	-179.6	-179.6	178.6	0	110.2	S860 Q864	S860-K862 PolarHBondContact O-N 3.12Å; S860-K862 VanDerWaalsContact O-N 3.11Å; S860-K862 PolarHBondContact OG-N 3.44Å; S860-K862 PolarHBondContact OG-O 3.08Å; K862-Q864 PolarHBondContact O-N 3.29Å
863	P	64	Low	64.3	Low	89 Å²	89	75.4 Å²	75.4	58%	0.578	40%	0.397	S	S	*	.	P	Polyproline II helix	trans	-64.7	118.2	170.9	28.1	-33.3	0	0	0	109.1
864	Q	68.3	Low	64.9	Low	103 Å²	103	77 Å²	77	48%	0.481	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-99.9	142.6	173.6	178.7	169	-23.5	0	0	109.1	S785 K862	S785-Q864 WeakPolarHBondContact CA-O 3.41Å; K862-Q864 PolarHBondContact O-N 3.29Å
865	E	73.1	Confident	64.8	Low	140 Å²	140	83.2 Å²	83.2	65%	0.654	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	127	163.6	-70.1	-166.4	171.6	0	0	109.3	F784	F784-E865 WeakPolarHBondContact O-CA 3.23Å
866	H	75.2	Confident	65.1	Low	29 Å²	29	79 Å²	79	13%	0.134	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	141.9	172.6	-65.9	-64.5	0	0	0	110.1	K783 F784 L835 D836 Y854	K783-H866 WeakPolarHBondContact CA-O 3.3Å; F784-H866 HydrophobicContact CD1-CB 4.09Å; F784-H866 HydrophobicContact CE1-CB 3.55Å; F784-H866 HydrophobicContact CE2-CB 4.45Å; F784-H866 HydrophobicContact CZ-CB 3.76Å; F784-H866 PolarHBondContact N-O 3.06Å; F784-H866 PolarHBondContact O-N 3.23Å; L835-H866 HydrophobicContact CD1-CB 3.97Å; L835-H866 HydrophobicContact CD2-CB 4.29Å; L835-H866 HydrophobicContact CG-CB 4.33Å; D836-H866 WeakPolarHBondContact OD1-CA 3.49Å; D836-H866 IonicContact OD1-ND1 3.14Å; D836-H866 IonicContact OD2-CE1 3.65Å; D836-H866 IonicContact OD2-CG 2.71Å; D836-H866 IonicContact OD2-ND1 3.64Å; D836-H866 PolarHBondContact OD2-ND1 3.08Å; Y854-H866 PolarHBondContact OH-CE1 2.88Å; Y854-H866 VanDerWaalsContact OH-CE1 3.23Å; Y854-H866 PolarHBondContact OH-ND1 2.7Å; Y854-H866 PolarHBondContact OH-NE2 3.3Å
867	E	80.1	Confident	65.4	Low	46 Å²	46	79.7 Å²	79.7	22%	0.215	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	107.2	177.2	-177.9	161.4	-162.2	0	0	110.6	S781 K783 L835 D836	S781-E867 WeakPolarHBondContact CB-OE1 3.38Å; S781-E867 PolarHBondContact OG-OE1 3.29Å; K783-E867 WeakPolarHBondContact CE-OE1 3.35Å; K783-E867 WeakPolarHBondContact CE-OE2 3.39Å; K783-E867 HydrophobicContact CG-CB 4.21Å; K783-E867 HydrophobicContact CG-CG 4.17Å; K783-E867 IonicContact NZ-OE2 2.62Å; K783-E867 PolarHBondContact NZ-OE2 3.49Å; L835-E867 WeakPolarHBondContact CA-O 3.35Å; D836-E867 PolarHBondContact N-O 3.09Å; D836-E867 PolarHBondContact OD1-N 3.02Å
868	V	79.6	Confident	65.3	Low	2 Å²	2	80.8 Å²	80.8	1%	0.012	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	128.5	167	-177.7	0	0	0	0	108.1	S781 V782 F784 L805 V833 C834 L835 I870	S781-V868 CarbonylContact C-O 3.54Å; S781-V868 WeakPolarHBondContact CA-O 3.31Å; S781-V868 VanDerWaalsContact CB-O 3.24Å; S781-V868 WeakPolarHBondContact CB-O 3.48Å; V782-V868 PolarHBondContact N-O 3.4Å; V782-V868 PolarHBondContact O-N 3.1Å; F784-V868 HydrophobicContact CD1-CG2 4.2Å; F784-V868 HydrophobicContact CE1-CG2 3.82Å; L805-V868 HydrophobicContact CD2-CB 4.46Å; L805-V868 HydrophobicContact CD2-CG1 3.55Å; L805-V868 HydrophobicContact CD2-CG2 4.03Å; V833-V868 HydrophobicContact CG1-CG1 3.71Å; C834-V868 CarbonylContact O-C 3.59Å; C834-V868 WeakPolarHBondContact O-CA 3.3Å; L835-V868 HydrophobicContact CD1-CG2 3.99Å; V868-I870 HydrophobicContact CG1-CD1 4.43Å; V868-I870 HydrophobicContact CG1-CG1 3.95Å
