A0A087YQ90_POEFO Loading...

Ssemaphorin 4F

AlphaFold DB , UniProt , Accession A0A087YQ90, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 872 aa.

						>A0A087YQ90_POEFO|A0A087YQ90
MGDGMTLSGALLVLVPMCCLMPGNCLPTILGELKVEQKTFYGVTNFSTFLLNSSSGILFLGAKDAILAVDTNNLKQPPKKIDWVVPEEKRKSCVGKGKTEADCNNYIRLLEFQKDGHIYVCGTYAFDPQCAFLHVPSFTLEKTEDGALRMETGKGKCPFEPSQRYTAVMAGKWENFGSVLSWLNSCFPSLLYYKCFYFFSSDGILYTAATSNFLGTSYDISRATGPEQERVRTDQSINWLNDPEFVSSALIEQAPDSNPTGDDDKIYFFFTEMAKEHDLYTKVPRVVRVCKSDVGGMKTLQRRWTTFLKAQLVCEDKASGQRYNILTDVFTAQHSPGDPSSTHFYGLFTSQWEPNDISAVCVFSLFDISKVMDGPFKELKKTCENWNSPETVPTPRPGQCLNNNLKAQGFESSLKLPDKVLTFVRDHPLMENSVTAAPLLVRKGIKYTKLAVTLMGEAEDRRGAVLHLGTDRGELHQVAVANQNATLLQEIPLFSPEEPVNNIIMHQGRALVGSPQSVAEVQTEGCALYSSCEVCARARGVGCEWSTEDNTCRFTLTDPGSGDVVDEALKKCNSQGRCDPSTKWLKVSPGLQILLPCVQLSPRPCSWEYPPHRHTRQHHSDLAVTVTEENLGSYVCTCQEGGPNVRDPTPCRRAAFYLHLEEPNASGSFGQNGNRHHLAIYVLLFFVGLVCGAFLLYFLTLKKNSSRPGNRAPDNSLSSGKEQKLLCSSATPQSQSSSSLVSDGFRSSEKQNGKTTSTTATTLLSSQGNGGPHANSYSGGSRVSSNPSNGHSLYGNCDTGGSGLKLNSEILVANALGGRTGDWRRPDLGEKEPGEGNGADELLGARKKGLEDEFVSLSEFQAPLAPCEESSI
					

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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	41.2	Very low	29.6	Very low	257 Å²	257	136 Å²	136	100%	1.266	86%	0.859	S	S	*	*				0	101.2	0	-74.5	163.4	167.3	0	0	106
2	G	29.7	Very low	29.1	Very low	65 Å²	65	136.3 Å²	136.3	67%	0.67	85%	0.848	S	S	*	*			trans	-171.8	174.4	-170.7	0	0	0	0	0	112.8
3	D	32.6	Very low	29.1	Very low	175 Å²	175	135.2 Å²	135.2	94%	0.936	84%	0.839	S	S	*	*			trans	56.8	133.9	156.7	-51.1	-26.3	0	0	0	120.7
4	G	26.1	Very low	28.7	Very low	78 Å²	78	136.9 Å²	136.9	80%	0.804	84%	0.839	S	S	*	*			trans	176.3	95.6	171.4	0	0	0	0	0	113.3
5	M	30	Very low	28.9	Very low	173 Å²	173	136.4 Å²	136.4	85%	0.852	84%	0.835	S	S	*	*			trans	-66.9	167.2	170.7	-63.2	141.8	66.7	0	0	110.7
6	T	26.9	Very low	29.6	Very low	140 Å²	140	135.1 Å²	135.1	86%	0.859	83%	0.83	S	S	*	*				179.3	170.6	90.6	30.8	0	0	0	0	114.1
7	L	28.6	Very low	29.5	Very low	162 Å²	162	137.8 Å²	137.8	85%	0.848	83%	0.834	S	S	*	*			trans	-95	156.9	-165.1	-108.6	77.8	0	0	0	115.7
8	S	28.9	Very low	29.2	Very low	124 Å²	124	137 Å²	137	87%	0.867	83%	0.834	S	S	*	*			trans	69.5	147.6	134.5	-160.7	0	0	0	0	121.8
9	G	26.4	Very low	29.1	Very low	76 Å²	76	136.1 Å²	136.1	78%	0.784	83%	0.832	S	S	*	*			trans	165.9	94.4	168.1	0	0	0	0	0	113.2
10	A	29.8	Very low	29.1	Very low	89 Å²	89	137.7 Å²	137.7	74%	0.736	83%	0.834	S	S	*	*			trans	-134.4	147.7	176.7	0	0	0	0	0	110.9
11	L	25.2	Very low	29.2	Very low	157 Å²	157	139.7 Å²	139.7	82%	0.822	84%	0.837	S	S	*	*			trans	-177.6	141.3	149.6	-124.2	59	0	0	0	115.2
12	L	24.1	Very low	29.1	Very low	140 Å²	140	133.4 Å²	133.4	73%	0.733	82%	0.816	S	S	*	*			trans	48.4	130.2	149.9	-66.7	158.6	0	0	0	120.1
13	V	28.1	Very low	29.2	Very low	121 Å²	121	133.6 Å²	133.6	73%	0.733	82%	0.817	S	S	*	*			cis	72.2	103.3	27.4	-162.9	0	0	0	0	115.8
14	L	24.7	Very low	29.2	Very low	159 Å²	159	132.9 Å²	132.9	83%	0.832	81%	0.813	S	S	*	*				175.9	161.5	122	-96.1	176.3	0	0	0	114.7
15	V	31.1	Very low	29.3	Very low	130 Å²	130	135 Å²	135	79%	0.788	82%	0.815	S	S	*	*			trans	-145.2	131.7	-158.5	168.8	0	0	0	0	110.6
16	P	39.9	Very low	29.2	Very low	116 Å²	116	134.2 Å²	134.2	75%	0.753	81%	0.813	S	S	*	*				-155.3	164.4	116.8	40.3	-22.5	0	0	0	118.3
17	M	27.4	Very low	29.4	Very low	181 Å²	181	132.5 Å²	132.5	89%	0.892	80%	0.804	S	S	*	*			trans	46.7	125.2	145.4	-76.8	-165.3	177.6	0	0	123.6
18	C	24.6	Very low	29.5	Very low	123 Å²	123	131.3 Å²	131.3	83%	0.831	80%	0.804	S	S	*	*				-156.4	129.1	108.3	-147.6	0	0	0	0	112.2
19	C	28.4	Very low	29.6	Very low	119 Å²	119	132.1 Å²	132.1	80%	0.804	80%	0.797	S	S	*	*			trans	-98.5	115.1	172.2	-66.7	0	0	0	0	110.2
20	L	28.8	Very low	29.9	Very low	168 Å²	168	136.2 Å²	136.2	88%	0.88	80%	0.8	S	S	*	*			trans	-143.4	131.5	157.1	-76	179.2	0	0	0	109.7
21	M	30.3	Very low	30.1	Very low	180 Å²	180	134.2 Å²	134.2	89%	0.887	79%	0.788	S	S	*	*			trans	-72.3	177.8	179.5	-61.4	-73.5	-162.4	0	0	111.8
22	P	39.4	Very low	30.8	Very low	126 Å²	126	134.9 Å²	134.9	82%	0.818	79%	0.787	S	S	*	*			cis	-130.1	168.5	-4.3	39.5	-24.5	0	0	0	114.6
23	G	31.6	Very low	32.2	Very low	68 Å²	68	130.5 Å²	130.5	70%	0.701	76%	0.764	S	S	*	*			trans	149	131.5	157.6	0	0	0	0	0	115.4
24	N	32.1	Very low	33.6	Very low	160 Å²	160	131.6 Å²	131.6	86%	0.856	76%	0.759	S	S	*	*			trans	63.5	63.4	166.5	-56.1	-5.8	0	0	0	116.7	L26	N24-L26 PolarHBondContact O-N 3.49Å
25	C	28.4	Very low	36	Very low	124 Å²	124	126.4 Å²	126.4	84%	0.838	73%	0.734	S	S	*	*			trans	-58	128.1	135.7	-64.8	0	0	0	0	107.7
26	L	29	Very low	38.3	Very low	155 Å²	155	122.4 Å²	122.4	81%	0.812	71%	0.707	S	S	*	*			trans	-57.3	129	161.4	-97.9	71.7	0	0	0	107.3	N24 T28	N24-L26 PolarHBondContact O-N 3.49Å; L26-T28 PolarHBondContact O-N 3.28Å; L26-T28 VanDerWaalsContact O-N 3.1Å
27	P	29.7	Very low	40.4	Very low	104 Å²	104	121.6 Å²	121.6	68%	0.675	69%	0.693	S	S	*	*			trans	-65.1	115.7	165.2	27.8	-30.7	0	0	0	107	I29	P27-I29 VanDerWaalsContact C-N 3.29Å; P27-I29 HydrophobicContact CG-CG1 4.49Å; P27-I29 PolarHBondContact O-N 3.41Å
28	T	30.9	Very low	43.2	Very low	138 Å²	138	115.1 Å²	115.1	85%	0.847	66%	0.66	S	S	*	*			trans	-65.3	102.5	156	-61.1	0	0	0	0	104.8	L26 L30	L26-T28 PolarHBondContact O-N 3.28Å; L26-T28 VanDerWaalsContact O-N 3.1Å; T28-L30 PolarHBondContact O-N 2.69Å
29	I	32.7	Very low	46.1	Very low	141 Å²	141	111.6 Å²	111.6	72%	0.723	63%	0.634	S	S	*	*			trans	-66.6	109.7	-174.3	-65.6	176.7	0	0	0	107.5	P27 G31	P27-I29 VanDerWaalsContact C-N 3.29Å; P27-I29 HydrophobicContact CG-CG1 4.49Å; P27-I29 PolarHBondContact O-N 3.41Å; I29-G31 PolarHBondContact O-N 3.45Å
30	L	32.3	Very low	48.8	Very low	161 Å²	161	106.5 Å²	106.5	84%	0.843	60%	0.599	S	S	*	*			trans	-55.9	119.9	160	-133.3	81.5	0	0	0	106.5	T28 E32	T28-L30 PolarHBondContact O-N 2.69Å; L30-E32 VanDerWaalsContact C-N 3.32Å; L30-E32 PolarHBondContact O-N 2.92Å
31	G	33.3	Very low	51.3	Low	47 Å²	47	108.4 Å²	108.4	49%	0.485	60%	0.596	S	S	.	*			trans	-70.1	82.9	-174.3	0	0	0	0	0	112.6	I29 S530	I29-G31 PolarHBondContact O-N 3.45Å; G31-S530 WeakPolarHBondContact O-CB 3.47Å; G31-S530 PolarHBondContact O-OG 2.96Å
32	E	41	Very low	53.7	Low	172 Å²	172	103.6 Å²	103.6	80%	0.804	59%	0.592	S	S	*	*			trans	-66.7	144.2	158.2	-69.2	-172.9	156.9	0	0	109.4	L30 K34	L30-E32 VanDerWaalsContact C-N 3.32Å; L30-E32 PolarHBondContact O-N 2.92Å; E32-K34 PolarHBondContact O-N 3.33Å
33	L	52.3	Low	55.9	Low	48 Å²	48	98.1 Å²	98.1	25%	0.251	56%	0.556	S	S	.	*			trans	-64.3	100.9	176.7	-176.3	76.2	0	0	0	108.9	V35 I491 V521	L33-V35 HydrophobicContact CD2-CG2 4.16Å; L33-V35 HydrophobicContact CG-CG2 4.33Å; L33-V35 PolarHBondContact O-N 2.85Å; L33-I491 HydrophobicContact CD2-CD1 3.66Å; L33-I491 HydrophobicContact CD2-CG1 3.98Å; L33-I491 HydrophobicContact CD2-CG2 4.03Å; L33-V521 HydrophobicContact CD2-CG1 4.37Å
34	K	58.8	Low	58.6	Low	143 Å²	143	97.2 Å²	97.2	62%	0.622	54%	0.537	S	S	*	.			trans	-75.7	85.9	-176.1	-164.6	-164.3	-172.9	-154.4	0	111	E32 E36	E32-K34 PolarHBondContact O-N 3.33Å; K34-E36 WeakPolarHBondContact CE-OE1 3.45Å; K34-E36 IonicContact NZ-OE1 3.89Å; K34-E36 PolarHBondContact NZ-OE1 2.89Å
35	V	74	Confident	61.4	Low	51 Å²	51	92.8 Å²	92.8	31%	0.309	51%	0.513	S	S	.	.			trans	-74.9	122.8	169.8	-178.7	0	0	0	0	108.9	L33 I491 L493 A519	L33-V35 HydrophobicContact CD2-CG2 4.16Å; L33-V35 HydrophobicContact CG-CG2 4.33Å; L33-V35 PolarHBondContact O-N 2.85Å; V35-I491 HydrophobicContact CG2-CG2 4.27Å; V35-L493 HydrophobicContact CG1-CD2 3.7Å; V35-L493 HydrophobicContact CG2-CD2 4.14Å; V35-A519 HydrophobicContact CG1-CB 4.34Å
36	E	79.7	Confident	64.4	Low	46 Å²	46	86.9 Å²	86.9	22%	0.215	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	112	171.3	-67.4	-154.7	-165.3	0	0	110	K34 L74 A519 E520	K34-E36 WeakPolarHBondContact CE-OE1 3.45Å; K34-E36 IonicContact NZ-OE1 3.89Å; K34-E36 PolarHBondContact NZ-OE1 2.89Å; E36-L74 HydrophobicContact CB-CD1 4.24Å; E36-A519 WeakPolarHBondContact O-CA 3.18Å; E36-E520 PolarHBondContact N-O 2.84Å; E36-E520 PolarHBondContact O-N 3.46Å
37	Q	84.3	Confident	67.1	Low	99 Å²	99	81 Å²	81	46%	0.463	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	141.3	-178.3	-169.3	-171.4	7.2	0	0	111.8	L493 F494 S517 V518 A519	Q37-L493 PolarHBondContact NE2-O 3.5Å; Q37-F494 HydrophobicContact CG-CE1 4.48Å; Q37-S517 PolarHBondContact NE2-OG 2.04Å; Q37-V518 WeakPolarHBondContact CA-O 3.41Å; Q37-A519 HydrophobicContact CB-CB 4.48Å; Q37-A519 HydrophobicContact CG-CB 4.35Å
38	K	85.7	Confident	70	Confident	45 Å²	45	76.7 Å²	76.7	20%	0.196	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	113.3	174	-177.8	59.3	167.9	-111.6	0	111	F40 L74 K75 Q76 S517 V518	K38-F40 HydrophobicContact CB-CE2 4.44Å; K38-F40 HydrophobicContact CB-CZ 4.32Å; K38-F40 HydrophobicContact CG-CD1 4.5Å; K38-F40 HydrophobicContact CG-CE1 3.88Å; K38-F40 HydrophobicContact CG-CE2 4.05Å; K38-F40 HydrophobicContact CG-CZ 3.62Å; K38-F40 WeakPolarHBondContact O-CE2 3.41Å; K38-L74 HydrophobicContact CB-CB 4.31Å; K38-L74 WeakPolarHBondContact CD-O 3.16Å; K38-L74 WeakPolarHBondContact CE-O 3.41Å; K38-L74 PolarHBondContact NZ-O 2.75Å; K38-K75 PolarHBondContact NZ-O 2.89Å; K38-K75 VanDerWaalsContact NZ-O 3.14Å; K38-Q76 PolarHBondContact NZ-O 2.9Å; K38-Q76 VanDerWaalsContact NZ-O 3.1Å; K38-S517 CarbonylContact O-C 3.54Å; K38-S517 VanDerWaalsContact O-CA 3.27Å; K38-S517 WeakPolarHBondContact O-CA 3.03Å; K38-S517 WeakPolarHBondContact O-CB 3.45Å; K38-V518 PolarHBondContact N-O 3.01Å; K38-V518 PolarHBondContact O-N 3.4Å
39	T	85.1	Confident	73	Confident	48 Å²	48	71 Å²	71	29%	0.294	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	139.8	169.7	-47.2	0	0	0	0	110.5
40	F	85.3	Confident	75.8	Confident	12 Å²	12	65.4 Å²	65.4	5%	0.053	35%	0.352	C	S	.	.			trans	-108.5	106.6	-177.1	-63.7	-82.3	0	0	0	111.3	K38 F46 L60 L67 V69 P78 Q516 V518	K38-F40 HydrophobicContact CB-CE2 4.44Å; K38-F40 HydrophobicContact CB-CZ 4.32Å; K38-F40 HydrophobicContact CG-CD1 4.5Å; K38-F40 HydrophobicContact CG-CE1 3.88Å; K38-F40 HydrophobicContact CG-CE2 4.05Å; K38-F40 HydrophobicContact CG-CZ 3.62Å; K38-F40 WeakPolarHBondContact O-CE2 3.41Å; F40-F46 HydrophobicContact CB-CE2 3.84Å; F40-F46 HydrophobicContact CB-CZ 3.64Å; F40-F46 AromaticContact CD2-CE2 3.66Å; F40-F46 HydrophobicContact CD2-CE2 3.66Å; F40-F46 AromaticContact CD2-CZ 3.77Å; F40-F46 HydrophobicContact CD2-CZ 3.77Å; F40-F46 HydrophobicContact CG-CE2 4.06Å; F40-F46 AromaticContact CG-CZ 3.81Å; F40-F46 HydrophobicContact CG-CZ 3.81Å; F40-L60 HydrophobicContact CE2-CD1 4.08Å; F40-L60 HydrophobicContact CZ-CD1 4.25Å; F40-L67 HydrophobicContact CD1-CD2 4Å; F40-L67 HydrophobicContact CE1-CD2 4.44Å; F40-L67 HydrophobicContact CG-CD2 4.42Å; F40-V69 HydrophobicContact CE1-CG2 4.03Å; F40-V69 HydrophobicContact CZ-CG1 4.15Å; F40-V69 HydrophobicContact CZ-CG2 3.75Å; F40-P78 HydrophobicContact CD1-CG 3.88Å; F40-P78 HydrophobicContact CE1-CB 4.08Å; F40-P78 HydrophobicContact CE1-CG 3.8Å; F40-Q516 PolarHBondContact N-O 3.31Å; F40-V518 HydrophobicContact CE2-CB 4.2Å; F40-V518 HydrophobicContact CE2-CG2 3.9Å
41	Y	81.9	Confident	78.6	Confident	209 Å²	209	58.5 Å²	58.5	82%	0.82	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	139.4	177.7	-59.2	-78.3	0	0	0	111.7	V43	Y41-V43 VanDerWaalsContact C-N 3.32Å
42	G	80.9	Confident	81.2	Confident	79 Å²	79	57.3 Å²	57.3	81%	0.814	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	5.1	177.7	0	0	0	0	0	115.3
43	V	85.1	Confident	83.1	Confident	11 Å²	11	52.7 Å²	52.7	7%	0.067	29%	0.285	C	S	.	.			trans	-136	143.7	172.4	179.9	0	0	0	0	107.8	Y41 F46 A62 A65 L67 K80	Y41-V43 VanDerWaalsContact C-N 3.32Å; V43-F46 HydrophobicContact CB-CZ 4.22Å; V43-F46 HydrophobicContact CG1-CE1 3.74Å; V43-F46 HydrophobicContact CG1-CZ 3.81Å; V43-A62 HydrophobicContact CG1-CB 3.32Å; V43-A65 HydrophobicContact CG1-CB 4.34Å; V43-A65 HydrophobicContact CG2-CB 4.48Å; V43-L67 HydrophobicContact CG1-CD1 3.88Å; V43-L67 HydrophobicContact CG2-CD1 4.15Å; V43-K80 HydrophobicContact CG2-CD 4.11Å
44	T	88.7	Confident	84.4	Confident	48 Å²	48	53 Å²	53	29%	0.294	29%	0.291	S	S	.	.			trans	-143.5	161.8	-175.3	54.4	0	0	0	0	111.2	K63	T44-K63 WeakPolarHBondContact O-CB 3.45Å; T44-K63 PolarHBondContact O-N 2.82Å
45	N	90.1	Very high	85.5	Confident	67 Å²	67	48.4 Å²	48.4	36%	0.358	28%	0.277	S	S	.	.			trans	62.4	55.6	177.5	-57.8	-87.7	0	0	0	113.4	S47 A62 K63 Y106 P515	N45-S47 PolarHBondContact O-N 2.98Å; N45-S47 VanDerWaalsContact O-N 3.15Å; N45-A62 WeakPolarHBondContact O-CA 3.47Å; N45-K63 HydrophobicContact CB-CB 4.33Å; N45-Y106 HydrophobicContact CB-CD1 4.24Å; N45-Y106 HydrophobicContact CB-CE1 3.96Å; N45-P515 WeakPolarHBondContact CA-O 3.34Å; N45-P515 PolarHBondContact N-O 2.95Å
46	F	90.8	Very high	86	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.263	C	S	.	.			trans	-60.6	116.3	164.5	-58.4	-64	0	0	0	109.6	F40 V43 F49 L60 A62 L67 N501 P515	F40-F46 HydrophobicContact CB-CE2 3.84Å; F40-F46 HydrophobicContact CB-CZ 3.64Å; F40-F46 AromaticContact CD2-CE2 3.66Å; F40-F46 HydrophobicContact CD2-CE2 3.66Å; F40-F46 AromaticContact CD2-CZ 3.77Å; F40-F46 HydrophobicContact CD2-CZ 3.77Å; F40-F46 HydrophobicContact CG-CE2 4.06Å; F40-F46 AromaticContact CG-CZ 3.81Å; F40-F46 HydrophobicContact CG-CZ 3.81Å; V43-F46 HydrophobicContact CB-CZ 4.22Å; V43-F46 HydrophobicContact CG1-CE1 3.74Å; V43-F46 HydrophobicContact CG1-CZ 3.81Å; F46-F49 HydrophobicContact CB-CE2 3.77Å; F46-F49 HydrophobicContact CB-CZ 3.85Å; F46-L60 HydrophobicContact CD1-CB 3.82Å; F46-L60 HydrophobicContact CD1-CD1 4.11Å; F46-L60 HydrophobicContact CE1-CB 4.08Å; F46-L60 HydrophobicContact CE1-CD1 4Å; F46-L60 HydrophobicContact CZ-CD1 4.47Å; F46-A62 HydrophobicContact CD1-CB 3.68Å; F46-A62 HydrophobicContact CE1-CB 3.73Å; F46-L67 HydrophobicContact CE1-CD1 4.34Å; F46-L67 HydrophobicContact CE1-CD2 4.13Å; F46-L67 HydrophobicContact CZ-CD2 4.23Å; F46-N501 PolarHBondContact O-ND2 2.73Å; F46-P515 WeakPolarHBondContact CD2-O 3.04Å; F46-P515 PolarHBondContact N-O 2.98Å; F46-P515 VanDerWaalsContact N-O 3.1Å
47	S	85.8	Confident	86.5	Confident	32 Å²	32	46.3 Å²	46.3	22%	0.224	27%	0.266	C	S	.	.			trans	-131	-10.3	-172.7	56.7	0	0	0	0	114	N45 G61 I107 R108	N45-S47 PolarHBondContact O-N 2.98Å; N45-S47 VanDerWaalsContact O-N 3.15Å; S47-G61 PolarHBondContact N-O 2.04Å; S47-I107 PolarHBondContact OG-O 3.25Å; S47-I107 VanDerWaalsContact OG-O 3.04Å; S47-R108 PolarHBondContact OG-NE 2.77Å
48	T	91	Very high	87	Confident	14 Å²	14	41.6 Å²	41.6	9%	0.086	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	140.4	174.3	-174.2	0	0	0	0	110.2	G61 I107 R108 L110	T48-G61 PolarHBondContact O-N 3.1Å; T48-I107 HydrophobicContact CG2-CB 4.5Å; T48-I107 HydrophobicContact CG2-CG2 3.97Å; T48-I107 WeakPolarHBondContact CG2-O 3.31Å; T48-R108 WeakPolarHBondContact CB-O 3.49Å; T48-R108 VanDerWaalsContact CG2-O 3.32Å; T48-R108 WeakPolarHBondContact CG2-O 3.46Å; T48-R108 PolarHBondContact OG1-O 2.87Å; T48-L110 HydrophobicContact CG2-CD1 3.85Å; T48-L110 HydrophobicContact CG2-CG 3.86Å
49	F	93.3	Very high	87.4	Confident	19 Å²	19	39.6 Å²	39.6	8%	0.083	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	125.4	-169	-73.9	-119.5	0	0	0	107.3	F46 L58 F59 L60 N502 I504 V518	F46-F49 HydrophobicContact CB-CE2 3.77Å; F46-F49 HydrophobicContact CB-CZ 3.85Å; F49-L58 HydrophobicContact CB-CD1 4.38Å; F49-L58 HydrophobicContact CD1-CD1 4.27Å; F49-L58 HydrophobicContact CD1-CD2 4.21Å; F49-F59 WeakPolarHBondContact CA-O 3.42Å; F49-L60 HydrophobicContact CD1-CD2 3.26Å; F49-L60 HydrophobicContact CD2-CD2 4.35Å; F49-L60 HydrophobicContact CE1-CD2 3.31Å; F49-L60 HydrophobicContact CE2-CD2 4.38Å; F49-L60 HydrophobicContact CG-CD2 3.8Å; F49-L60 HydrophobicContact CZ-CD2 3.87Å; F49-N502 HydrophobicContact CB-CB 4.37Å; F49-N502 HydrophobicContact CD1-CB 4.23Å; F49-N502 HydrophobicContact CD2-CB 3.56Å; F49-N502 HydrophobicContact CE1-CB 4.47Å; F49-N502 HydrophobicContact CE2-CB 3.86Å; F49-N502 HydrophobicContact CG-CB 3.82Å; F49-N502 HydrophobicContact CZ-CB 4.33Å; F49-I504 HydrophobicContact CB-CD1 3.68Å; F49-V518 HydrophobicContact CE1-CG2 3.78Å; F49-V518 HydrophobicContact CZ-CG2 4.26Å
50	L	93	Very high	87.9	Confident	22 Å²	22	37.3 Å²	37.3	12%	0.115	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	117.4	178.8	179.2	72.5	0	0	0	109.1	F59 L110 F112 I118	L50-F59 HydrophobicContact CB-CB 4.34Å; L50-F59 PolarHBondContact N-O 2.67Å; L50-F59 WeakPolarHBondContact O-CB 3.32Å; L50-F59 WeakPolarHBondContact O-CD2 3.37Å; L50-F59 PolarHBondContact O-N 2.98Å; L50-L110 HydrophobicContact CB-CB 3.8Å; L50-L110 HydrophobicContact CB-CD1 4.18Å; L50-L110 HydrophobicContact CD2-CB 4.05Å; L50-L110 HydrophobicContact CG-CB 4.5Å; L50-F112 HydrophobicContact CD1-CD2 3.76Å; L50-F112 HydrophobicContact CD1-CE2 3.57Å; L50-F112 HydrophobicContact CD1-CZ 4.31Å; L50-F112 HydrophobicContact CD2-CD1 4.09Å; L50-F112 HydrophobicContact CD2-CD2 3.9Å; L50-F112 HydrophobicContact CD2-CE1 3.91Å; L50-F112 HydrophobicContact CD2-CE2 3.73Å; L50-F112 HydrophobicContact CD2-CG 4.05Å; L50-F112 HydrophobicContact CD2-CZ 3.71Å; L50-F112 HydrophobicContact CG-CD2 3.97Å; L50-F112 HydrophobicContact CG-CE1 4.38Å; L50-F112 HydrophobicContact CG-CE2 3.45Å; L50-F112 VanDerWaalsContact CG-CE2 3.45Å; L50-F112 HydrophobicContact CG-CZ 3.67Å; L50-I118 HydrophobicContact CD2-CD1 4.13Å; L50-I118 HydrophobicContact CD2-CG1 4.12Å; L50-I118 HydrophobicContact CD2-CG2 3.86Å
51	L	90.7	Very high	88.4	Confident	17 Å²	17	36.7 Å²	36.7	9%	0.089	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.5	-176.6	-178.2	67.3	0	0	0	111.8	S53 L58 T71 F112 I504 H506 L511	L51-S53 PolarHBondContact O-N 3.02Å; L51-L58 HydrophobicContact CB-CD1 4.08Å; L51-L58 HydrophobicContact CD1-CB 3.91Å; L51-L58 HydrophobicContact CD1-CD1 4.21Å; L51-T71 HydrophobicContact CD1-CG2 3.9Å; L51-F112 WeakPolarHBondContact O-CE2 3.49Å; L51-I504 HydrophobicContact CB-CD1 4.28Å; L51-I504 HydrophobicContact CB-CG2 4.1Å; L51-I504 HydrophobicContact CD2-CG2 3.79Å; L51-H506 HydrophobicContact CD2-CB 3.37Å; L51-L511 HydrophobicContact CD1-CD1 4.02Å; L51-L511 HydrophobicContact CD2-CD1 3.87Å
52	N	88.5	Confident	89	Confident	22 Å²	22	26.8 Å²	26.8	12%	0.118	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	106.4	166	-176.1	-19.7	0	0	0	109.6	S54 S55 G56 I57 F59 F112	N52-S54 VanDerWaalsContact C-N 3.27Å; N52-S54 PolarHBondContact O-N 2.96Å; N52-S54 PolarHBondContact OD1-N 2.91Å; N52-S54 PolarHBondContact OD1-OG 3.18Å; N52-S55 WeakPolarHBondContact CB-OG 3.03Å; N52-S55 PolarHBondContact ND2-OG 3.02Å; N52-S55 PolarHBondContact O-N 3.23Å; N52-S55 PolarHBondContact OD1-N 2.97Å; N52-G56 PolarHBondContact O-N 3.12Å; N52-I57 PolarHBondContact N-O 3.14Å; N52-F59 HydrophobicContact CB-CE2 4.17Å; N52-F112 HydrophobicContact CB-CE1 4.15Å; N52-F112 HydrophobicContact CB-CE2 4.49Å; N52-F112 HydrophobicContact CB-CZ 3.64Å
53	S	80.3	Confident	89.7	Confident	74 Å²	74	25.9 Å²	25.9	52%	0.517	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-14.9	-177.1	-72.2	0	0	0	0	115.3	L51 H506	L51-S53 PolarHBondContact O-N 3.02Å; S53-H506 WeakPolarHBondContact CA-CE1 3.24Å; S53-H506 PolarHBondContact O-CE1 2.86Å; S53-H506 VanDerWaalsContact O-CE1 3.29Å; S53-H506 PolarHBondContact OG-ND1 2.6Å
54	S	79.6	Confident	90.2	Very high	54 Å²	54	26.3 Å²	26.3	38%	0.378	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-28.5	177.2	77.8	0	0	0	0	113.6	N52 F196	N52-S54 VanDerWaalsContact C-N 3.27Å; N52-S54 PolarHBondContact O-N 2.96Å; N52-S54 PolarHBondContact OD1-N 2.91Å; N52-S54 PolarHBondContact OD1-OG 3.18Å; S54-F196 PolarHBondContact OG-O 3.19Å
55	S	81.6	Confident	90.5	Very high	47 Å²	47	24.1 Å²	24.1	33%	0.329	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	-13.2	180	64.5	0	0	0	0	114.3	N52 I57	N52-S55 WeakPolarHBondContact CB-OG 3.03Å; N52-S55 PolarHBondContact ND2-OG 3.02Å; N52-S55 PolarHBondContact O-N 3.23Å; N52-S55 PolarHBondContact OD1-N 2.97Å; S55-I57 PolarHBondContact O-N 3.29Å; S55-I57 WeakPolarHBondContact OG-CG1 3.29Å; S55-I57 PolarHBondContact OG-N 3.46Å
56	G	85.2	Confident	90.9	Very high	2 Å²	2	20.9 Å²	20.9	2%	0.021	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	22.8	-171.2	0	0	0	0	0	113	N52 T71	N52-G56 PolarHBondContact O-N 3.12Å; G56-T71 WeakPolarHBondContact O-CG2 3.23Å; G56-T71 PolarHBondContact O-N 2.89Å; G56-T71 PolarHBondContact O-OG1 2.84Å
57	I	90.6	Very high	91.1	Very high	51 Å²	51	21 Å²	21	26%	0.262	13%	0.125	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117.6	177.8	-60.6	174.9	0	0	0	109.3	N52 S55 F59 A68 V69	N52-I57 PolarHBondContact N-O 3.14Å; S55-I57 PolarHBondContact O-N 3.29Å; S55-I57 WeakPolarHBondContact OG-CG1 3.29Å; S55-I57 PolarHBondContact OG-N 3.46Å; I57-F59 HydrophobicContact CB-CE2 4.25Å; I57-F59 HydrophobicContact CB-CZ 4.34Å; I57-F59 HydrophobicContact CG2-CD2 4.36Å; I57-F59 HydrophobicContact CG2-CE1 4.03Å; I57-F59 HydrophobicContact CG2-CE2 3.81Å; I57-F59 HydrophobicContact CG2-CZ 3.62Å; I57-A68 HydrophobicContact CG2-CB 3.85Å; I57-V69 CarbonylContact C-O 3.45Å; I57-V69 WeakPolarHBondContact CA-O 3.05Å
58	L	93.3	Very high	91.5	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	117.4	172.5	-179.7	63.3	0	0	0	109.9	F49 L51 L60 A68 V69 T71 I504 L511 V518	F49-L58 HydrophobicContact CB-CD1 4.38Å; F49-L58 HydrophobicContact CD1-CD1 4.27Å; F49-L58 HydrophobicContact CD1-CD2 4.21Å; L51-L58 HydrophobicContact CB-CD1 4.08Å; L51-L58 HydrophobicContact CD1-CB 3.91Å; L51-L58 HydrophobicContact CD1-CD1 4.21Å; L58-L60 HydrophobicContact CD1-CD2 4.34Å; L58-L60 HydrophobicContact CD2-CD2 3.78Å; L58-L60 HydrophobicContact CG-CD2 3.74Å; L58-L60 HydrophobicContact CG-CG 4.32Å; L58-A68 WeakPolarHBondContact O-CA 3.45Å; L58-V69 PolarHBondContact N-O 2.91Å; L58-V69 PolarHBondContact O-N 3.26Å; L58-T71 HydrophobicContact CB-CG2 3.63Å; L58-I504 HydrophobicContact CD1-CD1 4.12Å; L58-L511 HydrophobicContact CD2-CD1 4.44Å; L58-V518 HydrophobicContact CD2-CG1 4.19Å
59	F	95.1	Very high	91.5	Very high	3 Å²	3	19.7 Å²	19.7	1%	0.013	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	130.4	171.4	-60.1	-84.7	0	0	0	109.7	F49 L50 N52 I57 L67 A68 L110 F112 I118 V135 F138	F49-F59 WeakPolarHBondContact CA-O 3.42Å; L50-F59 HydrophobicContact CB-CB 4.34Å; L50-F59 PolarHBondContact N-O 2.67Å; L50-F59 WeakPolarHBondContact O-CB 3.32Å; L50-F59 WeakPolarHBondContact O-CD2 3.37Å; L50-F59 PolarHBondContact O-N 2.98Å; N52-F59 HydrophobicContact CB-CE2 4.17Å; I57-F59 HydrophobicContact CB-CE2 4.25Å; I57-F59 HydrophobicContact CB-CZ 4.34Å; I57-F59 HydrophobicContact CG2-CD2 4.36Å; I57-F59 HydrophobicContact CG2-CE1 4.03Å; I57-F59 HydrophobicContact CG2-CE2 3.81Å; I57-F59 HydrophobicContact CG2-CZ 3.62Å; F59-L67 CarbonylContact C-O 3.54Å; F59-L67 VanDerWaalsContact CA-O 3.3Å; F59-L67 WeakPolarHBondContact CA-O 3.47Å; F59-A68 HydrophobicContact CD1-CB 3.87Å; F59-A68 HydrophobicContact CE1-CB 3.79Å; F59-L110 HydrophobicContact CB-CD1 4.18Å; F59-F112 HydrophobicContact CD2-CE1 4.3Å; F59-F112 HydrophobicContact CD2-CZ 4.21Å; F59-F112 HydrophobicContact CE2-CE1 4.06Å; F59-F112 HydrophobicContact CE2-CZ 4.22Å; F59-I118 HydrophobicContact CB-CD1 4.49Å; F59-I118 HydrophobicContact CD1-CD1 3.78Å; F59-I118 HydrophobicContact CD2-CD1 3.62Å; F59-I118 HydrophobicContact CE1-CD1 3.84Å; F59-I118 HydrophobicContact CE2-CD1 3.7Å; F59-I118 HydrophobicContact CG-CD1 3.67Å; F59-I118 HydrophobicContact CZ-CD1 3.81Å; F59-V135 HydrophobicContact CZ-CG1 3.89Å; F59-V135 HydrophobicContact CZ-CG2 4.24Å; F59-F138 AromaticContact CD1-CE2 3.92Å; F59-F138 HydrophobicContact CD1-CE2 3.92Å; F59-F138 HydrophobicContact CE1-CD2 4.03Å; F59-F138 AromaticContact CE1-CE2 3.86Å; F59-F138 HydrophobicContact CE1-CE2 3.86Å
60	L	95.3	Very high	91.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.1	-179.1	-56.3	176.9	0	0	0	109.9	F40 F46 F49 L58 I66 L67 V69 V518	F40-L60 HydrophobicContact CE2-CD1 4.08Å; F40-L60 HydrophobicContact CZ-CD1 4.25Å; F46-L60 HydrophobicContact CD1-CB 3.82Å; F46-L60 HydrophobicContact CD1-CD1 4.11Å; F46-L60 HydrophobicContact CE1-CB 4.08Å; F46-L60 HydrophobicContact CE1-CD1 4Å; F46-L60 HydrophobicContact CZ-CD1 4.47Å; F49-L60 HydrophobicContact CD1-CD2 3.26Å; F49-L60 HydrophobicContact CD2-CD2 4.35Å; F49-L60 HydrophobicContact CE1-CD2 3.31Å; F49-L60 HydrophobicContact CE2-CD2 4.38Å; F49-L60 HydrophobicContact CG-CD2 3.8Å; F49-L60 HydrophobicContact CZ-CD2 3.87Å; L58-L60 HydrophobicContact CD1-CD2 4.34Å; L58-L60 HydrophobicContact CD2-CD2 3.78Å; L58-L60 HydrophobicContact CG-CD2 3.74Å; L58-L60 HydrophobicContact CG-CG 4.32Å; L60-I66 WeakPolarHBondContact O-CA 3.37Å; L60-L67 HydrophobicContact CB-CB 4.24Å; L60-L67 PolarHBondContact N-O 2.91Å; L60-L67 PolarHBondContact O-N 2.86Å; L60-V69 HydrophobicContact CD1-CG2 3.68Å; L60-V69 HydrophobicContact CG-CG2 4.21Å; L60-V518 HydrophobicContact CD1-CG2 4.09Å; L60-V518 HydrophobicContact CD2-CG2 4.41Å
61	G	95.8	Very high	91.1	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.7	169.3	0	0	0	0	0	110.7	S47 T48	S47-G61 PolarHBondContact N-O 2.04Å; T48-G61 PolarHBondContact O-N 3.1Å
62	A	95.2	Very high	90.8	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.142	C	C	.	.			trans	-124.8	-171	-174.8	0	0	0	0	0	111.7	V43 N45 F46 A65 I107	V43-A62 HydrophobicContact CG1-CB 3.32Å; N45-A62 WeakPolarHBondContact O-CA 3.47Å; F46-A62 HydrophobicContact CD1-CB 3.68Å; F46-A62 HydrophobicContact CE1-CB 3.73Å; A62-A65 PolarHBondContact N-O 2.89Å; A62-I107 WeakPolarHBondContact O-CG1 3.24Å; A62-I107 PolarHBondContact O-N 3.29Å
63	K	95.3	Very high	90.7	Very high	61 Å²	61	26.4 Å²	26.4	27%	0.265	15%	0.154	S	C	.	.	B	Isolated β-bridge	trans	-73	124.3	164.8	-164.7	-172.1	70.9	173.9	0	110.3	T44 N45 A65 N104 Y106	T44-K63 WeakPolarHBondContact O-CB 3.45Å; T44-K63 PolarHBondContact O-N 2.82Å; N45-K63 HydrophobicContact CB-CB 4.33Å; K63-A65 PolarHBondContact O-N 2.84Å; K63-N104 HydrophobicContact CD-CB 3.98Å; K63-N104 HydrophobicContact CG-CB 3.91Å; K63-Y106 HydrophobicContact CB-CD1 4.19Å; K63-Y106 HydrophobicContact CB-CE1 4.04Å; K63-Y106 HydrophobicContact CD-CE1 4Å; K63-Y106 HydrophobicContact CD-CE2 4.25Å; K63-Y106 HydrophobicContact CG-CD1 4.18Å; K63-Y106 HydrophobicContact CG-CD2 4.44Å; K63-Y106 HydrophobicContact CG-CE1 3.83Å; K63-Y106 HydrophobicContact CG-CE2 4.1Å; K63-Y106 HydrophobicContact CG-CG 4.48Å
64	D	95.6	Very high	90.8	Very high	20 Å²	20	23.2 Å²	23.2	11%	0.107	13%	0.131	C	C	.	.	S	Bend	trans	55.4	11.1	179.7	-55.2	-60.5	0	0	0	116	W83 V84 N104 N105	D64-W83 CarbonylContact O-C 3.53Å; D64-W83 PolarHBondContact O-N 2.91Å; D64-V84 HydrophobicContact CB-CB 4.42Å; D64-V84 HydrophobicContact CB-CG1 4.44Å; D64-V84 HydrophobicContact CB-CG2 4.13Å; D64-N104 WeakPolarHBondContact OD2-CB 3.23Å; D64-N105 WeakPolarHBondContact CA-O 3.44Å; D64-N105 PolarHBondContact N-O 3.3Å; D64-N105 PolarHBondContact OD1-N 3.41Å
65	A	95.8	Very high	91	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.008	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	153.7	-174.4	0	0	0	0	0	114.2	V43 A62 K63 L67 K80 I81	V43-A65 HydrophobicContact CG1-CB 4.34Å; V43-A65 HydrophobicContact CG2-CB 4.48Å; A62-A65 PolarHBondContact N-O 2.89Å; K63-A65 PolarHBondContact O-N 2.84Å; A65-L67 HydrophobicContact CB-CD1 3.97Å; A65-K80 HydrophobicContact CB-CG 4.33Å; A65-I81 CarbonylContact C-O 3.54Å; A65-I81 WeakPolarHBondContact CA-O 3.27Å; A65-I81 WeakPolarHBondContact CB-O 3.5Å
66	I	96.7	Very high	91.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.5	169.2	-50.2	157.4	0	0	0	107.4	L60 K80 I81 W83 I107 L110 V120 L133 F138 L140	L60-I66 WeakPolarHBondContact O-CA 3.37Å; I66-K80 WeakPolarHBondContact O-CA 3.23Å; I66-I81 HydrophobicContact CB-CB 4.46Å; I66-I81 PolarHBondContact N-O 3.37Å; I66-I81 PolarHBondContact O-N 3.23Å; I66-W83 HydrophobicContact CD1-CE3 4.27Å; I66-I107 HydrophobicContact CG1-CD1 4.36Å; I66-I107 HydrophobicContact CG1-CG1 4.07Å; I66-L110 HydrophobicContact CG2-CD2 4.47Å; I66-V120 HydrophobicContact CD1-CB 4.46Å; I66-V120 HydrophobicContact CD1-CG1 3.76Å; I66-V120 HydrophobicContact CD1-CG2 4.25Å; I66-V120 HydrophobicContact CG1-CG1 4.23Å; I66-L133 HydrophobicContact CG2-CD2 4.12Å; I66-F138 HydrophobicContact CG2-CZ 4.44Å; I66-L140 HydrophobicContact CD1-CD1 4.36Å; I66-L140 HydrophobicContact CD1-CD2 4.06Å