869	S	81	Confident	65.3	Low	29 Å²	29	72.7 Å²	72.7	20%	0.203	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.6	164.9	58.6	0	0	0	0	111.2	V833 C834	V833-S869 WeakPolarHBondContact CA-O 3.39Å; C834-S869 PolarHBondContact N-O 2.89Å; C834-S869 PolarHBondContact O-N 3.26Å
870	I	80.6	Confident	65.6	Low	1 Å²	1	72.5 Å²	72.5	1%	0.005	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	125.8	-176.6	-55.5	-178.7	0	0	0	108.2	S779 A780 L807 I830 V833 V868 F872 I890	S779-I870 CarbonylContact C-O 3.55Å; S779-I870 WeakPolarHBondContact CA-O 3.41Å; S779-I870 VanDerWaalsContact CB-O 3.26Å; S779-I870 WeakPolarHBondContact CB-O 3.45Å; A780-I870 PolarHBondContact N-O 2.71Å; A780-I870 PolarHBondContact O-N 3.2Å; L807-I870 HydrophobicContact CD1-CD1 4.05Å; L807-I870 HydrophobicContact CD2-CD1 3.59Å; I830-I870 HydrophobicContact CG1-CG2 4.14Å; I830-I870 HydrophobicContact CG2-CG2 3.98Å; V833-I870 HydrophobicContact CG1-CG1 4.29Å; V833-I870 HydrophobicContact CG2-CG1 4.46Å; V868-I870 HydrophobicContact CG1-CD1 4.43Å; V868-I870 HydrophobicContact CG1-CG1 3.95Å; I870-F872 HydrophobicContact CG2-CD1 4.34Å; I870-F872 HydrophobicContact CG2-CE1 3.84Å; I870-F872 HydrophobicContact CG2-CZ 3.99Å; I870-I890 HydrophobicContact CD1-CD1 3.54Å; I870-I890 HydrophobicContact CD1-CG1 4Å
871	N	80.2	Confident	65.5	Low	57 Å²	57	78.2 Å²	78.2	31%	0.305	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	133.5	175.5	-65.2	-14.2	0	0	0	109.5	S779 E831 R832	S779-N871 WeakPolarHBondContact CB-OD1 3.47Å; E831-N871 PolarHBondContact N-O 2.97Å; R832-N871 PolarHBondContact N-O 3.43Å; R832-N871 PolarHBondContact O-N 3.42Å
872	F	77.8	Confident	65.7	Low	8 Å²	8	73 Å²	73	4%	0.035	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	145.3	-177.5	-56.3	-75.2	0	0	0	111.4	I773 Q777 C778 A780 V829 I830 I870 V888	I773-F872 HydrophobicContact CG2-CE2 4.22Å; I773-F872 HydrophobicContact CG2-CZ 4.05Å; Q777-F872 WeakPolarHBondContact O-CD2 3.41Å; C778-F872 PolarHBondContact O-N 3.12Å; A780-F872 HydrophobicContact CB-CE2 4.33Å; V829-F872 HydrophobicContact CG1-CB 4.4Å; V829-F872 HydrophobicContact CG1-CD1 4Å; I830-F872 HydrophobicContact CG1-CD1 4.33Å; I830-F872 HydrophobicContact CG1-CE1 4.31Å; I870-F872 HydrophobicContact CG2-CD1 4.34Å; I870-F872 HydrophobicContact CG2-CE1 3.84Å; I870-F872 HydrophobicContact CG2-CZ 3.99Å; F872-V888 HydrophobicContact CE1-CB 4.35Å; F872-V888 HydrophobicContact CE1-CG2 3.93Å