67	L	95.1	Very high	91.3	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	153.3	178.6	-74.2	68.1	0	0	0	110.7	F40 V43 F46 F59 L60 A65 P78 K79 K80	F40-L67 HydrophobicContact CD1-CD2 4Å; F40-L67 HydrophobicContact CE1-CD2 4.44Å; F40-L67 HydrophobicContact CG-CD2 4.42Å; V43-L67 HydrophobicContact CG1-CD1 3.88Å; V43-L67 HydrophobicContact CG2-CD1 4.15Å; F46-L67 HydrophobicContact CE1-CD1 4.34Å; F46-L67 HydrophobicContact CE1-CD2 4.13Å; F46-L67 HydrophobicContact CZ-CD2 4.23Å; F59-L67 CarbonylContact C-O 3.54Å; F59-L67 VanDerWaalsContact CA-O 3.3Å; F59-L67 WeakPolarHBondContact CA-O 3.47Å; L60-L67 HydrophobicContact CB-CB 4.24Å; L60-L67 PolarHBondContact N-O 2.91Å; L60-L67 PolarHBondContact O-N 2.86Å; A65-L67 HydrophobicContact CB-CD1 3.97Å; L67-P78 HydrophobicContact CB-CB 4.48Å; L67-P78 HydrophobicContact CD2-CB 4.13Å; L67-P78 HydrophobicContact CD2-CG 3.97Å; L67-K79 CarbonylContact C-O 3.59Å; L67-K79 VanDerWaalsContact CA-O 3.22Å; L67-K79 WeakPolarHBondContact CA-O 3.43Å; L67-K80 HydrophobicContact CD1-CG 4.11Å; L67-K80 HydrophobicContact CG-CB 4.42Å; L67-K80 HydrophobicContact CG-CG 4.31Å
68	A	94.4	Very high	91.3	Very high	10 Å²	10	35.8 Å²	35.8	8%	0.083	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	126.4	164.4	0	0	0	0	0	109.5	I57 L58 F59 P78 K79 F138	I57-A68 HydrophobicContact CG2-CB 3.85Å; L58-A68 WeakPolarHBondContact O-CA 3.45Å; F59-A68 HydrophobicContact CD1-CB 3.87Å; F59-A68 HydrophobicContact CE1-CB 3.79Å; A68-P78 WeakPolarHBondContact O-CA 3.48Å; A68-P78 WeakPolarHBondContact O-CB 3.48Å; A68-K79 HydrophobicContact CB-CB 4.36Å; A68-K79 PolarHBondContact N-O 3.45Å; A68-K79 PolarHBondContact O-N 2.83Å; A68-F138 HydrophobicContact CB-CD2 3.99Å; A68-F138 HydrophobicContact CB-CE1 4.39Å; A68-F138 HydrophobicContact CB-CE2 3.51Å; A68-F138 HydrophobicContact CB-CZ 3.73Å
69	V	92.1	Very high	91.3	Very high	7 Å²	7	41.6 Å²	41.6	4%	0.042	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	132.3	-176	-167.1	0	0	0	0	108.5	F40 I57 L58 L60 L74 P78	F40-V69 HydrophobicContact CE1-CG2 4.03Å; F40-V69 HydrophobicContact CZ-CG1 4.15Å; F40-V69 HydrophobicContact CZ-CG2 3.75Å; I57-V69 CarbonylContact C-O 3.45Å; I57-V69 WeakPolarHBondContact CA-O 3.05Å; L58-V69 PolarHBondContact N-O 2.91Å; L58-V69 PolarHBondContact O-N 3.26Å; L60-V69 HydrophobicContact CD1-CG2 3.68Å; L60-V69 HydrophobicContact CG-CG2 4.21Å; V69-L74 HydrophobicContact CG1-CD2 3.88Å; V69-P78 HydrophobicContact CG2-CB 4.17Å
70	D	89.9	Confident	91.3	Very high	51 Å²	51	45.7 Å²	45.7	27%	0.273	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	115.4	169.4	-179.5	1.8	0	0	0	109.2	N72 N73 L74	D70-N72 VanDerWaalsContact C-N 3.26Å; D70-N72 PolarHBondContact O-N 3.48Å; D70-N72 VanDerWaalsContact OD1-CB 3.3Å; D70-N72 WeakPolarHBondContact OD1-CB 3.4Å; D70-N72 PolarHBondContact OD1-N 3.03Å; D70-N72 PolarHBondContact OD1-ND2 3.17Å; D70-N73 CarbonylContact O-C 3.59Å; D70-N73 PolarHBondContact O-N 3.27Å; D70-L74 PolarHBondContact O-N 2.81Å
71	T	87.4	Confident	91.3	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.018	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-71.5	-24.1	-179	63.6	0	0	0	0	111.9	L51 G56 L58 N73 L511	L51-T71 HydrophobicContact CD1-CG2 3.9Å; G56-T71 WeakPolarHBondContact O-CG2 3.23Å; G56-T71 PolarHBondContact O-N 2.89Å; G56-T71 PolarHBondContact O-OG1 2.84Å; L58-T71 HydrophobicContact CB-CG2 3.63Å; T71-N73 PolarHBondContact O-N 2.87Å; T71-L511 HydrophobicContact CG2-CD1 3.6Å; T71-L511 HydrophobicContact CG2-CD2 4.18Å
72	N	85.3	Confident	91.3	Very high	101 Å²	101	51.5 Å²	51.5	54%	0.54	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-72	-16.9	174.5	-50.7	-77.5	0	0	0	112	D70	D70-N72 VanDerWaalsContact C-N 3.26Å; D70-N72 PolarHBondContact O-N 3.48Å; D70-N72 VanDerWaalsContact OD1-CB 3.3Å; D70-N72 WeakPolarHBondContact OD1-CB 3.4Å; D70-N72 PolarHBondContact OD1-N 3.03Å; D70-N72 PolarHBondContact OD1-ND2 3.17Å
73	N	84.6	Confident	91.3	Very high	66 Å²	66	51.9 Å²	51.9	35%	0.353	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-151.1	68	-177.1	-163.9	-17.5	0	0	0	112.3	D70 T71 K75 Q76	D70-N73 CarbonylContact O-C 3.59Å; D70-N73 PolarHBondContact O-N 3.27Å; T71-N73 PolarHBondContact O-N 2.87Å; N73-K75 PolarHBondContact O-N 3.37Å; N73-Q76 HydrophobicContact CB-CG 4.3Å; N73-Q76 PolarHBondContact ND2-NE2 3.38Å; N73-Q76 PolarHBondContact O-N 2.96Å
74	L	83.6	Confident	91.3	Very high	7 Å²	7	52.6 Å²	52.6	4%	0.037	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-14.1	177.4	-63.6	178.7	0	0	0	114.5	E36 K38 V69 D70 E520	E36-L74 HydrophobicContact CB-CD1 4.24Å; K38-L74 HydrophobicContact CB-CB 4.31Å; K38-L74 WeakPolarHBondContact CD-O 3.16Å; K38-L74 WeakPolarHBondContact CE-O 3.41Å; K38-L74 PolarHBondContact NZ-O 2.75Å; V69-L74 HydrophobicContact CG1-CD2 3.88Å; D70-L74 PolarHBondContact O-N 2.81Å; L74-E520 HydrophobicContact CD1-CB 3.91Å
75	K	83.2	Confident	91.3	Very high	161 Å²	161	51.9 Å²	51.9	70%	0.7	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-28	176.1	-63.4	-180	-176.3	176	0	112.6	K38 N73	K38-K75 PolarHBondContact NZ-O 2.89Å; K38-K75 VanDerWaalsContact NZ-O 3.14Å; N73-K75 PolarHBondContact O-N 3.37Å
76	Q	86.3	Confident	91.2	Very high	101 Å²	101	55 Å²	55	47%	0.472	29%	0.289	S	S	.	.	S	Bend	trans	-59.6	151.5	176.4	-72.7	-171.7	27.9	0	0	111.8	K38 N73	K38-Q76 PolarHBondContact NZ-O 2.9Å; K38-Q76 VanDerWaalsContact NZ-O 3.1Å; N73-Q76 HydrophobicContact CB-CG 4.3Å; N73-Q76 PolarHBondContact ND2-NE2 3.38Å; N73-Q76 PolarHBondContact O-N 2.96Å
77	P	86.4	Confident	91.1	Very high	114 Å²	114	59.9 Å²	59.9	74%	0.74	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-68.8	134	169.8	29.1	-33.1	0	0	0	109.4
78	P	91.4	Very high	91.1	Very high	42 Å²	42	67.7 Å²	67.7	27%	0.273	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-67.7	151	177.2	32.3	-38.2	0	0	0	110.8	F40 L67 A68 V69	F40-P78 HydrophobicContact CD1-CG 3.88Å; F40-P78 HydrophobicContact CE1-CB 4.08Å; F40-P78 HydrophobicContact CE1-CG 3.8Å; L67-P78 HydrophobicContact CB-CB 4.48Å; L67-P78 HydrophobicContact CD2-CB 4.13Å; L67-P78 HydrophobicContact CD2-CG 3.97Å; A68-P78 WeakPolarHBondContact O-CA 3.48Å; A68-P78 WeakPolarHBondContact O-CB 3.48Å; V69-P78 HydrophobicContact CG2-CB 4.17Å
79	K	93.1	Very high	91.1	Very high	122 Å²	122	70.9 Å²	70.9	53%	0.53	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	143	161.5	-59.5	-178.7	-179.5	178.2	0	108.1	L67 A68 F138	L67-K79 CarbonylContact C-O 3.59Å; L67-K79 VanDerWaalsContact CA-O 3.22Å; L67-K79 WeakPolarHBondContact CA-O 3.43Å; A68-K79 HydrophobicContact CB-CB 4.36Å; A68-K79 PolarHBondContact N-O 3.45Å; A68-K79 PolarHBondContact O-N 2.83Å; K79-F138 HydrophobicContact CB-CD1 3.49Å; K79-F138 VanDerWaalsContact CB-CD1 3.49Å; K79-F138 HydrophobicContact CB-CE1 3.54Å; K79-F138 HydrophobicContact CB-CG 4.26Å; K79-F138 HydrophobicContact CB-CZ 4.38Å; K79-F138 HydrophobicContact CD-CB 4.11Å; K79-F138 HydrophobicContact CD-CD1 4.12Å; K79-F138 HydrophobicContact CD-CG 4.18Å; K79-F138 HydrophobicContact CG-CD1 4.45Å
80	K	94.6	Very high	91.3	Very high	90 Å²	90	73.7 Å²	73.7	39%	0.391	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	136.6	-179.2	-174	-168.9	173.2	-143.7	0	110.7	V43 A65 I66 L67 D82	V43-K80 HydrophobicContact CG2-CD 4.11Å; A65-K80 HydrophobicContact CB-CG 4.33Å; I66-K80 WeakPolarHBondContact O-CA 3.23Å; L67-K80 HydrophobicContact CD1-CG 4.11Å; L67-K80 HydrophobicContact CG-CB 4.42Å; L67-K80 HydrophobicContact CG-CG 4.31Å; K80-D82 VanDerWaalsContact CE-OD1 3.24Å; K80-D82 WeakPolarHBondContact CE-OD1 3.42Å; K80-D82 WeakPolarHBondContact CE-OD2 3.31Å; K80-D82 IonicContact NZ-OD1 3.54Å; K80-D82 PolarHBondContact NZ-OD1 2.85Å; K80-D82 IonicContact NZ-OD2 3.75Å; K80-D82 PolarHBondContact NZ-OD2 3.47Å
81	I	95.7	Very high	91.5	Very high	23 Å²	23	77.6 Å²	77.6	12%	0.118	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	129	164.8	-65.8	161.7	0	0	0	107.3	A65 I66 L133 F138 L140	A65-I81 CarbonylContact C-O 3.54Å; A65-I81 WeakPolarHBondContact CA-O 3.27Å; A65-I81 WeakPolarHBondContact CB-O 3.5Å; I66-I81 HydrophobicContact CB-CB 4.46Å; I66-I81 PolarHBondContact N-O 3.37Å; I66-I81 PolarHBondContact O-N 3.23Å; I81-L133 HydrophobicContact CD1-CD1 3.36Å; I81-F138 HydrophobicContact CB-CE1 4.46Å; I81-F138 HydrophobicContact CD1-CD1 3.83Å; I81-F138 HydrophobicContact CD1-CD2 4.25Å; I81-F138 HydrophobicContact CD1-CE1 3.7Å; I81-F138 HydrophobicContact CD1-CE2 4.1Å; I81-F138 HydrophobicContact CD1-CG 4.12Å; I81-F138 HydrophobicContact CD1-CZ 3.84Å; I81-F138 WeakPolarHBondContact CD1-O 3.4Å; I81-F138 HydrophobicContact CG1-CD1 3.83Å; I81-F138 HydrophobicContact CG1-CE1 3.57Å; I81-F138 HydrophobicContact CG1-CZ 4.11Å; I81-L140 HydrophobicContact CD1-CG 4.49Å; I81-L140 HydrophobicContact CG2-CD1 3.81Å; I81-L140 HydrophobicContact CG2-CG 4.15Å
82	D	95.3	Very high	91.9	Very high	98 Å²	98	80.4 Å²	80.4	52%	0.524	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	121	168.8	-78.6	-73.6	0	0	0	109.6	K80 V84	K80-D82 VanDerWaalsContact CE-OD1 3.24Å; K80-D82 WeakPolarHBondContact CE-OD1 3.42Å; K80-D82 WeakPolarHBondContact CE-OD2 3.31Å; K80-D82 IonicContact NZ-OD1 3.54Å; K80-D82 PolarHBondContact NZ-OD1 2.85Å; K80-D82 IonicContact NZ-OD2 3.75Å; K80-D82 PolarHBondContact NZ-OD2 3.47Å; D82-V84 HydrophobicContact CB-CG2 4.27Å
83	W	95.5	Very high	92.4	Very high	9 Å²	9	75.7 Å²	75.7	3%	0.034	38%	0.379	C	S	.	.			trans	-125.8	60.6	175.6	-171.3	19.8	0	0	0	110.2	D64 I66 N105 I107 V120 Y124 Q129 A131 L140 L148 M150	D64-W83 CarbonylContact O-C 3.53Å; D64-W83 PolarHBondContact O-N 2.91Å; I66-W83 HydrophobicContact CD1-CE3 4.27Å; W83-N105 WeakPolarHBondContact O-CB 3.38Å; W83-N105 PolarHBondContact O-ND2 3.16Å; W83-I107 HydrophobicContact CD2-CD1 4.36Å; W83-I107 HydrophobicContact CE3-CD1 3.39Å; W83-I107 HydrophobicContact CZ3-CD1 3.75Å; W83-V120 HydrophobicContact CE3-CG1 4.31Å; W83-V120 HydrophobicContact CZ3-CB 4.27Å; W83-V120 HydrophobicContact CZ3-CG1 3.82Å; W83-Y124 AromaticContact CD1-CE2 3.96Å; W83-Y124 AromaticContact NE1-CE2 3.49Å; W83-Q129 HydrophobicContact CH2-CB 4.41Å; W83-Q129 HydrophobicContact CZ2-CB 4.01Å; W83-A131 HydrophobicContact CH2-CB 3.72Å; W83-A131 HydrophobicContact CZ2-CB 3.84Å; W83-A131 HydrophobicContact CZ3-CB 4.25Å; W83-L140 HydrophobicContact CB-CD1 4.24Å; W83-L140 HydrophobicContact CD2-CD1 4.22Å; W83-L140 HydrophobicContact CG-CD1 4.09Å; W83-L148 HydrophobicContact CZ2-CD2 4.41Å; W83-M150 HydrophobicContact CZ2-CG 4.41Å; W83-M150 HydrophobicContact CZ2-SD 4.19Å
84	V	95.3	Very high	92.9	Very high	75 Å²	75	75.6 Å²	75.6	46%	0.455	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-73.9	148	-177.4	-164.9	0	0	0	0	111.5	D64 D82	D64-V84 HydrophobicContact CB-CB 4.42Å; D64-V84 HydrophobicContact CB-CG1 4.44Å; D64-V84 HydrophobicContact CB-CG2 4.13Å; D82-V84 HydrophobicContact CB-CG2 4.27Å
85	V	95.3	Very high	93.4	Very high	6 Å²	6	78.6 Å²	78.6	4%	0.036	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-74.2	131.9	170.3	-176.9	0	0	0	0	110.9	K89 R90 N105 Y124 A125	V85-K89 HydrophobicContact CG1-CB 3.56Å; V85-R90 HydrophobicContact CG1-CB 4.49Å; V85-N105 HydrophobicContact CG2-CB 3.75Å; V85-Y124 HydrophobicContact CG2-CD2 3.94Å; V85-Y124 HydrophobicContact CG2-CE2 4.23Å; V85-Y124 HydrophobicContact CG2-CG 4.08Å; V85-A125 HydrophobicContact CB-CB 4.41Å; V85-A125 HydrophobicContact CG1-CB 3.82Å; V85-A125 HydrophobicContact CG2-CB 4.02Å
86	P	95.2	Very high	93.8	Very high	66 Å²	66	77.3 Å²	77.3	43%	0.429	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-55.5	141.8	172.5	-27	34.5	0	0	0	112.9	E88 K89 R90 Y124	P86-E88 PolarHBondContact O-N 3.48Å; P86-E88 VanDerWaalsContact O-N 3.07Å; P86-K89 PolarHBondContact O-N 2.87Å; P86-R90 PolarHBondContact O-N 3.24Å; P86-Y124 WeakPolarHBondContact CD-OH 3.32Å
87	E	94.7	Very high	94.1	Very high	102 Å²	102	75.8 Å²	75.8	48%	0.477	42%	0.419	S	S	.	.	H	α-helix	trans	-52.7	-36.8	-175.8	-71.5	-130.6	128.7	0	0	114.1	R90 K91	E87-R90 PolarHBondContact O-N 2.95Å; E87-R90 IonicContact OE1-CZ 2.62Å; E87-R90 IonicContact OE1-NH2 2.63Å; E87-R90 PolarHBondContact OE1-NH2 3.42Å; E87-K91 WeakPolarHBondContact O-CB 3.08Å; E87-K91 VanDerWaalsContact O-CG 3.3Å; E87-K91 WeakPolarHBondContact O-CG 3.41Å; E87-K91 PolarHBondContact O-N 3.26Å; E87-K91 IonicContact OE2-NZ 2.83Å; E87-K91 PolarHBondContact OE2-NZ 3.22Å
88	E	94.9	Very high	94.3	Very high	167 Å²	167	73.1 Å²	73.1	78%	0.78	40%	0.396	S	S	*	.	H	α-helix	trans	-64.5	-44.4	179.7	-61.1	179.4	171.3	0	0	111.7	P86 K91 S92	P86-E88 PolarHBondContact O-N 3.48Å; P86-E88 VanDerWaalsContact O-N 3.07Å; E88-K91 PolarHBondContact O-N 3.34Å; E88-S92 WeakPolarHBondContact O-CB 3.46Å; E88-S92 PolarHBondContact O-N 3.08Å
89	K	94.3	Very high	94.4	Very high	78 Å²	78	74.6 Å²	74.6	34%	0.339	41%	0.405	S	S	.	.	H	α-helix	trans	-65.3	-41.8	173.6	-82.2	-159.1	178.5	-164.9	0	111.1	V85 P86 S92 C93 Y124 D127	V85-K89 HydrophobicContact CG1-CB 3.56Å; P86-K89 PolarHBondContact O-N 2.87Å; K89-S92 WeakPolarHBondContact O-CB 3.05Å; K89-S92 PolarHBondContact O-N 3.23Å; K89-C93 WeakPolarHBondContact O-CB 3.33Å; K89-C93 PolarHBondContact O-N 2.86Å; K89-Y124 HydrophobicContact CD-CD1 4.19Å; K89-Y124 HydrophobicContact CD-CE1 3.87Å; K89-D127 IonicContact NZ-OD2 3.24Å; K89-D127 PolarHBondContact NZ-OD2 3.34Å
90	R	95.3	Very high	94.4	Very high	66 Å²	66	75 Å²	75	25%	0.249	41%	0.409	C	S	.	.	H	α-helix	trans	-60.7	-47.6	176.4	-177.1	171.1	64.5	169.3	0.9	111.8	V85 P86 E87 S92 C93 V94 C103	V85-R90 HydrophobicContact CG1-CB 4.49Å; P86-R90 PolarHBondContact O-N 3.24Å; E87-R90 PolarHBondContact O-N 2.95Å; E87-R90 IonicContact OE1-CZ 2.62Å; E87-R90 IonicContact OE1-NH2 2.63Å; E87-R90 PolarHBondContact OE1-NH2 3.42Å; R90-S92 VanDerWaalsContact C-N 3.34Å; R90-S92 PolarHBondContact O-N 3.47Å; R90-C93 WeakPolarHBondContact O-CB 3.45Å; R90-C93 PolarHBondContact O-N 3.41Å; R90-V94 PolarHBondContact O-N 2.02Å; R90-C103 HydrophobicContact CG-CB 4.15Å
91	K	95.2	Very high	94.2	Very high	133 Å²	133	73.4 Å²	73.4	58%	0.578	41%	0.412	S	S	*	.	H	α-helix	trans	-61.8	-39.3	174.7	-73.7	164.8	-178.1	157.7	0	111.9	E87 E88 G95	E87-K91 WeakPolarHBondContact O-CB 3.08Å; E87-K91 VanDerWaalsContact O-CG 3.3Å; E87-K91 WeakPolarHBondContact O-CG 3.41Å; E87-K91 PolarHBondContact O-N 3.26Å; E87-K91 IonicContact OE2-NZ 2.83Å; E87-K91 PolarHBondContact OE2-NZ 3.22Å; E88-K91 PolarHBondContact O-N 3.34Å; K91-G95 PolarHBondContact O-N 2.97Å
92	S	95.6	Very high	94.1	Very high	61 Å²	61	74.4 Å²	74.4	43%	0.427	42%	0.418	S	S	.	.	H	α-helix	trans	-64.5	-39.9	173.8	-174.1	0	0	0	0	112.7	E88 K89 R90 G95 K96	E88-S92 WeakPolarHBondContact O-CB 3.46Å; E88-S92 PolarHBondContact O-N 3.08Å; K89-S92 WeakPolarHBondContact O-CB 3.05Å; K89-S92 PolarHBondContact O-N 3.23Å; R90-S92 VanDerWaalsContact C-N 3.34Å; R90-S92 PolarHBondContact O-N 3.47Å; S92-G95 PolarHBondContact O-N 3.45Å; S92-K96 WeakPolarHBondContact O-CG 2.97Å; S92-K96 PolarHBondContact O-N 2.91Å; S92-K96 VanDerWaalsContact O-N 3.17Å
93	C	94.7	Very high	94.1	Very high	3 Å²	3	69.8 Å²	69.8	2%	0.02	39%	0.393	C	S	.	.	H	α-helix	trans	-63.5	-47.3	175.4	171.4	0	0	0	0	112	K89 R90 G95 K96 C103 A125 F126	K89-C93 WeakPolarHBondContact O-CB 3.33Å; K89-C93 PolarHBondContact O-N 2.86Å; R90-C93 WeakPolarHBondContact O-CB 3.45Å; R90-C93 PolarHBondContact O-N 3.41Å; C93-G95 VanDerWaalsContact C-N 3.31Å; C93-G95 PolarHBondContact O-N 2.03Å; C93-K96 WeakPolarHBondContact O-CB 2.99Å; C93-K96 PolarHBondContact O-N 2.82Å; C93-C103 HydrophobicContact CB-CB 3.71Å; C93-C103 WeakPolarHBondContact CB-SG 3.45Å; C93-C103 WeakPolarHBondContact SG-CA 3.41Å; C93-C103 WeakPolarHBondContact SG-CB 3.47Å; C93-C103 CovalentContact SG-SG 2.04Å; C93-C103 PolarHBondContact SG-SG 3.01Å; C93-A125 HydrophobicContact CB-CB 3.94Å; C93-F126 VanDerWaalsContact SG-CD2 3.55Å
94	V	95.5	Very high	94.2	Very high	63 Å²	63	70.1 Å²	70.1	38%	0.382	40%	0.395	S	S	.	.	H	α-helix	trans	-63.6	-39	175.1	176.5	0	0	0	0	111	R90 K96 G97 E100 C103	R90-V94 PolarHBondContact O-N 2.02Å; V94-K96 PolarHBondContact O-N 2.85Å; V94-K96 VanDerWaalsContact O-N 3.16Å; V94-G97 PolarHBondContact O-N 2.86Å; V94-E100 HydrophobicContact CG2-CB 4.29Å; V94-C103 HydrophobicContact CG2-CB 4.1Å; V94-C103 PolarHBondContact N-SG 3.05Å; V94-C103 VanDerWaalsContact N-SG 3.4Å
95	G	94.1	Very high	94.2	Very high	70 Å²	70	66.5 Å²	66.5	72%	0.722	37%	0.373	S	S	*	.	H	α-helix	trans	-62.5	-16.6	173.6	0	0	0	0	0	114.9	K91 S92 C93 G97	K91-G95 PolarHBondContact O-N 2.97Å; S92-G95 PolarHBondContact O-N 3.45Å; C93-G95 VanDerWaalsContact C-N 3.31Å; C93-G95 PolarHBondContact O-N 2.03Å; G95-G97 VanDerWaalsContact C-N 3.33Å
96	K	91.4	Very high	94.3	Very high	134 Å²	134	67.1 Å²	67.1	58%	0.583	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	8	170.6	-66.5	167.4	-173.5	175.6	0	113.2	S92 C93 V94 F213	S92-K96 WeakPolarHBondContact O-CG 2.97Å; S92-K96 PolarHBondContact O-N 2.91Å; S92-K96 VanDerWaalsContact O-N 3.17Å; C93-K96 WeakPolarHBondContact O-CB 2.99Å; C93-K96 PolarHBondContact O-N 2.82Å; V94-K96 PolarHBondContact O-N 2.85Å; V94-K96 VanDerWaalsContact O-N 3.16Å; K96-F213 HydrophobicContact CB-CZ 4.44Å; K96-F213 HydrophobicContact CD-CE2 4.4Å; K96-F213 HydrophobicContact CD-CZ 4.23Å
97	G	91.8	Very high	94.4	Very high	70 Å²	70	64 Å²	64	72%	0.722	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	14.6	176.2	0	0	0	0	0	115.6	V94 G95	V94-G97 PolarHBondContact O-N 2.86Å; G95-G97 VanDerWaalsContact C-N 3.33Å
98	K	92.6	Very high	94.4	Very high	57 Å²	57	60.5 Å²	60.5	25%	0.248	34%	0.337	C	S	.	.			trans	-89.3	156.6	172.7	-66.3	-63	-167.8	168.1	0	111.1	F126 E160	K98-F126 HydrophobicContact CB-CD2 4.29Å; K98-F126 HydrophobicContact CB-CE2 3.77Å; K98-F126 HydrophobicContact CB-CZ 4.21Å; K98-F126 HydrophobicContact CD-CD1 4.4Å; K98-F126 HydrophobicContact CD-CE1 3.73Å; K98-F126 HydrophobicContact CD-CE2 3.89Å; K98-F126 HydrophobicContact CD-CZ 3.44Å; K98-F126 VanDerWaalsContact CD-CZ 3.44Å; K98-F126 HydrophobicContact CG-CD1 4.44Å; K98-F126 HydrophobicContact CG-CD2 3.99Å; K98-F126 HydrophobicContact CG-CE1 4.16Å; K98-F126 HydrophobicContact CG-CE2 3.65Å; K98-F126 HydrophobicContact CG-CG 4.37Å; K98-F126 HydrophobicContact CG-CZ 3.76Å; K98-E160 IonicContact NZ-OE2 2.79Å; K98-E160 PolarHBondContact NZ-OE2 3.24Å
99	T	93.3	Very high	94.3	Very high	74 Å²	74	52.9 Å²	52.9	45%	0.454	30%	0.302	S	S	.	.			trans	-73	152.5	-178.6	83.2	0	0	0	0	111.4	A101 D102 C103	T99-A101 PolarHBondContact O-N 3.3Å; T99-A101 PolarHBondContact OG1-N 3.32Å; T99-D102 WeakPolarHBondContact CB-OD2 3.32Å; T99-D102 WeakPolarHBondContact CG2-OD2 3.36Å; T99-D102 PolarHBondContact O-N 3.07Å; T99-D102 VanDerWaalsContact O-N 3.14Å; T99-D102 PolarHBondContact OG1-N 3.39Å; T99-D102 VanDerWaalsContact OG1-N 3.13Å; T99-D102 PolarHBondContact OG1-OD2 3.37Å; T99-C103 PolarHBondContact O-N 2.8Å; T99-C103 PolarHBondContact O-SG 2.92Å
100	E	91.8	Very high	94.3	Very high	131 Å²	131	49.5 Å²	49.5	61%	0.612	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.6	175.7	-173.7	173.7	-167.4	0	0	112.6	V94 N104	V94-E100 HydrophobicContact CG2-CB 4.29Å; E100-N104 PolarHBondContact O-ND2 3.36Å
101	A	91.9	Very high	94.1	Very high	56 Å²	56	48.2 Å²	48.2	46%	0.463	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-42	174.3	0	0	0	0	0	112	T99 N104 Y106	T99-A101 PolarHBondContact O-N 3.3Å; T99-A101 PolarHBondContact OG1-N 3.32Å; A101-N104 PolarHBondContact O-ND2 2.84Å; A101-Y106 WeakPolarHBondContact O-CE2 3.44Å; A101-Y106 PolarHBondContact O-OH 3.43Å
102	D	93.1	Very high	93.8	Very high	44 Å²	44	45 Å²	45	24%	0.235	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-25.8	-179.8	-54.4	-50.6	0	0	0	112.6	T99 N104 F126 P161	T99-D102 WeakPolarHBondContact CB-OD2 3.32Å; T99-D102 WeakPolarHBondContact CG2-OD2 3.36Å; T99-D102 PolarHBondContact O-N 3.07Å; T99-D102 VanDerWaalsContact O-N 3.14Å; T99-D102 PolarHBondContact OG1-N 3.39Å; T99-D102 VanDerWaalsContact OG1-N 3.13Å; T99-D102 PolarHBondContact OG1-OD2 3.37Å; D102-N104 PolarHBondContact O-N 3.07Å; D102-F126 HydrophobicContact CB-CE2 3.51Å; D102-F126 HydrophobicContact CB-CZ 3.78Å; D102-P161 HydrophobicContact CB-CG 4.4Å
103	C	95.8	Very high	93.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	28.3	178.7	-66.4	0	0	0	0	114.8	R90 C93 V94 T99 A125	R90-C103 HydrophobicContact CG-CB 4.15Å; C93-C103 HydrophobicContact CB-CB 3.71Å; C93-C103 WeakPolarHBondContact CB-SG 3.45Å; C93-C103 WeakPolarHBondContact SG-CA 3.41Å; C93-C103 WeakPolarHBondContact SG-CB 3.47Å; C93-C103 CovalentContact SG-SG 2.04Å; C93-C103 PolarHBondContact SG-SG 3.01Å; V94-C103 HydrophobicContact CG2-CB 4.1Å; V94-C103 PolarHBondContact N-SG 3.05Å; V94-C103 VanDerWaalsContact N-SG 3.4Å; T99-C103 PolarHBondContact O-N 2.8Å; T99-C103 PolarHBondContact O-SG 2.92Å; C103-A125 HydrophobicContact CB-CB 4.29Å; C103-A125 WeakPolarHBondContact O-CB 3.11Å
104	N	95.9	Very high	92	Very high	16 Å²	16	47 Å²	47	9%	0.086	27%	0.272	C	S	.	.	S	Bend	trans	-106.7	174.2	172.1	-62.4	-64.7	0	0	0	110.4	K63 D64 E100 A101 D102 Y106 T123 A125	K63-N104 HydrophobicContact CD-CB 3.98Å; K63-N104 HydrophobicContact CG-CB 3.91Å; D64-N104 WeakPolarHBondContact OD2-CB 3.23Å; E100-N104 PolarHBondContact O-ND2 3.36Å; A101-N104 PolarHBondContact O-ND2 2.84Å; D102-N104 PolarHBondContact O-N 3.07Å; N104-Y106 HydrophobicContact CB-CD2 4.48Å; N104-Y106 HydrophobicContact CB-CE2 3.99Å; N104-T123 PolarHBondContact O-OG1 2.86Å; N104-A125 PolarHBondContact O-N 2.93Å; N104-A125 VanDerWaalsContact O-N 3.16Å
105	N	96.6	Very high	90.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.282	C	S	.	.			trans	-90.6	105.7	174	-173.8	22.5	0	0	0	110.2	D64 W83 V85 I107 G122 T123 Y124	D64-N105 WeakPolarHBondContact CA-O 3.44Å; D64-N105 PolarHBondContact N-O 3.3Å; D64-N105 PolarHBondContact OD1-N 3.41Å; W83-N105 WeakPolarHBondContact O-CB 3.38Å; W83-N105 PolarHBondContact O-ND2 3.16Å; V85-N105 HydrophobicContact CG2-CB 3.75Å; N105-I107 WeakPolarHBondContact ND2-CD1 3.47Å; N105-G122 WeakPolarHBondContact OD1-CA 3.17Å; N105-T123 PolarHBondContact OD1-N 3.29Å; N105-Y124 HydrophobicContact CB-CD2 4.06Å; N105-Y124 PolarHBondContact OD1-N 3.46Å; N105-Y124 VanDerWaalsContact OD1-N 3.08Å
106	Y	96.5	Very high	90	Very high	18 Å²	18	46.5 Å²	46.5	7%	0.071	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-92.9	116.1	171.4	-68.6	-101.5	0	0	0	108.5	N45 K63 A101 N104 R108 G122 T123 P161	N45-Y106 HydrophobicContact CB-CD1 4.24Å; N45-Y106 HydrophobicContact CB-CE1 3.96Å; K63-Y106 HydrophobicContact CB-CD1 4.19Å; K63-Y106 HydrophobicContact CB-CE1 4.04Å; K63-Y106 HydrophobicContact CD-CE1 4Å; K63-Y106 HydrophobicContact CD-CE2 4.25Å; K63-Y106 HydrophobicContact CG-CD1 4.18Å; K63-Y106 HydrophobicContact CG-CD2 4.44Å; K63-Y106 HydrophobicContact CG-CE1 3.83Å; K63-Y106 HydrophobicContact CG-CE2 4.1Å; K63-Y106 HydrophobicContact CG-CG 4.48Å; A101-Y106 WeakPolarHBondContact O-CE2 3.44Å; A101-Y106 PolarHBondContact O-OH 3.43Å; N104-Y106 HydrophobicContact CB-CD2 4.48Å; N104-Y106 HydrophobicContact CB-CE2 3.99Å; Y106-R108 PolarHBondContact O-N 3.17Å; Y106-G122 CarbonylContact O-C 3.59Å; Y106-G122 WeakPolarHBondContact O-CA 3.43Å; Y106-T123 PolarHBondContact N-OG1 3.23Å; Y106-T123 PolarHBondContact O-N 3.38Å; Y106-P161 HydrophobicContact CD1-CB 4.15Å; Y106-P161 HydrophobicContact CD2-CB 3.73Å; Y106-P161 HydrophobicContact CD2-CG 3.33Å; Y106-P161 HydrophobicContact CE1-CB 4.37Å; Y106-P161 HydrophobicContact CE2-CB 3.99Å; Y106-P161 HydrophobicContact CE2-CG 3.54Å; Y106-P161 HydrophobicContact CG-CB 3.81Å; Y106-P161 HydrophobicContact CG-CG 3.93Å
107	I	97.2	Very high	89.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	130.1	175.4	-52.8	-54.6	0	0	0	109	S47 T48 A62 I66 W83 N105 L110 V120	S47-I107 PolarHBondContact OG-O 3.25Å; S47-I107 VanDerWaalsContact OG-O 3.04Å; T48-I107 HydrophobicContact CG2-CB 4.5Å; T48-I107 HydrophobicContact CG2-CG2 3.97Å; T48-I107 WeakPolarHBondContact CG2-O 3.31Å; A62-I107 WeakPolarHBondContact O-CG1 3.24Å; A62-I107 PolarHBondContact O-N 3.29Å; I66-I107 HydrophobicContact CG1-CD1 4.36Å; I66-I107 HydrophobicContact CG1-CG1 4.07Å; W83-I107 HydrophobicContact CD2-CD1 4.36Å; W83-I107 HydrophobicContact CE3-CD1 3.39Å; W83-I107 HydrophobicContact CZ3-CD1 3.75Å; N105-I107 WeakPolarHBondContact ND2-CD1 3.47Å; I107-L110 HydrophobicContact CG2-CD2 4.35Å; I107-L110 HydrophobicContact CG2-CG 4.35Å; I107-V120 HydrophobicContact CD1-CG1 4.45Å; I107-V120 HydrophobicContact CG2-CG1 3.69Å
108	R	94.5	Very high	89.7	Confident	30 Å²	30	38.4 Å²	38.4	11%	0.113	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	-52.5	-176.1	-63.6	-63.6	159.7	135.2	-1.6	110	S47 T48 Y106 L110 C121 T123 P158 P161 Y165	S47-R108 PolarHBondContact OG-NE 2.77Å; T48-R108 WeakPolarHBondContact CB-O 3.49Å; T48-R108 VanDerWaalsContact CG2-O 3.32Å; T48-R108 WeakPolarHBondContact CG2-O 3.46Å; T48-R108 PolarHBondContact OG1-O 2.87Å; Y106-R108 PolarHBondContact O-N 3.17Å; R108-L110 PolarHBondContact O-N 3.48Å; R108-C121 PolarHBondContact N-O 3.49Å; R108-T123 HydrophobicContact CG-CG2 4.42Å; R108-P158 HydrophobicContact CG-CG 4.37Å; R108-P161 PolarHBondContact NH1-O 2.73Å; R108-P161 PolarHBondContact NH2-O 3.5Å; R108-Y165 WeakPolarHBondContact CA-OH 3.26Å; R108-Y165 HydrophobicContact CB-CE1 3.97Å; R108-Y165 HydrophobicContact CB-CE2 3.92Å; R108-Y165 HydrophobicContact CG-CE1 4.19Å; R108-Y165 PolarHBondContact O-OH 2.88Å
109	L	94.2	Very high	89.7	Confident	6 Å²	6	35.7 Å²	35.7	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	117.5	170.4	163.3	175	0	0	0	113.4	E111 Y119 V120 C121 Y165 A167 L205	L109-E111 HydrophobicContact CD1-CG 3.57Å; L109-E111 HydrophobicContact CG-CG 4Å; L109-Y119 HydrophobicContact CD2-CD1 4.04Å; L109-Y119 HydrophobicContact CD2-CE1 4.48Å; L109-V120 VanDerWaalsContact O-CA 3.3Å; L109-V120 WeakPolarHBondContact O-CA 3.47Å; L109-V120 WeakPolarHBondContact O-CG1 3.46Å; L109-C121 HydrophobicContact CD2-CB 3.99Å; L109-C121 WeakPolarHBondContact CD2-SG 3.49Å; L109-C121 PolarHBondContact N-O 2.75Å; L109-C121 PolarHBondContact O-N 2.8Å; L109-Y165 HydrophobicContact CB-CE2 4.37Å; L109-A167 HydrophobicContact CD1-CB 3.25Å; L109-L205 HydrophobicContact CD1-CD1 3.93Å; L109-L205 HydrophobicContact CD1-CD2 4.45Å; L109-L205 HydrophobicContact CD2-CD2 3.9Å
110	L	94	Very high	89.8	Confident	7 Å²	7	32.2 Å²	32.2	4%	0.037	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	113.8	156.2	-72	179.9	0	0	0	109.4	T48 L50 F59 I66 I107 R108 I118 Y119 V120	T48-L110 HydrophobicContact CG2-CD1 3.85Å; T48-L110 HydrophobicContact CG2-CG 3.86Å; L50-L110 HydrophobicContact CB-CB 3.8Å; L50-L110 HydrophobicContact CB-CD1 4.18Å; L50-L110 HydrophobicContact CD2-CB 4.05Å; L50-L110 HydrophobicContact CG-CB 4.5Å; F59-L110 HydrophobicContact CB-CD1 4.18Å; I66-L110 HydrophobicContact CG2-CD2 4.47Å; I107-L110 HydrophobicContact CG2-CD2 4.35Å; I107-L110 HydrophobicContact CG2-CG 4.35Å; R108-L110 PolarHBondContact O-N 3.48Å; L110-I118 HydrophobicContact CB-CG2 4.45Å; L110-I118 HydrophobicContact CD2-CG2 3.95Å; L110-Y119 WeakPolarHBondContact CA-O 2.99Å; L110-V120 HydrophobicContact CD2-CB 4.27Å; L110-V120 HydrophobicContact CD2-CG1 3.77Å; L110-V120 HydrophobicContact CD2-CG2 3.85Å
111	E	91.3	Very high	90	Very high	39 Å²	39	26 Å²	26	18%	0.182	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	142	177.4	-75.1	-71.6	-171.1	0	0	112.2	L109 Q113 I118 Y119 M169 L205	L109-E111 HydrophobicContact CD1-CG 3.57Å; L109-E111 HydrophobicContact CG-CG 4Å; E111-Q113 PolarHBondContact O-N 3.25Å; E111-I118 CarbonylContact O-C 3.55Å; E111-I118 VanDerWaalsContact O-CA 3.27Å; E111-I118 WeakPolarHBondContact O-CA 3.35Å; E111-I118 WeakPolarHBondContact O-CG2 3.13Å; E111-Y119 PolarHBondContact N-O 3.44Å; E111-Y119 PolarHBondContact O-N 3.31Å; E111-M169 HydrophobicContact CB-CB 4.18Å; E111-M169 HydrophobicContact CB-CE 3.68Å; E111-M169 HydrophobicContact CB-SD 4.35Å; E111-M169 HydrophobicContact CG-CB 4.25Å; E111-M169 HydrophobicContact CG-CE 4.5Å; E111-L205 HydrophobicContact CG-CD1 3.98Å
112	F	87.8	Confident	90.2	Very high	66 Å²	66	23.3 Å²	23.3	29%	0.289	11%	0.114	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	121.6	179.2	-71.1	-65.8	0	0	0	112.2	L50 L51 N52 F59 I118	L50-F112 HydrophobicContact CD1-CD2 3.76Å; L50-F112 HydrophobicContact CD1-CE2 3.57Å; L50-F112 HydrophobicContact CD1-CZ 4.31Å; L50-F112 HydrophobicContact CD2-CD1 4.09Å; L50-F112 HydrophobicContact CD2-CD2 3.9Å; L50-F112 HydrophobicContact CD2-CE1 3.91Å; L50-F112 HydrophobicContact CD2-CE2 3.73Å; L50-F112 HydrophobicContact CD2-CG 4.05Å; L50-F112 HydrophobicContact CD2-CZ 3.71Å; L50-F112 HydrophobicContact CG-CD2 3.97Å; L50-F112 HydrophobicContact CG-CE1 4.38Å; L50-F112 HydrophobicContact CG-CE2 3.45Å; L50-F112 VanDerWaalsContact CG-CE2 3.45Å; L50-F112 HydrophobicContact CG-CZ 3.67Å; L51-F112 WeakPolarHBondContact O-CE2 3.49Å; N52-F112 HydrophobicContact CB-CE1 4.15Å; N52-F112 HydrophobicContact CB-CE2 4.49Å; N52-F112 HydrophobicContact CB-CZ 3.64Å; F59-F112 HydrophobicContact CD2-CE1 4.3Å; F59-F112 HydrophobicContact CD2-CZ 4.21Å; F59-F112 HydrophobicContact CE2-CE1 4.06Å; F59-F112 HydrophobicContact CE2-CZ 4.22Å; F112-I118 HydrophobicContact CD1-CD1 4.2Å; F112-I118 HydrophobicContact CD1-CG1 3.65Å; F112-I118 HydrophobicContact CE1-CD1 3.79Å; F112-I118 HydrophobicContact CE1-CG1 3.79Å
113	Q	80.8	Confident	90.3	Very high	38 Å²	38	21.2 Å²	21.2	18%	0.178	10%	0.103	C	C	.	.			trans	-107.1	179.4	178.8	-156.2	173.1	5	0	0	111.3	E111 H117 M169	E111-Q113 PolarHBondContact O-N 3.25Å; Q113-H117 HydrophobicContact CB-CB 4.42Å; Q113-H117 PolarHBondContact N-O 3.12Å; Q113-M169 HydrophobicContact CB-SD 4.46Å; Q113-M169 HydrophobicContact CG-SD 4.5Å
114	K	71.9	Confident	90.3	Very high	68 Å²	68	21.9 Å²	21.9	30%	0.296	11%	0.105	S	C	.	.	G	3₁₀ helix	trans	-48.1	158.1	170.7	-86.1	-176.3	157.2	178	0	114.4	G116 H117 S200 D202	K114-G116 PolarHBondContact O-N 2.66Å; K114-H117 WeakPolarHBondContact O-CB 3.15Å; K114-H117 PolarHBondContact O-N 3.15Å; K114-H117 PolarHBondContact O-ND1 2.96Å; K114-H117 VanDerWaalsContact O-ND1 3.16Å; K114-S200 VanDerWaalsContact CG-O 3.31Å; K114-S200 WeakPolarHBondContact CG-O 3.19Å; K114-D202 WeakPolarHBondContact CD-OD1 3.18Å; K114-D202 WeakPolarHBondContact CE-OD1 3.36Å; K114-D202 WeakPolarHBondContact CE-OD2 3.45Å; K114-D202 IonicContact NZ-OD1 2.7Å; K114-D202 PolarHBondContact NZ-OD1 3.4Å; K114-D202 IonicContact NZ-OD2 2.66Å; K114-D202 PolarHBondContact NZ-OD2 3.03Å
115	D	70.6	Confident	90.3	Very high	111 Å²	111	21.5 Å²	21.5	59%	0.594	11%	0.105	S	C	*	.	G	3₁₀ helix	trans	56	25.4	165.1	-51.1	-41.2	0	0	0	115	H117	D115-H117 PolarHBondContact O-CE1 3.08Å; D115-H117 PolarHBondContact O-ND1 3.48Å
116	G	76.8	Confident	90.2	Very high	12 Å²	12	21.8 Å²	21.8	12%	0.124	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	76.1	28.5	-179.5	0	0	0	0	0	113.5	K114 V135	K114-G116 PolarHBondContact O-N 2.66Å; G116-V135 WeakPolarHBondContact O-CB 3.19Å; G116-V135 VanDerWaalsContact O-CG2 3.3Å; G116-V135 WeakPolarHBondContact O-CG2 3.47Å; G116-V135 PolarHBondContact O-N 3.25Å
117	H	86.9	Confident	90.1	Very high	33 Å²	33	23.2 Å²	23.2	15%	0.153	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	156	173.7	-61.2	79.8	0	0	0	111.6	Q113 K114 D115 L133 H134 E141	Q113-H117 HydrophobicContact CB-CB 4.42Å; Q113-H117 PolarHBondContact N-O 3.12Å; K114-H117 WeakPolarHBondContact O-CB 3.15Å; K114-H117 PolarHBondContact O-N 3.15Å; K114-H117 PolarHBondContact O-ND1 2.96Å; K114-H117 VanDerWaalsContact O-ND1 3.16Å; D115-H117 PolarHBondContact O-CE1 3.08Å; D115-H117 PolarHBondContact O-ND1 3.48Å; H117-L133 CarbonylContact C-O 3.42Å; H117-L133 VanDerWaalsContact CA-O 3.22Å; H117-L133 WeakPolarHBondContact CA-O 3.27Å; H117-H134 AromaticContact CE1-CD2 3.7Å; H117-H134 AromaticContact NE2-CD2 3.37Å; H117-H134 PolarHBondContact NE2-CD2 3.48Å; H117-H134 AromaticContact NE2-CG 3.85Å; H117-E141 IonicContact CD2-OE1 2.71Å; H117-E141 PolarHBondContact CD2-OE1 2.98Å; H117-E141 VanDerWaalsContact CD2-OE1 3.24Å; H117-E141 IonicContact NE2-OE1 3.07Å; H117-E141 PolarHBondContact NE2-OE1 3.2Å
118	I	91.3	Very high	90	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	130.3	165	-66.2	164.7	0	0	0	107.2	L50 F59 L110 E111 F112 V120 L133 V135	L50-I118 HydrophobicContact CD2-CD1 4.13Å; L50-I118 HydrophobicContact CD2-CG1 4.12Å; L50-I118 HydrophobicContact CD2-CG2 3.86Å; F59-I118 HydrophobicContact CB-CD1 4.49Å; F59-I118 HydrophobicContact CD1-CD1 3.78Å; F59-I118 HydrophobicContact CD2-CD1 3.62Å; F59-I118 HydrophobicContact CE1-CD1 3.84Å; F59-I118 HydrophobicContact CE2-CD1 3.7Å; F59-I118 HydrophobicContact CG-CD1 3.67Å; F59-I118 HydrophobicContact CZ-CD1 3.81Å; L110-I118 HydrophobicContact CB-CG2 4.45Å; L110-I118 HydrophobicContact CD2-CG2 3.95Å; E111-I118 CarbonylContact O-C 3.55Å; E111-I118 VanDerWaalsContact O-CA 3.27Å; E111-I118 WeakPolarHBondContact O-CA 3.35Å; E111-I118 WeakPolarHBondContact O-CG2 3.13Å; F112-I118 HydrophobicContact CD1-CD1 4.2Å; F112-I118 HydrophobicContact CD1-CG1 3.65Å; F112-I118 HydrophobicContact CE1-CD1 3.79Å; F112-I118 HydrophobicContact CE1-CG1 3.79Å; I118-V120 HydrophobicContact CG2-CG2 3.97Å; I118-L133 HydrophobicContact CB-CB 4.18Å; I118-L133 HydrophobicContact CB-CD2 4.36Å; I118-L133 HydrophobicContact CB-CG 4.5Å; I118-L133 HydrophobicContact CD1-CD2 4.22Å; I118-L133 PolarHBondContact N-O 3.37Å; I118-L133 PolarHBondContact O-N 2.7Å; I118-V135 HydrophobicContact CD1-CG2 3.57Å; I118-V135 HydrophobicContact CG1-CG2 3.65Å
119	Y	92.2	Very high	90.1	Very high	1 Å²	1	22.9 Å²	22.9	0%	0.004	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	116.5	169.6	-162.6	-110.5	0	0	0	108.7	L109 L110 E111 C121 C130 F132 E151 K156 L205	L109-Y119 HydrophobicContact CD2-CD1 4.04Å; L109-Y119 HydrophobicContact CD2-CE1 4.48Å; L110-Y119 WeakPolarHBondContact CA-O 2.99Å; E111-Y119 PolarHBondContact N-O 3.44Å; E111-Y119 PolarHBondContact O-N 3.31Å; Y119-C121 VanDerWaalsContact CE1-SG 3.5Å; Y119-C130 HydrophobicContact CE1-CB 3.92Å; Y119-C130 HydrophobicContact CE2-CB 4.22Å; Y119-C130 WeakPolarHBondContact OH-CB 3.35Å; Y119-F132 AromaticContact CD2-CD1 3.87Å; Y119-F132 HydrophobicContact CD2-CD1 3.87Å; Y119-F132 AromaticContact CD2-CE1 3.55Å; Y119-F132 HydrophobicContact CD2-CE1 3.55Å; Y119-F132 HydrophobicContact CD2-CZ 4.21Å; Y119-F132 HydrophobicContact CE2-CD1 4.24Å; Y119-F132 AromaticContact CE2-CE1 3.56Å; Y119-F132 HydrophobicContact CE2-CE1 3.56Å; Y119-F132 AromaticContact CE2-CZ 3.74Å; Y119-F132 HydrophobicContact CE2-CZ 3.74Å; Y119-E151 PolarHBondContact OH-OE2 2.69Å; Y119-K156 HydrophobicContact CE1-CD 4.37Å; Y119-K156 PolarHBondContact OH-NZ 2.8Å; Y119-L205 HydrophobicContact CD1-CD2 3.98Å; Y119-L205 HydrophobicContact CE1-CD2 3.92Å
120	V	95.1	Very high	90.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.6	-175	-168.6	0	0	0	0	109.2	I66 W83 I107 L109 L110 I118 C130 A131 L133	I66-V120 HydrophobicContact CD1-CB 4.46Å; I66-V120 HydrophobicContact CD1-CG1 3.76Å; I66-V120 HydrophobicContact CD1-CG2 4.25Å; I66-V120 HydrophobicContact CG1-CG1 4.23Å; W83-V120 HydrophobicContact CE3-CG1 4.31Å; W83-V120 HydrophobicContact CZ3-CB 4.27Å; W83-V120 HydrophobicContact CZ3-CG1 3.82Å; I107-V120 HydrophobicContact CD1-CG1 4.45Å; I107-V120 HydrophobicContact CG2-CG1 3.69Å; L109-V120 VanDerWaalsContact O-CA 3.3Å; L109-V120 WeakPolarHBondContact O-CA 3.47Å; L109-V120 WeakPolarHBondContact O-CG1 3.46Å; L110-V120 HydrophobicContact CD2-CB 4.27Å; L110-V120 HydrophobicContact CD2-CG1 3.77Å; L110-V120 HydrophobicContact CD2-CG2 3.85Å; I118-V120 HydrophobicContact CG2-CG2 3.97Å; V120-C130 CarbonylContact O-C 3.53Å; V120-C130 WeakPolarHBondContact O-CA 3.34Å; V120-A131 PolarHBondContact N-O 3.47Å; V120-A131 PolarHBondContact O-N 2.94Å; V120-L133 HydrophobicContact CG2-CB 3.67Å; V120-L133 HydrophobicContact CG2-CD2 4.23Å
121	C	95.4	Very high	90.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	148.6	171.7	-53.2	0	0	0	0	112	R108 L109 Y119 Q129 C130 C157	R108-C121 PolarHBondContact N-O 3.49Å; L109-C121 HydrophobicContact CD2-CB 3.99Å; L109-C121 WeakPolarHBondContact CD2-SG 3.49Å; L109-C121 PolarHBondContact N-O 2.75Å; L109-C121 PolarHBondContact O-N 2.8Å; Y119-C121 VanDerWaalsContact CE1-SG 3.5Å; C121-Q129 CarbonylContact C-O 3.51Å; C121-Q129 VanDerWaalsContact CA-O 3.27Å; C121-Q129 WeakPolarHBondContact CA-O 3.26Å; C121-C130 HydrophobicContact CB-CB 4.08Å; C121-C130 WeakPolarHBondContact CB-SG 3.44Å; C121-C130 WeakPolarHBondContact SG-CB 3.41Å; C121-C130 CovalentContact SG-SG 2.03Å; C121-C130 PolarHBondContact SG-SG 2.85Å; C121-C157 HydrophobicContact CB-CB 3.75Å
122	G	96.4	Very high	90.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	164.2	175.8	0	0	0	0	0	113.6	N105 Y106 Y124 P128 Q129 C157	N105-G122 WeakPolarHBondContact OD1-CA 3.17Å; Y106-G122 CarbonylContact O-C 3.59Å; Y106-G122 WeakPolarHBondContact O-CA 3.43Å; G122-Y124 PolarHBondContact O-N 2.93Å; G122-P128 VanDerWaalsContact O-CA 3.31Å; G122-P128 WeakPolarHBondContact O-CA 3.15Å; G122-Q129 PolarHBondContact N-O 2.7Å; G122-Q129 PolarHBondContact O-N 2.84Å; G122-Q129 VanDerWaalsContact O-N 3.12Å; G122-C157 VanDerWaalsContact C-SG 3.52Å
123	T	95.7	Very high	90.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.091	C	C	.	.			trans	-63	-27.2	-175.6	59.9	0	0	0	0	113.3	N104 N105 Y106 R108 A125 F126 D127 P161	N104-T123 PolarHBondContact O-OG1 2.86Å; N105-T123 PolarHBondContact OD1-N 3.29Å; Y106-T123 PolarHBondContact N-OG1 3.23Å; Y106-T123 PolarHBondContact O-N 3.38Å; R108-T123 HydrophobicContact CG-CG2 4.42Å; T123-A125 VanDerWaalsContact C-N 3.3Å; T123-A125 PolarHBondContact O-N 2.82Å; T123-A125 VanDerWaalsContact O-N 3.16Å; T123-F126 PolarHBondContact O-N 2.8Å; T123-D127 CarbonylContact O-C 3.45Å; T123-D127 PolarHBondContact O-N 3.33Å; T123-D127 VanDerWaalsContact O-N 3.08Å; T123-P161 HydrophobicContact CG2-CG 4.35Å
124	Y	96.4	Very high	90.9	Very high	15 Å²	15	18.8 Å²	18.8	6%	0.059	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.3	50.1	175.6	-152.2	-103.2	0	0	0	114.2	W83 V85 P86 K89 N105 G122 Q129	W83-Y124 AromaticContact CD1-CE2 3.96Å; W83-Y124 AromaticContact NE1-CE2 3.49Å; V85-Y124 HydrophobicContact CG2-CD2 3.94Å; V85-Y124 HydrophobicContact CG2-CE2 4.23Å; V85-Y124 HydrophobicContact CG2-CG 4.08Å; P86-Y124 WeakPolarHBondContact CD-OH 3.32Å; K89-Y124 HydrophobicContact CD-CD1 4.19Å; K89-Y124 HydrophobicContact CD-CE1 3.87Å; N105-Y124 HydrophobicContact CB-CD2 4.06Å; N105-Y124 PolarHBondContact OD1-N 3.46Å; N105-Y124 VanDerWaalsContact OD1-N 3.08Å; G122-Y124 PolarHBondContact O-N 2.93Å; Y124-Q129 HydrophobicContact CD1-CG 3.51Å; Y124-Q129 HydrophobicContact CD2-CG 4.42Å; Y124-Q129 HydrophobicContact CE1-CG 4.09Å; Y124-Q129 HydrophobicContact CG-CB 4.25Å; Y124-Q129 HydrophobicContact CG-CG 3.69Å
125	A	95.7	Very high	91.7	Very high	8 Å²	8	16.5 Å²	16.5	7%	0.066	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	54.7	-175	0	0	0	0	0	115.1	V85 C93 C103 N104 T123 D127	V85-A125 HydrophobicContact CB-CB 4.41Å; V85-A125 HydrophobicContact CG1-CB 3.82Å; V85-A125 HydrophobicContact CG2-CB 4.02Å; C93-A125 HydrophobicContact CB-CB 3.94Å; C103-A125 HydrophobicContact CB-CB 4.29Å; C103-A125 WeakPolarHBondContact O-CB 3.11Å; N104-A125 PolarHBondContact O-N 2.93Å; N104-A125 VanDerWaalsContact O-N 3.16Å; T123-A125 VanDerWaalsContact C-N 3.3Å; T123-A125 PolarHBondContact O-N 2.82Å; T123-A125 VanDerWaalsContact O-N 3.16Å; A125-D127 VanDerWaalsContact C-N 3.26Å; A125-D127 PolarHBondContact O-N 3.4Å
126	F	94	Very high	92.5	Very high	5 Å²	5	14 Å²	14	2%	0.022	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	34.1	-177.4	-60	-104.7	0	0	0	113.7	C93 K98 D102 T123 F159 E160 F213	C93-F126 VanDerWaalsContact SG-CD2 3.55Å; K98-F126 HydrophobicContact CB-CD2 4.29Å; K98-F126 HydrophobicContact CB-CE2 3.77Å; K98-F126 HydrophobicContact CB-CZ 4.21Å; K98-F126 HydrophobicContact CD-CD1 4.4Å; K98-F126 HydrophobicContact CD-CE1 3.73Å; K98-F126 HydrophobicContact CD-CE2 3.89Å; K98-F126 HydrophobicContact CD-CZ 3.44Å; K98-F126 VanDerWaalsContact CD-CZ 3.44Å; K98-F126 HydrophobicContact CG-CD1 4.44Å; K98-F126 HydrophobicContact CG-CD2 3.99Å; K98-F126 HydrophobicContact CG-CE1 4.16Å; K98-F126 HydrophobicContact CG-CE2 3.65Å; K98-F126 HydrophobicContact CG-CG 4.37Å; K98-F126 HydrophobicContact CG-CZ 3.76Å; D102-F126 HydrophobicContact CB-CE2 3.51Å; D102-F126 HydrophobicContact CB-CZ 3.78Å; T123-F126 PolarHBondContact O-N 2.8Å; F126-F159 HydrophobicContact CD1-CB 4.21Å; F126-F159 WeakPolarHBondContact CD1-O 3.22Å; F126-F159 WeakPolarHBondContact O-CD1 3.28Å; F126-E160 HydrophobicContact CD1-CB 4.38Å; F126-E160 HydrophobicContact CE1-CB 3.6Å; F126-E160 HydrophobicContact CE1-CG 3.56Å; F126-E160 WeakPolarHBondContact CE1-OE2 3.4Å; F126-E160 HydrophobicContact CZ-CB 4.23Å; F126-E160 HydrophobicContact CZ-CG 3.73Å; F126-F213 HydrophobicContact CB-CD2 3.83Å; F126-F213 HydrophobicContact CB-CE2 3.46Å; F126-F213 VanDerWaalsContact CB-CE2 3.46Å; F126-F213 HydrophobicContact CB-CZ 4.49Å; F126-F213 HydrophobicContact CD1-CE2 4.3Å; F126-F213 HydrophobicContact CG-CE2 4.13Å
127	D	94.4	Very high	93	Very high	49 Å²	49	16.3 Å²	16.3	26%	0.262	9%	0.091	S	C	.	.	S	Bend	trans	-141.6	70.9	170.2	-179.6	35.5	0	0	0	108.6	K89 T123 A125 Q129	K89-D127 IonicContact NZ-OD2 3.24Å; K89-D127 PolarHBondContact NZ-OD2 3.34Å; T123-D127 CarbonylContact O-C 3.45Å; T123-D127 PolarHBondContact O-N 3.33Å; T123-D127 VanDerWaalsContact O-N 3.08Å; A125-D127 VanDerWaalsContact C-N 3.26Å; A125-D127 PolarHBondContact O-N 3.4Å; D127-Q129 WeakPolarHBondContact O-CG 3.27Å; D127-Q129 PolarHBondContact O-N 2.97Å; D127-Q129 PolarHBondContact O-NE2 2.79Å; D127-Q129 PolarHBondContact OD2-NE2 2.95Å
128	P	94.9	Very high	93.3	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.087	C	C	.	.			trans	-54.8	131.6	-163.7	-30.3	37.5	0	0	0	113.4	G122 G153 C157 P158 F159	G122-P128 VanDerWaalsContact O-CA 3.31Å; G122-P128 WeakPolarHBondContact O-CA 3.15Å; P128-G153 WeakPolarHBondContact O-CA 3.37Å; P128-G153 PolarHBondContact O-N 2.88Å; P128-C157 HydrophobicContact CB-CB 4.18Å; P128-P158 VanDerWaalsContact CG-O 3.32Å; P128-P158 WeakPolarHBondContact CG-O 3.35Å; P128-F159 VanDerWaalsContact CD-CD1 3.41Å; P128-F159 HydrophobicContact CG-CB 4.35Å; P128-F159 HydrophobicContact CG-CD1 4Å; P128-F159 HydrophobicContact CG-CD2 4Å; P128-F159 HydrophobicContact CG-CE1 4.33Å; P128-F159 HydrophobicContact CG-CE2 4.32Å; P128-F159 HydrophobicContact CG-CG 3.84Å; P128-F159 HydrophobicContact CG-CZ 4.49Å
129	Q	95.6	Very high	93.4	Very high	22 Å²	22	19 Å²	19	10%	0.103	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	149.9	178.4	-56.4	-55.1	-47.8	0	0	110.2	W83 C121 G122 Y124 D127 M150 E151	W83-Q129 HydrophobicContact CH2-CB 4.41Å; W83-Q129 HydrophobicContact CZ2-CB 4.01Å; C121-Q129 CarbonylContact C-O 3.51Å; C121-Q129 VanDerWaalsContact CA-O 3.27Å; C121-Q129 WeakPolarHBondContact CA-O 3.26Å; G122-Q129 PolarHBondContact N-O 2.7Å; G122-Q129 PolarHBondContact O-N 2.84Å; G122-Q129 VanDerWaalsContact O-N 3.12Å; Y124-Q129 HydrophobicContact CD1-CG 3.51Å; Y124-Q129 HydrophobicContact CD2-CG 4.42Å; Y124-Q129 HydrophobicContact CE1-CG 4.09Å; Y124-Q129 HydrophobicContact CG-CB 4.25Å; Y124-Q129 HydrophobicContact CG-CG 3.69Å; D127-Q129 WeakPolarHBondContact O-CG 3.27Å; D127-Q129 PolarHBondContact O-N 2.97Å; D127-Q129 PolarHBondContact O-NE2 2.79Å; D127-Q129 PolarHBondContact OD2-NE2 2.95Å; Q129-M150 HydrophobicContact CB-SD 4.25Å; Q129-M150 HydrophobicContact CG-SD 4.26Å; Q129-E151 WeakPolarHBondContact CA-O 3.37Å; Q129-E151 PolarHBondContact OE1-O 3.31Å
130	C	94.5	Very high	93.5	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	149.7	169	-60.4	0	0	0	0	110.2	Y119 V120 C121 M150 E151 G153	Y119-C130 HydrophobicContact CE1-CB 3.92Å; Y119-C130 HydrophobicContact CE2-CB 4.22Å; Y119-C130 WeakPolarHBondContact OH-CB 3.35Å; V120-C130 CarbonylContact O-C 3.53Å; V120-C130 WeakPolarHBondContact O-CA 3.34Å; C121-C130 HydrophobicContact CB-CB 4.08Å; C121-C130 WeakPolarHBondContact CB-SG 3.44Å; C121-C130 WeakPolarHBondContact SG-CB 3.41Å; C121-C130 CovalentContact SG-SG 2.03Å; C121-C130 PolarHBondContact SG-SG 2.85Å; C130-M150 CarbonylContact O-C 3.58Å; C130-M150 WeakPolarHBondContact O-CA 3.41Å; C130-E151 HydrophobicContact CB-CB 4.44Å; C130-E151 PolarHBondContact N-O 2.81Å; C130-E151 PolarHBondContact O-N 2.84Å; C130-G153 VanDerWaalsContact SG-CA 3.51Å
131	A	94.6	Very high	93.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	163.3	179.5	0	0	0	0	0	110.1	W83 V120 L140	W83-A131 HydrophobicContact CH2-CB 3.72Å; W83-A131 HydrophobicContact CZ2-CB 3.84Å; W83-A131 HydrophobicContact CZ3-CB 4.25Å; V120-A131 PolarHBondContact N-O 3.47Å; V120-A131 PolarHBondContact O-N 2.94Å; A131-L140 HydrophobicContact CB-CD2 4.11Å
132	F	92.7	Very high	93.2	Very high	11 Å²	11	28.8 Å²	28.8	5%	0.048	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	124	-177.5	-55.8	-89.9	0	0	0	109.8	Y119 L140 E141 R149 E151	Y119-F132 AromaticContact CD2-CD1 3.87Å; Y119-F132 HydrophobicContact CD2-CD1 3.87Å; Y119-F132 AromaticContact CD2-CE1 3.55Å; Y119-F132 HydrophobicContact CD2-CE1 3.55Å; Y119-F132 HydrophobicContact CD2-CZ 4.21Å; Y119-F132 HydrophobicContact CE2-CD1 4.24Å; Y119-F132 AromaticContact CE2-CE1 3.56Å; Y119-F132 HydrophobicContact CE2-CE1 3.56Å; Y119-F132 AromaticContact CE2-CZ 3.74Å; Y119-F132 HydrophobicContact CE2-CZ 3.74Å; F132-L140 CarbonylContact O-C 3.57Å; F132-L140 VanDerWaalsContact O-CA 3.3Å; F132-L140 WeakPolarHBondContact O-CA 3.31Å; F132-E141 HydrophobicContact CB-CB 4.13Å; F132-E141 HydrophobicContact CB-CG 3.86Å; F132-E141 WeakPolarHBondContact CB-OE1 3.3Å; F132-E141 PolarHBondContact O-N 2.96Å; F132-R149 HydrophobicContact CD2-CG 4.19Å; F132-R149 HydrophobicContact CE2-CG 4.35Å; F132-E151 HydrophobicContact CE2-CG 4.09Å; F132-E151 HydrophobicContact CZ-CG 4.28Å; F132-E151 WeakPolarHBondContact CZ-OE1 3.44Å
133	L	93.4	Very high	92.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	110.9	179.7	170	59.1	0	0	0	110.1	I66 I81 H117 I118 V120 V135 F138 L140	I66-L133 HydrophobicContact CG2-CD2 4.12Å; I81-L133 HydrophobicContact CD1-CD1 3.36Å; H117-L133 CarbonylContact C-O 3.42Å; H117-L133 VanDerWaalsContact CA-O 3.22Å; H117-L133 WeakPolarHBondContact CA-O 3.27Å; I118-L133 HydrophobicContact CB-CB 4.18Å; I118-L133 HydrophobicContact CB-CD2 4.36Å; I118-L133 HydrophobicContact CB-CG 4.5Å; I118-L133 HydrophobicContact CD1-CD2 4.22Å; I118-L133 PolarHBondContact N-O 3.37Å; I118-L133 PolarHBondContact O-N 2.7Å; V120-L133 HydrophobicContact CG2-CB 3.67Å; V120-L133 HydrophobicContact CG2-CD2 4.23Å; L133-V135 PolarHBondContact O-N 3.45Å; L133-F138 HydrophobicContact CD1-CD2 4.13Å; L133-F138 HydrophobicContact CD1-CE2 4.37Å; L133-F138 HydrophobicContact CD2-CD2 4.39Å; L133-F138 HydrophobicContact CD2-CE2 4.03Å; L133-L140 HydrophobicContact CB-CD2 3.89Å; L133-L140 HydrophobicContact CD1-CD2 4.38Å
134	H	90.9	Very high	92.5	Very high	59 Å²	59	41.2 Å²	41.2	27%	0.273	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	115.5	173.6	-179.3	-119.2	0	0	0	110.1	H117 S137 F138 T139	H117-H134 AromaticContact CE1-CD2 3.7Å; H117-H134 AromaticContact NE2-CD2 3.37Å; H117-H134 PolarHBondContact NE2-CD2 3.48Å; H117-H134 AromaticContact NE2-CG 3.85Å; H134-S137 PolarHBondContact ND1-OG 2.04Å; H134-F138 VanDerWaalsContact O-CA 3.28Å; H134-F138 WeakPolarHBondContact O-CA 3.48Å; H134-F138 PolarHBondContact O-N 3.48Å; H134-T139 PolarHBondContact N-O 3.21Å; H134-T139 PolarHBondContact O-N 3.11Å
135	V	89.1	Confident	91.9	Very high	20 Å²	20	47.8 Å²	47.8	12%	0.121	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-46.3	-171.7	171.6	0	0	0	0	113.6	F59 G116 I118 L133 S137 F138	F59-V135 HydrophobicContact CZ-CG1 3.89Å; F59-V135 HydrophobicContact CZ-CG2 4.24Å; G116-V135 WeakPolarHBondContact O-CB 3.19Å; G116-V135 VanDerWaalsContact O-CG2 3.3Å; G116-V135 WeakPolarHBondContact O-CG2 3.47Å; G116-V135 PolarHBondContact O-N 3.25Å; I118-V135 HydrophobicContact CD1-CG2 3.57Å; I118-V135 HydrophobicContact CG1-CG2 3.65Å; L133-V135 PolarHBondContact O-N 3.45Å; V135-S137 PolarHBondContact O-N 3.41Å; V135-F138 PolarHBondContact O-N 3.32Å
136	P	86.5	Confident	91.4	Very high	59 Å²	59	49.5 Å²	49.5	38%	0.383	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-43.2	-176.9	-25.5	34.4	0	0	0	114.2	Y197	P136-Y197 HydrophobicContact CG-CE1 4.07Å
137	S	88.1	Confident	91	Very high	60 Å²	60	52 Å²	52	42%	0.42	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-17.7	176.6	58.4	0	0	0	0	113.4	H134 V135 T139	H134-S137 PolarHBondContact ND1-OG 2.04Å; V135-S137 PolarHBondContact O-N 3.41Å; S137-T139 PolarHBondContact OG-OG1 3.17Å
138	F	93.1	Very high	90.8	Very high	16 Å²	16	51.8 Å²	51.8	7%	0.07	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	56.4	-170.1	-164.1	-110.9	0	0	0	111.9	F59 I66 A68 K79 I81 L133 H134 V135	F59-F138 AromaticContact CD1-CE2 3.92Å; F59-F138 HydrophobicContact CD1-CE2 3.92Å; F59-F138 HydrophobicContact CE1-CD2 4.03Å; F59-F138 AromaticContact CE1-CE2 3.86Å; F59-F138 HydrophobicContact CE1-CE2 3.86Å; I66-F138 HydrophobicContact CG2-CZ 4.44Å; A68-F138 HydrophobicContact CB-CD2 3.99Å; A68-F138 HydrophobicContact CB-CE1 4.39Å; A68-F138 HydrophobicContact CB-CE2 3.51Å; A68-F138 HydrophobicContact CB-CZ 3.73Å; K79-F138 HydrophobicContact CB-CD1 3.49Å; K79-F138 VanDerWaalsContact CB-CD1 3.49Å; K79-F138 HydrophobicContact CB-CE1 3.54Å; K79-F138 HydrophobicContact CB-CG 4.26Å; K79-F138 HydrophobicContact CB-CZ 4.38Å; K79-F138 HydrophobicContact CD-CB 4.11Å; K79-F138 HydrophobicContact CD-CD1 4.12Å; K79-F138 HydrophobicContact CD-CG 4.18Å; K79-F138 HydrophobicContact CG-CD1 4.45Å; I81-F138 HydrophobicContact CB-CE1 4.46Å; I81-F138 HydrophobicContact CD1-CD1 3.83Å; I81-F138 HydrophobicContact CD1-CD2 4.25Å; I81-F138 HydrophobicContact CD1-CE1 3.7Å; I81-F138 HydrophobicContact CD1-CE2 4.1Å; I81-F138 HydrophobicContact CD1-CG 4.12Å; I81-F138 HydrophobicContact CD1-CZ 3.84Å; I81-F138 WeakPolarHBondContact CD1-O 3.4Å; I81-F138 HydrophobicContact CG1-CD1 3.83Å; I81-F138 HydrophobicContact CG1-CE1 3.57Å; I81-F138 HydrophobicContact CG1-CZ 4.11Å; L133-F138 HydrophobicContact CD1-CD2 4.13Å; L133-F138 HydrophobicContact CD1-CE2 4.37Å; L133-F138 HydrophobicContact CD2-CD2 4.39Å; L133-F138 HydrophobicContact CD2-CE2 4.03Å; H134-F138 VanDerWaalsContact O-CA 3.28Å; H134-F138 WeakPolarHBondContact O-CA 3.48Å; H134-F138 PolarHBondContact O-N 3.48Å; V135-F138 PolarHBondContact O-N 3.32Å
139	T	93.6	Very high	90.7	Very high	73 Å²	73	56.7 Å²	56.7	45%	0.448	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	141	178.7	54.7	0	0	0	0	110.7	H134 S137	H134-T139 PolarHBondContact N-O 3.21Å; H134-T139 PolarHBondContact O-N 3.11Å; S137-T139 PolarHBondContact OG-OG1 3.17Å
140	L	93.8	Very high	90.5	Very high	17 Å²	17	59.1 Å²	59.1	9%	0.089	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	141	169.5	-65.3	169.6	0	0	0	110.8	I66 I81 W83 A131 F132 L133 L148	I66-L140 HydrophobicContact CD1-CD1 4.36Å; I66-L140 HydrophobicContact CD1-CD2 4.06Å; I81-L140 HydrophobicContact CD1-CG 4.49Å; I81-L140 HydrophobicContact CG2-CD1 3.81Å; I81-L140 HydrophobicContact CG2-CG 4.15Å; W83-L140 HydrophobicContact CB-CD1 4.24Å; W83-L140 HydrophobicContact CD2-CD1 4.22Å; W83-L140 HydrophobicContact CG-CD1 4.09Å; A131-L140 HydrophobicContact CB-CD2 4.11Å; F132-L140 CarbonylContact O-C 3.57Å; F132-L140 VanDerWaalsContact O-CA 3.3Å; F132-L140 WeakPolarHBondContact O-CA 3.31Å; L133-L140 HydrophobicContact CB-CD2 3.89Å; L133-L140 HydrophobicContact CD1-CD2 4.38Å; L140-L148 HydrophobicContact CB-CD1 3.52Å; L140-L148 HydrophobicContact CD1-CD1 4.05Å; L140-L148 HydrophobicContact CD1-CD2 4.23Å; L140-L148 HydrophobicContact CG-CD1 4.42Å
141	E	92.6	Very high	90.4	Very high	45 Å²	45	62.5 Å²	62.5	21%	0.21	34%	0.336	C	S	.	.			trans	-61.8	150.8	177.7	-76.7	-173.3	-142.2	0	0	112.9	H117 F132 R149	H117-E141 IonicContact CD2-OE1 2.71Å; H117-E141 PolarHBondContact CD2-OE1 2.98Å; H117-E141 VanDerWaalsContact CD2-OE1 3.24Å; H117-E141 IonicContact NE2-OE1 3.07Å; H117-E141 PolarHBondContact NE2-OE1 3.2Å; F132-E141 HydrophobicContact CB-CB 4.13Å; F132-E141 HydrophobicContact CB-CG 3.86Å; F132-E141 WeakPolarHBondContact CB-OE1 3.3Å; F132-E141 PolarHBondContact O-N 2.96Å; E141-R149 HydrophobicContact CB-CB 4.04Å; E141-R149 PolarHBondContact O-N 3.2Å; E141-R149 IonicContact OE1-NH1 3.87Å; E141-R149 WeakPolarHBondContact OE2-CD 3.44Å; E141-R149 IonicContact OE2-CZ 3.6Å; E141-R149 IonicContact OE2-NE 3.79Å; E141-R149 IonicContact OE2-NH1 2.68Å; E141-R149 PolarHBondContact OE2-NH1 3.38Å
142	K	92.1	Very high	90.2	Very high	145 Å²	145	65.8 Å²	65.8	63%	0.63	36%	0.356	S	S	*	.	B	Isolated β-bridge	trans	-125.9	149.8	178.4	-66.5	-179.5	174.5	-168.9	0	110.9	A147	K142-A147 CarbonylContact C-O 3.57Å; K142-A147 WeakPolarHBondContact CA-O 3.1Å; K142-A147 VanDerWaalsContact CB-O 3.28Å; K142-A147 WeakPolarHBondContact CB-O 3.21Å
143	T	90	Very high	90.1	Very high	57 Å²	57	65.3 Å²	65.3	35%	0.35	35%	0.354	S	S	.	.			trans	-74.8	171	169.4	62.8	0	0	0	0	110.7	D145 G146 A147 R149	T143-D145 PolarHBondContact O-N 2.79Å; T143-G146 WeakPolarHBondContact O-CA 3.28Å; T143-G146 PolarHBondContact O-N 2.91Å; T143-A147 PolarHBondContact N-O 3.32Å; T143-A147 PolarHBondContact OG1-O 3.23Å; T143-R149 HydrophobicContact CG2-CB 4.14Å; T143-R149 HydrophobicContact CG2-CG 4.43Å
144	E	86.4	Confident	89.9	Confident	205 Å²	205	70.2 Å²	70.2	96%	0.958	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-33.6	177.6	-61.6	-178.8	-177.3	0	0	112.4	G146	E144-G146 PolarHBondContact O-N 3.29Å
145	D	85.2	Confident	89.6	Confident	153 Å²	153	67.4 Å²	67.4	82%	0.818	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	1.2	174.9	-49.3	-63.5	0	0	0	114.2	T143 A147	T143-D145 PolarHBondContact O-N 2.79Å; D145-A147 PolarHBondContact O-N 3.02Å
146	G	83.7	Confident	89.7	Confident	44 Å²	44	67.3 Å²	67.3	45%	0.454	36%	0.36	S	S	.	.	S	Bend	trans	76.5	-0.7	-178.5	0	0	0	0	0	115.4	T143 E144	T143-G146 WeakPolarHBondContact O-CA 3.28Å; T143-G146 PolarHBondContact O-N 2.91Å; E144-G146 PolarHBondContact O-N 3.29Å
147	A	86.4	Confident	89.9	Confident	56 Å²	56	64.6 Å²	64.6	46%	0.463	34%	0.342	S	S	.	.	S	Bend	trans	-71.2	160.5	171.4	0	0	0	0	0	111.3	K142 T143 D145 R149	K142-A147 CarbonylContact C-O 3.57Å; K142-A147 WeakPolarHBondContact CA-O 3.1Å; K142-A147 VanDerWaalsContact CB-O 3.28Å; K142-A147 WeakPolarHBondContact CB-O 3.21Å; T143-A147 PolarHBondContact N-O 3.32Å; T143-A147 PolarHBondContact OG1-O 3.23Å; D145-A147 PolarHBondContact O-N 3.02Å; A147-R149 PolarHBondContact O-N 2.99Å
148	L	90.5	Very high	90.1	Very high	45 Å²	45	61.7 Å²	61.7	24%	0.236	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-67.9	129.5	177.5	-161.4	73.3	0	0	0	110.5	W83 L140 M150	W83-L148 HydrophobicContact CZ2-CD2 4.41Å; L140-L148 HydrophobicContact CB-CD1 3.52Å; L140-L148 HydrophobicContact CD1-CD1 4.05Å; L140-L148 HydrophobicContact CD1-CD2 4.23Å; L140-L148 HydrophobicContact CG-CD1 4.42Å; L148-M150 HydrophobicContact CB-CE 4.4Å; L148-M150 HydrophobicContact CB-CG 4.21Å; L148-M150 HydrophobicContact CD2-CG 3.8Å; L148-M150 HydrophobicContact CD2-SD 3.87Å; L148-M150 HydrophobicContact CG-CG 4.07Å; L148-M150 PolarHBondContact O-N 3.35Å
149	R	92.1	Very high	90.1	Very high	103 Å²	103	61.4 Å²	61.4	39%	0.389	32%	0.321	S	S	.	.			trans	-72.8	101.3	174.5	-175.6	-173	174.2	-169	-4.3	108.8	F132 E141 T143 A147	F132-R149 HydrophobicContact CD2-CG 4.19Å; F132-R149 HydrophobicContact CE2-CG 4.35Å; E141-R149 HydrophobicContact CB-CB 4.04Å; E141-R149 PolarHBondContact O-N 3.2Å; E141-R149 IonicContact OE1-NH1 3.87Å; E141-R149 WeakPolarHBondContact OE2-CD 3.44Å; E141-R149 IonicContact OE2-CZ 3.6Å; E141-R149 IonicContact OE2-NE 3.79Å; E141-R149 IonicContact OE2-NH1 2.68Å; E141-R149 PolarHBondContact OE2-NH1 3.38Å; T143-R149 HydrophobicContact CG2-CB 4.14Å; T143-R149 HydrophobicContact CG2-CG 4.43Å; A147-R149 PolarHBondContact O-N 2.99Å
150	M	92.1	Very high	90.1	Very high	74 Å²	74	60.3 Å²	60.3	37%	0.365	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	145.4	-179.7	-67.3	-178.2	-67.8	0	0	112.2	W83 Q129 C130 L148	W83-M150 HydrophobicContact CZ2-CG 4.41Å; W83-M150 HydrophobicContact CZ2-SD 4.19Å; Q129-M150 HydrophobicContact CB-SD 4.25Å; Q129-M150 HydrophobicContact CG-SD 4.26Å; C130-M150 CarbonylContact O-C 3.58Å; C130-M150 WeakPolarHBondContact O-CA 3.41Å; L148-M150 HydrophobicContact CB-CE 4.4Å; L148-M150 HydrophobicContact CB-CG 4.21Å; L148-M150 HydrophobicContact CD2-CG 3.8Å; L148-M150 HydrophobicContact CD2-SD 3.87Å; L148-M150 HydrophobicContact CG-CG 4.07Å; L148-M150 PolarHBondContact O-N 3.35Å