873	K	74.5	Confident	65.7	Low	53 Å²	53	71.9 Å²	71.9	23%	0.23	39%	0.393	C	S	.	.			trans	-64.8	133.8	-176.5	-68.6	173.4	-176.6	158.6	0	111.5	C828 V829 I830 E831 E875 S876	C828-K873 PolarHBondContact O-NZ 3.15Å; V829-K873 PolarHBondContact O-N 2.97Å; I830-K873 WeakPolarHBondContact O-CE 3.32Å; E831-K873 HydrophobicContact CB-CG 3.86Å; E831-K873 HydrophobicContact CG-CG 4.33Å; K873-E875 PolarHBondContact O-N 3.24Å; K873-S876 WeakPolarHBondContact O-CB 3.31Å; K873-S876 PolarHBondContact O-N 3.2Å; K873-S876 PolarHBondContact O-OG 3.41Å
874	P	66.1	Low	65.8	Low	88 Å²	88	73 Å²	73	57%	0.571	39%	0.386	S	S	*	.	H	α-helix	trans	-61.7	-30	178.9	24.4	-33.8	0	0	0	113.2	S876 I877 S878	P874-S876 PolarHBondContact O-N 2.8Å; P874-I877 WeakPolarHBondContact O-CB 3.22Å; P874-I877 PolarHBondContact O-N 3.18Å; P874-S878 PolarHBondContact O-N 3.38Å
875	E	57.2	Low	65.9	Low	154 Å²	154	69.3 Å²	69.3	72%	0.72	37%	0.371	S	S	*	.	H	α-helix	trans	-62	-22	174.4	-60.3	-176.8	151.2	0	0	114.1	K873 S878	K873-E875 PolarHBondContact O-N 3.24Å; E875-S878 PolarHBondContact O-OG 3.48Å
876	S	56.2	Low	65.9	Low	21 Å²	21	63.6 Å²	63.6	15%	0.147	35%	0.346	C	S	.	.	H	α-helix	trans	-77.6	-33.1	172.8	71.7	0	0	0	0	111.7	K873 P874 S879	K873-S876 WeakPolarHBondContact O-CB 3.31Å; K873-S876 PolarHBondContact O-N 3.2Å; K873-S876 PolarHBondContact O-OG 3.41Å; P874-S876 PolarHBondContact O-N 2.8Å; S876-S879 PolarHBondContact O-N 3.1Å; S876-S879 PolarHBondContact O-OG 3.48Å
877	I	55.9	Low	65.9	Low	63 Å²	63	62.5 Å²	62.5	32%	0.323	34%	0.341	S	S	.	.	H	α-helix	trans	-75.1	-38.7	-179.1	-50.1	177.6	0	0	0	110.4	C778 P874 S879 I880	C778-I877 HydrophobicContact CB-CD1 4.3Å; P874-I877 WeakPolarHBondContact O-CB 3.22Å; P874-I877 PolarHBondContact O-N 3.18Å; I877-S879 PolarHBondContact O-N 3.15Å; I877-S879 VanDerWaalsContact O-N 3.12Å; I877-I880 WeakPolarHBondContact O-CG1 3.45Å
878	S	48.2	Very low	65.8	Low	88 Å²	88	60.3 Å²	60.3	62%	0.615	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-11.9	177.2	63.9	0	0	0	0	114	P874 E875 I880	P874-S878 PolarHBondContact O-N 3.38Å; E875-S878 PolarHBondContact O-OG 3.48Å; S878-I880 PolarHBondContact O-N 3.18Å
879	S	50.5	Low	65.7	Low	59 Å²	59	60.2 Å²	60.2	41%	0.413	33%	0.33	S	S	.	.			trans	-76.6	40.9	172.7	76.7	0	0	0	0	113.8	S876 I877 H881 S882	S876-S879 PolarHBondContact O-N 3.1Å; S876-S879 PolarHBondContact O-OG 3.48Å; I877-S879 PolarHBondContact O-N 3.15Å; I877-S879 VanDerWaalsContact O-N 3.12Å; S879-H881 PolarHBondContact O-N 2.71Å; S879-S882 WeakPolarHBondContact O-CB 3.34Å; S879-S882 PolarHBondContact O-N 3.26Å
880	I	51.4	Low	65.6	Low	109 Å²	109	59 Å²	59	56%	0.559	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-33.7	-177.3	-62.1	167.1	0	0	0	111.9	I877 S878 S882	I877-I880 WeakPolarHBondContact O-CG1 3.45Å; S878-I880 PolarHBondContact O-N 3.18Å; I880-S882 VanDerWaalsContact C-N 3.3Å; I880-S882 PolarHBondContact O-N 3.24Å
881	H	47.9	Very low	65.5	Low	177 Å²	177	59.2 Å²	59.2	82%	0.819	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	6.8	177.8	-49.8	-51.5	0	0	0	114.9	S879 T883	S879-H881 PolarHBondContact O-N 2.71Å; H881-T883 PolarHBondContact O-N 3.37Å