151	E	91.8	Very high	90	Very high	71 Å²	71	60.2 Å²	60.2	33%	0.332	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	159.4	169	-64.9	-174.7	164.3	0	0	110.5	Y119 Q129 C130 F132 G153 K156	Y119-E151 PolarHBondContact OH-OE2 2.69Å; Q129-E151 WeakPolarHBondContact CA-O 3.37Å; Q129-E151 PolarHBondContact OE1-O 3.31Å; C130-E151 HydrophobicContact CB-CB 4.44Å; C130-E151 PolarHBondContact N-O 2.81Å; C130-E151 PolarHBondContact O-N 2.84Å; F132-E151 HydrophobicContact CE2-CG 4.09Å; F132-E151 HydrophobicContact CZ-CG 4.28Å; F132-E151 WeakPolarHBondContact CZ-OE1 3.44Å; E151-G153 PolarHBondContact O-N 2.82Å; E151-K156 IonicContact OE2-NZ 3.11Å; E151-K156 PolarHBondContact OE2-NZ 2.8Å; E151-K156 VanDerWaalsContact OE2-NZ 3.11Å
152	T	90.8	Very high	89.9	Confident	69 Å²	69	61.9 Å²	61.9	42%	0.423	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	129.5	170.4	-167.5	0	0	0	0	111.3	K154 K156	T152-K154 WeakPolarHBondContact OG1-CG 3.33Å; T152-K156 WeakPolarHBondContact O-CE 3.24Å; T152-K156 PolarHBondContact O-NZ 2.71Å; T152-K156 VanDerWaalsContact O-NZ 3.09Å
153	G	90	Very high	89.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.305	C	S	.	.			trans	-92.3	6	174.1	0	0	0	0	0	114	P128 C130 E151 G155 K156 C157	P128-G153 WeakPolarHBondContact O-CA 3.37Å; P128-G153 PolarHBondContact O-N 2.88Å; C130-G153 VanDerWaalsContact SG-CA 3.51Å; E151-G153 PolarHBondContact O-N 2.82Å; G153-G155 PolarHBondContact O-N 2.56Å; G153-K156 WeakPolarHBondContact O-CA 3.44Å; G153-K156 WeakPolarHBondContact O-CB 3.36Å; G153-K156 PolarHBondContact O-N 3.36Å; G153-C157 PolarHBondContact O-N 3.49Å
154	K	89.7	Confident	89.9	Confident	103 Å²	103	59.9 Å²	59.9	45%	0.448	31%	0.312	S	S	.	.	B	Isolated β-bridge	trans	-60.1	125.3	-178.3	-67.5	178	-178.8	171.2	0	110.9	T152 K156 F159	T152-K154 WeakPolarHBondContact OG1-CG 3.33Å; K154-K156 PolarHBondContact O-N 3.42Å; K154-F159 HydrophobicContact CD-CZ 4.29Å; K154-F159 HydrophobicContact CG-CE2 4.37Å; K154-F159 HydrophobicContact CG-CZ 3.79Å
155	G	85.3	Confident	90.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	14.2	-173.7	0	0	0	0	0	114.4	G153 T207 S221 R230	G153-G155 PolarHBondContact O-N 2.56Å; G155-T207 PolarHBondContact O-OG1 2.83Å; G155-S221 PolarHBondContact O-OG 3.38Å; G155-R230 PolarHBondContact O-NH2 3.3Å
156	K	89.2	Confident	90.7	Very high	19 Å²	19	45.8 Å²	45.8	8%	0.083	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-37.9	168.4	-42.7	-173.7	-176.9	166.5	0	110.9	Y119 E151 T152 G153 K154 T207 A223	Y119-K156 HydrophobicContact CE1-CD 4.37Å; Y119-K156 PolarHBondContact OH-NZ 2.8Å; E151-K156 IonicContact OE2-NZ 3.11Å; E151-K156 PolarHBondContact OE2-NZ 2.8Å; E151-K156 VanDerWaalsContact OE2-NZ 3.11Å; T152-K156 WeakPolarHBondContact O-CE 3.24Å; T152-K156 PolarHBondContact O-NZ 2.71Å; T152-K156 VanDerWaalsContact O-NZ 3.09Å; G153-K156 WeakPolarHBondContact O-CA 3.44Å; G153-K156 WeakPolarHBondContact O-CB 3.36Å; G153-K156 PolarHBondContact O-N 3.36Å; K154-K156 PolarHBondContact O-N 3.42Å; K156-T207 HydrophobicContact CB-CG2 4.42Å; K156-T207 WeakPolarHBondContact O-CG2 3.36Å; K156-A223 HydrophobicContact CB-CB 4.31Å; K156-A223 HydrophobicContact CD-CB 4.33Å; K156-A223 VanDerWaalsContact CE-O 3.26Å; K156-A223 WeakPolarHBondContact CE-O 3.32Å; K156-A223 HydrophobicContact CG-CB 3.91Å
157	C	91.8	Very high	91.1	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.007	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-131.3	143.8	179.1	174	0	0	0	0	108.8	C121 G122 P128 G153	C121-C157 HydrophobicContact CB-CB 3.75Å; G122-C157 VanDerWaalsContact C-SG 3.52Å; P128-C157 HydrophobicContact CB-CB 4.18Å; G153-C157 PolarHBondContact O-N 3.49Å
158	P	93.1	Very high	91.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.209	C	C	.	.			trans	-63.2	157.6	175.4	26.5	-35.5	0	0	0	112.3	R108 P128 Q163 Y165	R108-P158 HydrophobicContact CG-CG 4.37Å; P128-P158 VanDerWaalsContact CG-O 3.32Å; P128-P158 WeakPolarHBondContact CG-O 3.35Å; P158-Q163 HydrophobicContact CB-CB 3.73Å; P158-Y165 HydrophobicContact CG-CD1 3.87Å; P158-Y165 HydrophobicContact CG-CG 3.99Å
159	F	92.8	Very high	91.3	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.044	20%	0.201	C	C	.	.	S	Bend	trans	-79.9	-41.5	174.1	-76.8	-105.9	0	0	0	112	F126 P128 K154 N212 F213	F126-F159 HydrophobicContact CD1-CB 4.21Å; F126-F159 WeakPolarHBondContact CD1-O 3.22Å; F126-F159 WeakPolarHBondContact O-CD1 3.28Å; P128-F159 VanDerWaalsContact CD-CD1 3.41Å; P128-F159 HydrophobicContact CG-CB 4.35Å; P128-F159 HydrophobicContact CG-CD1 4Å; P128-F159 HydrophobicContact CG-CD2 4Å; P128-F159 HydrophobicContact CG-CE1 4.33Å; P128-F159 HydrophobicContact CG-CE2 4.32Å; P128-F159 HydrophobicContact CG-CG 3.84Å; P128-F159 HydrophobicContact CG-CZ 4.49Å; K154-F159 HydrophobicContact CD-CZ 4.29Å; K154-F159 HydrophobicContact CG-CE2 4.37Å; K154-F159 HydrophobicContact CG-CZ 3.79Å; F159-N212 VanDerWaalsContact CD2-O 3.24Å; F159-N212 WeakPolarHBondContact CD2-O 3.26Å; F159-N212 VanDerWaalsContact CE2-C 3.44Å; F159-F213 HydrophobicContact CD1-CB 4.04Å; F159-F213 HydrophobicContact CD1-CD2 4.13Å; F159-F213 HydrophobicContact CE1-CB 4Å
160	E	92.3	Very high	90.9	Very high	50 Å²	50	36.5 Å²	36.5	23%	0.234	18%	0.184	C	C	.	.	S	Bend	trans	-98.3	141.1	-177.3	-163.9	164.5	118.2	0	0	111.8	K98 F126 S162 Q163	K98-E160 IonicContact NZ-OE2 2.79Å; K98-E160 PolarHBondContact NZ-OE2 3.24Å; F126-E160 HydrophobicContact CD1-CB 4.38Å; F126-E160 HydrophobicContact CE1-CB 3.6Å; F126-E160 HydrophobicContact CE1-CG 3.56Å; F126-E160 WeakPolarHBondContact CE1-OE2 3.4Å; F126-E160 HydrophobicContact CZ-CB 4.23Å; F126-E160 HydrophobicContact CZ-CG 3.73Å; E160-S162 VanDerWaalsContact CG-OG 3.32Å; E160-S162 WeakPolarHBondContact CG-OG 3.36Å; E160-S162 PolarHBondContact O-N 3.29Å; E160-S162 PolarHBondContact OE1-OG 3.38Å; E160-Q163 HydrophobicContact CB-CB 4.4Å; E160-Q163 HydrophobicContact CB-CG 3.86Å; E160-Q163 PolarHBondContact O-N 3.49Å
161	P	91.7	Very high	89.7	Confident	14 Å²	14	33.1 Å²	33.1	9%	0.091	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.1	177.3	-23.3	35.5	0	0	0	114.8	D102 Y106 R108 T123	D102-P161 HydrophobicContact CB-CG 4.4Å; Y106-P161 HydrophobicContact CD1-CB 4.15Å; Y106-P161 HydrophobicContact CD2-CB 3.73Å; Y106-P161 HydrophobicContact CD2-CG 3.33Å; Y106-P161 HydrophobicContact CE1-CB 4.37Å; Y106-P161 HydrophobicContact CE2-CB 3.99Å; Y106-P161 HydrophobicContact CE2-CG 3.54Å; Y106-P161 HydrophobicContact CG-CB 3.81Å; Y106-P161 HydrophobicContact CG-CG 3.93Å; R108-P161 PolarHBondContact NH1-O 2.73Å; R108-P161 PolarHBondContact NH2-O 3.5Å; T123-P161 HydrophobicContact CG2-CG 4.35Å
162	S	90.3	Very high	87.9	Confident	81 Å²	81	35.9 Å²	35.9	57%	0.566	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-25.2	176.8	66.4	0	0	0	0	112.7	E160 R164	E160-S162 VanDerWaalsContact CG-OG 3.32Å; E160-S162 WeakPolarHBondContact CG-OG 3.36Å; E160-S162 PolarHBondContact O-N 3.29Å; E160-S162 PolarHBondContact OE1-OG 3.38Å; S162-R164 PolarHBondContact O-N 2.8Å
163	Q	90.8	Very high	85.8	Confident	33 Å²	33	38.7 Å²	38.7	15%	0.154	18%	0.181	C	C	.	.			trans	-70	132.4	-169	-81.4	166.9	-2.9	0	0	111.7	P158 E160 T210	P158-Q163 HydrophobicContact CB-CB 3.73Å; E160-Q163 HydrophobicContact CB-CB 4.4Å; E160-Q163 HydrophobicContact CB-CG 3.86Å; E160-Q163 PolarHBondContact O-N 3.49Å; Q163-T210 HydrophobicContact CG-CG2 4.44Å; Q163-T210 PolarHBondContact OE1-OG1 2.81Å
164	R	91.8	Very high	83.4	Confident	127 Å²	127	43.7 Å²	43.7	48%	0.479	21%	0.205	S	C	.	.			trans	-70.1	140.6	172	-72.4	-71.6	-179.1	148.5	1.1	110.4	S162 F245 T327	S162-R164 PolarHBondContact O-N 2.8Å; R164-F245 WeakPolarHBondContact CB-O 3.3Å; R164-T327 PolarHBondContact NH1-O 3.05Å
165	Y	93.4	Very high	80.9	Confident	45 Å²	45	44.9 Å²	44.9	18%	0.176	22%	0.216	C	C	.	.			trans	-153.4	159.3	179.3	73.2	-70	0	0	0	108.2	R108 L109 P158 A208	R108-Y165 WeakPolarHBondContact CA-OH 3.26Å; R108-Y165 HydrophobicContact CB-CE1 3.97Å; R108-Y165 HydrophobicContact CB-CE2 3.92Å; R108-Y165 HydrophobicContact CG-CE1 4.19Å; R108-Y165 PolarHBondContact O-OH 2.88Å; L109-Y165 HydrophobicContact CB-CE2 4.37Å; P158-Y165 HydrophobicContact CG-CD1 3.87Å; P158-Y165 HydrophobicContact CG-CG 3.99Å; Y165-A208 WeakPolarHBondContact CA-O 3.45Å
166	T	94.8	Very high	78.8	Confident	17 Å²	17	50 Å²	50	10%	0.104	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	160.6	166.4	-166.9	0	0	0	0	110.1	A208 F245 S247 S248 F268	T166-A208 HydrophobicContact CG2-CB 3.88Å; T166-A208 PolarHBondContact N-O 3.38Å; T166-A208 PolarHBondContact O-N 2.82Å; T166-F245 HydrophobicContact CG2-CB 4.31Å; T166-S247 VanDerWaalsContact OG1-C 3.28Å; T166-S247 VanDerWaalsContact OG1-CA 3.29Å; T166-S247 WeakPolarHBondContact OG1-CA 3.23Å; T166-S248 PolarHBondContact OG1-N 2.97Å; T166-S248 VanDerWaalsContact OG1-N 3.14Å; T166-S248 PolarHBondContact OG1-OG 2.98Å; T166-F268 HydrophobicContact CG2-CD1 4.14Å
167	A	93.6	Very high	76.5	Confident	17 Å²	17	51.3 Å²	51.3	14%	0.14	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	161.7	179.2	0	0	0	0	0	110.6	L109 L205 Y206 T207 S248	L109-A167 HydrophobicContact CD1-CB 3.25Å; A167-L205 HydrophobicContact CB-CD1 4.17Å; A167-Y206 CarbonylContact C-O 3.55Å; A167-Y206 WeakPolarHBondContact CA-O 3.5Å; A167-Y206 WeakPolarHBondContact CB-O 3.18Å; A167-T207 HydrophobicContact CB-CG2 3.72Å; A167-S248 PolarHBondContact N-OG 3.03Å; A167-S248 PolarHBondContact O-OG 3.3Å
168	V	91.7	Very high	74.2	Confident	21 Å²	21	55.2 Å²	55.2	13%	0.127	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	134.3	172.8	58.2	0	0	0	0	108.8	Y206 L250 I266	V168-Y206 PolarHBondContact N-O 3.21Å; V168-Y206 PolarHBondContact O-N 3.22Å; V168-L250 HydrophobicContact CG2-CB 4.02Å; V168-I266 HydrophobicContact CG1-CG2 3.74Å
169	M	88.4	Confident	71.7	Confident	13 Å²	13	58.6 Å²	58.6	6%	0.064	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.5	169.2	-166.2	161.8	-70.5	0	0	110.4	E111 Q113 L205	E111-M169 HydrophobicContact CB-CB 4.18Å; E111-M169 HydrophobicContact CB-CE 3.68Å; E111-M169 HydrophobicContact CB-SD 4.35Å; E111-M169 HydrophobicContact CG-CB 4.25Å; E111-M169 HydrophobicContact CG-CE 4.5Å; Q113-M169 HydrophobicContact CB-SD 4.46Å; Q113-M169 HydrophobicContact CG-SD 4.5Å; M169-L205 HydrophobicContact CB-CD1 4.46Å; M169-L205 HydrophobicContact CE-CB 4.13Å; M169-L205 HydrophobicContact CE-CD1 4.2Å
170	A	83.1	Confident	69.4	Low	2 Å²	2	60 Å²	60	2%	0.017	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	100.4	174.8	0	0	0	0	0	110	I204 Y206 L250 I266	A170-I204 PolarHBondContact N-O 3.29Å; A170-I204 PolarHBondContact O-N 3.42Å; A170-Y206 HydrophobicContact CB-CD2 4.12Å; A170-Y206 HydrophobicContact CB-CE2 3.82Å; A170-L250 HydrophobicContact CB-CD1 3.96Å; A170-L250 HydrophobicContact CB-CD2 3.73Å; A170-L250 HydrophobicContact CB-CG 4.4Å; A170-I266 HydrophobicContact CB-CD1 4.31Å
171	G	68.5	Low	67.1	Low	3 Å²	3	61.4 Å²	61.4	3%	0.031	33%	0.328	C	S	.	.			trans	-135.8	155.5	170.9	0	0	0	0	0	109.1	W173	G171-W173 VanDerWaalsContact O-CZ3 3.22Å; G171-W173 WeakPolarHBondContact O-CZ3 3.4Å
172	K	52.1	Low	64.9	Low	129 Å²	129	70.3 Å²	70.3	56%	0.561	36%	0.36	S	S	*	.			trans	-83.4	122.3	-179.2	-165.1	176.8	-174.7	176.9	0	109.6	E174 S201	K172-E174 PolarHBondContact O-N 2.92Å; K172-E174 VanDerWaalsContact O-N 3.11Å; K172-S201 WeakPolarHBondContact CA-OG 3.14Å; K172-S201 WeakPolarHBondContact CB-OG 3.39Å; K172-S201 PolarHBondContact N-OG 2.8Å; K172-S201 VanDerWaalsContact N-OG 3.09Å; K172-S201 PolarHBondContact O-N 3.38Å; K172-S201 VanDerWaalsContact O-N 3.11Å; K172-S201 PolarHBondContact O-OG 2.03Å
173	W	46.9	Very low	62.5	Low	127 Å²	127	70.9 Å²	70.9	48%	0.481	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-71.4	97.9	171.6	-58.6	-95.9	0	0	0	109.6	G171 N175 L250 E252	G171-W173 VanDerWaalsContact O-CZ3 3.22Å; G171-W173 WeakPolarHBondContact O-CZ3 3.4Å; W173-N175 PolarHBondContact O-N 2.84Å; W173-N175 VanDerWaalsContact O-N 3.17Å; W173-L250 HydrophobicContact CH2-CD2 3.96Å; W173-L250 HydrophobicContact CZ3-CD2 4.22Å; W173-E252 WeakPolarHBondContact CZ3-OE2 3.24Å
174	E	39.4	Very low	60.4	Low	105 Å²	105	74 Å²	74	49%	0.491	37%	0.373	S	S	.	.			trans	-79.4	102	175.4	-66.9	-160	152.8	0	0	110.2	K172 F176	K172-E174 PolarHBondContact O-N 2.92Å; K172-E174 VanDerWaalsContact O-N 3.11Å; E174-F176 VanDerWaalsContact C-N 3.33Å; E174-F176 HydrophobicContact CB-CD2 4.19Å; E174-F176 HydrophobicContact CB-CE2 4.03Å; E174-F176 WeakPolarHBondContact O-CD2 3.17Å; E174-F176 PolarHBondContact O-N 3.31Å
175	N	38.5	Very low	58.5	Low	128 Å²	128	72.2 Å²	72.2	68%	0.684	38%	0.38	S	S	*	.			trans	-65.4	89.7	169.4	-77.3	-34.4	0	0	0	110.1	W173 G177	W173-N175 PolarHBondContact O-N 2.84Å; W173-N175 VanDerWaalsContact O-N 3.17Å; N175-G177 PolarHBondContact O-N 2.92Å
176	F	41.5	Very low	56.2	Low	109 Å²	109	74 Å²	74	48%	0.478	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	14.5	174.8	-90.5	-85.9	0	0	0	115.2	E174 S178 V179 L180	E174-F176 VanDerWaalsContact C-N 3.33Å; E174-F176 HydrophobicContact CB-CD2 4.19Å; E174-F176 HydrophobicContact CB-CE2 4.03Å; E174-F176 WeakPolarHBondContact O-CD2 3.17Å; E174-F176 PolarHBondContact O-N 3.31Å; F176-S178 VanDerWaalsContact C-N 3.3Å; F176-S178 PolarHBondContact O-N 2.7Å; F176-V179 HydrophobicContact CD1-CB 4.16Å; F176-V179 HydrophobicContact CD1-CG2 3.98Å; F176-V179 HydrophobicContact CE1-CG2 4.3Å; F176-V179 PolarHBondContact O-N 3.03Å; F176-L180 WeakPolarHBondContact O-CG 3.45Å; F176-L180 PolarHBondContact O-N 2.95Å
177	G	39.8	Very low	53.9	Low	45 Å²	45	79.7 Å²	79.7	46%	0.464	42%	0.422	S	S	.	.	H	α-helix	trans	-61.4	-32.7	176.3	0	0	0	0	0	113.9	N175 S181	N175-G177 PolarHBondContact O-N 2.92Å; G177-S181 PolarHBondContact O-N 3.02Å
178	S	42.9	Very low	51.8	Low	83 Å²	83	83.8 Å²	83.8	58%	0.58	45%	0.447	S	S	*	.	H	α-helix	trans	-68.1	-42	179	56.6	0	0	0	0	112.8	F176 S181	F176-S178 VanDerWaalsContact C-N 3.3Å; F176-S178 PolarHBondContact O-N 2.7Å; S178-S181 WeakPolarHBondContact O-CB 3.4Å; S178-S181 PolarHBondContact O-N 2.92Å
179	V	40.8	Very low	49.6	Very low	71 Å²	71	87.8 Å²	87.8	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-70.6	-37.2	177.2	-176.2	0	0	0	0	111	F176 S181 W182 L183	F176-V179 HydrophobicContact CD1-CB 4.16Å; F176-V179 HydrophobicContact CD1-CG2 3.98Å; F176-V179 HydrophobicContact CE1-CG2 4.3Å; F176-V179 PolarHBondContact O-N 3.03Å; V179-S181 VanDerWaalsContact C-N 3.32Å; V179-S181 PolarHBondContact O-N 2.71Å; V179-W182 PolarHBondContact O-N 3.25Å; V179-L183 HydrophobicContact CG1-CD1 4.21Å; V179-L183 PolarHBondContact O-N 2.77Å
180	L	44.8	Very low	47.4	Very low	41 Å²	41	93.8 Å²	93.8	22%	0.215	51%	0.508	C	S	.	.	H	α-helix	trans	-67.9	-29.8	176	-72.6	168.4	0	0	0	112.9	F176 L183 N184 F196	F176-L180 WeakPolarHBondContact O-CG 3.45Å; F176-L180 PolarHBondContact O-N 2.95Å; L180-L183 PolarHBondContact O-N 3.49Å; L180-N184 VanDerWaalsContact O-CB 3.3Å; L180-N184 WeakPolarHBondContact O-CB 3Å; L180-N184 PolarHBondContact O-N 3.46Å; L180-N184 PolarHBondContact O-ND2 2.84Å; L180-N184 PolarHBondContact O-OD1 3.45Å; L180-F196 HydrophobicContact CD1-CE1 3.89Å; L180-F196 HydrophobicContact CD1-CZ 4.39Å
181	S	44.3	Very low	45.5	Very low	78 Å²	78	100.7 Å²	100.7	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-60.8	-43.8	171.4	-173.2	0	0	0	0	112.2	G177 S178 V179 S185	G177-S181 PolarHBondContact O-N 3.02Å; S178-S181 WeakPolarHBondContact O-CB 3.4Å; S178-S181 PolarHBondContact O-N 2.92Å; V179-S181 VanDerWaalsContact C-N 3.32Å; V179-S181 PolarHBondContact O-N 2.71Å; S181-S185 PolarHBondContact O-N 3.2Å; S181-S185 PolarHBondContact O-OG 2.82Å
182	W	44.7	Very low	44.1	Very low	202 Å²	202	109.7 Å²	109.7	77%	0.765	58%	0.578	S	S	*	*	H	α-helix	trans	-67.9	-38.9	175.3	-86.6	81	0	0	0	113.2	V179 S185	V179-W182 PolarHBondContact O-N 3.25Å; W182-S185 WeakPolarHBondContact CA-OG 2.99Å; W182-S185 PolarHBondContact O-N 3.14Å; W182-S185 PolarHBondContact O-OG 3.17Å
183	L	41.8	Very low	43.5	Very low	93 Å²	93	113.2 Å²	113.2	49%	0.487	59%	0.589	S	S	.	*	H	α-helix	trans	-71.6	-35	178	-70.7	169.5	0	0	0	112.7	V179 L180 S185 C186 F187	V179-L183 HydrophobicContact CG1-CD1 4.21Å; V179-L183 PolarHBondContact O-N 2.77Å; L180-L183 PolarHBondContact O-N 3.49Å; L183-S185 PolarHBondContact O-N 3.24Å; L183-C186 PolarHBondContact O-N 3.26Å; L183-C186 VanDerWaalsContact O-N 3.12Å; L183-F187 PolarHBondContact O-N 2.88Å; L183-F187 VanDerWaalsContact O-N 3.16Å
184	N	45	Very low	42.9	Very low	97 Å²	97	112.7 Å²	112.7	52%	0.519	59%	0.59	S	S	.	*	H	α-helix	trans	-66.3	-22.5	176.1	-73.3	-10.6	0	0	0	112.8	L180 K194	L180-N184 VanDerWaalsContact O-CB 3.3Å; L180-N184 WeakPolarHBondContact O-CB 3Å; L180-N184 PolarHBondContact O-N 3.46Å; L180-N184 PolarHBondContact O-ND2 2.84Å; L180-N184 PolarHBondContact O-OD1 3.45Å; N184-K194 PolarHBondContact OD1-NZ 3.3Å
185	S	51.6	Low	42.7	Very low	90 Å²	90	112 Å²	112	63%	0.629	60%	0.597	S	S	*	*	H	α-helix	trans	-82.4	-14.3	173.5	27.3	0	0	0	0	113.8	S181 W182 L183	S181-S185 PolarHBondContact O-N 3.2Å; S181-S185 PolarHBondContact O-OG 2.82Å; W182-S185 WeakPolarHBondContact CA-OG 2.99Å; W182-S185 PolarHBondContact O-N 3.14Å; W182-S185 PolarHBondContact O-OG 3.17Å; L183-S185 PolarHBondContact O-N 3.24Å
186	C	46.8	Very low	42.7	Very low	82 Å²	82	112.7 Å²	112.7	55%	0.554	59%	0.594	S	S	*	*	H	α-helix	trans	-102	-34.3	179.3	-76.7	0	0	0	0	115.1	L183	L183-C186 PolarHBondContact O-N 3.26Å; L183-C186 VanDerWaalsContact O-N 3.12Å
187	F	45.7	Very low	42.8	Very low	138 Å²	138	112.4 Å²	112.4	61%	0.605	59%	0.59	S	S	*	*			trans	-139.8	81.3	-173	-66.1	-77	0	0	0	113.6	L183 S189	L183-F187 PolarHBondContact O-N 2.88Å; L183-F187 VanDerWaalsContact O-N 3.16Å; F187-S189 PolarHBondContact O-N 3.35Å
188	P	50.6	Low	42.8	Very low	103 Å²	103	116.5 Å²	116.5	67%	0.669	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-7.3	-177.6	29	-35.7	0	0	0	114.9
189	S	45.4	Very low	42.6	Very low	104 Å²	104	116.9 Å²	116.9	73%	0.727	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-5.6	-173.3	50	0	0	0	0	115.6	F187 L191	F187-S189 PolarHBondContact O-N 3.35Å; S189-L191 PolarHBondContact O-N 3.33Å
190	L	40.6	Very low	42.5	Very low	139 Å²	139	114.2 Å²	114.2	73%	0.728	57%	0.571	S	S	*	*			trans	-96.7	60.9	176.8	-73.6	168.6	0	0	0	111.5
191	L	44.1	Very low	42.2	Very low	148 Å²	148	114 Å²	114	78%	0.775	57%	0.573	S	S	*	*			trans	-106.6	68.9	177.2	-93.1	167.3	0	0	0	111.7	S189	S189-L191 PolarHBondContact O-N 3.33Å
192	Y	38.7	Very low	42.8	Very low	191 Å²	191	115.5 Å²	115.5	75%	0.749	58%	0.575	S	S	*	*	S	Bend	trans	-155.2	134.4	156.8	-137.4	-112.4	0	0	0	109.2
193	Y	38.6	Very low	44.1	Very low	203 Å²	203	106.1 Å²	106.1	80%	0.796	54%	0.541	S	S	*	.			trans	65.9	75.9	-171.9	-45.9	-67.5	0	0	0	116.6
194	K	34.7	Very low	46.2	Very low	116 Å²	116	104.4 Å²	104.4	50%	0.504	53%	0.532	S	S	.	.			trans	-120.4	87.2	153.9	-87.2	178.8	177.1	166.8	0	109.8	N184	N184-K194 PolarHBondContact OD1-NZ 3.3Å
195	C	36	Very low	48.3	Very low	92 Å²	92	99.8 Å²	99.8	62%	0.622	51%	0.507	S	S	*	.			trans	-73.4	123.2	159.4	-66.1	0	0	0	0	107.8	Y197	C195-Y197 VanDerWaalsContact C-N 3.29Å; C195-Y197 HydrophobicContact CB-CD2 4.05Å; C195-Y197 HydrophobicContact CB-CE2 3.7Å; C195-Y197 WeakPolarHBondContact O-CD2 3.23Å; C195-Y197 PolarHBondContact O-N 3.08Å
196	F	39.3	Very low	50.3	Low	142 Å²	142	95.5 Å²	95.5	62%	0.623	48%	0.477	S	S	*	.			trans	-73.1	87.1	170.2	-82.5	-87.5	0	0	0	109.5	S54 L180 F198	S54-F196 PolarHBondContact OG-O 3.19Å; L180-F196 HydrophobicContact CD1-CE1 3.89Å; L180-F196 HydrophobicContact CD1-CZ 4.39Å; F196-F198 PolarHBondContact O-N 3.01Å
197	Y	42.2	Very low	52.6	Low	103 Å²	103	91.6 Å²	91.6	40%	0.404	45%	0.451	S	S	.	.			trans	-72.2	115.2	162.7	-68.1	-77.7	0	0	0	108.3	P136 C195 F199	P136-Y197 HydrophobicContact CG-CE1 4.07Å; C195-Y197 VanDerWaalsContact C-N 3.29Å; C195-Y197 HydrophobicContact CB-CD2 4.05Å; C195-Y197 HydrophobicContact CB-CE2 3.7Å; C195-Y197 WeakPolarHBondContact O-CD2 3.23Å; C195-Y197 PolarHBondContact O-N 3.08Å; Y197-F199 VanDerWaalsContact CB-CE2 3.49Å; Y197-F199 VanDerWaalsContact CB-CZ 3.42Å; Y197-F199 HydrophobicContact CD2-CZ 4.3Å; Y197-F199 HydrophobicContact CG-CE2 4.42Å; Y197-F199 AromaticContact CG-CZ 3.98Å; Y197-F199 HydrophobicContact CG-CZ 3.98Å; Y197-F199 WeakPolarHBondContact O-CD2 3.28Å; Y197-F199 PolarHBondContact O-N 3.46Å
198	F	39.3	Very low	55	Low	131 Å²	131	85 Å²	85	58%	0.575	42%	0.422	S	S	*	.			trans	-70.4	107.1	163.9	-82.3	-99.2	0	0	0	107.6	F196	F196-F198 PolarHBondContact O-N 3.01Å
199	F	39.6	Very low	57	Low	90 Å²	90	80.1 Å²	80.1	40%	0.395	39%	0.39	S	S	.	.			trans	-94.9	118	172.6	-63.6	-70.8	0	0	0	109.1	Y197	Y197-F199 VanDerWaalsContact CB-CE2 3.49Å; Y197-F199 VanDerWaalsContact CB-CZ 3.42Å; Y197-F199 HydrophobicContact CD2-CZ 4.3Å; Y197-F199 HydrophobicContact CG-CE2 4.42Å; Y197-F199 AromaticContact CG-CZ 3.98Å; Y197-F199 HydrophobicContact CG-CZ 3.98Å; Y197-F199 WeakPolarHBondContact O-CD2 3.28Å; Y197-F199 PolarHBondContact O-N 3.46Å
200	S	39.6	Very low	59.2	Low	15 Å²	15	75.4 Å²	75.4	11%	0.105	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-69.4	136.8	164	-173.9	0	0	0	0	108.9	K114	K114-S200 VanDerWaalsContact CG-O 3.31Å; K114-S200 WeakPolarHBondContact CG-O 3.19Å
201	S	37.8	Very low	61.4	Low	36 Å²	36	70.4 Å²	70.4	25%	0.252	33%	0.333	S	S	.	.	S	Bend	trans	-64.5	177.1	154.1	63	0	0	0	0	109.9	K172 G203	K172-S201 WeakPolarHBondContact CA-OG 3.14Å; K172-S201 WeakPolarHBondContact CB-OG 3.39Å; K172-S201 PolarHBondContact N-OG 2.8Å; K172-S201 VanDerWaalsContact N-OG 3.09Å; K172-S201 PolarHBondContact O-N 3.38Å; K172-S201 VanDerWaalsContact O-N 3.11Å; K172-S201 PolarHBondContact O-OG 2.03Å; S201-G203 PolarHBondContact O-N 3.1Å
202	D	57	Low	63.5	Low	110 Å²	110	65.2 Å²	65.2	59%	0.588	31%	0.307	S	S	*	.	S	Bend	trans	-45.5	98.1	-168.3	-77.6	-64.6	0	0	0	114.1	K114 I204	K114-D202 WeakPolarHBondContact CD-OD1 3.18Å; K114-D202 WeakPolarHBondContact CE-OD1 3.36Å; K114-D202 WeakPolarHBondContact CE-OD2 3.45Å; K114-D202 IonicContact NZ-OD1 2.7Å; K114-D202 PolarHBondContact NZ-OD1 3.4Å; K114-D202 IonicContact NZ-OD2 2.66Å; K114-D202 PolarHBondContact NZ-OD2 3.03Å; D202-I204 PolarHBondContact O-N 3.1Å; D202-I204 VanDerWaalsContact O-N 3.14Å
203	G	72.1	Confident	65.7	Low	6 Å²	6	59.5 Å²	59.5	6%	0.062	29%	0.286	C	S	.	.			trans	-75.6	101.5	-179.9	0	0	0	0	0	109.6	S201 L205	S201-G203 PolarHBondContact O-N 3.1Å; G203-L205 PolarHBondContact O-N 2.92Å
204	I	85.5	Confident	68	Low	57 Å²	57	56 Å²	56	29%	0.292	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	116.9	173.2	-61.7	-179.9	0	0	0	107.2	A170 D202 Y206 R222	A170-I204 PolarHBondContact N-O 3.29Å; A170-I204 PolarHBondContact O-N 3.42Å; D202-I204 PolarHBondContact O-N 3.1Å; D202-I204 VanDerWaalsContact O-N 3.14Å; I204-Y206 HydrophobicContact CB-CE2 3.76Å; I204-Y206 HydrophobicContact CG2-CD2 4Å; I204-Y206 HydrophobicContact CG2-CE2 3.33Å; I204-Y206 VanDerWaalsContact O-CD2 3.25Å; I204-Y206 WeakPolarHBondContact O-CD2 3.46Å; I204-Y206 WeakPolarHBondContact O-CE2 3.34Å; I204-R222 HydrophobicContact CG2-CG 3.43Å; I204-R222 VanDerWaalsContact CG2-CG 3.43Å
205	L	89.8	Confident	70.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	132.2	173.6	-174.8	64.6	0	0	0	110.4	L109 E111 Y119 A167 M169 G203 T207 R222 A223 T224	L109-L205 HydrophobicContact CD1-CD1 3.93Å; L109-L205 HydrophobicContact CD1-CD2 4.45Å; L109-L205 HydrophobicContact CD2-CD2 3.9Å; E111-L205 HydrophobicContact CG-CD1 3.98Å; Y119-L205 HydrophobicContact CD1-CD2 3.98Å; Y119-L205 HydrophobicContact CE1-CD2 3.92Å; A167-L205 HydrophobicContact CB-CD1 4.17Å; M169-L205 HydrophobicContact CB-CD1 4.46Å; M169-L205 HydrophobicContact CE-CB 4.13Å; M169-L205 HydrophobicContact CE-CD1 4.2Å; G203-L205 PolarHBondContact O-N 2.92Å; L205-T207 HydrophobicContact CD1-CG2 4.36Å; L205-T207 HydrophobicContact CD2-CG2 3.78Å; L205-T207 HydrophobicContact CG-CG2 3.82Å; L205-R222 CarbonylContact O-C 3.54Å; L205-A223 HydrophobicContact CB-CB 4.12Å; L205-A223 HydrophobicContact CD2-CB 3.84Å; L205-A223 HydrophobicContact CG-CB 3.94Å; L205-A223 PolarHBondContact O-N 3.19Å; L205-T224 WeakPolarHBondContact CB-OG1 3.42Å
206	Y	93.4	Very high	72.8	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.5	167.4	-60.8	-110.6	0	0	0	108.6	A167 V168 A170 I204 S221 R222 I266 K291 W304	A167-Y206 CarbonylContact C-O 3.55Å; A167-Y206 WeakPolarHBondContact CA-O 3.5Å; A167-Y206 WeakPolarHBondContact CB-O 3.18Å; V168-Y206 PolarHBondContact N-O 3.21Å; V168-Y206 PolarHBondContact O-N 3.22Å; A170-Y206 HydrophobicContact CB-CD2 4.12Å; A170-Y206 HydrophobicContact CB-CE2 3.82Å; I204-Y206 HydrophobicContact CB-CE2 3.76Å; I204-Y206 HydrophobicContact CG2-CD2 4Å; I204-Y206 HydrophobicContact CG2-CE2 3.33Å; I204-Y206 VanDerWaalsContact O-CD2 3.25Å; I204-Y206 WeakPolarHBondContact O-CD2 3.46Å; I204-Y206 WeakPolarHBondContact O-CE2 3.34Å; Y206-S221 CarbonylContact C-O 3.51Å; Y206-S221 VanDerWaalsContact CA-O 3.29Å; Y206-S221 WeakPolarHBondContact CA-O 3.45Å; Y206-R222 HydrophobicContact CD1-CB 4.44Å; Y206-R222 HydrophobicContact CE1-CB 4.35Å; Y206-I266 HydrophobicContact CD1-CD1 3.5Å; Y206-I266 HydrophobicContact CD2-CD1 3.39Å; Y206-I266 HydrophobicContact CE1-CD1 3.56Å; Y206-I266 HydrophobicContact CE2-CD1 3.5Å; Y206-I266 VanDerWaalsContact CE2-CD1 3.5Å; Y206-I266 HydrophobicContact CG-CD1 3.43Å; Y206-I266 VanDerWaalsContact CG-CD1 3.43Å; Y206-K291 PolarHBondContact OH-O 3.28Å; Y206-W304 AromaticContact CD1-CH2 3.84Å; Y206-W304 HydrophobicContact CD1-CH2 3.84Å; Y206-W304 HydrophobicContact CD1-CZ2 4.29Å; Y206-W304 AromaticContact CE1-CH2 3.64Å; Y206-W304 HydrophobicContact CE1-CH2 3.64Å; Y206-W304 HydrophobicContact CE1-CZ3 4.34Å
207	T	94.8	Very high	75.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	148.9	-174.7	53.2	0	0	0	0	111.2	G155 K156 A167 L205 I220 S221 A223	G155-T207 PolarHBondContact O-OG1 2.83Å; K156-T207 HydrophobicContact CB-CG2 4.42Å; K156-T207 WeakPolarHBondContact O-CG2 3.36Å; A167-T207 HydrophobicContact CB-CG2 3.72Å; L205-T207 HydrophobicContact CD1-CG2 4.36Å; L205-T207 HydrophobicContact CD2-CG2 3.78Å; L205-T207 HydrophobicContact CG-CG2 3.82Å; T207-I220 CarbonylContact O-C 3.35Å; T207-I220 WeakPolarHBondContact O-CA 3.39Å; T207-S221 PolarHBondContact N-O 2.83Å; T207-S221 PolarHBondContact O-N 3.35Å; T207-S221 PolarHBondContact OG1-OG 2.82Å; T207-A223 HydrophobicContact CG2-CB 3.83Å; T207-A223 WeakPolarHBondContact OG1-CB 3.19Å
208	A	95.1	Very high	77.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	107.6	167.5	0	0	0	0	0	108.4	Y165 T166 D219 I220 F245 F268	Y165-A208 WeakPolarHBondContact CA-O 3.45Å; T166-A208 HydrophobicContact CG2-CB 3.88Å; T166-A208 PolarHBondContact N-O 3.38Å; T166-A208 PolarHBondContact O-N 2.82Å; A208-D219 WeakPolarHBondContact CA-O 3.4Å; A208-I220 HydrophobicContact CB-CB 4.45Å; A208-I220 HydrophobicContact CB-CD1 4.29Å; A208-I220 HydrophobicContact CB-CG1 3.78Å; A208-I220 HydrophobicContact CB-CG2 4.42Å; A208-F245 HydrophobicContact CB-CD1 3.59Å; A208-F245 HydrophobicContact CB-CD2 4.25Å; A208-F245 HydrophobicContact CB-CE1 3.75Å; A208-F245 HydrophobicContact CB-CE2 4.36Å; A208-F245 HydrophobicContact CB-CG 3.86Å; A208-F245 HydrophobicContact CB-CZ 4.13Å; A208-F245 WeakPolarHBondContact O-CD2 3.19Å; A208-F268 HydrophobicContact CB-CD1 3.71Å; A208-F268 HydrophobicContact CB-CE1 3.98Å
209	A	93.1	Very high	80.1	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	170.8	-170.3	0	0	0	0	0	112.7	D219	A209-D219 PolarHBondContact N-O 2.81Å; A209-D219 PolarHBondContact O-N 3.21Å
210	T	91	Very high	82.7	Confident	4 Å²	4	32.7 Å²	32.7	3%	0.025	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	136.5	167.2	52.1	0	0	0	0	110.7	Q163 S217 Y218	Q163-T210 HydrophobicContact CG-CG2 4.44Å; Q163-T210 PolarHBondContact OE1-OG1 2.81Å; T210-S217 CarbonylContact C-O 3.58Å; T210-S217 WeakPolarHBondContact CA-O 3.44Å; T210-Y218 HydrophobicContact CG2-CD1 4.02Å; T210-Y218 HydrophobicContact CG2-CE1 3.87Å
211	S	87	Confident	85.3	Confident	34 Å²	34	32 Å²	32	24%	0.238	18%	0.177	C	C	.	.			trans	-103.2	-12	-177.9	48.8	0	0	0	0	113.7	S217	S211-S217 PolarHBondContact N-O 2.9Å; S211-S217 PolarHBondContact OG-O 2.96Å; S211-S217 PolarHBondContact OG-OG 2.75Å