882	S	54.1	Low	65.5	Low	53 Å²	53	56.6 Å²	56.6	37%	0.371	31%	0.308	S	S	.	.			trans	-77.9	102.7	173.5	175.4	0	0	0	0	110.5	S879 I880 R884	S879-S882 WeakPolarHBondContact O-CB 3.34Å; S879-S882 PolarHBondContact O-N 3.26Å; I880-S882 VanDerWaalsContact C-N 3.3Å; I880-S882 PolarHBondContact O-N 3.24Å; S882-R884 PolarHBondContact O-N 3.4Å
883	T	57.6	Low	65.5	Low	141 Å²	141	56.2 Å²	56.2	87%	0.865	31%	0.307	S	S	*	.	S	Bend	trans	-63.2	16.1	-176.1	58.5	0	0	0	0	116.8	H881	H881-T883 PolarHBondContact O-N 3.37Å
884	R	66.6	Low	65.8	Low	112 Å²	112	53.8 Å²	53.8	42%	0.423	30%	0.297	S	S	.	.	S	Bend	trans	-140.2	118.8	176.7	-63.5	-173.7	-178.3	-159.2	-3.8	109.5	D819 S882 T886	D819-R884 IonicContact OD2-NH1 3.64Å; S882-R884 PolarHBondContact O-N 3.4Å; R884-T886 PolarHBondContact O-N 3.23Å
885	P	69.2	Low	66.3	Low	25 Å²	25	49.8 Å²	49.8	16%	0.162	27%	0.271	C	S	.	.			trans	-65.1	137.2	177.7	27.4	-33	0	0	0	110.2	L610 R811 I812	L610-P885 WeakPolarHBondContact O-CG 3.38Å; R811-P885 WeakPolarHBondContact CA-O 3.36Å; I812-P885 HydrophobicContact CB-CG 4.06Å; I812-P885 HydrophobicContact CD1-CG 4.41Å; I812-P885 HydrophobicContact CG1-CG 4.25Å; I812-P885 PolarHBondContact N-O 3.49Å
886	T	73.6	Confident	67.4	Low	21 Å²	21	42.7 Å²	42.7	13%	0.129	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	143.3	169.4	43.6	0	0	0	0	109.4	V775 G810 R811 R884	V775-T886 WeakPolarHBondContact CB-O 3.23Å; V775-T886 WeakPolarHBondContact CB-OG1 3.43Å; V775-T886 WeakPolarHBondContact CG2-O 3.42Å; V775-T886 PolarHBondContact N-O 2.72Å; V775-T886 VanDerWaalsContact N-O 3.13Å; G810-T886 WeakPolarHBondContact O-CA 3.14Å; R811-T886 HydrophobicContact CG-CG2 3.62Å; R884-T886 PolarHBondContact O-N 3.23Å
887	C	74.9	Confident	68.5	Low	6 Å²	6	47.7 Å²	47.7	4%	0.041	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	160.7	178.9	-53.9	0	0	0	0	109.3	W772 I773 G810	W772-C887 HydrophobicContact CE3-CB 3.62Å; W772-C887 HydrophobicContact CZ3-CB 3.71Å; I773-C887 CarbonylContact O-C 3.49Å; I773-C887 WeakPolarHBondContact O-CA 3.39Å; I773-C887 WeakPolarHBondContact O-CB 3.33Å; G810-C887 PolarHBondContact N-O 2.86Å; G810-C887 PolarHBondContact O-N 2.91Å
888	V	77.7	Confident	69.3	Low	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.8	171.2	177.5	0	0	0	0	108.8	I773 V775 L807 V808 I830 F872 I890	I773-V888 PolarHBondContact N-O 3.08Å; I773-V888 PolarHBondContact O-N 3.33Å; V775-V888 HydrophobicContact CG2-CG2 4.35Å; L807-V888 HydrophobicContact CB-CG1 4.36Å; V808-V888 CarbonylContact O-C 3.43Å; V808-V888 WeakPolarHBondContact O-CA 3.35Å; I830-V888 HydrophobicContact CD1-CG1 4.45Å; F872-V888 HydrophobicContact CE1-CB 4.35Å; F872-V888 HydrophobicContact CE1-CG2 3.93Å; V888-I890 HydrophobicContact CG1-CG1 4.39Å
889	A	78.9	Confident	70.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.1	167.9	0	0	0	0	0	109.1	V748 Q771 W772 V808	V748-A889 HydrophobicContact CG2-CB 3.99Å; Q771-A889 CarbonylContact O-C 3.56Å; Q771-A889 WeakPolarHBondContact O-CA 3.39Å; W772-A889 HydrophobicContact CD2-CB 4Å; W772-A889 HydrophobicContact CG-CB 4.39Å; W772-A889 HydrophobicContact CH2-CB 4.31Å; W772-A889 HydrophobicContact CZ2-CB 3.53Å; V808-A889 HydrophobicContact CB-CB 4.03Å; V808-A889 PolarHBondContact N-O 3.06Å; V808-A889 PolarHBondContact O-N 3.1Å
890	I	78.4	Confident	70.3	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.1	178.1	-55.6	174.2	0	0	0	107.5	C770 Q771 I773 V782 L805 L807 I870 V888	C770-I890 CarbonylContact C-O 3.58Å; C770-I890 WeakPolarHBondContact CA-O 3.2Å; Q771-I890 PolarHBondContact N-O 2.54Å; Q771-I890 PolarHBondContact O-N 3.07Å; I773-I890 HydrophobicContact CD1-CD1 3.41Å; I773-I890 VanDerWaalsContact CD1-CD1 3.41Å; I773-I890 HydrophobicContact CG1-CD1 3.75Å; V782-I890 HydrophobicContact CG2-CD1 3.52Å; V782-I890 HydrophobicContact CG2-CG2 4.18Å; L805-I890 HydrophobicContact CD1-CG2 3.72Å; L807-I890 HydrophobicContact CD2-CB 4.24Å; L807-I890 HydrophobicContact CD2-CG1 3.9Å; L807-I890 HydrophobicContact CD2-CG2 3.93Å; I870-I890 HydrophobicContact CD1-CD1 3.54Å; I870-I890 HydrophobicContact CD1-CG1 4Å; V888-I890 HydrophobicContact CG1-CG1 4.39Å
891	M	78.8	Confident	69.9	Low	7 Å²	7	48.3 Å²	48.3	3%	0.034	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	138.6	176.2	-176.3	174.3	51	0	0	110.2	V748 V752 L766 C770 I806 V893	V748-M891 HydrophobicContact CG1-CE 4.25Å; V752-M891 HydrophobicContact CB-CE 3.94Å; V752-M891 HydrophobicContact CG1-CE 3.69Å; V752-M891 HydrophobicContact CG2-CE 3.75Å; L766-M891 HydrophobicContact CD1-CG 3.63Å; L766-M891 HydrophobicContact CD1-SD 3.59Å; L766-M891 VanDerWaalsContact CD1-SD 3.59Å; C770-M891 PolarHBondContact SG-SD 3.13Å; I806-M891 PolarHBondContact N-O 2.84Å; I806-M891 PolarHBondContact O-N 3.39Å; M891-V893 HydrophobicContact CE-CG2 3.74Å; M891-V893 HydrophobicContact CG-CG2 3.76Å; M891-V893 HydrophobicContact SD-CG2 3.93Å
892	I	79.4	Confident	69.6	Low	2 Å²	2	45.3 Å²	45.3	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	120.1	176	-54.5	177.4	0	0	0	108	V767 S768 F784 P803 I804 L805	V767-I892 HydrophobicContact CB-CB 4.06Å; V767-I892 HydrophobicContact CB-CG2 3.78Å; V767-I892 WeakPolarHBondContact CB-O 3.34Å; V767-I892 HydrophobicContact CG1-CG2 4.22Å; V767-I892 HydrophobicContact CG2-CG2 3.98Å; V767-I892 PolarHBondContact N-O 2.86Å; S768-I892 PolarHBondContact N-O 3Å; F784-I892 HydrophobicContact CB-CD1 3.88Å; F784-I892 HydrophobicContact CD1-CD1 3.3Å; F784-I892 HydrophobicContact CD2-CD1 3.9Å; F784-I892 HydrophobicContact CD2-CG2 4.5Å; F784-I892 HydrophobicContact CE1-CD1 3.7Å; F784-I892 HydrophobicContact CE2-CD1 4.25Å; F784-I892 HydrophobicContact CE2-CG2 4.44Å; F784-I892 HydrophobicContact CG-CD1 3.4Å; F784-I892 VanDerWaalsContact CG-CD1 3.4Å; F784-I892 HydrophobicContact CZ-CD1 4.15Å; P803-I892 HydrophobicContact CB-CG2 4.47Å; I804-I892 WeakPolarHBondContact O-CA 3.09Å; L805-I892 HydrophobicContact CD1-CD1 4.3Å; L805-I892 HydrophobicContact CD1-CG1 3.73Å