212	N	88.4	Confident	87.8	Confident	39 Å²	39	31.6 Å²	31.6	21%	0.209	17%	0.17	C	C	.	.	S	Bend	trans	-124.5	161.5	178.6	71.7	-2.8	0	0	0	113.8	F159 L214 G215 T216 S217	F159-N212 VanDerWaalsContact CD2-O 3.24Å; F159-N212 WeakPolarHBondContact CD2-O 3.26Å; F159-N212 VanDerWaalsContact CE2-C 3.44Å; N212-L214 PolarHBondContact O-N 2.84Å; N212-G215 PolarHBondContact O-N 2.91Å; N212-G215 WeakPolarHBondContact OD1-CA 3.44Å; N212-G215 PolarHBondContact OD1-N 3.24Å; N212-T216 PolarHBondContact ND2-OG1 3.38Å; N212-T216 PolarHBondContact OD1-N 3.49Å; N212-S217 VanDerWaalsContact CB-OG 3.23Å; N212-S217 WeakPolarHBondContact CB-OG 3.4Å; N212-S217 PolarHBondContact N-OG 2.86Å; N212-S217 PolarHBondContact ND2-N 2.92Å; N212-S217 PolarHBondContact ND2-OG 2.99Å; N212-S217 PolarHBondContact OD1-N 2.88Å; N212-S217 VanDerWaalsContact OD1-N 3.12Å; N212-S217 PolarHBondContact OD1-OG 2.69Å
213	F	85.6	Confident	89	Confident	71 Å²	71	26.6 Å²	26.6	31%	0.311	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.7	178.6	176.7	-89	0	0	0	113.7	K96 F126 F159 G215	K96-F213 HydrophobicContact CB-CZ 4.44Å; K96-F213 HydrophobicContact CD-CE2 4.4Å; K96-F213 HydrophobicContact CD-CZ 4.23Å; F126-F213 HydrophobicContact CB-CD2 3.83Å; F126-F213 HydrophobicContact CB-CE2 3.46Å; F126-F213 VanDerWaalsContact CB-CE2 3.46Å; F126-F213 HydrophobicContact CB-CZ 4.49Å; F126-F213 HydrophobicContact CD1-CE2 4.3Å; F126-F213 HydrophobicContact CG-CE2 4.13Å; F159-F213 HydrophobicContact CD1-CB 4.04Å; F159-F213 HydrophobicContact CD1-CD2 4.13Å; F159-F213 HydrophobicContact CE1-CB 4Å; F213-G215 VanDerWaalsContact C-N 3.31Å
214	L	86.3	Confident	89.2	Confident	131 Å²	131	28 Å²	28	69%	0.686	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-12.8	-179.5	-62.6	176.9	0	0	0	113.2	N212 T216	N212-L214 PolarHBondContact O-N 2.84Å; L214-T216 HydrophobicContact CB-CG2 4.15Å; L214-T216 PolarHBondContact O-N 3.44Å
215	G	84.6	Confident	88.5	Confident	7 Å²	7	28 Å²	28	7%	0.072	17%	0.166	C	C	.	.	S	Bend	trans	74.1	6.9	-174.3	0	0	0	0	0	114.9	N212 F213 Y218	N212-G215 PolarHBondContact O-N 2.91Å; N212-G215 WeakPolarHBondContact OD1-CA 3.44Å; N212-G215 PolarHBondContact OD1-N 3.24Å; F213-G215 VanDerWaalsContact C-N 3.31Å; G215-Y218 VanDerWaalsContact O-CZ 3.32Å; G215-Y218 PolarHBondContact O-OH 3.16Å
216	T	87.2	Confident	87.5	Confident	95 Å²	95	31.1 Å²	31.1	58%	0.583	19%	0.186	S	C	*	.			trans	-94.1	-11.3	-174	58.2	0	0	0	0	114.6	N212 L214	N212-T216 PolarHBondContact ND2-OG1 3.38Å; N212-T216 PolarHBondContact OD1-N 3.49Å; L214-T216 HydrophobicContact CB-CG2 4.15Å; L214-T216 PolarHBondContact O-N 3.44Å
217	S	89.1	Confident	86.5	Confident	23 Å²	23	38.7 Å²	38.7	16%	0.161	22%	0.221	C	C	.	.			trans	-112.3	122.5	175.5	70.4	0	0	0	0	111.2	T210 S211 N212	T210-S217 CarbonylContact C-O 3.58Å; T210-S217 WeakPolarHBondContact CA-O 3.44Å; S211-S217 PolarHBondContact N-O 2.9Å; S211-S217 PolarHBondContact OG-O 2.96Å; S211-S217 PolarHBondContact OG-OG 2.75Å; N212-S217 VanDerWaalsContact CB-OG 3.23Å; N212-S217 WeakPolarHBondContact CB-OG 3.4Å; N212-S217 PolarHBondContact N-OG 2.86Å; N212-S217 PolarHBondContact ND2-N 2.92Å; N212-S217 PolarHBondContact ND2-OG 2.99Å; N212-S217 PolarHBondContact OD1-N 2.88Å; N212-S217 VanDerWaalsContact OD1-N 3.12Å; N212-S217 PolarHBondContact OD1-OG 2.69Å
218	Y	92.3	Very high	85.3	Confident	51 Å²	51	44.5 Å²	44.5	20%	0.2	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	140.9	-175.5	-55.9	-81.2	0	0	0	110.2	T210 G215 D242 P243 F245	T210-Y218 HydrophobicContact CG2-CD1 4.02Å; T210-Y218 HydrophobicContact CG2-CE1 3.87Å; G215-Y218 VanDerWaalsContact O-CZ 3.32Å; G215-Y218 PolarHBondContact O-OH 3.16Å; Y218-D242 PolarHBondContact OH-OD1 3.09Å; Y218-P243 HydrophobicContact CD1-CG 3.76Å; Y218-P243 HydrophobicContact CD2-CG 4.16Å; Y218-P243 HydrophobicContact CE1-CG 4.4Å; Y218-P243 HydrophobicContact CG-CG 3.61Å; Y218-F245 HydrophobicContact CD1-CE2 4.16Å
219	D	91.9	Very high	84.2	Confident	8 Å²	8	50.3 Å²	50.3	4%	0.043	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	126.1	-178.3	-169.6	11.6	0	0	0	110.9	A208 A209 S221 R230 R232 T233	A208-D219 WeakPolarHBondContact CA-O 3.4Å; A209-D219 PolarHBondContact N-O 2.81Å; A209-D219 PolarHBondContact O-N 3.21Å; D219-S221 WeakPolarHBondContact OD2-CB 3.43Å; D219-R230 IonicContact OD2-CZ 3.11Å; D219-R230 IonicContact OD2-NE 3.01Å; D219-R230 IonicContact OD2-NH2 3.27Å; D219-R230 PolarHBondContact OD2-NH2 3.47Å; D219-R232 WeakPolarHBondContact OD1-CB 3.46Å; D219-T233 PolarHBondContact OD1-N 3.48Å; D219-T233 PolarHBondContact OD1-OG1 3.03Å
220	I	95.6	Very high	83.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	119	159.9	-54.2	-173.5	0	0	0	107.1	T207 A208 R232 T233 L240 F245 F268 F270 V287 W304 F307	T207-I220 CarbonylContact O-C 3.35Å; T207-I220 WeakPolarHBondContact O-CA 3.39Å; A208-I220 HydrophobicContact CB-CB 4.45Å; A208-I220 HydrophobicContact CB-CD1 4.29Å; A208-I220 HydrophobicContact CB-CG1 3.78Å; A208-I220 HydrophobicContact CB-CG2 4.42Å; I220-R232 CarbonylContact O-C 3.47Å; I220-R232 WeakPolarHBondContact O-CA 3.36Å; I220-T233 HydrophobicContact CB-CG2 3.76Å; I220-T233 HydrophobicContact CG1-CG2 4.33Å; I220-T233 PolarHBondContact N-OG1 2.94Å; I220-T233 PolarHBondContact O-N 3.43Å; I220-T233 VanDerWaalsContact O-N 3.09Å; I220-L240 HydrophobicContact CD1-CD2 4.27Å; I220-L240 HydrophobicContact CG1-CD1 4.23Å; I220-F245 HydrophobicContact CD1-CE1 4Å; I220-F245 HydrophobicContact CG1-CE1 3.9Å; I220-F245 HydrophobicContact CG1-CZ 4.21Å; I220-F268 HydrophobicContact CD1-CB 4.01Å; I220-F268 HydrophobicContact CD1-CD2 4.47Å; I220-F268 HydrophobicContact CD1-CG 4.1Å; I220-F268 HydrophobicContact CG2-CD1 4.07Å; I220-F268 HydrophobicContact CG2-CD2 3.69Å; I220-F268 HydrophobicContact CG2-CE1 3.92Å; I220-F268 HydrophobicContact CG2-CE2 3.51Å; I220-F268 HydrophobicContact CG2-CG 3.97Å; I220-F268 HydrophobicContact CG2-CZ 3.65Å; I220-F270 HydrophobicContact CD1-CE1 4.21Å; I220-V287 HydrophobicContact CD1-CG1 4.46Å; I220-W304 PolarHBondContact O-NE1 2.91Å; I220-F307 HydrophobicContact CD1-CE2 4.33Å
221	S	93.3	Very high	83.9	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	156.8	-164.4	67.9	0	0	0	0	114.8	G155 Y206 T207 D219 A223 R230 V231	G155-S221 PolarHBondContact O-OG 3.38Å; Y206-S221 CarbonylContact C-O 3.51Å; Y206-S221 VanDerWaalsContact CA-O 3.29Å; Y206-S221 WeakPolarHBondContact CA-O 3.45Å; T207-S221 PolarHBondContact N-O 2.83Å; T207-S221 PolarHBondContact O-N 3.35Å; T207-S221 PolarHBondContact OG1-OG 2.82Å; D219-S221 WeakPolarHBondContact OD2-CB 3.43Å; S221-A223 PolarHBondContact O-N 3.42Å; S221-R230 VanDerWaalsContact OG-CZ 3.26Å; S221-R230 PolarHBondContact OG-NH2 3.49Å; S221-V231 CarbonylContact C-O 3.27Å; S221-V231 VanDerWaalsContact CA-O 3.25Å; S221-V231 WeakPolarHBondContact CA-O 3.42Å; S221-V231 WeakPolarHBondContact CB-O 3.22Å
222	R	91.3	Very high	84.2	Confident	27 Å²	27	54.5 Å²	54.5	10%	0.102	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	104.5	160.4	-178.3	164	68.3	-148.5	5.2	108.4	I204 L205 Y206 E229 R230 V231 D293 W304	I204-R222 HydrophobicContact CG2-CG 3.43Å; I204-R222 VanDerWaalsContact CG2-CG 3.43Å; L205-R222 CarbonylContact O-C 3.54Å; Y206-R222 HydrophobicContact CD1-CB 4.44Å; Y206-R222 HydrophobicContact CE1-CB 4.35Å; R222-E229 PolarHBondContact NH2-O 3.27Å; R222-R230 WeakPolarHBondContact O-CG 3.4Å; R222-V231 PolarHBondContact N-O 2.82Å; R222-D293 PolarHBondContact NH1-O 3.26Å; R222-W304 HydrophobicContact CB-CH2 4.03Å; R222-W304 HydrophobicContact CB-CZ2 4.39Å
223	A	82.6	Confident	84.5	Confident	6 Å²	6	52.7 Å²	52.7	5%	0.05	28%	0.276	C	S	.	.			trans	-84.7	-29.7	-169.9	0	0	0	0	0	114.6	K156 L205 T207 S221	K156-A223 HydrophobicContact CB-CB 4.31Å; K156-A223 HydrophobicContact CD-CB 4.33Å; K156-A223 VanDerWaalsContact CE-O 3.26Å; K156-A223 WeakPolarHBondContact CE-O 3.32Å; K156-A223 HydrophobicContact CG-CB 3.91Å; L205-A223 HydrophobicContact CB-CB 4.12Å; L205-A223 HydrophobicContact CD2-CB 3.84Å; L205-A223 HydrophobicContact CG-CB 3.94Å; L205-A223 PolarHBondContact O-N 3.19Å; T207-A223 HydrophobicContact CG2-CB 3.83Å; T207-A223 WeakPolarHBondContact OG1-CB 3.19Å; S221-A223 PolarHBondContact O-N 3.42Å
224	T	76.5	Confident	84.8	Confident	36 Å²	36	50.7 Å²	50.7	22%	0.221	27%	0.269	C	S	.	.	S	Bend	trans	-99.2	142	178.5	-60.5	0	0	0	0	111.3	L205	L205-T224 WeakPolarHBondContact CB-OG1 3.42Å
225	G	69.9	Low	84.9	Confident	57 Å²	57	50.2 Å²	50.2	59%	0.588	26%	0.263	S	S	*	.	S	Bend	trans	123.7	178.9	-177.8	0	0	0	0	0	111.9
226	P	68.9	Low	85	Confident	64 Å²	64	51.9 Å²	51.9	42%	0.416	27%	0.274	S	S	.	.			trans	-58.3	138.1	172.5	-21.6	33.4	0	0	0	111.1	Q228 E229 R230	P226-Q228 PolarHBondContact O-N 2.84Å; P226-Q228 VanDerWaalsContact O-N 3.13Å; P226-E229 HydrophobicContact CB-CB 4.41Å; P226-E229 HydrophobicContact CB-CG 4.31Å; P226-E229 HydrophobicContact CG-CG 4.49Å; P226-E229 PolarHBondContact O-N 3.35Å; P226-R230 PolarHBondContact O-N 3.36Å
227	E	71.3	Confident	85.1	Confident	159 Å²	159	51.3 Å²	51.3	74%	0.743	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-59.2	-29.4	179.3	-172.1	177	-170	0	0	112	E229 R230	E227-E229 PolarHBondContact O-N 2.84Å; E227-R230 PolarHBondContact O-N 2.86Å
228	Q	69.6	Low	85.1	Confident	123 Å²	123	51.9 Å²	51.9	58%	0.575	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-68.6	-12.3	175.7	-59.5	79.6	4.8	0	0	113.7	P226 R302	P226-Q228 PolarHBondContact O-N 2.84Å; P226-Q228 VanDerWaalsContact O-N 3.13Å; Q228-R302 PolarHBondContact O-NE 3.46Å; Q228-R302 PolarHBondContact O-NH2 2.86Å
229	E	73.8	Confident	85.2	Confident	121 Å²	121	49.4 Å²	49.4	57%	0.565	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-120.1	3.5	-178.5	-63.6	176.9	-168.7	0	0	112.7	R222 P226 E227 V231	R222-E229 PolarHBondContact NH2-O 3.27Å; P226-E229 HydrophobicContact CB-CB 4.41Å; P226-E229 HydrophobicContact CB-CG 4.31Å; P226-E229 HydrophobicContact CG-CG 4.49Å; P226-E229 PolarHBondContact O-N 3.35Å; E227-E229 PolarHBondContact O-N 2.84Å; E229-V231 PolarHBondContact O-N 3.4Å
230	R	85.4	Confident	85.3	Confident	43 Å²	43	49.8 Å²	49.8	16%	0.162	26%	0.259	C	S	.	.			trans	-65.4	119.5	175	169.7	159.6	175.2	140.8	-0.8	110.6	G155 D219 S221 R222 P226 E227	G155-R230 PolarHBondContact O-NH2 3.3Å; D219-R230 IonicContact OD2-CZ 3.11Å; D219-R230 IonicContact OD2-NE 3.01Å; D219-R230 IonicContact OD2-NH2 3.27Å; D219-R230 PolarHBondContact OD2-NH2 3.47Å; S221-R230 VanDerWaalsContact OG-CZ 3.26Å; S221-R230 PolarHBondContact OG-NH2 3.49Å; R222-R230 WeakPolarHBondContact O-CG 3.4Å; P226-R230 PolarHBondContact O-N 3.36Å; E227-R230 PolarHBondContact O-N 2.86Å
231	V	91.8	Very high	85.2	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	27%	0.268	C	S	.	.			trans	-94.2	136.8	171.2	-173.4	0	0	0	0	108.8	S221 R222 E229 R302 R303 W304	S221-V231 CarbonylContact C-O 3.27Å; S221-V231 VanDerWaalsContact CA-O 3.25Å; S221-V231 WeakPolarHBondContact CA-O 3.42Å; S221-V231 WeakPolarHBondContact CB-O 3.22Å; R222-V231 PolarHBondContact N-O 2.82Å; E229-V231 PolarHBondContact O-N 3.4Å; V231-R302 WeakPolarHBondContact CA-O 3.31Å; V231-R303 VanDerWaalsContact CG1-C 3.5Å; V231-W304 HydrophobicContact CB-CD2 4.43Å; V231-W304 HydrophobicContact CB-CE3 4.26Å; V231-W304 HydrophobicContact CB-CH2 4.06Å; V231-W304 HydrophobicContact CB-CZ2 4.27Å; V231-W304 HydrophobicContact CB-CZ3 4.07Å; V231-W304 HydrophobicContact CG1-CD2 3.51Å; V231-W304 HydrophobicContact CG1-CE3 3.48Å; V231-W304 VanDerWaalsContact CG1-CE3 3.48Å; V231-W304 HydrophobicContact CG1-CG 4.01Å; V231-W304 HydrophobicContact CG1-CH2 4.14Å; V231-W304 HydrophobicContact CG1-CZ2 4.21Å; V231-W304 HydrophobicContact CG1-CZ3 3.8Å
232	R	93.1	Very high	85.2	Confident	82 Å²	82	55 Å²	55	31%	0.309	29%	0.287	S	S	.	.	B	Isolated β-bridge	trans	-144	169.3	-173.7	54.9	176.4	-172.8	108.2	-5.4	113.1	D219 I220 R302 R303 W304	D219-R232 WeakPolarHBondContact OD1-CB 3.46Å; I220-R232 CarbonylContact O-C 3.47Å; I220-R232 WeakPolarHBondContact O-CA 3.36Å; R232-R302 WeakPolarHBondContact CG-O 3.45Å; R232-R302 PolarHBondContact N-O 3.17Å; R232-R302 VanDerWaalsContact N-O 3.1Å; R232-R303 WeakPolarHBondContact O-CA 3.46Å; R232-W304 PolarHBondContact O-N 2.87Å
233	T	94.9	Very high	85.3	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	28%	0.284	C	S	.	.			trans	-69.4	159.3	174.3	42.4	0	0	0	0	112.4	D219 I220 W239 L240 R303 F307	D219-T233 PolarHBondContact OD1-N 3.48Å; D219-T233 PolarHBondContact OD1-OG1 3.03Å; I220-T233 HydrophobicContact CB-CG2 3.76Å; I220-T233 HydrophobicContact CG1-CG2 4.33Å; I220-T233 PolarHBondContact N-OG1 2.94Å; I220-T233 PolarHBondContact O-N 3.43Å; I220-T233 VanDerWaalsContact O-N 3.09Å; T233-W239 HydrophobicContact CG2-CE3 3.8Å; T233-W239 HydrophobicContact CG2-CZ3 4.08Å; T233-L240 HydrophobicContact CG2-CD1 4.23Å; T233-R303 PolarHBondContact O-NH1 2.8Å; T233-F307 HydrophobicContact CG2-CD2 3.86Å; T233-F307 HydrophobicContact CG2-CE2 3.62Å; T233-F307 HydrophobicContact CG2-CZ 4.38Å
234	D	92	Very high	85.9	Confident	29 Å²	29	56.9 Å²	56.9	16%	0.155	30%	0.297	C	S	.	.			trans	-67.8	153.9	162	-163.2	68.7	0	0	0	110.9	S236 W239 R303	D234-S236 VanDerWaalsContact C-N 3.3Å; D234-S236 WeakPolarHBondContact OD2-CB 3.49Å; D234-S236 PolarHBondContact OD2-N 2.88Å; D234-W239 HydrophobicContact CB-CD2 3.67Å; D234-W239 HydrophobicContact CB-CE3 4.15Å; D234-W239 HydrophobicContact CB-CG 3.96Å; D234-W239 HydrophobicContact CB-CH2 4.48Å; D234-W239 HydrophobicContact CB-CZ2 4.06Å; D234-W239 VanDerWaalsContact N-CE3 3.32Å; D234-R303 VanDerWaalsContact OD1-CD 3.28Å; D234-R303 WeakPolarHBondContact OD1-CD 3.16Å; D234-R303 IonicContact OD1-CZ 3.01Å; D234-R303 IonicContact OD1-NE 3.5Å; D234-R303 PolarHBondContact OD1-NE 2.96Å; D234-R303 IonicContact OD1-NH1 2.67Å; D234-R303 IonicContact OD1-NH2 3.54Å; D234-R303 PolarHBondContact OD1-NH2 3.28Å
235	Q	87.3	Confident	86.9	Confident	122 Å²	122	55.3 Å²	55.3	57%	0.57	29%	0.287	S	S	*	.	S	Bend	trans	-90.9	6.2	-179	-75.4	172.7	-62	0	0	112.8
236	S	88.3	Confident	88.1	Confident	42 Å²	42	53.2 Å²	53.2	29%	0.294	26%	0.263	S	S	.	.	S	Bend	trans	-69	138.6	171.2	178.7	0	0	0	0	112.8	D234 N238 W239 L240	D234-S236 VanDerWaalsContact C-N 3.3Å; D234-S236 WeakPolarHBondContact OD2-CB 3.49Å; D234-S236 PolarHBondContact OD2-N 2.88Å; S236-N238 PolarHBondContact O-N 3.32Å; S236-N238 VanDerWaalsContact O-N 3.08Å; S236-N238 PolarHBondContact OG-N 3.01Å; S236-W239 WeakPolarHBondContact O-CB 3.04Å; S236-W239 PolarHBondContact O-N 2.91Å; S236-L240 PolarHBondContact O-N 2.04Å
237	I	88.4	Confident	89.4	Confident	82 Å²	82	51.2 Å²	51.2	42%	0.421	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-22.6	171.1	-163.6	170.7	0	0	0	113.6	W239 N241 K275	I237-W239 PolarHBondContact O-N 3.14Å; I237-N241 WeakPolarHBondContact CD1-OD1 3.13Å; I237-N241 HydrophobicContact CG1-CB 3.72Å; I237-N241 VanDerWaalsContact CG1-CG 3.43Å; I237-N241 WeakPolarHBondContact CG1-OD1 3.49Å; I237-K275 HydrophobicContact CG2-CD 4.45Å
238	N	88.9	Confident	90.6	Very high	35 Å²	35	44.4 Å²	44.4	19%	0.187	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-27.9	175	-69.6	-0.3	0	0	0	111.9	S236 K275 K309 P428	S236-N238 PolarHBondContact O-N 3.32Å; S236-N238 VanDerWaalsContact O-N 3.08Å; S236-N238 PolarHBondContact OG-N 3.01Å; N238-K275 PolarHBondContact OD1-NZ 3.19Å; N238-K309 VanDerWaalsContact O-CE 3.25Å; N238-K309 WeakPolarHBondContact O-CE 3.3Å; N238-K309 PolarHBondContact O-NZ 3.24Å; N238-K309 VanDerWaalsContact O-NZ 3.09Å; N238-P428 HydrophobicContact CB-CG 4.49Å; N238-P428 WeakPolarHBondContact O-CG 3.41Å
239	W	93.6	Very high	91.7	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-54.6	-179.6	-77.7	52.4	0	0	0	111.6	T233 D234 S236 I237 L300 W304 F307 K309 R425 P428	T233-W239 HydrophobicContact CG2-CE3 3.8Å; T233-W239 HydrophobicContact CG2-CZ3 4.08Å; D234-W239 HydrophobicContact CB-CD2 3.67Å; D234-W239 HydrophobicContact CB-CE3 4.15Å; D234-W239 HydrophobicContact CB-CG 3.96Å; D234-W239 HydrophobicContact CB-CH2 4.48Å; D234-W239 HydrophobicContact CB-CZ2 4.06Å; D234-W239 VanDerWaalsContact N-CE3 3.32Å; S236-W239 WeakPolarHBondContact O-CB 3.04Å; S236-W239 PolarHBondContact O-N 2.91Å; I237-W239 PolarHBondContact O-N 3.14Å; W239-L300 HydrophobicContact CH2-CD2 4.27Å; W239-L300 HydrophobicContact CZ2-CD2 4.01Å; W239-W304 HydrophobicContact CH2-CB 4.26Å; W239-W304 WeakPolarHBondContact CH2-O 3.05Å; W239-W304 HydrophobicContact CZ3-CB 4.14Å; W239-F307 HydrophobicContact CB-CE1 4.36Å; W239-F307 HydrophobicContact CD2-CD1 4.04Å; W239-F307 HydrophobicContact CD2-CE1 4.13Å; W239-F307 HydrophobicContact CE3-CB 4.3Å; W239-F307 AromaticContact CE3-CD1 3.59Å; W239-F307 HydrophobicContact CE3-CD1 3.59Å; W239-F307 HydrophobicContact CE3-CD2 4.07Å; W239-F307 AromaticContact CE3-CE1 3.81Å; W239-F307 HydrophobicContact CE3-CE1 3.81Å; W239-F307 HydrophobicContact CE3-CE2 4.24Å; W239-F307 AromaticContact CE3-CG 3.74Å; W239-F307 HydrophobicContact CE3-CG 3.74Å; W239-F307 HydrophobicContact CE3-CZ 4.13Å; W239-F307 HydrophobicContact CG-CE1 4.38Å; W239-F307 HydrophobicContact CH2-CB 3.95Å; W239-F307 HydrophobicContact CH2-CD1 4.4Å; W239-F307 HydrophobicContact CH2-CG 4.28Å; W239-F307 HydrophobicContact CZ3-CB 3.61Å; W239-F307 AromaticContact CZ3-CD1 3.8Å; W239-F307 HydrophobicContact CZ3-CD1 3.8Å; W239-F307 HydrophobicContact CZ3-CD2 4.02Å; W239-F307 HydrophobicContact CZ3-CE1 4.46Å; W239-F307 AromaticContact CZ3-CG 3.55Å; W239-F307 HydrophobicContact CZ3-CG 3.55Å; W239-K309 WeakPolarHBondContact O-CE 3.43Å; W239-K309 PolarHBondContact O-NZ 3.49Å; W239-R425 PolarHBondContact NE1-O 2.82Å; W239-P428 HydrophobicContact CG-CG 4.45Å
240	L	94.4	Very high	92.6	Very high	15 Å²	15	34.6 Å²	34.6	8%	0.079	18%	0.176	C	C	.	.			trans	-138.2	127.3	-179.9	-64.8	174.9	0	0	0	109.4	I220 T233 S236 P243 F245 F270 F307	I220-L240 HydrophobicContact CD1-CD2 4.27Å; I220-L240 HydrophobicContact CG1-CD1 4.23Å; T233-L240 HydrophobicContact CG2-CD1 4.23Å; S236-L240 PolarHBondContact O-N 2.04Å; L240-P243 HydrophobicContact CB-CG 4.12Å; L240-P243 HydrophobicContact CD2-CB 4.48Å; L240-P243 HydrophobicContact CD2-CG 4.31Å; L240-F245 HydrophobicContact CD1-CZ 4.42Å; L240-F270 HydrophobicContact CD2-CE1 4.31Å; L240-F270 HydrophobicContact CD2-CE2 3.94Å; L240-F270 HydrophobicContact CD2-CZ 3.68Å; L240-F307 HydrophobicContact CD2-CZ 4.37Å
241	N	93.5	Very high	92.9	Very high	35 Å²	35	32.6 Å²	32.6	19%	0.187	17%	0.169	C	C	.	.	S	Bend	trans	-126.2	95.8	178.4	-173.6	23.6	0	0	0	111.5	I237 E272 M273	I237-N241 WeakPolarHBondContact CD1-OD1 3.13Å; I237-N241 HydrophobicContact CG1-CB 3.72Å; I237-N241 VanDerWaalsContact CG1-CG 3.43Å; I237-N241 WeakPolarHBondContact CG1-OD1 3.49Å; N241-E272 PolarHBondContact N-OE2 2.83Å; N241-E272 WeakPolarHBondContact O-CB 3.43Å; N241-M273 WeakPolarHBondContact CB-O 3.48Å; N241-M273 WeakPolarHBondContact ND2-CB 3.47Å; N241-M273 PolarHBondContact ND2-O 3.13Å; N241-M273 PolarHBondContact O-N 3.05Å
242	D	93.1	Very high	92.7	Very high	74 Å²	74	35.5 Å²	35.5	40%	0.396	18%	0.182	S	C	.	.	S	Bend	trans	49.3	55.4	-175.9	-156.7	45.1	0	0	0	114.3	Y218 M273	Y218-D242 PolarHBondContact OH-OD1 3.09Å; D242-M273 HydrophobicContact CB-CG 4.03Å
243	P	95.2	Very high	92.1	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.032	18%	0.177	C	C	.	.			trans	-76.8	128.9	-175.7	33.4	-38.8	0	0	0	114.1	Y218 L240 F245 F270 T271 E272	Y218-P243 HydrophobicContact CD1-CG 3.76Å; Y218-P243 HydrophobicContact CD2-CG 4.16Å; Y218-P243 HydrophobicContact CE1-CG 4.4Å; Y218-P243 HydrophobicContact CG-CG 3.61Å; L240-P243 HydrophobicContact CB-CG 4.12Å; L240-P243 HydrophobicContact CD2-CB 4.48Å; L240-P243 HydrophobicContact CD2-CG 4.31Å; P243-F245 HydrophobicContact CB-CD1 4.44Å; P243-F245 HydrophobicContact CB-CE1 3.95Å; P243-F245 HydrophobicContact CB-CZ 4.1Å; P243-F245 HydrophobicContact CG-CE1 3.98Å; P243-F245 HydrophobicContact CG-CE2 4.15Å; P243-F245 HydrophobicContact CG-CZ 3.62Å; P243-F270 HydrophobicContact CB-CB 4.45Å; P243-F270 HydrophobicContact CB-CD2 3.62Å; P243-F270 HydrophobicContact CB-CE2 4.12Å; P243-F270 HydrophobicContact CB-CG 4.24Å; P243-T271 CarbonylContact C-O 3.54Å; P243-T271 WeakPolarHBondContact CA-O 3.47Å; P243-E272 HydrophobicContact CB-CB 4.38Å
244	E	95	Very high	90.9	Very high	69 Å²	69	34.7 Å²	34.7	32%	0.322	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	101.6	162.7	-68.1	178.4	-148.9	0	0	109.8	F270 T271 K282	E244-F270 CarbonylContact O-C 3.41Å; E244-F270 WeakPolarHBondContact O-CA 3.42Å; E244-F270 VanDerWaalsContact O-CB 3.25Å; E244-F270 WeakPolarHBondContact O-CB 3.38Å; E244-T271 PolarHBondContact N-O 2.94Å; E244-T271 PolarHBondContact O-N 3.27Å; E244-K282 IonicContact OE1-NZ 3.84Å; E244-K282 PolarHBondContact OE1-NZ 2.83Å
245	F	96.3	Very high	89.7	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.009	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	137.2	-179.3	-60	-62.6	0	0	0	113.1	R164 T166 A208 Y218 I220 L240 P243 F270	R164-F245 WeakPolarHBondContact CB-O 3.3Å; T166-F245 HydrophobicContact CG2-CB 4.31Å; A208-F245 HydrophobicContact CB-CD1 3.59Å; A208-F245 HydrophobicContact CB-CD2 4.25Å; A208-F245 HydrophobicContact CB-CE1 3.75Å; A208-F245 HydrophobicContact CB-CE2 4.36Å; A208-F245 HydrophobicContact CB-CG 3.86Å; A208-F245 HydrophobicContact CB-CZ 4.13Å; A208-F245 WeakPolarHBondContact O-CD2 3.19Å; Y218-F245 HydrophobicContact CD1-CE2 4.16Å; I220-F245 HydrophobicContact CD1-CE1 4Å; I220-F245 HydrophobicContact CG1-CE1 3.9Å; I220-F245 HydrophobicContact CG1-CZ 4.21Å; L240-F245 HydrophobicContact CD1-CZ 4.42Å; P243-F245 HydrophobicContact CB-CD1 4.44Å; P243-F245 HydrophobicContact CB-CE1 3.95Å; P243-F245 HydrophobicContact CB-CZ 4.1Å; P243-F245 HydrophobicContact CG-CE1 3.98Å; P243-F245 HydrophobicContact CG-CE2 4.15Å; P243-F245 HydrophobicContact CG-CZ 3.62Å; F245-F270 HydrophobicContact CD1-CB 3.83Å; F245-F270 HydrophobicContact CD1-CD1 4.34Å; F245-F270 HydrophobicContact CD1-CG 4.22Å; F245-F270 HydrophobicContact CE1-CB 4.47Å; F245-F270 HydrophobicContact CE1-CD1 4.44Å; F245-F270 HydrophobicContact CE1-CG 4.42Å
246	V	95.8	Very high	88.5	Confident	14 Å²	14	40.8 Å²	40.8	9%	0.085	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	-58	-173.9	177.2	0	0	0	0	112.2	F269 L326 V329	V246-F269 WeakPolarHBondContact CB-O 3.32Å; V246-F269 PolarHBondContact N-O 3.07Å; V246-L326 HydrophobicContact CB-CD2 4.19Å; V246-L326 HydrophobicContact CB-CG 4.45Å; V246-L326 HydrophobicContact CG1-CD2 4.3Å; V246-L326 HydrophobicContact CG1-CG 4.2Å; V246-L326 HydrophobicContact CG2-CB 4.38Å; V246-L326 HydrophobicContact CG2-CD2 4.09Å; V246-L326 HydrophobicContact CG2-CG 4.1Å; V246-L326 VanDerWaalsContact CG2-O 3.3Å; V246-L326 WeakPolarHBondContact CG2-O 3.36Å; V246-V329 HydrophobicContact CG1-CG2 4.28Å
247	S	95.4	Very high	87.3	Confident	21 Å²	21	41.6 Å²	41.6	15%	0.147	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	158.5	-170.5	-171.1	0	0	0	0	110.9	T166 F269 V329	T166-S247 VanDerWaalsContact OG1-C 3.28Å; T166-S247 VanDerWaalsContact OG1-CA 3.29Å; T166-S247 WeakPolarHBondContact OG1-CA 3.23Å; S247-F269 PolarHBondContact N-O 3.46Å; S247-F269 PolarHBondContact O-N 3.18Å; S247-V329 PolarHBondContact OG-O 2.62Å; S247-V329 VanDerWaalsContact OG-O 3.1Å
248	S	95.9	Very high	86.6	Confident	16 Å²	16	39.1 Å²	39.1	11%	0.112	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	144.4	173.2	50.6	0	0	0	0	111.4	T166 A167 Y267	T166-S248 PolarHBondContact OG1-N 2.97Å; T166-S248 VanDerWaalsContact OG1-N 3.14Å; T166-S248 PolarHBondContact OG1-OG 2.98Å; A167-S248 PolarHBondContact N-OG 3.03Å; A167-S248 PolarHBondContact O-OG 3.3Å; S248-Y267 CarbonylContact C-O 3.53Å; S248-Y267 WeakPolarHBondContact CA-O 3.46Å; S248-Y267 WeakPolarHBondContact CB-O 3.44Å
249	A	94.4	Very high	85.8	Confident	9 Å²	9	43.2 Å²	43.2	7%	0.074	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	132.7	-176.7	0	0	0	0	0	111.1	I266 Y267 T331 F344	A249-I266 WeakPolarHBondContact O-CA 3.26Å; A249-Y267 PolarHBondContact N-O 3.09Å; A249-Y267 PolarHBondContact O-N 2.83Å; A249-T331 HydrophobicContact CB-CG2 4.24Å; A249-T331 WeakPolarHBondContact CB-OG1 3.16Å; A249-F344 HydrophobicContact CB-CE1 4.13Å
250	L	92.6	Very high	85	Confident	29 Å²	29	47 Å²	47	15%	0.152	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	126.5	166.9	174.7	69.2	0	0	0	109	V168 A170 W173 E252 D264 I266	V168-L250 HydrophobicContact CG2-CB 4.02Å; A170-L250 HydrophobicContact CB-CD1 3.96Å; A170-L250 HydrophobicContact CB-CD2 3.73Å; A170-L250 HydrophobicContact CB-CG 4.4Å; W173-L250 HydrophobicContact CH2-CD2 3.96Å; W173-L250 HydrophobicContact CZ3-CD2 4.22Å; L250-E252 HydrophobicContact CD1-CG 4.4Å; L250-E252 HydrophobicContact CD2-CG 3.77Å; L250-E252 HydrophobicContact CG-CG 3.89Å; L250-D264 HydrophobicContact CD1-CB 4.34Å; L250-I266 HydrophobicContact CD1-CD1 4.35Å; L250-I266 HydrophobicContact CD1-CG1 3.68Å
251	I	91.3	Very high	84.2	Confident	2 Å²	2	47 Å²	47	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	102.5	171.2	-52.8	-58.1	0	0	0	107.7	K265 Y267 T331 P339 T342 F344 L365	I251-K265 PolarHBondContact N-O 2.96Å; I251-K265 PolarHBondContact O-N 3.1Å; I251-Y267 HydrophobicContact CB-CD2 4.43Å; I251-Y267 HydrophobicContact CB-CE2 4.2Å; I251-Y267 HydrophobicContact CG1-CD2 3.7Å; I251-Y267 HydrophobicContact CG1-CE2 3.81Å; I251-T331 HydrophobicContact CD1-CG2 4.17Å; I251-P339 HydrophobicContact CG2-CB 3.79Å; I251-T342 HydrophobicContact CD1-CG2 3.8Å; I251-F344 HydrophobicContact CD1-CE1 4.45Å; I251-F344 HydrophobicContact CD1-CZ 4.25Å; I251-F344 HydrophobicContact CG1-CZ 4.35Å; I251-L365 HydrophobicContact CG2-CD2 3.94Å
252	E	86.5	Confident	83.8	Confident	61 Å²	61	47.6 Å²	47.6	29%	0.285	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-78.8	146.4	174.7	-60.4	-157.9	126.8	0	0	111.4	W173 L250 D264 K291	W173-E252 WeakPolarHBondContact CZ3-OE2 3.24Å; L250-E252 HydrophobicContact CD1-CG 4.4Å; L250-E252 HydrophobicContact CD2-CG 3.77Å; L250-E252 HydrophobicContact CG-CG 3.89Å; E252-D264 VanDerWaalsContact CA-OD1 3.26Å; E252-D264 WeakPolarHBondContact CA-OD1 3.45Å; E252-K291 IonicContact OE1-NZ 2.99Å; E252-K291 PolarHBondContact OE1-NZ 2.89Å; E252-K291 VanDerWaalsContact OE1-NZ 3.11Å
253	Q	81.8	Confident	83.4	Confident	43 Å²	43	45.3 Å²	45.3	20%	0.201	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-86.8	121.8	173.2	-61.5	-62.3	-36.2	0	0	109.8	N258 D264	Q253-N258 HydrophobicContact CB-CB 4.18Å; Q253-N258 VanDerWaalsContact CB-ND2 3.3Å; Q253-N258 WeakPolarHBondContact CB-ND2 3Å; Q253-D264 PolarHBondContact N-OD1 3.41Å
254	A	69.7	Low	83.2	Confident	24 Å²	24	46.3 Å²	46.3	20%	0.198	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-68.7	139.2	178.7	0	0	0	0	0	111	D256 S257 N258 G337	A254-D256 VanDerWaalsContact C-N 3.3Å; A254-D256 PolarHBondContact O-N 2.75Å; A254-S257 PolarHBondContact O-N 2.83Å; A254-S257 PolarHBondContact O-OG 2.9Å; A254-N258 VanDerWaalsContact O-CB 3.22Å; A254-N258 WeakPolarHBondContact O-CB 3.4Å; A254-N258 PolarHBondContact O-N 3.37Å; A254-G337 WeakPolarHBondContact CB-O 3.47Å
255	P	65.9	Low	83.1	Confident	113 Å²	113	43.8 Å²	43.8	73%	0.734	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-58.4	-40.6	-175.2	-25.2	34.4	0	0	0	113.4
256	D	62.4	Low	83.1	Confident	166 Å²	166	43.7 Å²	43.7	89%	0.888	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-77.2	-22.6	-175.2	-53.9	-44.7	0	0	0	112.6	A254	A254-D256 VanDerWaalsContact C-N 3.3Å; A254-D256 PolarHBondContact O-N 2.75Å
257	S	63.6	Low	83.1	Confident	59 Å²	59	43 Å²	43	41%	0.413	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-100.8	3.7	179.7	80	0	0	0	0	113.9	A254 P259	A254-S257 PolarHBondContact O-N 2.83Å; A254-S257 PolarHBondContact O-OG 2.9Å; S257-P259 WeakPolarHBondContact O-CD 3.5Å
258	N	73.4	Confident	83.3	Confident	30 Å²	30	42 Å²	42	16%	0.16	25%	0.251	C	S	.	.			trans	-117.1	62.7	-173.8	-171.9	8.7	0	0	0	113.1	Q253 A254 T260 G261 D262	Q253-N258 HydrophobicContact CB-CB 4.18Å; Q253-N258 VanDerWaalsContact CB-ND2 3.3Å; Q253-N258 WeakPolarHBondContact CB-ND2 3Å; A254-N258 VanDerWaalsContact O-CB 3.22Å; A254-N258 WeakPolarHBondContact O-CB 3.4Å; A254-N258 PolarHBondContact O-N 3.37Å; N258-T260 PolarHBondContact O-N 2.92Å; N258-T260 PolarHBondContact OD1-OG1 2.73Å; N258-G261 PolarHBondContact O-N 2.84Å; N258-G261 WeakPolarHBondContact OD1-CA 3.39Å; N258-G261 PolarHBondContact OD1-N 3.16Å; N258-D262 PolarHBondContact ND2-N 2.04Å; N258-D262 PolarHBondContact ND2-O 2.8Å; N258-D262 PolarHBondContact OD1-N 2.79Å
259	P	73	Confident	83.4	Confident	120 Å²	120	41.3 Å²	41.3	78%	0.779	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.1	178.3	29.5	-36.3	0	0	0	112.8	S257	S257-P259 WeakPolarHBondContact O-CD 3.5Å
260	T	74.8	Confident	83.5	Confident	80 Å²	80	40.9 Å²	40.9	49%	0.491	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-15.4	178.8	44.7	0	0	0	0	113.6	N258 D262 N403	N258-T260 PolarHBondContact O-N 2.92Å; N258-T260 PolarHBondContact OD1-OG1 2.73Å; T260-D262 VanDerWaalsContact C-N 3.28Å; T260-D262 PolarHBondContact O-N 2.88Å; T260-N403 WeakPolarHBondContact O-CB 3.39Å; T260-N403 PolarHBondContact O-N 2.91Å
261	G	79	Confident	83.7	Confident	16 Å²	16	39.6 Å²	39.6	17%	0.165	24%	0.235	C	C	.	.			trans	58.8	40.3	-172.4	0	0	0	0	0	112.8	N258 N402 N403	N258-G261 PolarHBondContact O-N 2.84Å; N258-G261 WeakPolarHBondContact OD1-CA 3.39Å; N258-G261 PolarHBondContact OD1-N 3.16Å; G261-N402 WeakPolarHBondContact O-CA 3.35Å; G261-N403 WeakPolarHBondContact CA-ND2 3.46Å
262	D	83.8	Confident	83.9	Confident	47 Å²	47	39.6 Å²	39.6	25%	0.251	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-69.4	154.9	172.6	-168.1	9.7	0	0	0	110.8	N258 T260 K265 C400	N258-D262 PolarHBondContact ND2-N 2.04Å; N258-D262 PolarHBondContact ND2-O 2.8Å; N258-D262 PolarHBondContact OD1-N 2.79Å; T260-D262 VanDerWaalsContact C-N 3.28Å; T260-D262 PolarHBondContact O-N 2.88Å; D262-K265 IonicContact OD1-NZ 3.46Å; D262-K265 PolarHBondContact OD1-NZ 3Å; D262-K265 IonicContact OD2-NZ 3.82Å; D262-K265 PolarHBondContact OD2-NZ 2.81Å; D262-C400 WeakPolarHBondContact OD1-CB 3.42Å
263	D	86.6	Confident	84.2	Confident	25 Å²	25	38.3 Å²	38.3	13%	0.134	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-88.1	156.8	-173.6	-171	34.8	0	0	0	112.5	K265 C290 K291 S292 C400	D263-K265 PolarHBondContact O-NZ 2.82Å; D263-C290 VanDerWaalsContact OD2-CB 3.31Å; D263-C290 WeakPolarHBondContact OD2-CB 3.19Å; D263-K291 PolarHBondContact OD2-N 2.82Å; D263-S292 WeakPolarHBondContact OD2-CB 3.42Å; D263-S292 PolarHBondContact OD2-N 3.3Å; D263-S292 PolarHBondContact OD2-OG 2.91Å; D263-C400 HydrophobicContact CB-CB 3.89Å
264	D	90.6	Very high	84.5	Confident	27 Å²	27	36.7 Å²	36.7	14%	0.144	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-64.4	143.9	171.7	-58.7	-36.4	0	0	0	110.2	L250 E252 Q253 K291	L250-D264 HydrophobicContact CD1-CB 4.34Å; E252-D264 VanDerWaalsContact CA-OD1 3.26Å; E252-D264 WeakPolarHBondContact CA-OD1 3.45Å; Q253-D264 PolarHBondContact N-OD1 3.41Å; D264-K291 HydrophobicContact CB-CB 3.94Å; D264-K291 HydrophobicContact CB-CD 3.52Å; D264-K291 HydrophobicContact CB-CG 4.44Å; D264-K291 WeakPolarHBondContact O-CB 3.42Å; D264-K291 PolarHBondContact O-N 2.95Å; D264-K291 WeakPolarHBondContact OD2-CD 3.42Å; D264-K291 WeakPolarHBondContact OD2-CE 3.45Å; D264-K291 IonicContact OD2-NZ 3.95Å; D264-K291 PolarHBondContact OD2-NZ 2.8Å
265	K	92.6	Very high	85	Confident	15 Å²	15	40.2 Å²	40.2	7%	0.065	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.8	-172.5	-70.9	160.8	-175.1	70.5	0	110.5	I251 D262 D263 Y267 R288 V289 C400	I251-K265 PolarHBondContact N-O 2.96Å; I251-K265 PolarHBondContact O-N 3.1Å; D262-K265 IonicContact OD1-NZ 3.46Å; D262-K265 PolarHBondContact OD1-NZ 3Å; D262-K265 IonicContact OD2-NZ 3.82Å; D262-K265 PolarHBondContact OD2-NZ 2.81Å; D263-K265 PolarHBondContact O-NZ 2.82Å; K265-Y267 HydrophobicContact CB-CD2 4.37Å; K265-Y267 HydrophobicContact CB-CE2 3.6Å; K265-R288 HydrophobicContact CG-CG 4.46Å; K265-V289 WeakPolarHBondContact CA-O 3.03Å; K265-C400 VanDerWaalsContact CE-SG 3.57Å
266	I	95.4	Very high	85.7	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.2	175.2	-55.5	172.4	0	0	0	108	V168 A170 Y206 A249 L250 F268 V289	V168-I266 HydrophobicContact CG1-CG2 3.74Å; A170-I266 HydrophobicContact CB-CD1 4.31Å; Y206-I266 HydrophobicContact CD1-CD1 3.5Å; Y206-I266 HydrophobicContact CD2-CD1 3.39Å; Y206-I266 HydrophobicContact CE1-CD1 3.56Å; Y206-I266 HydrophobicContact CE2-CD1 3.5Å; Y206-I266 VanDerWaalsContact CE2-CD1 3.5Å; Y206-I266 HydrophobicContact CG-CD1 3.43Å; Y206-I266 VanDerWaalsContact CG-CD1 3.43Å; A249-I266 WeakPolarHBondContact O-CA 3.26Å; L250-I266 HydrophobicContact CD1-CD1 4.35Å; L250-I266 HydrophobicContact CD1-CG1 3.68Å; I266-F268 HydrophobicContact CB-CE2 4.22Å; I266-F268 HydrophobicContact CG2-CD2 4.17Å; I266-F268 HydrophobicContact CG2-CE2 3.46Å; I266-F268 VanDerWaalsContact CG2-CE2 3.46Å; I266-F268 HydrophobicContact CG2-CZ 3.67Å; I266-V289 HydrophobicContact CB-CG2 3.94Å; I266-V289 PolarHBondContact N-O 2.69Å; I266-V289 PolarHBondContact O-N 3.04Å
267	Y	97.3	Very high	86.3	Confident	1 Å²	1	32.2 Å²	32.2	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	134.7	179.4	-67.9	-92.4	0	0	0	110.1	S248 A249 I251 K265 V286 V287 R288 F344 L365 I368	S248-Y267 CarbonylContact C-O 3.53Å; S248-Y267 WeakPolarHBondContact CA-O 3.46Å; S248-Y267 WeakPolarHBondContact CB-O 3.44Å; A249-Y267 PolarHBondContact N-O 3.09Å; A249-Y267 PolarHBondContact O-N 2.83Å; I251-Y267 HydrophobicContact CB-CD2 4.43Å; I251-Y267 HydrophobicContact CB-CE2 4.2Å; I251-Y267 HydrophobicContact CG1-CD2 3.7Å; I251-Y267 HydrophobicContact CG1-CE2 3.81Å; K265-Y267 HydrophobicContact CB-CD2 4.37Å; K265-Y267 HydrophobicContact CB-CE2 3.6Å; Y267-V286 HydrophobicContact CD1-CG2 3.77Å; Y267-V287 CarbonylContact C-O 3.58Å; Y267-V287 VanDerWaalsContact CA-O 3.23Å; Y267-V287 WeakPolarHBondContact CA-O 3.08Å; Y267-R288 HydrophobicContact CD1-CB 4.32Å; Y267-R288 HydrophobicContact CE1-CB 3.97Å; Y267-R288 HydrophobicContact CE1-CG 3.95Å; Y267-F344 HydrophobicContact CD2-CZ 4.46Å; Y267-F344 HydrophobicContact CG-CZ 4.43Å; Y267-L365 HydrophobicContact CE1-CD1 4.17Å; Y267-L365 HydrophobicContact CE2-CD1 3.82Å; Y267-L365 WeakPolarHBondContact OH-CD1 3.49Å; Y267-I368 HydrophobicContact CE1-CG2 3.99Å
268	F	98.1	Very high	86.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.9	175.5	-67.3	-88.4	0	0	0	109.9	T166 A208 I220 I266 V286 V287 V289	T166-F268 HydrophobicContact CG2-CD1 4.14Å; A208-F268 HydrophobicContact CB-CD1 3.71Å; A208-F268 HydrophobicContact CB-CE1 3.98Å; I220-F268 HydrophobicContact CD1-CB 4.01Å; I220-F268 HydrophobicContact CD1-CD2 4.47Å; I220-F268 HydrophobicContact CD1-CG 4.1Å; I220-F268 HydrophobicContact CG2-CD1 4.07Å; I220-F268 HydrophobicContact CG2-CD2 3.69Å; I220-F268 HydrophobicContact CG2-CE1 3.92Å; I220-F268 HydrophobicContact CG2-CE2 3.51Å; I220-F268 HydrophobicContact CG2-CG 3.97Å; I220-F268 HydrophobicContact CG2-CZ 3.65Å; I266-F268 HydrophobicContact CB-CE2 4.22Å; I266-F268 HydrophobicContact CG2-CD2 4.17Å; I266-F268 HydrophobicContact CG2-CE2 3.46Å; I266-F268 VanDerWaalsContact CG2-CE2 3.46Å; I266-F268 HydrophobicContact CG2-CZ 3.67Å; F268-V286 CarbonylContact O-C 3.54Å; F268-V286 WeakPolarHBondContact O-CA 3.42Å; F268-V287 HydrophobicContact CB-CB 4.21Å; F268-V287 HydrophobicContact CB-CG1 4.43Å; F268-V287 HydrophobicContact CD2-CG1 4.28Å; F268-V287 PolarHBondContact N-O 2.81Å; F268-V287 PolarHBondContact O-N 2.92Å; F268-V289 HydrophobicContact CE2-CG2 3.94Å
269	F	98.4	Very high	85.8	Confident	1 Å²	1	42.6 Å²	42.6	0%	0.004	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.3	-178.1	-60.5	-84.9	0	0	0	110	V246 S247 R285 V286 L312 L326 V329 F344	V246-F269 WeakPolarHBondContact CB-O 3.32Å; V246-F269 PolarHBondContact N-O 3.07Å; S247-F269 PolarHBondContact N-O 3.46Å; S247-F269 PolarHBondContact O-N 3.18Å; F269-R285 WeakPolarHBondContact CA-O 3.32Å; F269-V286 HydrophobicContact CD1-CB 4Å; F269-V286 HydrophobicContact CD1-CG2 4.03Å; F269-V286 HydrophobicContact CE1-CB 3.8Å; F269-V286 HydrophobicContact CE1-CG2 3.5Å; F269-V286 HydrophobicContact CZ-CG2 3.93Å; F269-L312 HydrophobicContact CD1-CD1 4.01Å; F269-L312 HydrophobicContact CE1-CD1 4.29Å; F269-L326 HydrophobicContact CB-CD2 3.89Å; F269-V329 HydrophobicContact CB-CG2 3.89Å; F269-V329 HydrophobicContact CD1-CG1 4.5Å; F269-V329 HydrophobicContact CD1-CG2 4.21Å; F269-V329 HydrophobicContact CD2-CB 4.41Å; F269-V329 HydrophobicContact CD2-CG1 4.18Å; F269-V329 HydrophobicContact CD2-CG2 4.48Å; F269-V329 HydrophobicContact CE2-CG1 4.25Å; F269-V329 HydrophobicContact CG-CB 4.37Å; F269-V329 HydrophobicContact CG-CG1 4.32Å; F269-V329 HydrophobicContact CG-CG2 3.95Å; F269-V329 HydrophobicContact CZ-CG1 4.44Å; F269-F344 HydrophobicContact CE1-CD1 4.39Å; F269-F344 HydrophobicContact CE1-CG 4.32Å; F269-F344 AromaticContact CE2-CD1 3.81Å; F269-F344 HydrophobicContact CE2-CD1 3.81Å; F269-F344 AromaticContact CE2-CE1 3.95Å; F269-F344 HydrophobicContact CE2-CE1 3.95Å; F269-F344 HydrophobicContact CZ-CB 4.27Å; F269-F344 AromaticContact CZ-CD1 3.4Å; F269-F344 HydrophobicContact CZ-CD1 3.4Å; F269-F344 VanDerWaalsContact CZ-CD1 3.4Å; F269-F344 HydrophobicContact CZ-CD2 4.23Å; F269-F344 AromaticContact CZ-CE1 3.68Å; F269-F344 HydrophobicContact CZ-CE1 3.68Å; F269-F344 HydrophobicContact CZ-CE2 4.45Å; F269-F344 AromaticContact CZ-CG 3.7Å; F269-F344 HydrophobicContact CZ-CG 3.7Å; F269-F344 HydrophobicContact CZ-CZ 4.19Å
270	F	97.7	Very high	86	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	164.4	-177.9	57.7	-87.8	0	0	0	111.7	I220 L240 P243 E244 F245 E272 P284 R285 V287	I220-F270 HydrophobicContact CD1-CE1 4.21Å; L240-F270 HydrophobicContact CD2-CE1 4.31Å; L240-F270 HydrophobicContact CD2-CE2 3.94Å; L240-F270 HydrophobicContact CD2-CZ 3.68Å; P243-F270 HydrophobicContact CB-CB 4.45Å; P243-F270 HydrophobicContact CB-CD2 3.62Å; P243-F270 HydrophobicContact CB-CE2 4.12Å; P243-F270 HydrophobicContact CB-CG 4.24Å; E244-F270 CarbonylContact O-C 3.41Å; E244-F270 WeakPolarHBondContact O-CA 3.42Å; E244-F270 VanDerWaalsContact O-CB 3.25Å; E244-F270 WeakPolarHBondContact O-CB 3.38Å; F245-F270 HydrophobicContact CD1-CB 3.83Å; F245-F270 HydrophobicContact CD1-CD1 4.34Å; F245-F270 HydrophobicContact CD1-CG 4.22Å; F245-F270 HydrophobicContact CE1-CB 4.47Å; F245-F270 HydrophobicContact CE1-CD1 4.44Å; F245-F270 HydrophobicContact CE1-CG 4.42Å; F270-E272 HydrophobicContact CD2-CB 3.98Å; F270-E272 HydrophobicContact CE2-CB 3.91Å; F270-E272 HydrophobicContact CE2-CG 4.12Å; F270-P284 CarbonylContact O-C 3.54Å; F270-P284 WeakPolarHBondContact O-CA 3.15Å; F270-R285 HydrophobicContact CD1-CB 4.47Å; F270-R285 HydrophobicContact CD2-CB 4.09Å; F270-R285 HydrophobicContact CD2-CG 4.35Å; F270-R285 HydrophobicContact CE1-CB 4.16Å; F270-R285 HydrophobicContact CE2-CB 3.76Å; F270-R285 HydrophobicContact CE2-CG 3.86Å; F270-R285 HydrophobicContact CG-CB 4.44Å; F270-R285 HydrophobicContact CZ-CB 3.79Å; F270-R285 HydrophobicContact CZ-CG 4.24Å; F270-R285 PolarHBondContact N-O 3.38Å; F270-R285 PolarHBondContact O-N 2.85Å; F270-V287 HydrophobicContact CE1-CB 4.02Å; F270-V287 HydrophobicContact CE1-CG2 3.5Å; F270-V287 VanDerWaalsContact CE1-CG2 3.5Å; F270-V287 HydrophobicContact CZ-CG2 3.75Å
271	T	96.8	Very high	86.5	Confident	1 Å²	1	44 Å²	44	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.7	169	-54.9	0	0	0	0	108.6	P243 E244 K282 V283 I325 L326	P243-T271 CarbonylContact C-O 3.54Å; P243-T271 WeakPolarHBondContact CA-O 3.47Å; E244-T271 PolarHBondContact N-O 2.94Å; E244-T271 PolarHBondContact O-N 3.27Å; T271-K282 HydrophobicContact CG2-CB 3.7Å; T271-K282 HydrophobicContact CG2-CD 4.42Å; T271-K282 HydrophobicContact CG2-CG 4.36Å; T271-V283 WeakPolarHBondContact CA-O 3.5Å; T271-I325 HydrophobicContact CG2-CD1 4.03Å; T271-L326 PolarHBondContact OG1-N 3.32Å; T271-L326 PolarHBondContact OG1-O 3.2Å
272	E	94.9	Very high	87.2	Confident	3 Å²	3	45.6 Å²	45.6	1%	0.014	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	166.2	178.2	75.9	173	172.9	0	0	111.7	N241 P243 F270 A274 K282 V283 R285 K309	N241-E272 PolarHBondContact N-OE2 2.83Å; N241-E272 WeakPolarHBondContact O-CB 3.43Å; P243-E272 HydrophobicContact CB-CB 4.38Å; F270-E272 HydrophobicContact CD2-CB 3.98Å; F270-E272 HydrophobicContact CE2-CB 3.91Å; F270-E272 HydrophobicContact CE2-CG 4.12Å; E272-A274 PolarHBondContact O-N 3.36Å; E272-K282 CarbonylContact O-C 3.57Å; E272-K282 WeakPolarHBondContact O-CA 3.06Å; E272-V283 HydrophobicContact CG-CG2 4.25Å; E272-V283 PolarHBondContact N-O 3.38Å; E272-V283 PolarHBondContact O-N 3.35Å; E272-R285 HydrophobicContact CG-CG 3.81Å; E272-R285 IonicContact OE1-CZ 2.73Å; E272-R285 VanDerWaalsContact OE1-CZ 3.3Å; E272-R285 IonicContact OE1-NE 3.32Å; E272-R285 PolarHBondContact OE1-NE 2.92Å; E272-R285 IonicContact OE1-NH2 3.53Å; E272-R285 PolarHBondContact OE1-NH2 2.76Å; E272-K309 WeakPolarHBondContact OE1-CE 3.45Å; E272-K309 IonicContact OE1-NZ 3.16Å; E272-K309 PolarHBondContact OE1-NZ 3.3Å; E272-K309 IonicContact OE2-NZ 2.69Å; E272-K309 PolarHBondContact OE2-NZ 2.85Å
273	M	92.1	Very high	87.7	Confident	33 Å²	33	43.6 Å²	43.6	16%	0.163	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	116.4	170.3	-65.2	-60.6	-65.6	0	0	110.1	N241 D242 Y280 K282	N241-M273 WeakPolarHBondContact CB-O 3.48Å; N241-M273 WeakPolarHBondContact ND2-CB 3.47Å; N241-M273 PolarHBondContact ND2-O 3.13Å; N241-M273 PolarHBondContact O-N 3.05Å; D242-M273 HydrophobicContact CB-CG 4.03Å; M273-Y280 HydrophobicContact CE-CD1 4.06Å; M273-Y280 HydrophobicContact CE-CG 4.43Å; M273-K282 HydrophobicContact SD-CD 4.2Å; M273-K282 HydrophobicContact SD-CG 3.38Å; M273-K282 WeakPolarHBondContact SD-CG 3.49Å
274	A	87.9	Confident	88.2	Confident	10 Å²	10	42.6 Å²	42.6	8%	0.083	20%	0.204	C	C	.	.			trans	-61	138.1	177.8	0	0	0	0	0	111.2	E272 H277 T281 V283	E272-A274 PolarHBondContact O-N 3.36Å; A274-H277 HydrophobicContact CB-CB 4.01Å; A274-T281 VanDerWaalsContact CB-O 3.32Å; A274-T281 WeakPolarHBondContact CB-O 3.27Å; A274-T281 PolarHBondContact N-O 2.97Å; A274-V283 HydrophobicContact CB-CB 4.42Å; A274-V283 HydrophobicContact CB-CG1 3.85Å; A274-V283 HydrophobicContact CB-CG2 3.7Å
275	K	81	Confident	88.5	Confident	97 Å²	97	41.3 Å²	41.3	42%	0.422	20%	0.197	S	C	.	.	S	Bend	trans	-102.7	-21.3	172.7	-174.2	175.6	177.1	-177.1	0	111.8	I237 N238 H277 L379	I237-K275 HydrophobicContact CG2-CD 4.45Å; N238-K275 PolarHBondContact OD1-NZ 3.19Å; K275-H277 PolarHBondContact O-N 3.01Å; K275-L379 HydrophobicContact CD-CD2 4.18Å
276	E	80.1	Confident	88.8	Confident	41 Å²	41	40.6 Å²	40.6	19%	0.192	19%	0.194	C	C	.	.	S	Bend	trans	-82.3	7.2	176	69.4	-92.2	-130.7	0	0	114	R285 K377	E276-R285 VanDerWaalsContact CD-NH2 3.27Å; E276-R285 IonicContact OE1-CZ 3.22Å; E276-R285 IonicContact OE1-NH1 2.81Å; E276-R285 PolarHBondContact OE1-NH1 3.02Å; E276-R285 IonicContact OE1-NH2 3.59Å; E276-R285 PolarHBondContact OE1-NH2 3.42Å; E276-R285 IonicContact OE2-NH2 2.84Å; E276-R285 PolarHBondContact OE2-NH2 2.89Å; E276-K377 HydrophobicContact CB-CD 4.27Å
277	H	74.6	Confident	88.9	Confident	71 Å²	71	40.6 Å²	40.6	33%	0.329	19%	0.194	S	C	.	.	S	Bend	trans	-129.1	129.7	178.5	-63.5	-24.3	0	0	0	108.7	A274 K275 L279	A274-H277 HydrophobicContact CB-CB 4.01Å; K275-H277 PolarHBondContact O-N 3.01Å; H277-L279 PolarHBondContact O-N 3.08Å
278	D	60.4	Low	88.8	Confident	175 Å²	175	40.9 Å²	40.9	94%	0.936	20%	0.195	S	C	*	.	S	Bend	trans	-70.5	-13.2	-176.1	-53.3	-53.9	0	0	0	113.6
279	L	67.5	Low	88.7	Confident	131 Å²	131	40.9 Å²	40.9	69%	0.686	20%	0.195	S	C	*	.	S	Bend	trans	-98.7	141.5	175.2	-64.5	171	0	0	0	109.5	H277 T281	H277-L279 PolarHBondContact O-N 3.08Å; L279-T281 WeakPolarHBondContact CB-OG1 3.43Å; L279-T281 WeakPolarHBondContact O-CB 3.36Å; L279-T281 PolarHBondContact O-N 2.92Å; L279-T281 PolarHBondContact O-OG1 2.62Å
280	Y	76.1	Confident	88.5	Confident	204 Å²	204	40.9 Å²	40.9	80%	0.8	20%	0.195	S	C	*	.			trans	-56.6	73.4	171.6	-66.5	-78.2	0	0	0	112.5	M273	M273-Y280 HydrophobicContact CE-CD1 4.06Å; M273-Y280 HydrophobicContact CE-CG 4.43Å
281	T	86.6	Confident	88.2	Confident	27 Å²	27	42.8 Å²	42.8	17%	0.166	20%	0.203	C	C	.	.			trans	-112.7	117.4	-166.4	-55.4	0	0	0	0	108.7	A274 L279 V283	A274-T281 VanDerWaalsContact CB-O 3.32Å; A274-T281 WeakPolarHBondContact CB-O 3.27Å; A274-T281 PolarHBondContact N-O 2.97Å; L279-T281 WeakPolarHBondContact CB-OG1 3.43Å; L279-T281 WeakPolarHBondContact O-CB 3.36Å; L279-T281 PolarHBondContact O-N 2.92Å; L279-T281 PolarHBondContact O-OG1 2.62Å; T281-V283 HydrophobicContact CG2-CG1 4.3Å
282	K	92.1	Very high	87.8	Confident	49 Å²	49	45.2 Å²	45.2	21%	0.213	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	134.6	170.1	-74.8	-173.7	174.5	-174.3	0	109.9	E244 T271 E272 M273 N324 I325	E244-K282 IonicContact OE1-NZ 3.84Å; E244-K282 PolarHBondContact OE1-NZ 2.83Å; T271-K282 HydrophobicContact CG2-CB 3.7Å; T271-K282 HydrophobicContact CG2-CD 4.42Å; T271-K282 HydrophobicContact CG2-CG 4.36Å; E272-K282 CarbonylContact O-C 3.57Å; E272-K282 WeakPolarHBondContact O-CA 3.06Å; M273-K282 HydrophobicContact SD-CD 4.2Å; M273-K282 HydrophobicContact SD-CG 3.38Å; M273-K282 WeakPolarHBondContact SD-CG 3.49Å; K282-N324 PolarHBondContact O-ND2 3.28Å; K282-I325 HydrophobicContact CB-CD1 3.43Å; K282-I325 VanDerWaalsContact CB-CD1 3.43Å; K282-I325 HydrophobicContact CD-CD1 3.68Å; K282-I325 HydrophobicContact CG-CD1 4.12Å
283	V	94.6	Very high	87.7	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.024	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.9	177.5	-69.3	0	0	0	0	110.5	T271 E272 A274 T281 Q311	T271-V283 WeakPolarHBondContact CA-O 3.5Å; E272-V283 HydrophobicContact CG-CG2 4.25Å; E272-V283 PolarHBondContact N-O 3.38Å; E272-V283 PolarHBondContact O-N 3.35Å; A274-V283 HydrophobicContact CB-CB 4.42Å; A274-V283 HydrophobicContact CB-CG1 3.85Å; A274-V283 HydrophobicContact CB-CG2 3.7Å; T281-V283 HydrophobicContact CG2-CG1 4.3Å; V283-Q311 HydrophobicContact CB-CG 4.45Å
284	P	97.3	Very high	87.7	Confident	4 Å²	4	46.3 Å²	46.3	3%	0.026	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	141.3	176.4	27.8	-18.2	0	0	0	110	F270 L312 N324 L326 F348	F270-P284 CarbonylContact O-C 3.54Å; F270-P284 WeakPolarHBondContact O-CA 3.15Å; P284-L312 HydrophobicContact CB-CB 4.37Å; P284-L312 WeakPolarHBondContact CD-O 3.48Å; P284-L312 HydrophobicContact CG-CB 4.3Å; P284-L312 WeakPolarHBondContact CG-O 3.48Å; P284-L312 PolarHBondContact O-N 3.49Å; P284-N324 VanDerWaalsContact CD-O 3.3Å; P284-N324 WeakPolarHBondContact CD-O 3.46Å; P284-L326 HydrophobicContact CB-CB 3.74Å; P284-F348 HydrophobicContact CB-CE1 3.88Å; P284-F348 HydrophobicContact CG-CD1 4.16Å; P284-F348 HydrophobicContact CG-CE1 3.65Å
285	R	97.3	Very high	87.9	Confident	1 Å²	1	45.8 Å²	45.8	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	150.2	-174.5	-62	-61.6	-157.9	-159.9	-5.5	111	F269 F270 E272 E276 A310	F269-R285 WeakPolarHBondContact CA-O 3.32Å; F270-R285 HydrophobicContact CD1-CB 4.47Å; F270-R285 HydrophobicContact CD2-CB 4.09Å; F270-R285 HydrophobicContact CD2-CG 4.35Å; F270-R285 HydrophobicContact CE1-CB 4.16Å; F270-R285 HydrophobicContact CE2-CB 3.76Å; F270-R285 HydrophobicContact CE2-CG 3.86Å; F270-R285 HydrophobicContact CG-CB 4.44Å; F270-R285 HydrophobicContact CZ-CB 3.79Å; F270-R285 HydrophobicContact CZ-CG 4.24Å; F270-R285 PolarHBondContact N-O 3.38Å; F270-R285 PolarHBondContact O-N 2.85Å; E272-R285 HydrophobicContact CG-CG 3.81Å; E272-R285 IonicContact OE1-CZ 2.73Å; E272-R285 VanDerWaalsContact OE1-CZ 3.3Å; E272-R285 IonicContact OE1-NE 3.32Å; E272-R285 PolarHBondContact OE1-NE 2.92Å; E272-R285 IonicContact OE1-NH2 3.53Å; E272-R285 PolarHBondContact OE1-NH2 2.76Å; E276-R285 VanDerWaalsContact CD-NH2 3.27Å; E276-R285 IonicContact OE1-CZ 3.22Å; E276-R285 IonicContact OE1-NH1 2.81Å; E276-R285 PolarHBondContact OE1-NH1 3.02Å; E276-R285 IonicContact OE1-NH2 3.59Å; E276-R285 PolarHBondContact OE1-NH2 3.42Å; E276-R285 IonicContact OE2-NH2 2.84Å; E276-R285 PolarHBondContact OE2-NH2 2.89Å; R285-A310 WeakPolarHBondContact CA-O 3.2Å
286	V	98.1	Very high	88.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	131.6	158.7	58	0	0	0	0	108.5	Y267 F268 F269 K309 A310 L312 I368 M372	Y267-V286 HydrophobicContact CD1-CG2 3.77Å; F268-V286 CarbonylContact O-C 3.54Å; F268-V286 WeakPolarHBondContact O-CA 3.42Å; F269-V286 HydrophobicContact CD1-CB 4Å; F269-V286 HydrophobicContact CD1-CG2 4.03Å; F269-V286 HydrophobicContact CE1-CB 3.8Å; F269-V286 HydrophobicContact CE1-CG2 3.5Å; F269-V286 HydrophobicContact CZ-CG2 3.93Å; V286-K309 WeakPolarHBondContact O-CA 3.38Å; V286-A310 HydrophobicContact CG1-CB 4.22Å; V286-A310 PolarHBondContact N-O 2.9Å; V286-A310 PolarHBondContact O-N 2.77Å; V286-L312 HydrophobicContact CB-CD1 4.3Å; V286-L312 HydrophobicContact CB-CD2 4.18Å; V286-L312 HydrophobicContact CB-CG 4.26Å; V286-L312 HydrophobicContact CG1-CD2 3.67Å; V286-L312 HydrophobicContact CG1-CG 4.11Å; V286-I368 HydrophobicContact CG1-CG2 4.08Å; V286-I368 HydrophobicContact CG2-CG2 4.36Å; V286-M372 HydrophobicContact CG1-CE 4.03Å; V286-M372 WeakPolarHBondContact O-CE 3.45Å
287	V	97.4	Very high	88.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	143.3	169.5	154	0	0	0	0	109.5	I220 Y267 F268 F270 V289 F307 L308 K309	I220-V287 HydrophobicContact CD1-CG1 4.46Å; Y267-V287 CarbonylContact C-O 3.58Å; Y267-V287 VanDerWaalsContact CA-O 3.23Å; Y267-V287 WeakPolarHBondContact CA-O 3.08Å; F268-V287 HydrophobicContact CB-CB 4.21Å; F268-V287 HydrophobicContact CB-CG1 4.43Å; F268-V287 HydrophobicContact CD2-CG1 4.28Å; F268-V287 PolarHBondContact N-O 2.81Å; F268-V287 PolarHBondContact O-N 2.92Å; F270-V287 HydrophobicContact CE1-CB 4.02Å; F270-V287 HydrophobicContact CE1-CG2 3.5Å; F270-V287 VanDerWaalsContact CE1-CG2 3.5Å; F270-V287 HydrophobicContact CZ-CG2 3.75Å; V287-V289 HydrophobicContact CG1-CG1 4.27Å; V287-F307 HydrophobicContact CB-CE2 4.3Å; V287-F307 HydrophobicContact CG1-CD2 3.7Å; V287-F307 HydrophobicContact CG1-CE2 3.6Å; V287-F307 HydrophobicContact CG1-CZ 4.34Å; V287-F307 HydrophobicContact CG2-CD2 4.41Å; V287-F307 HydrophobicContact CG2-CE1 4.28Å; V287-F307 HydrophobicContact CG2-CE2 3.65Å; V287-F307 HydrophobicContact CG2-CZ 3.57Å; V287-L308 CarbonylContact C-O 3.51Å; V287-L308 VanDerWaalsContact CA-O 3.25Å; V287-L308 WeakPolarHBondContact CA-O 3.33Å; V287-K309 HydrophobicContact CG2-CB 3.51Å
288	R	96.1	Very high	89.7	Confident	6 Å²	6	48.1 Å²	48.1	2%	0.023	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	136.7	168.9	-175.6	-177.7	78.9	-173.3	3.1	109.5	K265 Y267 T306 F307 L308 M372 D373 G398	K265-R288 HydrophobicContact CG-CG 4.46Å; Y267-R288 HydrophobicContact CD1-CB 4.32Å; Y267-R288 HydrophobicContact CE1-CB 3.97Å; Y267-R288 HydrophobicContact CE1-CG 3.95Å; R288-T306 VanDerWaalsContact O-O 3.08Å; R288-F307 WeakPolarHBondContact O-CA 3.44Å; R288-L308 PolarHBondContact N-O 3.28Å; R288-L308 PolarHBondContact O-N 2.66Å; R288-M372 HydrophobicContact CB-CE 4.25Å; R288-M372 HydrophobicContact CB-SD 4.5Å; R288-D373 IonicContact CZ-OD1 2.67Å; R288-D373 IonicContact NH1-OD1 2.74Å; R288-D373 PolarHBondContact NH1-OD1 2.9Å; R288-D373 IonicContact NH2-OD1 2.89Å; R288-G398 PolarHBondContact NH2-O 3.08Å
289	V	96.1	Very high	91.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	154.2	162.9	-62.3	0	0	0	0	110.1	K265 I266 F268 V287 W304 F307	K265-V289 WeakPolarHBondContact CA-O 3.03Å; I266-V289 HydrophobicContact CB-CG2 3.94Å; I266-V289 PolarHBondContact N-O 2.69Å; I266-V289 PolarHBondContact O-N 3.04Å; F268-V289 HydrophobicContact CE2-CG2 3.94Å; V287-V289 HydrophobicContact CG1-CG1 4.27Å; V289-W304 HydrophobicContact CB-CD2 4.45Å; V289-W304 HydrophobicContact CB-CE3 4.29Å; V289-W304 HydrophobicContact CG1-CD2 4.04Å; V289-W304 HydrophobicContact CG1-CE3 4.36Å; V289-W304 HydrophobicContact CG1-CG 4.14Å; V289-F307 HydrophobicContact CG1-CB 4.23Å; V289-F307 HydrophobicContact CG1-CD2 4.18Å
290	C	93.9	Very high	92.4	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.007	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	138.7	177	-47.2	0	0	0	0	110.4	D263 S292 D293 T306 C400	D263-C290 VanDerWaalsContact OD2-CB 3.31Å; D263-C290 WeakPolarHBondContact OD2-CB 3.19Å; C290-S292 VanDerWaalsContact C-N 3.29Å; C290-S292 PolarHBondContact O-N 2.82Å; C290-D293 WeakPolarHBondContact O-CB 3.47Å; C290-D293 PolarHBondContact O-N 3.23Å; C290-T306 HydrophobicContact CB-CG2 3.91Å; C290-T306 PolarHBondContact N-OG1 3.16Å; C290-T306 WeakPolarHBondContact SG-CB 3.2Å; C290-T306 WeakPolarHBondContact SG-CG2 3.48Å; C290-C400 HydrophobicContact CB-CB 3.9Å; C290-C400 WeakPolarHBondContact CB-SG 3.43Å; C290-C400 WeakPolarHBondContact SG-CA 3.37Å; C290-C400 WeakPolarHBondContact SG-CB 3.48Å; C290-C400 CovalentContact SG-SG 2.03Å; C290-C400 PolarHBondContact SG-SG 2.9Å
291	K	91	Very high	93.2	Very high	40 Å²	40	31.7 Å²	31.7	17%	0.174	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-35	-176.7	-176.1	179.7	178.4	176.5	0	112.6	Y206 E252 D263 D264 D293	Y206-K291 PolarHBondContact OH-O 3.28Å; E252-K291 IonicContact OE1-NZ 2.99Å; E252-K291 PolarHBondContact OE1-NZ 2.89Å; E252-K291 VanDerWaalsContact OE1-NZ 3.11Å; D263-K291 PolarHBondContact OD2-N 2.82Å; D264-K291 HydrophobicContact CB-CB 3.94Å; D264-K291 HydrophobicContact CB-CD 3.52Å; D264-K291 HydrophobicContact CB-CG 4.44Å; D264-K291 WeakPolarHBondContact O-CB 3.42Å; D264-K291 PolarHBondContact O-N 2.95Å; D264-K291 WeakPolarHBondContact OD2-CD 3.42Å; D264-K291 WeakPolarHBondContact OD2-CE 3.45Å; D264-K291 IonicContact OD2-NZ 3.95Å; D264-K291 PolarHBondContact OD2-NZ 2.8Å; K291-D293 VanDerWaalsContact C-N 3.31Å; K291-D293 PolarHBondContact O-N 2.94Å
292	S	88.8	Confident	93.4	Very high	53 Å²	53	37 Å²	37	37%	0.371	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	4.1	-177.7	93.8	0	0	0	0	114.7	D263 C290	D263-S292 WeakPolarHBondContact OD2-CB 3.42Å; D263-S292 PolarHBondContact OD2-N 3.3Å; D263-S292 PolarHBondContact OD2-OG 2.91Å; C290-S292 VanDerWaalsContact C-N 3.29Å; C290-S292 PolarHBondContact O-N 2.82Å
293	D	92.7	Very high	93.5	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.011	18%	0.177	C	C	.	.			trans	-71.9	130.2	-178.4	-168.4	-5.6	0	0	0	110.8	R222 C290 K291 G295 W304 T305 T306 S413	R222-D293 PolarHBondContact NH1-O 3.26Å; C290-D293 WeakPolarHBondContact O-CB 3.47Å; C290-D293 PolarHBondContact O-N 3.23Å; K291-D293 VanDerWaalsContact C-N 3.31Å; K291-D293 PolarHBondContact O-N 2.94Å; D293-G295 PolarHBondContact OD1-N 2.93Å; D293-W304 HydrophobicContact CB-CE3 3.88Å; D293-W304 HydrophobicContact CB-CZ3 4Å; D293-T305 VanDerWaalsContact CG-OG1 3.24Å; D293-T305 PolarHBondContact OD1-N 2.89Å; D293-T305 PolarHBondContact OD1-OG1 2.82Å; D293-T305 PolarHBondContact OD2-N 2.87Å; D293-T305 PolarHBondContact OD2-OG1 2.84Å; D293-T306 HydrophobicContact CB-CG2 4.19Å; D293-T306 WeakPolarHBondContact OD2-CB 3.42Å; D293-T306 WeakPolarHBondContact OD2-CG2 3.43Å; D293-T306 PolarHBondContact OD2-N 3.17Å; D293-T306 PolarHBondContact OD2-OG1 2.85Å; D293-S413 PolarHBondContact OD1-OG 2.82Å
294	V	91.6	Very high	93.6	Very high	56 Å²	56	36.9 Å²	36.9	34%	0.339	18%	0.176	S	C	.	.			trans	-120.6	7	179.4	-63	0	0	0	0	112.4	S412 S413 L414	V294-S412 WeakPolarHBondContact CG2-OG 3.25Å; V294-S413 WeakPolarHBondContact CG2-OG 3.46Å; V294-S413 PolarHBondContact N-OG 3.4Å; V294-S413 VanDerWaalsContact N-OG 3.15Å; V294-L414 HydrophobicContact CG2-CD1 4.12Å; V294-L414 HydrophobicContact CG2-CD2 4.3Å; V294-L414 HydrophobicContact CG2-CG 3.78Å
295	G	92.6	Very high	93.5	Very high	0 Å²	0	37 Å²	37	0%	0	18%	0.176	C	C	.	.			trans	86.6	-178.7	-173.2	0	0	0	0	0	113.9	D293 R303 T305 S413 L414	D293-G295 PolarHBondContact OD1-N 2.93Å; G295-R303 WeakPolarHBondContact CA-O 3.29Å; G295-T305 VanDerWaalsContact C-CG2 3.44Å; G295-S413 PolarHBondContact N-OG 3.11Å; G295-S413 CarbonylContact O-C 3.44Å; G295-S413 WeakPolarHBondContact O-CB 3.49Å; G295-S413 PolarHBondContact O-OG 2.95Å; G295-L414 WeakPolarHBondContact O-CD2 3.37Å; G295-L414 PolarHBondContact O-N 2.62Å
296	G	92.8	Very high	93.5	Very high	3 Å²	3	37.3 Å²	37.3	3%	0.031	18%	0.178	C	C	.	.			trans	-99	160.3	178.1	0	0	0	0	0	113.5	T299 L300 Q301	G296-T299 CarbonylContact C-O 3.59Å; G296-T299 VanDerWaalsContact CA-O 3.27Å; G296-T299 WeakPolarHBondContact CA-O 3.39Å; G296-L300 PolarHBondContact N-O 2.81Å; G296-Q301 WeakPolarHBondContact O-CA 3.43Å
297	M	90.3	Very high	93.4	Very high	115 Å²	115	37.3 Å²	37.3	57%	0.567	18%	0.178	S	C	*	.	S	Bend	trans	-77.2	-35.9	-175.1	177.7	176.5	58.8	0	0	113.9	Q301 L414	M297-Q301 WeakPolarHBondContact O-CG 3.38Å; M297-Q301 PolarHBondContact O-NE2 2.86Å; M297-L414 HydrophobicContact CB-CB 4.43Å; M297-L414 VanDerWaalsContact CB-O 3.25Å; M297-L414 WeakPolarHBondContact CB-O 3.31Å
298	K	90.3	Very high	93.4	Very high	140 Å²	140	37.3 Å²	37.3	61%	0.609	18%	0.178	S	C	*	.	S	Bend	trans	-122.4	-61.1	178.7	-61.2	-179.2	-166.6	161.3	0	110.7	Q301 D418	K298-Q301 WeakPolarHBondContact O-CG 3.31Å; K298-D418 IonicContact NZ-OD2 3.92Å