893	V	78.6	Confident	69.1	Low	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.9	-170.6	-171.7	0	0	0	0	109.4	Q763 G765 P803 I804 I806 M891 V895	Q763-V893 HydrophobicContact CB-CG1 4.07Å; Q763-V893 HydrophobicContact CG-CG1 3.56Å; G765-V893 WeakPolarHBondContact O-CG1 3.26Å; P803-V893 WeakPolarHBondContact CA-O 3.38Å; I804-V893 PolarHBondContact N-O 3.36Å; I804-V893 PolarHBondContact O-N 2.89Å; I806-V893 HydrophobicContact CD1-CB 4.27Å; I806-V893 HydrophobicContact CD1-CG2 3.81Å; I806-V893 HydrophobicContact CG1-CG2 4.45Å; M891-V893 HydrophobicContact CE-CG2 3.74Å; M891-V893 HydrophobicContact CG-CG2 3.76Å; M891-V893 HydrophobicContact SD-CG2 3.93Å; V893-V895 HydrophobicContact CB-CG2 3.91Å; V893-V895 HydrophobicContact CG1-CG2 3.58Å
894	A	79.9	Confident	68.1	Low	2 Å²	2	51.4 Å²	51.4	2%	0.017	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	122.6	169.2	0	0	0	0	0	108.6	V764 G765 V767 W786 L790 V801	V764-A894 PolarHBondContact N-O 3.16Å; G765-A894 PolarHBondContact N-O 3.22Å; G765-A894 VanDerWaalsContact N-O 3.13Å; G765-A894 PolarHBondContact O-N 2.95Å; V767-A894 HydrophobicContact CG2-CB 4.13Å; W786-A894 HydrophobicContact CH2-CB 3.63Å; W786-A894 HydrophobicContact CZ3-CB 3.9Å; L790-A894 HydrophobicContact CD2-CB 4.01Å; V801-A894 HydrophobicContact CG1-CB 3.99Å
895	V	78.1	Confident	66.8	Low	4 Å²	4	53.1 Å²	53.1	2%	0.024	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.4	-165.7	-173.1	0	0	0	0	111	L756 L761 V762 V801 A802 I804 V893	L756-V895 HydrophobicContact CD2-CG1 3.92Å; L756-V895 HydrophobicContact CD2-CG2 4.1Å; L761-V895 HydrophobicContact CB-CG1 3.59Å; L761-V895 HydrophobicContact CD1-CG1 4.14Å; L761-V895 HydrophobicContact CD2-CG1 3.78Å; L761-V895 HydrophobicContact CG-CG1 4.02Å; V762-V895 WeakPolarHBondContact O-CA 3.16Å; V762-V895 WeakPolarHBondContact O-CG1 3.35Å; V801-V895 CarbonylContact C-O 3.58Å; V801-V895 WeakPolarHBondContact CA-O 3.41Å; A802-V895 PolarHBondContact N-O 2.93Å; A802-V895 PolarHBondContact O-N 2.93Å; I804-V895 HydrophobicContact CB-CG2 4.35Å; I804-V895 HydrophobicContact CD1-CB 3.88Å; I804-V895 HydrophobicContact CD1-CG1 4.04Å; I804-V895 HydrophobicContact CD1-CG2 3.87Å; I804-V895 HydrophobicContact CG1-CB 4.13Å; I804-V895 HydrophobicContact CG1-CG2 3.94Å; V893-V895 HydrophobicContact CB-CG2 3.91Å; V893-V895 HydrophobicContact CG1-CG2 3.58Å
896	A	79.1	Confident	65.2	Low	4 Å²	4	56.7 Å²	56.7	3%	0.033	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	163.2	171.8	0	0	0	0	0	111.1	V762 V764 V800 V801	V762-A896 PolarHBondContact N-O 2.81Å; V762-A896 PolarHBondContact O-N 3.01Å; V764-A896 HydrophobicContact CG2-CB 3.59Å; V800-A896 WeakPolarHBondContact O-CB 3.45Å; V801-A896 HydrophobicContact CG2-CB 4.38Å
897	L	79.2	Confident	63.6	Low	126 Å²	126	59.3 Å²	59.3	66%	0.66	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	142.9	174.5	-70.8	166.1	0	0	0	111.9	L761	L761-L897 HydrophobicContact CD2-CD2 4.04Å