299	T	91.4	Very high	93.4	Very high	28 Å²	28	37.3 Å²	37.3	17%	0.172	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	145.3	169.1	-49	0	0	0	0	109.2	G296 Q301 D418 L421	G296-T299 CarbonylContact C-O 3.59Å; G296-T299 VanDerWaalsContact CA-O 3.27Å; G296-T299 WeakPolarHBondContact CA-O 3.39Å; T299-Q301 VanDerWaalsContact C-N 3.29Å; T299-Q301 PolarHBondContact O-N 2.84Å; T299-D418 VanDerWaalsContact CB-OD1 3.31Å; T299-D418 WeakPolarHBondContact CB-OD1 3.41Å; T299-D418 PolarHBondContact N-OD1 2.81Å; T299-D418 PolarHBondContact OG1-OD1 2.9Å; T299-L421 HydrophobicContact CG2-CB 3.85Å
300	L	92.9	Very high	93.5	Very high	12 Å²	12	37.3 Å²	37.3	6%	0.063	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	37.1	-179.6	-65.4	169.1	0	0	0	114.8	W239 G296 R302 R303 T305 L421 V424 R425	W239-L300 HydrophobicContact CH2-CD2 4.27Å; W239-L300 HydrophobicContact CZ2-CD2 4.01Å; G296-L300 PolarHBondContact N-O 2.81Å; L300-R302 PolarHBondContact O-N 2.77Å; L300-R303 HydrophobicContact CB-CB 4.15Å; L300-R303 HydrophobicContact CD2-CB 3.78Å; L300-R303 PolarHBondContact O-N 2.91Å; L300-R303 VanDerWaalsContact O-O 3.11Å; L300-T305 HydrophobicContact CB-CG2 4.46Å; L300-L421 HydrophobicContact CD1-CB 4.27Å; L300-L421 HydrophobicContact CD1-CD2 4.45Å; L300-L421 WeakPolarHBondContact CD1-O 3.47Å; L300-V424 HydrophobicContact CD1-CG1 3.6Å; L300-R425 HydrophobicContact CD1-CB 4.26Å; L300-R425 HydrophobicContact CD2-CB 4.07Å; L300-R425 HydrophobicContact CD2-CG 4.05Å; L300-R425 HydrophobicContact CG-CB 4.33Å
301	Q	93.4	Very high	93.6	Very high	125 Å²	125	39 Å²	39	58%	0.584	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	123.3	170.4	-76.6	176.2	-7.3	0	0	110.9	G296 M297 K298 T299 R303	G296-Q301 WeakPolarHBondContact O-CA 3.43Å; M297-Q301 WeakPolarHBondContact O-CG 3.38Å; M297-Q301 PolarHBondContact O-NE2 2.86Å; K298-Q301 WeakPolarHBondContact O-CG 3.31Å; T299-Q301 VanDerWaalsContact C-N 3.29Å; T299-Q301 PolarHBondContact O-N 2.84Å; Q301-R303 PolarHBondContact O-N 2.95Å; Q301-R303 VanDerWaalsContact O-N 3.16Å
302	R	90.7	Very high	93.9	Very high	137 Å²	137	37.2 Å²	37.2	52%	0.517	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	24.8	-176.3	-60.2	176	176.7	155.7	-0.5	114	Q228 V231 R232 L300	Q228-R302 PolarHBondContact O-NE 3.46Å; Q228-R302 PolarHBondContact O-NH2 2.86Å; V231-R302 WeakPolarHBondContact CA-O 3.31Å; R232-R302 WeakPolarHBondContact CG-O 3.45Å; R232-R302 PolarHBondContact N-O 3.17Å; R232-R302 VanDerWaalsContact N-O 3.1Å; L300-R302 PolarHBondContact O-N 2.77Å
303	R	95	Very high	94.3	Very high	52 Å²	52	35.4 Å²	35.4	20%	0.196	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-124.9	149.3	174.6	-60.5	-176.8	-169.1	-82.6	20.9	110.4	V231 R232 T233 D234 G295 L300 Q301 T305	V231-R303 VanDerWaalsContact CG1-C 3.5Å; R232-R303 WeakPolarHBondContact O-CA 3.46Å; T233-R303 PolarHBondContact O-NH1 2.8Å; D234-R303 VanDerWaalsContact OD1-CD 3.28Å; D234-R303 WeakPolarHBondContact OD1-CD 3.16Å; D234-R303 IonicContact OD1-CZ 3.01Å; D234-R303 IonicContact OD1-NE 3.5Å; D234-R303 PolarHBondContact OD1-NE 2.96Å; D234-R303 IonicContact OD1-NH1 2.67Å; D234-R303 IonicContact OD1-NH2 3.54Å; D234-R303 PolarHBondContact OD1-NH2 3.28Å; G295-R303 WeakPolarHBondContact CA-O 3.29Å; L300-R303 HydrophobicContact CB-CB 4.15Å; L300-R303 HydrophobicContact CD2-CB 3.78Å; L300-R303 PolarHBondContact O-N 2.91Å; L300-R303 VanDerWaalsContact O-O 3.11Å; Q301-R303 PolarHBondContact O-N 2.95Å; Q301-R303 VanDerWaalsContact O-N 3.16Å; R303-T305 PolarHBondContact O-N 2.83Å
304	W	96.3	Very high	94.4	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.166	C	C	.	.			trans	-54.1	135.8	-179.6	-60	112.2	0	0	0	111.5	Y206 I220 R222 V231 R232 W239 V289 D293 F307	Y206-W304 AromaticContact CD1-CH2 3.84Å; Y206-W304 HydrophobicContact CD1-CH2 3.84Å; Y206-W304 HydrophobicContact CD1-CZ2 4.29Å; Y206-W304 AromaticContact CE1-CH2 3.64Å; Y206-W304 HydrophobicContact CE1-CH2 3.64Å; Y206-W304 HydrophobicContact CE1-CZ3 4.34Å; I220-W304 PolarHBondContact O-NE1 2.91Å; R222-W304 HydrophobicContact CB-CH2 4.03Å; R222-W304 HydrophobicContact CB-CZ2 4.39Å; V231-W304 HydrophobicContact CB-CD2 4.43Å; V231-W304 HydrophobicContact CB-CE3 4.26Å; V231-W304 HydrophobicContact CB-CH2 4.06Å; V231-W304 HydrophobicContact CB-CZ2 4.27Å; V231-W304 HydrophobicContact CB-CZ3 4.07Å; V231-W304 HydrophobicContact CG1-CD2 3.51Å; V231-W304 HydrophobicContact CG1-CE3 3.48Å; V231-W304 VanDerWaalsContact CG1-CE3 3.48Å; V231-W304 HydrophobicContact CG1-CG 4.01Å; V231-W304 HydrophobicContact CG1-CH2 4.14Å; V231-W304 HydrophobicContact CG1-CZ2 4.21Å; V231-W304 HydrophobicContact CG1-CZ3 3.8Å; R232-W304 PolarHBondContact O-N 2.87Å; W239-W304 HydrophobicContact CH2-CB 4.26Å; W239-W304 WeakPolarHBondContact CH2-O 3.05Å; W239-W304 HydrophobicContact CZ3-CB 4.14Å; V289-W304 HydrophobicContact CB-CD2 4.45Å; V289-W304 HydrophobicContact CB-CE3 4.29Å; V289-W304 HydrophobicContact CG1-CD2 4.04Å; V289-W304 HydrophobicContact CG1-CE3 4.36Å; V289-W304 HydrophobicContact CG1-CG 4.14Å; D293-W304 HydrophobicContact CB-CE3 3.88Å; D293-W304 HydrophobicContact CB-CZ3 4Å; W304-F307 HydrophobicContact CB-CB 3.69Å; W304-F307 HydrophobicContact CG-CB 4.35Å
305	T	95.8	Very high	94.5	Very high	5 Å²	5	34 Å²	34	3%	0.031	16%	0.155	C	C	.	.	S	Bend	trans	-97.6	-15.1	168.2	64.2	0	0	0	0	111.7	D293 G295 L300 R303 S413 L421	D293-T305 VanDerWaalsContact CG-OG1 3.24Å; D293-T305 PolarHBondContact OD1-N 2.89Å; D293-T305 PolarHBondContact OD1-OG1 2.82Å; D293-T305 PolarHBondContact OD2-N 2.87Å; D293-T305 PolarHBondContact OD2-OG1 2.84Å; G295-T305 VanDerWaalsContact C-CG2 3.44Å; L300-T305 HydrophobicContact CB-CG2 4.46Å; R303-T305 PolarHBondContact O-N 2.83Å; T305-S413 WeakPolarHBondContact OG1-CB 3.18Å; T305-L421 HydrophobicContact CG2-CD2 3.45Å; T305-L421 VanDerWaalsContact CG2-CD2 3.45Å
306	T	96	Very high	94.5	Very high	8 Å²	8	36.3 Å²	36.3	5%	0.049	17%	0.168	C	C	.	.	S	Bend	trans	-108.5	2.9	-173.4	59.8	0	0	0	0	114.7	R288 C290 D293 L308	R288-T306 VanDerWaalsContact O-O 3.08Å; C290-T306 HydrophobicContact CB-CG2 3.91Å; C290-T306 PolarHBondContact N-OG1 3.16Å; C290-T306 WeakPolarHBondContact SG-CB 3.2Å; C290-T306 WeakPolarHBondContact SG-CG2 3.48Å; D293-T306 HydrophobicContact CB-CG2 4.19Å; D293-T306 WeakPolarHBondContact OD2-CB 3.42Å; D293-T306 WeakPolarHBondContact OD2-CG2 3.43Å; D293-T306 PolarHBondContact OD2-N 3.17Å; D293-T306 PolarHBondContact OD2-OG1 2.85Å; T306-L308 PolarHBondContact O-N 2.79Å
307	F	97.3	Very high	94.2	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.2	C	C	.	.			trans	-68.1	115.9	179.4	-179.2	-83.4	0	0	0	111.4	I220 T233 W239 L240 V287 R288 V289 W304 K309 P428	I220-F307 HydrophobicContact CD1-CE2 4.33Å; T233-F307 HydrophobicContact CG2-CD2 3.86Å; T233-F307 HydrophobicContact CG2-CE2 3.62Å; T233-F307 HydrophobicContact CG2-CZ 4.38Å; W239-F307 HydrophobicContact CB-CE1 4.36Å; W239-F307 HydrophobicContact CD2-CD1 4.04Å; W239-F307 HydrophobicContact CD2-CE1 4.13Å; W239-F307 HydrophobicContact CE3-CB 4.3Å; W239-F307 AromaticContact CE3-CD1 3.59Å; W239-F307 HydrophobicContact CE3-CD1 3.59Å; W239-F307 HydrophobicContact CE3-CD2 4.07Å; W239-F307 AromaticContact CE3-CE1 3.81Å; W239-F307 HydrophobicContact CE3-CE1 3.81Å; W239-F307 HydrophobicContact CE3-CE2 4.24Å; W239-F307 AromaticContact CE3-CG 3.74Å; W239-F307 HydrophobicContact CE3-CG 3.74Å; W239-F307 HydrophobicContact CE3-CZ 4.13Å; W239-F307 HydrophobicContact CG-CE1 4.38Å; W239-F307 HydrophobicContact CH2-CB 3.95Å; W239-F307 HydrophobicContact CH2-CD1 4.4Å; W239-F307 HydrophobicContact CH2-CG 4.28Å; W239-F307 HydrophobicContact CZ3-CB 3.61Å; W239-F307 AromaticContact CZ3-CD1 3.8Å; W239-F307 HydrophobicContact CZ3-CD1 3.8Å; W239-F307 HydrophobicContact CZ3-CD2 4.02Å; W239-F307 HydrophobicContact CZ3-CE1 4.46Å; W239-F307 AromaticContact CZ3-CG 3.55Å; W239-F307 HydrophobicContact CZ3-CG 3.55Å; L240-F307 HydrophobicContact CD2-CZ 4.37Å; V287-F307 HydrophobicContact CB-CE2 4.3Å; V287-F307 HydrophobicContact CG1-CD2 3.7Å; V287-F307 HydrophobicContact CG1-CE2 3.6Å; V287-F307 HydrophobicContact CG1-CZ 4.34Å; V287-F307 HydrophobicContact CG2-CD2 4.41Å; V287-F307 HydrophobicContact CG2-CE1 4.28Å; V287-F307 HydrophobicContact CG2-CE2 3.65Å; V287-F307 HydrophobicContact CG2-CZ 3.57Å; R288-F307 WeakPolarHBondContact O-CA 3.44Å; V289-F307 HydrophobicContact CG1-CB 4.23Å; V289-F307 HydrophobicContact CG1-CD2 4.18Å; W304-F307 HydrophobicContact CB-CB 3.69Å; W304-F307 HydrophobicContact CG-CB 4.35Å; F307-K309 HydrophobicContact CE1-CB 4.49Å; F307-P428 HydrophobicContact CD1-CB 3.93Å; F307-P428 HydrophobicContact CE1-CB 4.01Å
308	L	97.1	Very high	94	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	141.6	168.9	-63.1	-178.9	0	0	0	109.8	V287 R288 T306 M372 F376 V424 M430	V287-L308 CarbonylContact C-O 3.51Å; V287-L308 VanDerWaalsContact CA-O 3.25Å; V287-L308 WeakPolarHBondContact CA-O 3.33Å; R288-L308 PolarHBondContact N-O 3.28Å; R288-L308 PolarHBondContact O-N 2.66Å; T306-L308 PolarHBondContact O-N 2.79Å; L308-M372 HydrophobicContact CB-SD 3.65Å; L308-F376 HydrophobicContact CD2-CE1 3.68Å; L308-V424 HydrophobicContact CD2-CG2 4.09Å; L308-M430 HydrophobicContact CB-SD 4.35Å; L308-M430 HydrophobicContact CD1-SD 4.22Å; L308-M430 HydrophobicContact CD2-SD 4.24Å
309	K	96.4	Very high	93.7	Very high	6 Å²	6	40 Å²	40	3%	0.026	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.1	175.4	74.4	177.7	176.6	-179.4	0	112.7	N238 W239 E272 V286 V287 F307 P428 L429 M430	N238-K309 VanDerWaalsContact O-CE 3.25Å; N238-K309 WeakPolarHBondContact O-CE 3.3Å; N238-K309 PolarHBondContact O-NZ 3.24Å; N238-K309 VanDerWaalsContact O-NZ 3.09Å; W239-K309 WeakPolarHBondContact O-CE 3.43Å; W239-K309 PolarHBondContact O-NZ 3.49Å; E272-K309 WeakPolarHBondContact OE1-CE 3.45Å; E272-K309 IonicContact OE1-NZ 3.16Å; E272-K309 PolarHBondContact OE1-NZ 3.3Å; E272-K309 IonicContact OE2-NZ 2.69Å; E272-K309 PolarHBondContact OE2-NZ 2.85Å; V286-K309 WeakPolarHBondContact O-CA 3.38Å; V287-K309 HydrophobicContact CG2-CB 3.51Å; F307-K309 HydrophobicContact CE1-CB 4.49Å; K309-P428 PolarHBondContact N-O 2.59Å; K309-L429 HydrophobicContact CG-CB 4.23Å; K309-L429 HydrophobicContact CG-CD1 3.93Å; K309-L429 WeakPolarHBondContact O-CA 3.29Å; K309-M430 WeakPolarHBondContact O-CG 3.49Å; K309-M430 PolarHBondContact O-N 3.23Å
310	A	97.1	Very high	93.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	151.7	174.8	0	0	0	0	0	110.8	R285 V286 V371 M372 M430	R285-A310 WeakPolarHBondContact CA-O 3.2Å; V286-A310 HydrophobicContact CG1-CB 4.22Å; V286-A310 PolarHBondContact N-O 2.9Å; V286-A310 PolarHBondContact O-N 2.77Å; A310-V371 HydrophobicContact CB-CG1 3.76Å; A310-M372 HydrophobicContact CB-CE 3.77Å; A310-M372 HydrophobicContact CB-SD 4.21Å; A310-M430 HydrophobicContact CB-CB 4.31Å; A310-M430 HydrophobicContact CB-CG 4.17Å
311	Q	96.6	Very high	93.1	Very high	38 Å²	38	43.4 Å²	43.4	18%	0.178	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	132.8	173.8	-165.7	177.7	13.7	0	0	110.6	V283 V313 V434	V283-Q311 HydrophobicContact CB-CG 4.45Å; Q311-V313 HydrophobicContact CG-CG2 3.97Å; Q311-V434 PolarHBondContact O-N 3Å
312	L	97.6	Very high	92.9	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	137	162.4	-60.6	-179	0	0	0	108.4	F269 P284 V286 F363 V434	F269-L312 HydrophobicContact CD1-CD1 4.01Å; F269-L312 HydrophobicContact CE1-CD1 4.29Å; P284-L312 HydrophobicContact CB-CB 4.37Å; P284-L312 WeakPolarHBondContact CD-O 3.48Å; P284-L312 HydrophobicContact CG-CB 4.3Å; P284-L312 WeakPolarHBondContact CG-O 3.48Å; P284-L312 PolarHBondContact O-N 3.49Å; V286-L312 HydrophobicContact CB-CD1 4.3Å; V286-L312 HydrophobicContact CB-CD2 4.18Å; V286-L312 HydrophobicContact CB-CG 4.26Å; V286-L312 HydrophobicContact CG1-CD2 3.67Å; V286-L312 HydrophobicContact CG1-CG 4.11Å; L312-F363 HydrophobicContact CB-CE1 4.28Å; L312-F363 HydrophobicContact CB-CZ 4.13Å; L312-F363 HydrophobicContact CD2-CD1 4.03Å; L312-F363 HydrophobicContact CD2-CE1 4.2Å; L312-F363 HydrophobicContact CD2-CG 4.23Å; L312-V434 HydrophobicContact CD2-CB 3.96Å; L312-V434 HydrophobicContact CD2-CG2 4.24Å
313	V	96.2	Very high	93.1	Very high	15 Å²	15	38.7 Å²	38.7	9%	0.091	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	111.2	177.4	178.9	0	0	0	0	108.8	Q311 E315 V434 T435 A436	Q311-V313 HydrophobicContact CG-CG2 3.97Å; V313-E315 HydrophobicContact CG1-CB 4.01Å; V313-E315 HydrophobicContact CG1-CG 3.96Å; V313-V434 PolarHBondContact N-O 3.39Å; V313-T435 HydrophobicContact CB-CG2 4.23Å; V313-T435 HydrophobicContact CG1-CG2 4.09Å; V313-T435 WeakPolarHBondContact O-CA 3.46Å; V313-A436 PolarHBondContact O-N 3.07Å
314	C	95.9	Very high	93	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.014	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	103.3	168.9	-172.3	0	0	0	0	107.9	Y323 F348 C361	C314-Y323 PolarHBondContact O-N 3.23Å; C314-F348 HydrophobicContact CB-CD1 4.08Å; C314-F348 HydrophobicContact CB-CD2 3.85Å; C314-F348 HydrophobicContact CB-CE1 4.19Å; C314-F348 HydrophobicContact CB-CE2 3.99Å; C314-F348 HydrophobicContact CB-CG 3.92Å; C314-F348 HydrophobicContact CB-CZ 4.15Å; C314-C361 WeakPolarHBondContact CA-SG 3.34Å; C314-C361 HydrophobicContact CB-CB 3.76Å; C314-C361 WeakPolarHBondContact CB-SG 3.47Å; C314-C361 WeakPolarHBondContact SG-CB 3.3Å; C314-C361 CovalentContact SG-SG 2.04Å; C314-C361 PolarHBondContact SG-SG 2.94Å
315	E	93.8	Very high	92.9	Very high	27 Å²	27	38.3 Å²	38.3	13%	0.126	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	133.2	-176.1	71.3	177.1	-164.2	0	0	112.7	V313 K317 Q321 R322 T435 A436 P438	V313-E315 HydrophobicContact CG1-CB 4.01Å; V313-E315 HydrophobicContact CG1-CG 3.96Å; E315-K317 HydrophobicContact CG-CG 4.18Å; E315-K317 PolarHBondContact O-N 3.06Å; E315-K317 WeakPolarHBondContact OE1-CE 3.41Å; E315-Q321 WeakPolarHBondContact CA-O 3.16Å; E315-R322 HydrophobicContact CB-CG 3.86Å; E315-R322 IonicContact OE2-CZ 2.9Å; E315-R322 IonicContact OE2-NE 2.75Å; E315-R322 PolarHBondContact OE2-NE 2.83Å; E315-R322 IonicContact OE2-NH2 2.74Å; E315-R322 PolarHBondContact OE2-NH2 2.99Å; E315-T435 HydrophobicContact CG-CG2 3.88Å; E315-A436 PolarHBondContact N-O 2.97Å; E315-A436 VanDerWaalsContact N-O 3.16Å; E315-P438 WeakPolarHBondContact O-CD 3.32Å
316	D	91.2	Very high	93	Very high	48 Å²	48	38.2 Å²	38.2	26%	0.257	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	103.8	166.5	173.2	16.7	0	0	0	109	A318 S319 G320 Q321 P438	D316-A318 PolarHBondContact O-N 2.76Å; D316-A318 WeakPolarHBondContact OD1-CB 3.37Å; D316-A318 PolarHBondContact OD1-N 3.21Å; D316-S319 WeakPolarHBondContact CB-OG 3.14Å; D316-S319 PolarHBondContact O-N 3.43Å; D316-S319 VanDerWaalsContact OD2-CB 3.24Å; D316-S319 WeakPolarHBondContact OD2-CB 3.3Å; D316-S319 PolarHBondContact OD2-N 2.82Å; D316-S319 PolarHBondContact OD2-OG 2.92Å; D316-G320 WeakPolarHBondContact O-CA 3.29Å; D316-G320 PolarHBondContact O-N 3.46Å; D316-Q321 PolarHBondContact N-O 2.54Å; D316-Q321 PolarHBondContact O-N 2.94Å; D316-P438 HydrophobicContact CB-CG 3.86Å
317	K	87.9	Confident	92.9	Very high	163 Å²	163	38.9 Å²	38.9	71%	0.709	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-18.9	179.5	-64.7	-176	176.1	179.6	0	113.8	E315	E315-K317 HydrophobicContact CG-CG 4.18Å; E315-K317 PolarHBondContact O-N 3.06Å; E315-K317 WeakPolarHBondContact OE1-CE 3.41Å
318	A	85.4	Confident	92.9	Very high	99 Å²	99	39.3 Å²	39.3	82%	0.818	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-37.6	179.4	0	0	0	0	0	112.4	D316	D316-A318 PolarHBondContact O-N 2.76Å; D316-A318 WeakPolarHBondContact OD1-CB 3.37Å; D316-A318 PolarHBondContact OD1-N 3.21Å
319	S	83.6	Confident	92.9	Very high	74 Å²	74	39.7 Å²	39.7	52%	0.517	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-17.9	174.2	61.5	0	0	0	0	114.2	D316 Q321	D316-S319 WeakPolarHBondContact CB-OG 3.14Å; D316-S319 PolarHBondContact O-N 3.43Å; D316-S319 VanDerWaalsContact OD2-CB 3.24Å; D316-S319 WeakPolarHBondContact OD2-CB 3.3Å; D316-S319 PolarHBondContact OD2-N 2.82Å; D316-S319 PolarHBondContact OD2-OG 2.92Å; S319-Q321 PolarHBondContact O-N 2.65Å; S319-Q321 WeakPolarHBondContact OG-CB 3.04Å; S319-Q321 PolarHBondContact OG-N 2.63Å
320	G	84.4	Confident	92.9	Very high	61 Å²	61	41.9 Å²	41.9	63%	0.629	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.5	3.1	-169.4	0	0	0	0	0	113.9	D316	D316-G320 WeakPolarHBondContact O-CA 3.29Å; D316-G320 PolarHBondContact O-N 3.46Å
321	Q	87.3	Confident	92.7	Very high	50 Å²	50	43.9 Å²	43.9	23%	0.234	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	136.9	-176.5	-163.7	70	18.7	0	0	111.9	E315 D316 S319 Y323 E353	E315-Q321 WeakPolarHBondContact CA-O 3.16Å; D316-Q321 PolarHBondContact N-O 2.54Å; D316-Q321 PolarHBondContact O-N 2.94Å; S319-Q321 PolarHBondContact O-N 2.65Å; S319-Q321 WeakPolarHBondContact OG-CB 3.04Å; S319-Q321 PolarHBondContact OG-N 2.63Å; Q321-Y323 HydrophobicContact CB-CE2 4.45Å; Q321-Y323 HydrophobicContact CG-CE1 3.93Å; Q321-Y323 HydrophobicContact CG-CE2 4.32Å; Q321-E353 PolarHBondContact NE2-OE1 2.92Å
322	R	90.5	Very high	92.5	Very high	153 Å²	153	42.5 Å²	42.5	58%	0.577	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.7	173.1	-70.4	-174.1	164.6	166.9	-2	112.1	E315 S350	E315-R322 HydrophobicContact CB-CG 3.86Å; E315-R322 IonicContact OE2-CZ 2.9Å; E315-R322 IonicContact OE2-NE 2.75Å; E315-R322 PolarHBondContact OE2-NE 2.83Å; E315-R322 IonicContact OE2-NH2 2.74Å; E315-R322 PolarHBondContact OE2-NH2 2.99Å; R322-S350 PolarHBondContact O-OG 2.85Å
323	Y	93.8	Very high	92	Very high	9 Å²	9	46.2 Å²	46.2	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	101.5	176.3	-50	-79.9	0	0	0	107.8	C314 Q321 F348 T349 I357 A359 P438 V441	C314-Y323 PolarHBondContact O-N 3.23Å; Q321-Y323 HydrophobicContact CB-CE2 4.45Å; Q321-Y323 HydrophobicContact CG-CE1 3.93Å; Q321-Y323 HydrophobicContact CG-CE2 4.32Å; Y323-F348 WeakPolarHBondContact O-CD1 3.38Å; Y323-T349 CarbonylContact C-O 3.55Å; Y323-T349 WeakPolarHBondContact CA-O 3.36Å; Y323-I357 HydrophobicContact CE1-CG2 3.73Å; Y323-A359 HydrophobicContact CD1-CB 3.74Å; Y323-A359 HydrophobicContact CD2-CB 3.59Å; Y323-A359 HydrophobicContact CE1-CB 3.97Å; Y323-A359 HydrophobicContact CE2-CB 3.84Å; Y323-A359 HydrophobicContact CG-CB 3.55Å; Y323-P438 HydrophobicContact CE2-CB 4.43Å; Y323-P438 HydrophobicContact CE2-CG 4.18Å; Y323-V441 HydrophobicContact CE1-CG1 4.48Å; Y323-V441 HydrophobicContact CE2-CG2 4.26Å; Y323-V441 WeakPolarHBondContact OH-CG1 3.49Å
324	N	92.6	Very high	91.4	Very high	20 Å²	20	48.2 Å²	48.2	11%	0.107	27%	0.266	C	S	.	.			trans	-111.6	-5.9	-161.2	75.4	-71.8	0	0	0	113.8	K282 P284 T349 Q351	K282-N324 PolarHBondContact O-ND2 3.28Å; P284-N324 VanDerWaalsContact CD-O 3.3Å; P284-N324 WeakPolarHBondContact CD-O 3.46Å; N324-T349 PolarHBondContact N-O 3.12Å; N324-T349 VanDerWaalsContact N-O 3.1Å; N324-Q351 PolarHBondContact ND2-NE2 3.42Å; N324-Q351 PolarHBondContact ND2-OE1 3.39Å; N324-Q351 WeakPolarHBondContact OD1-CG 3.4Å; N324-Q351 PolarHBondContact OD1-N 2.88Å
325	I	94.9	Very high	90.6	Very high	24 Å²	24	50.6 Å²	50.6	12%	0.123	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.6	173.6	-55.1	-57.9	0	0	0	107.7	T271 K282 T327 F348 T349 Q351	T271-I325 HydrophobicContact CG2-CD1 4.03Å; K282-I325 HydrophobicContact CB-CD1 3.43Å; K282-I325 VanDerWaalsContact CB-CD1 3.43Å; K282-I325 HydrophobicContact CD-CD1 3.68Å; K282-I325 HydrophobicContact CG-CD1 4.12Å; I325-T327 HydrophobicContact CG2-CG2 4.41Å; I325-F348 CarbonylContact O-C 3.58Å; I325-F348 WeakPolarHBondContact O-CA 3.38Å; I325-T349 WeakPolarHBondContact CB-OG1 3.18Å; I325-T349 PolarHBondContact N-O 2.87Å; I325-T349 VanDerWaalsContact N-O 3.08Å; I325-T349 PolarHBondContact O-N 3.28Å; I325-Q351 HydrophobicContact CD1-CB 3.97Å; I325-Q351 HydrophobicContact CG1-CB 3.87Å
326	L	96.8	Very high	89.7	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	129.1	174	179.4	75.3	0	0	0	109.5	V246 F269 T271 P284 V329 L347 F348	V246-L326 HydrophobicContact CB-CD2 4.19Å; V246-L326 HydrophobicContact CB-CG 4.45Å; V246-L326 HydrophobicContact CG1-CD2 4.3Å; V246-L326 HydrophobicContact CG1-CG 4.2Å; V246-L326 HydrophobicContact CG2-CB 4.38Å; V246-L326 HydrophobicContact CG2-CD2 4.09Å; V246-L326 HydrophobicContact CG2-CG 4.1Å; V246-L326 VanDerWaalsContact CG2-O 3.3Å; V246-L326 WeakPolarHBondContact CG2-O 3.36Å; F269-L326 HydrophobicContact CB-CD2 3.89Å; T271-L326 PolarHBondContact OG1-N 3.32Å; T271-L326 PolarHBondContact OG1-O 3.2Å; P284-L326 HydrophobicContact CB-CB 3.74Å; L326-V329 HydrophobicContact CD1-CG2 3.7Å; L326-V329 HydrophobicContact CD2-CG2 3.68Å; L326-V329 HydrophobicContact CG-CG2 4.01Å; L326-L347 WeakPolarHBondContact CD1-O 3.45Å; L326-F348 HydrophobicContact CB-CD1 4.15Å; L326-F348 HydrophobicContact CB-CE1 4.02Å; L326-F348 HydrophobicContact CD1-CD1 3.97Å; L326-F348 HydrophobicContact CD1-CD2 4.3Å; L326-F348 HydrophobicContact CD1-CE1 3.52Å; L326-F348 HydrophobicContact CD1-CE2 3.86Å; L326-F348 HydrophobicContact CD1-CG 4.34Å; L326-F348 HydrophobicContact CD1-CZ 3.45Å; L326-F348 VanDerWaalsContact CD1-CZ 3.45Å; L326-F348 HydrophobicContact CG-CE1 4.34Å
327	T	94.9	Very high	88.8	Confident	21 Å²	21	53.6 Å²	53.6	13%	0.129	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	-33	-174.6	57.7	0	0	0	0	114	R164 I325 L347 T349	R164-T327 PolarHBondContact NH1-O 3.05Å; I325-T327 HydrophobicContact CG2-CG2 4.41Å; T327-L347 PolarHBondContact N-O 2.67Å; T327-L347 WeakPolarHBondContact OG1-CD2 3.44Å; T327-L347 VanDerWaalsContact OG1-CG 3.29Å; T327-L347 WeakPolarHBondContact OG1-CG 3.46Å; T327-L347 PolarHBondContact OG1-O 3.49Å; T327-T349 HydrophobicContact CG2-CG2 3.95Å
328	D	96.9	Very high	88.4	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.053	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	154.1	177.4	-153.2	38.8	0	0	0	111.4	L347 K449 L450	D328-L347 HydrophobicContact CB-CB 4.16Å; D328-L347 HydrophobicContact CB-CD2 4.22Å; D328-L347 PolarHBondContact O-N 2.78Å; D328-K449 HydrophobicContact CB-CD 4.48Å; D328-K449 VanDerWaalsContact CG-CD 3.47Å; D328-K449 WeakPolarHBondContact OD1-CD 3.33Å; D328-K449 IonicContact OD1-NZ 3.91Å; D328-K449 PolarHBondContact OD1-NZ 2.69Å; D328-K449 WeakPolarHBondContact OD2-CA 3.38Å; D328-K449 WeakPolarHBondContact OD2-CD 3.34Å; D328-K449 IonicContact OD2-NZ 2.6Å; D328-L450 PolarHBondContact OD2-N 3.29Å
329	V	97.6	Very high	88.3	Confident	8 Å²	8	44 Å²	44	5%	0.048	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	125	171.9	-178.8	0	0	0	0	110.4	V246 S247 F269 L326 F344 Y345	V246-V329 HydrophobicContact CG1-CG2 4.28Å; S247-V329 PolarHBondContact OG-O 2.62Å; S247-V329 VanDerWaalsContact OG-O 3.1Å; F269-V329 HydrophobicContact CB-CG2 3.89Å; F269-V329 HydrophobicContact CD1-CG1 4.5Å; F269-V329 HydrophobicContact CD1-CG2 4.21Å; F269-V329 HydrophobicContact CD2-CB 4.41Å; F269-V329 HydrophobicContact CD2-CG1 4.18Å; F269-V329 HydrophobicContact CD2-CG2 4.48Å; F269-V329 HydrophobicContact CE2-CG1 4.25Å; F269-V329 HydrophobicContact CG-CB 4.37Å; F269-V329 HydrophobicContact CG-CG1 4.32Å; F269-V329 HydrophobicContact CG-CG2 3.95Å; F269-V329 HydrophobicContact CZ-CG1 4.44Å; L326-V329 HydrophobicContact CD1-CG2 3.7Å; L326-V329 HydrophobicContact CD2-CG2 3.68Å; L326-V329 HydrophobicContact CG-CG2 4.01Å; V329-F344 HydrophobicContact CG1-CB 4.1Å; V329-F344 HydrophobicContact CG1-CD1 4.46Å; V329-Y345 WeakPolarHBondContact CA-O 3.4Å
330	F	95.9	Very high	88.4	Confident	51 Å²	51	44 Å²	44	22%	0.224	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.9	171.8	-167.3	-93.7	0	0	0	110.6	A332 Y345 L450 A451 V452	F330-A332 HydrophobicContact CD1-CB 4.34Å; F330-A332 HydrophobicContact CE1-CB 4.24Å; F330-Y345 PolarHBondContact N-O 2.88Å; F330-Y345 PolarHBondContact O-N 2.73Å; F330-L450 HydrophobicContact CB-CD2 4.4Å; F330-L450 HydrophobicContact CB-CG 4.11Å; F330-L450 WeakPolarHBondContact CD2-O 3.32Å; F330-A451 HydrophobicContact CD2-CB 4.11Å; F330-A451 HydrophobicContact CE2-CB 3.86Å; F330-A451 HydrophobicContact CZ-CB 4.4Å; F330-V452 HydrophobicContact CB-CG2 4.43Å; F330-V452 HydrophobicContact CD1-CB 3.67Å; F330-V452 HydrophobicContact CD1-CG2 3.62Å; F330-V452 HydrophobicContact CE1-CB 3.73Å; F330-V452 HydrophobicContact CE1-CG2 4.21Å; F330-V452 HydrophobicContact CG-CG2 4.24Å
331	T	93.9	Very high	88.5	Confident	43 Å²	43	41.7 Å²	41.7	26%	0.264	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.2	179.4	-56.1	0	0	0	0	109.4	A249 I251 T342 F344	A249-T331 HydrophobicContact CB-CG2 4.24Å; A249-T331 WeakPolarHBondContact CB-OG1 3.16Å; I251-T331 HydrophobicContact CD1-CG2 4.17Å; T331-T342 HydrophobicContact CG2-CG2 3.54Å; T331-F344 HydrophobicContact CG2-CD1 3.91Å; T331-F344 HydrophobicContact CG2-CE1 3.63Å; T331-F344 WeakPolarHBondContact OG1-CD1 3.37Å
332	A	90.6	Very high	88.7	Confident	9 Å²	9	39.3 Å²	39.3	7%	0.074	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	131.2	179.4	0	0	0	0	0	111.4	F330 T342 H343 Y345 L454	F330-A332 HydrophobicContact CD1-CB 4.34Å; F330-A332 HydrophobicContact CE1-CB 4.24Å; A332-T342 WeakPolarHBondContact O-CA 3.48Å; A332-H343 PolarHBondContact N-O 2.81Å; A332-H343 PolarHBondContact O-N 3.1Å; A332-Y345 HydrophobicContact CB-CD2 4.38Å; A332-Y345 HydrophobicContact CB-CE2 4.04Å; A332-L454 HydrophobicContact CB-CD1 4.42Å
333	Q	87.8	Confident	88.9	Confident	79 Å²	79	34.5 Å²	34.5	37%	0.369	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116	172.8	-69.2	-177.8	-1.3	0	0	109.7	L454 R461	Q333-L454 WeakPolarHBondContact O-CD1 3.45Å; Q333-R461 PolarHBondContact O-NH1 2.97Å
334	H	83.1	Confident	89	Confident	57 Å²	57	34.1 Å²	34.1	26%	0.264	21%	0.205	S	C	.	.	S	Bend	trans	-74.3	-28.8	-178.4	-79.3	-114	0	0	0	112.8	S341 H343 Y345 R461	H334-S341 PolarHBondContact N-O 3.48Å; H334-S341 PolarHBondContact N-OG 3.49Å; H334-H343 AromaticContact CD2-CG 3.78Å; H334-H343 AromaticContact CD2-ND1 3.32Å; H334-H343 PolarHBondContact CD2-ND1 2.89Å; H334-H343 VanDerWaalsContact CD2-ND1 3.32Å; H334-H343 AromaticContact CG-ND1 3.99Å; H334-Y345 PolarHBondContact NE2-OH 3.32Å; H334-R461 VanDerWaalsContact C-NH1 3.32Å; H334-R461 WeakPolarHBondContact O-CD 3.35Å; H334-R461 PolarHBondContact O-NH1 2.87Å
335	S	78.7	Confident	89.2	Confident	52 Å²	52	33.4 Å²	33.4	36%	0.364	20%	0.201	S	C	.	.	S	Bend	trans	-123.8	112.5	175.2	-62.4	0	0	0	0	108.7	G337 D338 S341	S335-G337 PolarHBondContact O-N 2.87Å; S335-D338 PolarHBondContact O-N 3.4Å; S335-S341 PolarHBondContact N-OG 2.86Å; S335-S341 PolarHBondContact O-OG 2.95Å
336	P	75.9	Confident	89.3	Confident	88 Å²	88	32.4 Å²	32.4	57%	0.571	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	125.1	-179	-24.8	34.3	0	0	0	111.6	D338 A458	P336-D338 VanDerWaalsContact C-N 3.35Å; P336-A458 HydrophobicContact CG-CB 4.27Å
337	G	71.8	Confident	89.3	Confident	50 Å²	50	32.2 Å²	32.2	52%	0.515	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	-8.1	-179.1	0	0	0	0	0	115.6	A254 S335 P339	A254-G337 WeakPolarHBondContact CB-O 3.47Å; S335-G337 PolarHBondContact O-N 2.87Å; G337-P339 WeakPolarHBondContact O-CD 3.27Å
338	D	80.9	Confident	89.4	Confident	54 Å²	54	31.2 Å²	31.2	29%	0.289	19%	0.189	S	C	.	.			trans	-101.5	106.9	168	169.5	27.2	0	0	0	110.4	S335 P336 S340 S341	S335-D338 PolarHBondContact O-N 3.4Å; P336-D338 VanDerWaalsContact C-N 3.35Å; D338-S340 VanDerWaalsContact CG-OG 3.23Å; D338-S340 PolarHBondContact O-N 3.14Å; D338-S340 VanDerWaalsContact OD1-CB 3.29Å; D338-S340 WeakPolarHBondContact OD1-CB 3.2Å; D338-S340 PolarHBondContact OD1-N 3.46Å; D338-S340 PolarHBondContact OD1-OG 2.71Å; D338-S340 PolarHBondContact OD2-OG 2.88Å; D338-S341 WeakPolarHBondContact O-CB 3.33Å; D338-S341 PolarHBondContact O-N 2.77Å; D338-S341 PolarHBondContact O-OG 2.82Å; D338-S341 WeakPolarHBondContact OD2-CB 3.04Å; D338-S341 PolarHBondContact OD2-N 2.84Å
339	P	83.5	Confident	89.2	Confident	8 Å²	8	31.9 Å²	31.9	5%	0.052	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-65.6	-25.8	178.7	27	-33.5	0	0	0	112.6	I251 G337 S341 T342 L365	I251-P339 HydrophobicContact CG2-CB 3.79Å; G337-P339 WeakPolarHBondContact O-CD 3.27Å; P339-S341 VanDerWaalsContact C-N 3.26Å; P339-S341 PolarHBondContact O-N 2.91Å; P339-T342 VanDerWaalsContact O-CB 3.25Å; P339-T342 WeakPolarHBondContact O-CB 3.32Å; P339-T342 PolarHBondContact O-N 2.82Å; P339-T342 VanDerWaalsContact O-N 3.11Å; P339-T342 PolarHBondContact O-OG1 2.93Å; P339-L365 WeakPolarHBondContact O-CD2 3.14Å