898	S	72.8	Confident	61.9	Low	55 Å²	55	66.2 Å²	66.2	39%	0.385	35%	0.347	S	S	.	.			trans	-72.4	128.6	173.1	-168.8	0	0	0	0	110.6	D760 S900	D760-S898 VanDerWaalsContact O-CB 3.23Å; D760-S898 WeakPolarHBondContact O-CB 3.26Å; D760-S898 PolarHBondContact O-N 3.01Å; S898-S900 PolarHBondContact O-N 3.01Å
899	Q	64.8	Low	60	Low	84 Å²	84	74.1 Å²	74.1	39%	0.393	38%	0.384	S	S	.	.			trans	-88.6	96.4	176	-75.6	178.4	-32.8	0	0	110.4	D901	Q899-D901 VanDerWaalsContact C-N 3.35Å
900	S	54.9	Low	58	Low	85 Å²	85	81.3 Å²	81.3	59%	0.594	42%	0.422	S	S	*	.			trans	-69.3	-28.6	173.2	31.3	0	0	0	0	114	S898 N902 K903	S898-S900 PolarHBondContact O-N 3.01Å; S900-N902 VanDerWaalsContact C-N 3.25Å; S900-N902 PolarHBondContact O-N 3.28Å; S900-K903 PolarHBondContact O-N 3.26Å
901	D	43.8	Very low	55.9	Low	108 Å²	108	83.7 Å²	83.7	58%	0.578	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-1.6	-147.3	-47.5	-14.5	0	0	0	115.1	Q899 K903	Q899-D901 VanDerWaalsContact C-N 3.35Å; D901-K903 VanDerWaalsContact C-N 3.34Å
902	N	42	Very low	53.7	Low	115 Å²	115	90.9 Å²	90.9	62%	0.615	49%	0.486	S	S	*	.	H	α-helix	trans	-84.6	-3.6	176.9	-77.6	-23.1	0	0	0	113.7	S900 V906	S900-N902 VanDerWaalsContact C-N 3.25Å; S900-N902 PolarHBondContact O-N 3.28Å; N902-V906 WeakPolarHBondContact O-CG2 3.4Å
903	K	41.8	Very low	51.4	Low	182 Å²	182	97.7 Å²	97.7	79%	0.791	52%	0.522	S	S	*	.	H	α-helix	trans	-79.1	-29.1	175.5	-83.2	-171.1	173.2	-177.8	0	114.5	S900 D901 S907	S900-K903 PolarHBondContact O-N 3.26Å; D901-K903 VanDerWaalsContact C-N 3.34Å; K903-S907 PolarHBondContact O-OG 3.06Å
904	E	37.2	Very low	49.3	Very low	140 Å²	140	105 Å²	105	65%	0.654	56%	0.56	S	S	*	*	H	α-helix	trans	-86.4	-35.1	-178.6	-63.6	-168.2	135.2	0	0	113.1	V906 S907 Q908	E904-V906 VanDerWaalsContact C-N 3.33Å; E904-V906 PolarHBondContact O-N 3.25Å; E904-S907 WeakPolarHBondContact CA-OG 3.32Å; E904-S907 PolarHBondContact O-N 3.31Å; E904-S907 PolarHBondContact O-OG 3.45Å; E904-Q908 WeakPolarHBondContact O-CG 3.32Å; E904-Q908 PolarHBondContact O-N 2.99Å
905	K	38.8	Very low	47.1	Very low	148 Å²	148	108.6 Å²	108.6	64%	0.643	59%	0.59	S	S	*	*	H	α-helix	trans	-70.8	-24.7	-178.4	-72	-178.5	176.8	174.6	0	114.1
906	V	37.1	Very low	45	Very low	100 Å²	100	115.7 Å²	115.7	61%	0.606	63%	0.627	S	S	*	*	H	α-helix	trans	-80.6	-30.9	174.9	-179.9	0	0	0	0	111.7	N902 E904	N902-V906 WeakPolarHBondContact O-CG2 3.4Å; E904-V906 VanDerWaalsContact C-N 3.33Å; E904-V906 PolarHBondContact O-N 3.25Å
907	S	39.2	Very low	42.8	Very low	75 Å²	75	124.2 Å²	124.2	52%	0.524	67%	0.666	S	S	.	*	H	α-helix	trans	-71.4	-31.4	172.8	37.8	0	0	0	0	113.6	K903 E904	K903-S907 PolarHBondContact O-OG 3.06Å; E904-S907 WeakPolarHBondContact CA-OG 3.32Å; E904-S907 PolarHBondContact O-N 3.31Å; E904-S907 PolarHBondContact O-OG 3.45Å
908	Q	38.6	Very low	40.7	Very low	151 Å²	151	124.3 Å²	124.3	71%	0.706	68%	0.677	S	S	*	*	H	α-helix	trans	-76.8	-20.1	-176	-74	177.3	-1.8	0	0	114.4	E904	E904-Q908 WeakPolarHBondContact O-CG 3.32Å; E904-Q908 PolarHBondContact O-N 2.99Å
909	Q	38.5	Very low	38.7	Very low	167 Å²	167	127 Å²	127	78%	0.78	70%	0.696	S	S	*	*	H	α-helix	trans	-85.7	-17.8	178.3	-71.5	-169.9	-40.1	0	0	114.5
910	N	36.1	Very low	37.3	Very low	150 Å²	150	134.5 Å²	134.5	80%	0.802	72%	0.721	S	S	*	*	S	Bend	trans	-105.5	4.4	178.8	-73.5	-13.8	0	0	0	113.8
911	G	34.3	Very low	36.3	Very low	53 Å²	53	139.1 Å²	139.1	55%	0.546	74%	0.737	S	S	.	*			trans	-92.7	12	-178.2	0	0	0	0	0	115.6	L913	G911-L913 PolarHBondContact O-N 3.14Å
912	N	33.3	Very low	35.6	Very low	158 Å²	158	139.1 Å²	139.1	85%	0.845	75%	0.746	S	S	*	*			trans	-84.4	51.7	-168.5	-161.7	28.3	0	0	0	113.8
913	L	32.3	Very low	35.3	Very low	145 Å²	145	141.6 Å²	141.6	76%	0.759	76%	0.757	S	S	*	*	S	Bend	trans	-157.1	121.1	173.9	-106.9	154.5	0	0	0	109.4	G911	G911-L913 PolarHBondContact O-N 3.14Å
914	N	33.9	Very low	35	Very low	152 Å²	152	136.6 Å²	136.6	81%	0.813	75%	0.75	S	S	*	*			trans	67.2	142.2	179	-43.8	-37.9	0	0	0	116.5
915	A	34.1	Very low	34.9	Very low	78 Å²	78	137.8 Å²	137.8	65%	0.645	76%	0.761	S	S	*	*			cis	-173.6	127.5	-37.1	0	0	0	0	0	107.9
916	I	32.6	Very low	34.5	Very low	153 Å²	153	136.3 Å²	136.3	79%	0.785	77%	0.769	S	S	*	*			trans	68.8	149.7	147.3	-63.7	167.4	0	0	0	117.5
917	Q	33.3	Very low	34.4	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	78%	0.782	S	S	*	*			trans	56.3	87.2	167.7	-75.5	167.2	13	0	0	118.9
918	S	34.2	Very low	34.3	Very low	127 Å²	127	144.7 Å²	144.7	89%	0.888	80%	0.798	S	S	*	*				-173.5	98.7	106.9	60.6	0	0	0	0	111.4
919	S	31.5	Very low	34.2	Very low	112 Å²	112	147.4 Å²	147.4	78%	0.783	83%	0.825	S	S	*	*			trans	-104.6	126.8	176.2	50	0	0	0	0	111.7
920	R	35.5	Very low	34	Very low	242 Å²	242	146.5 Å²	146.5	91%	0.913	83%	0.828	S	S	*	*			trans	172.9	161.7	147.8	-96.4	154.4	-171.6	-157.5	0.6	110.9
921	L	34.3	Very low	33.9	Very low	181 Å²	181	146.3 Å²	146.3	95%	0.948	83%	0.829	S	S	*	*			trans	70.5	54.7	173.1	-55.8	176.7	0	0	0	117.1
922	S	28.8	Very low	33.9	Very low	108 Å²	108	151.4 Å²	151.4	76%	0.755	85%	0.845	S	S	*	*			trans	-109.8	139.3	132.7	58.9	0	0	0	0	108.7
923	I	35.6	Very low	33.9	Very low	167 Å²	167	151.1 Å²	151.1	86%	0.856	85%	0.845	S	S	*	*			trans	168.7	143.4	158.5	-94.4	155.3	0	0	0	108.7
924	A	36.7	Very low	34	Very low	78 Å²	78	151.4 Å²	151.4	65%	0.645	85%	0.85	S	S	*	*			trans	65.6	137.4	169.4	0	0	0	0	0	118.3
925	N	35.1	Very low	34.1	Very low	165 Å²	165	151.4 Å²	151.4	88%	0.882	85%	0.852	S	S	*	*			cis	-153.1	142.1	-12.8	-109.8	-11.9	0	0	0	110.3
926	S	30	Very low	34	Very low	116 Å²	116	156.6 Å²	156.6	81%	0.811	87%	0.867	S	S	*	*			trans	-128.7	88.7	174.8	59	0	0	0	0	110.2
927	Q	33.7	Very low	34.2	Very low	188 Å²	188	156.9 Å²	156.9	88%	0.879	87%	0.874	S	S	*	*			trans	-167.7	115.8	169.5	-113.5	173.2	19.1	0	0	110.4
928	L	37	Very low	34.2	Very low	163 Å²	163	154.7 Å²	154.7	85%	0.853	88%	0.875	S	S	*	*			trans	178.4	120	143.9	-101.6	161.2	0	0	0	109.1
929	T	38.4	Very low	34.2	Very low	209 Å²	209	157.2 Å²	157.2	100%	1.282	87%	0.873	S	S	*	*			trans	40.9	0	165.5	60.4	0	0	0	0	117.9

Retrieved 929 of 929 residues in 1382.9 ms (Link to these results)

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