340	S	84.3	Confident	88.8	Confident	72 Å²	72	32.4 Å²	32.4	50%	0.503	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-67.6	-27.6	-178.5	80.4	0	0	0	0	112.8	D338 T342	D338-S340 VanDerWaalsContact CG-OG 3.23Å; D338-S340 PolarHBondContact O-N 3.14Å; D338-S340 VanDerWaalsContact OD1-CB 3.29Å; D338-S340 WeakPolarHBondContact OD1-CB 3.2Å; D338-S340 PolarHBondContact OD1-N 3.46Å; D338-S340 PolarHBondContact OD1-OG 2.71Å; D338-S340 PolarHBondContact OD2-OG 2.88Å; S340-T342 PolarHBondContact O-N 2.84Å; S340-T342 VanDerWaalsContact O-N 3.17Å
341	S	87.3	Confident	88.1	Confident	13 Å²	13	32.5 Å²	32.5	9%	0.091	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-67.9	-2.5	171.8	81	0	0	0	0	115.2	H334 S335 D338 P339 H343	H334-S341 PolarHBondContact N-O 3.48Å; H334-S341 PolarHBondContact N-OG 3.49Å; S335-S341 PolarHBondContact N-OG 2.86Å; S335-S341 PolarHBondContact O-OG 2.95Å; D338-S341 WeakPolarHBondContact O-CB 3.33Å; D338-S341 PolarHBondContact O-N 2.77Å; D338-S341 PolarHBondContact O-OG 2.82Å; D338-S341 WeakPolarHBondContact OD2-CB 3.04Å; D338-S341 PolarHBondContact OD2-N 2.84Å; P339-S341 VanDerWaalsContact C-N 3.26Å; P339-S341 PolarHBondContact O-N 2.91Å; S341-H343 PolarHBondContact O-N 2.9Å; S341-H343 PolarHBondContact O-ND1 2.8Å
342	T	92.1	Very high	87.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	129.4	-178	-54.9	0	0	0	0	111.7	I251 T331 A332 P339 S340 F344 L365	I251-T342 HydrophobicContact CD1-CG2 3.8Å; T331-T342 HydrophobicContact CG2-CG2 3.54Å; A332-T342 WeakPolarHBondContact O-CA 3.48Å; P339-T342 VanDerWaalsContact O-CB 3.25Å; P339-T342 WeakPolarHBondContact O-CB 3.32Å; P339-T342 PolarHBondContact O-N 2.82Å; P339-T342 VanDerWaalsContact O-N 3.11Å; P339-T342 PolarHBondContact O-OG1 2.93Å; S340-T342 PolarHBondContact O-N 2.84Å; S340-T342 VanDerWaalsContact O-N 3.17Å; T342-F344 HydrophobicContact CG2-CE1 4.2Å; T342-F344 HydrophobicContact CG2-CE2 4.28Å; T342-F344 HydrophobicContact CG2-CZ 3.96Å; T342-L365 WeakPolarHBondContact O-CB 3.37Å; T342-L365 PolarHBondContact O-N 3.1Å
343	H	93.5	Very high	86.2	Confident	53 Å²	53	42.1 Å²	42.1	25%	0.245	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.1	173	-70.7	71.2	0	0	0	110.6	A332 H334 S341 Y345 V362	A332-H343 PolarHBondContact N-O 2.81Å; A332-H343 PolarHBondContact O-N 3.1Å; H334-H343 AromaticContact CD2-CG 3.78Å; H334-H343 AromaticContact CD2-ND1 3.32Å; H334-H343 PolarHBondContact CD2-ND1 2.89Å; H334-H343 VanDerWaalsContact CD2-ND1 3.32Å; H334-H343 AromaticContact CG-ND1 3.99Å; S341-H343 PolarHBondContact O-N 2.9Å; S341-H343 PolarHBondContact O-ND1 2.8Å; H343-Y345 HydrophobicContact CB-CD2 4.45Å; H343-Y345 HydrophobicContact CB-CE2 4Å; H343-V362 HydrophobicContact CB-CG1 3.97Å
344	F	96.6	Very high	84.7	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	110.6	174.8	-55.9	-79.3	0	0	0	108.5	A249 I251 Y267 F269 V329 T331 T342 G346 V362 F363 L365 I368	A249-F344 HydrophobicContact CB-CE1 4.13Å; I251-F344 HydrophobicContact CD1-CE1 4.45Å; I251-F344 HydrophobicContact CD1-CZ 4.25Å; I251-F344 HydrophobicContact CG1-CZ 4.35Å; Y267-F344 HydrophobicContact CD2-CZ 4.46Å; Y267-F344 HydrophobicContact CG-CZ 4.43Å; F269-F344 HydrophobicContact CE1-CD1 4.39Å; F269-F344 HydrophobicContact CE1-CG 4.32Å; F269-F344 AromaticContact CE2-CD1 3.81Å; F269-F344 HydrophobicContact CE2-CD1 3.81Å; F269-F344 AromaticContact CE2-CE1 3.95Å; F269-F344 HydrophobicContact CE2-CE1 3.95Å; F269-F344 HydrophobicContact CZ-CB 4.27Å; F269-F344 AromaticContact CZ-CD1 3.4Å; F269-F344 HydrophobicContact CZ-CD1 3.4Å; F269-F344 VanDerWaalsContact CZ-CD1 3.4Å; F269-F344 HydrophobicContact CZ-CD2 4.23Å; F269-F344 AromaticContact CZ-CE1 3.68Å; F269-F344 HydrophobicContact CZ-CE1 3.68Å; F269-F344 HydrophobicContact CZ-CE2 4.45Å; F269-F344 AromaticContact CZ-CG 3.7Å; F269-F344 HydrophobicContact CZ-CG 3.7Å; F269-F344 HydrophobicContact CZ-CZ 4.19Å; V329-F344 HydrophobicContact CG1-CB 4.1Å; V329-F344 HydrophobicContact CG1-CD1 4.46Å; T331-F344 HydrophobicContact CG2-CD1 3.91Å; T331-F344 HydrophobicContact CG2-CE1 3.63Å; T331-F344 WeakPolarHBondContact OG1-CD1 3.37Å; T342-F344 HydrophobicContact CG2-CE1 4.2Å; T342-F344 HydrophobicContact CG2-CE2 4.28Å; T342-F344 HydrophobicContact CG2-CZ 3.96Å; F344-G346 PolarHBondContact O-N 2.72Å; F344-V362 WeakPolarHBondContact O-CA 3.35Å; F344-F363 PolarHBondContact N-O 2.96Å; F344-F363 PolarHBondContact O-N 3.44Å; F344-L365 HydrophobicContact CE2-CB 4.15Å; F344-L365 HydrophobicContact CE2-CD1 3.84Å; F344-L365 HydrophobicContact CZ-CD1 4.11Å; F344-I368 HydrophobicContact CD2-CD1 3.46Å; F344-I368 VanDerWaalsContact CD2-CD1 3.46Å; F344-I368 HydrophobicContact CE2-CD1 3.72Å; F344-I368 HydrophobicContact CG-CD1 4.47Å
345	Y	96.6	Very high	83.9	Confident	5 Å²	5	46.5 Å²	46.5	2%	0.02	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	107.3	173.6	-66.2	-108.5	0	0	0	107.7	V329 F330 A332 H334 H343 V362 V452 L466	V329-Y345 WeakPolarHBondContact CA-O 3.4Å; F330-Y345 PolarHBondContact N-O 2.88Å; F330-Y345 PolarHBondContact O-N 2.73Å; A332-Y345 HydrophobicContact CB-CD2 4.38Å; A332-Y345 HydrophobicContact CB-CE2 4.04Å; H334-Y345 PolarHBondContact NE2-OH 3.32Å; H343-Y345 HydrophobicContact CB-CD2 4.45Å; H343-Y345 HydrophobicContact CB-CE2 4Å; Y345-V362 HydrophobicContact CD1-CB 4.47Å; Y345-V362 HydrophobicContact CD1-CG1 4.21Å; Y345-V362 HydrophobicContact CD1-CG2 3.5Å; Y345-V362 VanDerWaalsContact CD1-CG2 3.5Å; Y345-V362 HydrophobicContact CD2-CG1 4.3Å; Y345-V362 HydrophobicContact CE1-CG1 4.16Å; Y345-V362 HydrophobicContact CE1-CG2 3.64Å; Y345-V362 HydrophobicContact CE2-CG1 4.24Å; Y345-V362 HydrophobicContact CG-CG1 4.27Å; Y345-V362 HydrophobicContact CG-CG2 4.2Å; Y345-V452 HydrophobicContact CD1-CG2 4.01Å; Y345-V452 HydrophobicContact CD2-CG2 3.96Å; Y345-V452 HydrophobicContact CE1-CG1 4.41Å; Y345-V452 HydrophobicContact CE1-CG2 4.36Å; Y345-V452 HydrophobicContact CE2-CG1 4.24Å; Y345-V452 HydrophobicContact CE2-CG2 4.31Å; Y345-V452 HydrophobicContact CG-CG2 3.8Å; Y345-L466 HydrophobicContact CD1-CD2 3.76Å; Y345-L466 HydrophobicContact CE1-CD2 3.79Å
346	G	97.1	Very high	83.8	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134.7	178.2	0	0	0	0	0	111.4	F344 F348 V360 C361	F344-G346 PolarHBondContact O-N 2.72Å; G346-F348 VanDerWaalsContact C-CE2 3.46Å; G346-F348 VanDerWaalsContact O-CD2 3.3Å; G346-F348 WeakPolarHBondContact O-CD2 3.37Å; G346-F348 WeakPolarHBondContact O-CE2 3.47Å; G346-V360 WeakPolarHBondContact O-CA 3.45Å; G346-C361 PolarHBondContact N-O 2.73Å; G346-C361 PolarHBondContact O-N 2.69Å
347	L	97.3	Very high	84.3	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	128.8	171.7	-177.5	67.9	0	0	0	109.3	L326 T327 D328 V360 Y447 L468	L326-L347 WeakPolarHBondContact CD1-O 3.45Å; T327-L347 PolarHBondContact N-O 2.67Å; T327-L347 WeakPolarHBondContact OG1-CD2 3.44Å; T327-L347 VanDerWaalsContact OG1-CG 3.29Å; T327-L347 WeakPolarHBondContact OG1-CG 3.46Å; T327-L347 PolarHBondContact OG1-O 3.49Å; D328-L347 HydrophobicContact CB-CB 4.16Å; D328-L347 HydrophobicContact CB-CD2 4.22Å; D328-L347 PolarHBondContact O-N 2.78Å; L347-V360 HydrophobicContact CD1-CG2 3.81Å; L347-Y447 HydrophobicContact CD1-CD2 4.11Å; L347-Y447 HydrophobicContact CD1-CG 4.39Å; L347-L468 HydrophobicContact CD1-CD2 4.17Å
348	F	96	Very high	85.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.2	-173.1	-60.7	-98.5	0	0	0	112.3	P284 C314 Y323 I325 L326 G346 S358 A359 C361 F363	P284-F348 HydrophobicContact CB-CE1 3.88Å; P284-F348 HydrophobicContact CG-CD1 4.16Å; P284-F348 HydrophobicContact CG-CE1 3.65Å; C314-F348 HydrophobicContact CB-CD1 4.08Å; C314-F348 HydrophobicContact CB-CD2 3.85Å; C314-F348 HydrophobicContact CB-CE1 4.19Å; C314-F348 HydrophobicContact CB-CE2 3.99Å; C314-F348 HydrophobicContact CB-CG 3.92Å; C314-F348 HydrophobicContact CB-CZ 4.15Å; Y323-F348 WeakPolarHBondContact O-CD1 3.38Å; I325-F348 CarbonylContact O-C 3.58Å; I325-F348 WeakPolarHBondContact O-CA 3.38Å; L326-F348 HydrophobicContact CB-CD1 4.15Å; L326-F348 HydrophobicContact CB-CE1 4.02Å; L326-F348 HydrophobicContact CD1-CD1 3.97Å; L326-F348 HydrophobicContact CD1-CD2 4.3Å; L326-F348 HydrophobicContact CD1-CE1 3.52Å; L326-F348 HydrophobicContact CD1-CE2 3.86Å; L326-F348 HydrophobicContact CD1-CG 4.34Å; L326-F348 HydrophobicContact CD1-CZ 3.45Å; L326-F348 VanDerWaalsContact CD1-CZ 3.45Å; L326-F348 HydrophobicContact CG-CE1 4.34Å; G346-F348 VanDerWaalsContact C-CE2 3.46Å; G346-F348 VanDerWaalsContact O-CD2 3.3Å; G346-F348 WeakPolarHBondContact O-CD2 3.37Å; G346-F348 WeakPolarHBondContact O-CE2 3.47Å; F348-S358 CarbonylContact O-C 3.55Å; F348-S358 WeakPolarHBondContact O-CA 3.35Å; F348-A359 PolarHBondContact N-O 2.99Å; F348-A359 PolarHBondContact O-N 2.77Å; F348-C361 HydrophobicContact CD2-CB 4.13Å; F348-C361 HydrophobicContact CE2-CB 3.75Å; F348-F363 AromaticContact CE2-CE2 3.7Å; F348-F363 HydrophobicContact CE2-CE2 3.7Å; F348-F363 HydrophobicContact CE2-CZ 4.19Å; F348-F363 AromaticContact CZ-CE2 3.54Å; F348-F363 HydrophobicContact CZ-CE2 3.54Å; F348-F363 AromaticContact CZ-CZ 3.83Å; F348-F363 HydrophobicContact CZ-CZ 3.83Å
349	T	93.1	Very high	85.9	Confident	24 Å²	24	38.8 Å²	38.8	15%	0.147	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	172.1	164.6	61.3	0	0	0	0	110	Y323 N324 I325 T327 I357	Y323-T349 CarbonylContact C-O 3.55Å; Y323-T349 WeakPolarHBondContact CA-O 3.36Å; N324-T349 PolarHBondContact N-O 3.12Å; N324-T349 VanDerWaalsContact N-O 3.1Å; I325-T349 WeakPolarHBondContact CB-OG1 3.18Å; I325-T349 PolarHBondContact N-O 2.87Å; I325-T349 VanDerWaalsContact N-O 3.08Å; I325-T349 PolarHBondContact O-N 3.28Å; T327-T349 HydrophobicContact CG2-CG2 3.95Å; T349-I357 WeakPolarHBondContact CA-O 3.38Å
350	S	88.8	Confident	86.5	Confident	19 Å²	19	38.4 Å²	38.4	13%	0.133	20%	0.202	C	C	.	.			trans	-107.6	137	177.2	-162.2	0	0	0	0	110.6	R322	R322-S350 PolarHBondContact O-OG 2.85Å
351	Q	82.5	Confident	87.1	Confident	53 Å²	53	35 Å²	35	25%	0.248	18%	0.178	C	C	.	.	S	Bend	trans	-76.6	-21.2	-176.5	77.4	-172.2	-6.3	0	0	114.4	N324 I325	N324-Q351 PolarHBondContact ND2-NE2 3.42Å; N324-Q351 PolarHBondContact ND2-OE1 3.39Å; N324-Q351 WeakPolarHBondContact OD1-CG 3.4Å; N324-Q351 PolarHBondContact OD1-N 2.88Å; I325-Q351 HydrophobicContact CD1-CB 3.97Å; I325-Q351 HydrophobicContact CG1-CB 3.87Å
352	W	73.6	Confident	87.4	Confident	190 Å²	190	36.2 Å²	36.2	72%	0.72	19%	0.185	S	C	*	.	S	Bend	trans	-106.3	-3.7	-171.3	-61.6	131.9	0	0	0	114.1
353	E	69.8	Low	87.6	Confident	64 Å²	64	36.5 Å²	36.5	30%	0.299	19%	0.186	S	C	.	.			trans	-86.2	127.6	-177.1	-73.6	-69.4	152.3	0	0	111	Q321 N355 I357	Q321-E353 PolarHBondContact NE2-OE1 2.92Å; E353-N355 PolarHBondContact O-N 3.46Å; E353-I357 HydrophobicContact CB-CD1 4.28Å; E353-I357 HydrophobicContact CB-CG1 4.45Å; E353-I357 HydrophobicContact CG-CD1 3.91Å
354	P	56.5	Low	87.7	Confident	121 Å²	121	34.7 Å²	34.7	79%	0.786	18%	0.179	S	C	*	.	S	Bend	trans	-75.9	-11.8	178.4	31.7	-36	0	0	0	113.3
355	N	65.3	Low	87.6	Confident	107 Å²	107	35.2 Å²	35.2	57%	0.572	18%	0.182	S	C	*	.	S	Bend	trans	-105.7	144.2	173.7	-63.9	-52	0	0	0	109.1	E353 I357	E353-N355 PolarHBondContact O-N 3.46Å; N355-I357 PolarHBondContact O-N 3.1Å
356	D	77.1	Confident	87.4	Confident	74 Å²	74	41.5 Å²	41.5	40%	0.396	21%	0.21	S	C	.	.			trans	-62.7	103.6	173.5	-64.7	-72.5	0	0	0	110.7	K443 G444 I445 K446	D356-K443 CarbonylContact O-C 3.58Å; D356-G444 CarbonylContact O-C 3.53Å; D356-G444 WeakPolarHBondContact O-CA 3.29Å; D356-G444 PolarHBondContact O-N 3.16Å; D356-I445 PolarHBondContact O-N 2.85Å; D356-I445 VanDerWaalsContact O-N 3.16Å; D356-K446 HydrophobicContact CB-CB 4.12Å
357	I	87.6	Confident	87.3	Confident	7 Å²	7	44.7 Å²	44.7	4%	0.036	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	122.7	173.1	-52.6	-175.2	0	0	0	108.8	Y323 T349 E353 N355 V441 R442 K443	Y323-I357 HydrophobicContact CE1-CG2 3.73Å; T349-I357 WeakPolarHBondContact CA-O 3.38Å; E353-I357 HydrophobicContact CB-CD1 4.28Å; E353-I357 HydrophobicContact CB-CG1 4.45Å; E353-I357 HydrophobicContact CG-CD1 3.91Å; N355-I357 PolarHBondContact O-N 3.1Å; I357-V441 HydrophobicContact CG2-CG1 3.91Å; I357-R442 WeakPolarHBondContact CA-O 3.44Å; I357-K443 HydrophobicContact CD1-CD 4.03Å; I357-K443 HydrophobicContact CD1-CG 3.99Å; I357-K443 HydrophobicContact CG1-CB 4.34Å; I357-K443 HydrophobicContact CG1-CG 4.04Å; I357-K443 HydrophobicContact CG2-CG 4.26Å
358	S	92.4	Very high	87.3	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.007	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.9	173.6	-57.2	0	0	0	0	110.7	F348 R442 I445 K446 Y447	F348-S358 CarbonylContact O-C 3.55Å; F348-S358 WeakPolarHBondContact O-CA 3.35Å; S358-R442 PolarHBondContact N-O 3.21Å; S358-R442 PolarHBondContact O-N 3.03Å; S358-I445 WeakPolarHBondContact CB-O 3.47Å; S358-I445 PolarHBondContact OG-O 3.3Å; S358-K446 WeakPolarHBondContact OG-CA 3.18Å; S358-Y447 PolarHBondContact OG-N 2.97Å
359	A	93.6	Very high	87.1	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	148	175.3	0	0	0	0	0	111.3	Y323 F348 P438 L440 V441	Y323-A359 HydrophobicContact CD1-CB 3.74Å; Y323-A359 HydrophobicContact CD2-CB 3.59Å; Y323-A359 HydrophobicContact CE1-CB 3.97Å; Y323-A359 HydrophobicContact CE2-CB 3.84Å; Y323-A359 HydrophobicContact CG-CB 3.55Å; F348-A359 PolarHBondContact N-O 2.99Å; F348-A359 PolarHBondContact O-N 2.77Å; A359-P438 HydrophobicContact CB-CB 4.23Å; A359-L440 CarbonylContact C-O 3.6Å; A359-L440 WeakPolarHBondContact CA-O 3.41Å; A359-V441 HydrophobicContact CB-CG2 4.17Å
360	V	95.9	Very high	87.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.3	172.9	-177.3	0	0	0	0	108.5	G346 L347 P438 L439 L440 L450 L466 L468	G346-V360 WeakPolarHBondContact O-CA 3.45Å; L347-V360 HydrophobicContact CD1-CG2 3.81Å; V360-P438 CarbonylContact O-C 3.58Å; V360-P438 WeakPolarHBondContact O-CA 3.36Å; V360-L439 PolarHBondContact O-N 3.14Å; V360-L440 HydrophobicContact CB-CB 4.27Å; V360-L440 HydrophobicContact CG2-CB 4.34Å; V360-L440 HydrophobicContact CG2-CD2 4.42Å; V360-L440 PolarHBondContact N-O 3.24Å; V360-L450 HydrophobicContact CG1-CD2 4.35Å; V360-L466 HydrophobicContact CG1-CD1 4.19Å; V360-L468 HydrophobicContact CG2-CD1 4.47Å; V360-L468 HydrophobicContact CG2-CD2 4.04Å
361	C	95.8	Very high	87.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	151.2	172.6	-85.5	0	0	0	0	110.1	C314 G346 F348 F363 A436 A437 P438	C314-C361 WeakPolarHBondContact CA-SG 3.34Å; C314-C361 HydrophobicContact CB-CB 3.76Å; C314-C361 WeakPolarHBondContact CB-SG 3.47Å; C314-C361 WeakPolarHBondContact SG-CB 3.3Å; C314-C361 CovalentContact SG-SG 2.04Å; C314-C361 PolarHBondContact SG-SG 2.94Å; G346-C361 PolarHBondContact N-O 2.73Å; G346-C361 PolarHBondContact O-N 2.69Å; F348-C361 HydrophobicContact CD2-CB 4.13Å; F348-C361 HydrophobicContact CE2-CB 3.75Å; C361-F363 HydrophobicContact CB-CE2 3.77Å; C361-F363 HydrophobicContact CB-CZ 3.87Å; C361-A436 HydrophobicContact CB-CB 4.12Å; C361-A437 VanDerWaalsContact SG-C 3.59Å; C361-P438 VanDerWaalsContact SG-CA 3.51Å
362	V	95.1	Very high	88.2	Confident	39 Å²	39	49 Å²	49	24%	0.236	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.3	179.4	-167.7	0	0	0	0	109.2	H343 F344 Y345 A436 L439	H343-V362 HydrophobicContact CB-CG1 3.97Å; F344-V362 WeakPolarHBondContact O-CA 3.35Å; Y345-V362 HydrophobicContact CD1-CB 4.47Å; Y345-V362 HydrophobicContact CD1-CG1 4.21Å; Y345-V362 HydrophobicContact CD1-CG2 3.5Å; Y345-V362 VanDerWaalsContact CD1-CG2 3.5Å; Y345-V362 HydrophobicContact CD2-CG1 4.3Å; Y345-V362 HydrophobicContact CE1-CG1 4.16Å; Y345-V362 HydrophobicContact CE1-CG2 3.64Å; Y345-V362 HydrophobicContact CE2-CG1 4.24Å; Y345-V362 HydrophobicContact CG-CG1 4.27Å; Y345-V362 HydrophobicContact CG-CG2 4.2Å; V362-A436 WeakPolarHBondContact O-CB 3.33Å; V362-L439 HydrophobicContact CG2-CD2 3.82Å
363	F	95.9	Very high	89.1	Confident	5 Å²	5	43.8 Å²	43.8	2%	0.022	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	128.2	179	-55	-88.2	0	0	0	109.5	L312 F344 F348 C361 I368 V434 A436	L312-F363 HydrophobicContact CB-CE1 4.28Å; L312-F363 HydrophobicContact CB-CZ 4.13Å; L312-F363 HydrophobicContact CD2-CD1 4.03Å; L312-F363 HydrophobicContact CD2-CE1 4.2Å; L312-F363 HydrophobicContact CD2-CG 4.23Å; F344-F363 PolarHBondContact N-O 2.96Å; F344-F363 PolarHBondContact O-N 3.44Å; F348-F363 AromaticContact CE2-CE2 3.7Å; F348-F363 HydrophobicContact CE2-CE2 3.7Å; F348-F363 HydrophobicContact CE2-CZ 4.19Å; F348-F363 AromaticContact CZ-CE2 3.54Å; F348-F363 HydrophobicContact CZ-CE2 3.54Å; F348-F363 AromaticContact CZ-CZ 3.83Å; F348-F363 HydrophobicContact CZ-CZ 3.83Å; C361-F363 HydrophobicContact CB-CE2 3.77Å; C361-F363 HydrophobicContact CB-CZ 3.87Å; F363-I368 HydrophobicContact CB-CD1 4.11Å; F363-I368 HydrophobicContact CB-CG1 4.5Å; F363-V434 HydrophobicContact CD1-CB 4.33Å; F363-V434 HydrophobicContact CD1-CG1 3.81Å; F363-V434 WeakPolarHBondContact CE1-O 3.38Å; F363-A436 HydrophobicContact CD1-CB 3.81Å; F363-A436 HydrophobicContact CE1-CB 3.46Å; F363-A436 VanDerWaalsContact CE1-CB 3.46Å; F363-A436 HydrophobicContact CZ-CB 3.9Å
364	S	94.8	Very high	90.3	Very high	15 Å²	15	41.4 Å²	41.4	11%	0.105	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	148.3	175.1	81.2	0	0	0	0	110.8	F366 D367 I368	S364-F366 PolarHBondContact O-N 3.02Å; S364-F366 PolarHBondContact OG-N 3.04Å; S364-D367 PolarHBondContact O-N 2.89Å; S364-D367 WeakPolarHBondContact OG-CB 3.49Å; S364-D367 PolarHBondContact OG-N 3.15Å; S364-D367 PolarHBondContact OG-OD2 2.77Å; S364-I368 WeakPolarHBondContact O-CG1 3.44Å; S364-I368 PolarHBondContact O-N 3.49Å
365	L	94.2	Very high	92	Very high	12 Å²	12	39 Å²	39	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-31.1	170.8	-177.7	67.3	0	0	0	111.7	I251 Y267 P339 T342 F344 S369	I251-L365 HydrophobicContact CG2-CD2 3.94Å; Y267-L365 HydrophobicContact CE1-CD1 4.17Å; Y267-L365 HydrophobicContact CE2-CD1 3.82Å; Y267-L365 WeakPolarHBondContact OH-CD1 3.49Å; P339-L365 WeakPolarHBondContact O-CD2 3.14Å; T342-L365 WeakPolarHBondContact O-CB 3.37Å; T342-L365 PolarHBondContact O-N 3.1Å; F344-L365 HydrophobicContact CE2-CB 4.15Å; F344-L365 HydrophobicContact CE2-CD1 3.84Å; F344-L365 HydrophobicContact CZ-CD1 4.11Å; L365-S369 VanDerWaalsContact O-CB 3.28Å; L365-S369 WeakPolarHBondContact O-CB 3.49Å; L365-S369 PolarHBondContact O-N 2.59Å; L365-S369 PolarHBondContact O-OG 2.85Å
366	F	92.8	Very high	93.3	Very high	138 Å²	138	34.8 Å²	34.8	61%	0.605	18%	0.184	S	C	*	.	H	α-helix	trans	-61.1	-50	176.6	178.3	-98	0	0	0	112.1	S364 S369 K370	S364-F366 PolarHBondContact O-N 3.02Å; S364-F366 PolarHBondContact OG-N 3.04Å; F366-S369 PolarHBondContact O-N 3.41Å; F366-K370 WeakPolarHBondContact O-CB 3.44Å; F366-K370 PolarHBondContact O-N 2.85Å
367	D	95.1	Very high	93.8	Very high	69 Å²	69	33.8 Å²	33.8	37%	0.369	18%	0.177	S	C	.	.	H	α-helix	trans	-66.9	-39.1	-180	-65.4	-53.9	0	0	0	112.1	S364 K370 V371 V434	S364-D367 PolarHBondContact O-N 2.89Å; S364-D367 WeakPolarHBondContact OG-CB 3.49Å; S364-D367 PolarHBondContact OG-N 3.15Å; S364-D367 PolarHBondContact OG-OD2 2.77Å; D367-K370 PolarHBondContact O-N 3.41Å; D367-V371 WeakPolarHBondContact O-CG2 3.45Å; D367-V371 PolarHBondContact O-N 2.98Å; D367-V371 VanDerWaalsContact O-N 3.08Å; D367-V434 HydrophobicContact CB-CG1 4.03Å
368	I	96.5	Very high	93.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.6	-47	173.9	-66.1	167.8	0	0	0	110.2	Y267 V286 F344 F363 S364 V371 M372 V434	Y267-I368 HydrophobicContact CE1-CG2 3.99Å; V286-I368 HydrophobicContact CG1-CG2 4.08Å; V286-I368 HydrophobicContact CG2-CG2 4.36Å; F344-I368 HydrophobicContact CD2-CD1 3.46Å; F344-I368 VanDerWaalsContact CD2-CD1 3.46Å; F344-I368 HydrophobicContact CE2-CD1 3.72Å; F344-I368 HydrophobicContact CG-CD1 4.47Å; F363-I368 HydrophobicContact CB-CD1 4.11Å; F363-I368 HydrophobicContact CB-CG1 4.5Å; S364-I368 WeakPolarHBondContact O-CG1 3.44Å; S364-I368 PolarHBondContact O-N 3.49Å; I368-V371 PolarHBondContact O-N 3.43Å; I368-M372 HydrophobicContact CG2-CE 4.47Å; I368-M372 HydrophobicContact CG2-CG 4.36Å; I368-M372 VanDerWaalsContact O-CG 3.31Å; I368-M372 WeakPolarHBondContact O-CG 3.35Å; I368-M372 PolarHBondContact O-N 2.65Å; I368-V434 HydrophobicContact CG1-CG1 4.07Å; I368-V434 HydrophobicContact CG1-CG2 4.14Å
369	S	93.8	Very high	92.2	Very high	31 Å²	31	41.2 Å²	41.2	22%	0.217	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-44.1	-179.6	-58.3	0	0	0	0	111.4	L365 F366 V371 M372 D373	L365-S369 VanDerWaalsContact O-CB 3.28Å; L365-S369 WeakPolarHBondContact O-CB 3.49Å; L365-S369 PolarHBondContact O-N 2.59Å; L365-S369 PolarHBondContact O-OG 2.85Å; F366-S369 PolarHBondContact O-N 3.41Å; S369-V371 VanDerWaalsContact C-N 3.27Å; S369-V371 PolarHBondContact O-N 3.03Å; S369-M372 PolarHBondContact O-N 3.13Å; S369-D373 WeakPolarHBondContact O-CB 3.14Å; S369-D373 PolarHBondContact O-N 3.25Å
370	K	94.9	Very high	90.6	Very high	140 Å²	140	47.9 Å²	47.9	61%	0.609	24%	0.242	S	C	*	.	H	α-helix	trans	-56.8	-36.5	174	179.6	-176.8	174.8	-173.2	0	113.2	F366 D367 G374	F366-K370 WeakPolarHBondContact O-CB 3.44Å; F366-K370 PolarHBondContact O-N 2.85Å; D367-K370 PolarHBondContact O-N 3.41Å; K370-G374 PolarHBondContact O-N 3.05Å
371	V	96.6	Very high	88.6	Confident	15 Å²	15	56.1 Å²	56.1	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-76.1	-41.6	176.1	167.9	0	0	0	0	112	A310 D367 I368 S369 D373 G374 M430 N432 V434	A310-V371 HydrophobicContact CB-CG1 3.76Å; D367-V371 WeakPolarHBondContact O-CG2 3.45Å; D367-V371 PolarHBondContact O-N 2.98Å; D367-V371 VanDerWaalsContact O-N 3.08Å; I368-V371 PolarHBondContact O-N 3.43Å; S369-V371 VanDerWaalsContact C-N 3.27Å; S369-V371 PolarHBondContact O-N 3.03Å; V371-D373 PolarHBondContact O-N 3.36Å; V371-G374 WeakPolarHBondContact O-CA 3.43Å; V371-G374 PolarHBondContact O-N 3.34Å; V371-M430 HydrophobicContact CG1-CB 4.16Å; V371-N432 HydrophobicContact CG1-CB 4.25Å; V371-N432 WeakPolarHBondContact CG1-O 3.49Å; V371-N432 HydrophobicContact CG2-CB 4.32Å; V371-V434 HydrophobicContact CB-CG2 3.95Å; V371-V434 HydrophobicContact CG1-CG2 4.1Å; V371-V434 HydrophobicContact CG2-CG2 3.93Å
372	M	95	Very high	86.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.7	-28.7	173.9	-66.3	-66.5	-177.3	0	0	112.6	V286 R288 L308 A310 I368 S369 G374 R396 M430	V286-M372 HydrophobicContact CG1-CE 4.03Å; V286-M372 WeakPolarHBondContact O-CE 3.45Å; R288-M372 HydrophobicContact CB-CE 4.25Å; R288-M372 HydrophobicContact CB-SD 4.5Å; L308-M372 HydrophobicContact CB-SD 3.65Å; A310-M372 HydrophobicContact CB-CE 3.77Å; A310-M372 HydrophobicContact CB-SD 4.21Å; I368-M372 HydrophobicContact CG2-CE 4.47Å; I368-M372 HydrophobicContact CG2-CG 4.36Å; I368-M372 VanDerWaalsContact O-CG 3.31Å; I368-M372 WeakPolarHBondContact O-CG 3.35Å; I368-M372 PolarHBondContact O-N 2.65Å; S369-M372 PolarHBondContact O-N 3.13Å; M372-G374 VanDerWaalsContact C-N 3.32Å; M372-R396 PolarHBondContact O-NH2 3.11Å; M372-M430 VanDerWaalsContact O-CE 3.3Å; M372-M430 WeakPolarHBondContact O-CE 3.25Å; M372-M430 HydrophobicContact SD-CG 4.01Å
373	D	93.5	Very high	84.6	Confident	81 Å²	81	64.3 Å²	64.3	43%	0.433	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	8.9	175	-57.8	-20.5	0	0	0	112.3	R288 S369 V371 R396	R288-D373 IonicContact CZ-OD1 2.67Å; R288-D373 IonicContact NH1-OD1 2.74Å; R288-D373 PolarHBondContact NH1-OD1 2.9Å; R288-D373 IonicContact NH2-OD1 2.89Å; S369-D373 WeakPolarHBondContact O-CB 3.14Å; S369-D373 PolarHBondContact O-N 3.25Å; V371-D373 PolarHBondContact O-N 3.36Å; D373-R396 VanDerWaalsContact C-CZ 3.46Å; D373-R396 VanDerWaalsContact O-CZ 3.28Å; D373-R396 PolarHBondContact O-NH1 3.17Å; D373-R396 PolarHBondContact O-NH2 3.35Å
374	G	93.3	Very high	82.2	Confident	13 Å²	13	72.4 Å²	72.4	13%	0.134	37%	0.37	C	S	.	.	S	Bend	trans	-87.1	-168	174	0	0	0	0	0	115.2	K370 V371 M372 R396 M430	K370-G374 PolarHBondContact O-N 3.05Å; V371-G374 WeakPolarHBondContact O-CA 3.43Å; V371-G374 PolarHBondContact O-N 3.34Å; M372-G374 VanDerWaalsContact C-N 3.32Å; G374-R396 PolarHBondContact O-NH2 3.29Å; G374-M430 VanDerWaalsContact O-CE 3.29Å; G374-M430 WeakPolarHBondContact O-CE 3.49Å
375	P	93.3	Very high	79.8	Confident	71 Å²	71	77.2 Å²	77.2	46%	0.461	39%	0.394	S	S	.	.			trans	-72.1	149.8	177.1	27.8	-32.4	0	0	0	113.1	E431	P375-E431 HydrophobicContact CB-CB 4.49Å; P375-E431 HydrophobicContact CG-CB 4.22Å; P375-E431 WeakPolarHBondContact O-CB 3.27Å; P375-E431 PolarHBondContact O-N 3.24Å
376	F	92.3	Very high	77.5	Confident	18 Å²	18	87.1 Å²	87.1	8%	0.079	43%	0.431	C	S	.	.	B	Isolated β-bridge	trans	-82.5	151.8	176	-63	-90.6	0	0	0	111.6	L308 V392 P397 F423 H427 M430	L308-F376 HydrophobicContact CD2-CE1 3.68Å; F376-V392 HydrophobicContact CD2-CG1 4.44Å; F376-V392 HydrophobicContact CD2-CG2 3.99Å; F376-V392 HydrophobicContact CE2-CG1 3.88Å; F376-V392 HydrophobicContact CE2-CG2 4.24Å; F376-P397 HydrophobicContact CE1-CB 4.43Å; F376-P397 HydrophobicContact CZ-CB 3.92Å; F376-P397 HydrophobicContact CZ-CG 4.35Å; F376-F423 HydrophobicContact CB-CE1 4.29Å; F376-F423 HydrophobicContact CB-CZ 4.44Å; F376-F423 HydrophobicContact CD1-CE1 4.06Å; F376-F423 AromaticContact CD2-CE1 3.63Å; F376-F423 HydrophobicContact CD2-CE1 3.63Å; F376-F423 HydrophobicContact CD2-CZ 4.04Å; F376-F423 HydrophobicContact CE1-CE1 4.26Å; F376-F423 AromaticContact CE2-CE1 3.89Å; F376-F423 HydrophobicContact CE2-CE1 3.89Å; F376-F423 AromaticContact CG-CE1 3.73Å; F376-F423 HydrophobicContact CG-CE1 3.73Å; F376-F423 HydrophobicContact CG-CZ 4.25Å; F376-F423 HydrophobicContact CZ-CE1 4.2Å; F376-H427 HydrophobicContact CB-CB 4.3Å; F376-H427 HydrophobicContact CD1-CB 4.34Å; F376-H427 VanDerWaalsContact CD1-O 3.27Å; F376-H427 WeakPolarHBondContact CD1-O 3.35Å; F376-M430 HydrophobicContact CD1-CE 4.1Å; F376-M430 HydrophobicContact CD1-SD 4.04Å; F376-M430 HydrophobicContact CE1-CE 4.2Å; F376-M430 HydrophobicContact CE1-SD 4.12Å; F376-M430 HydrophobicContact CG-CE 4.37Å
377	K	88.6	Confident	75.2	Confident	54 Å²	54	86.8 Å²	86.8	24%	0.235	44%	0.436	C	S	.	.			trans	-85.1	113	175.7	-169.6	149.8	-155	88.1	0	110.6	E276 L379 L429 E431	E276-K377 HydrophobicContact CB-CD 4.27Å; K377-L379 PolarHBondContact O-N 3.28Å; K377-L429 HydrophobicContact CB-CB 4.34Å; K377-L429 HydrophobicContact CB-CD2 4.26Å; K377-L429 HydrophobicContact CB-CG 4.01Å; K377-L429 WeakPolarHBondContact CB-O 3.46Å; K377-L429 HydrophobicContact CD-CD2 3.77Å; K377-L429 HydrophobicContact CD-CG 4.2Å; K377-L429 HydrophobicContact CG-CD2 4.29Å; K377-L429 PolarHBondContact N-O 2.71Å; K377-E431 HydrophobicContact CB-CB 4.44Å; K377-E431 WeakPolarHBondContact CB-OE2 3.37Å; K377-E431 WeakPolarHBondContact CD-OE2 3.36Å; K377-E431 WeakPolarHBondContact CG-OE2 3.34Å; K377-E431 IonicContact NZ-OE1 3.99Å; K377-E431 PolarHBondContact NZ-OE1 3.18Å; K377-E431 IonicContact NZ-OE2 2.86Å; K377-E431 PolarHBondContact NZ-OE2 3.24Å
378	E	78.7	Confident	73.2	Confident	84 Å²	84	88.8 Å²	88.8	39%	0.393	46%	0.455	S	S	.	.			trans	-83.2	104.8	173	-69.6	-173.6	170.2	0	0	110.4	K380 P389 E390	E378-K380 PolarHBondContact O-N 2.74Å; E378-K380 VanDerWaalsContact O-N 3.11Å; E378-P389 WeakPolarHBondContact OE1-CA 3.45Å; E378-E390 PolarHBondContact OE1-N 2.93Å
379	L	66.3	Low	71.5	Confident	80 Å²	80	93.4 Å²	93.4	42%	0.419	49%	0.485	S	S	.	.			trans	-76.4	97.1	171.2	-171.3	80.7	0	0	0	109.2	K275 K377 K381	K275-L379 HydrophobicContact CD-CD2 4.18Å; K377-L379 PolarHBondContact O-N 3.28Å; L379-K381 PolarHBondContact O-N 2.9Å
380	K	59.5	Low	70.3	Confident	141 Å²	141	96.1 Å²	96.1	61%	0.613	49%	0.494	S	S	*	.			trans	-53	107.4	177.9	-71.5	-169.3	174.7	-170.3	0	110.8	E378 T382	E378-K380 PolarHBondContact O-N 2.74Å; E378-K380 VanDerWaalsContact O-N 3.11Å; K380-T382 PolarHBondContact O-N 3.05Å
381	K	54.8	Low	69.7	Low	172 Å²	172	94.3 Å²	94.3	75%	0.748	50%	0.495	S	S	*	.	S	Bend	trans	-72	-24.1	-173.1	-101.5	176.3	177	168.7	0	114.4	L379	L379-K381 PolarHBondContact O-N 2.9Å
382	T	53.4	Low	69.4	Low	87 Å²	87	97.1 Å²	97.1	53%	0.534	51%	0.512	S	S	.	.			trans	-152.2	153.3	170.8	48.6	0	0	0	0	109.9	K380 E384	K380-T382 PolarHBondContact O-N 3.05Å; T382-E384 VanDerWaalsContact C-N 3.27Å; T382-E384 PolarHBondContact O-N 3.29Å
383	C	52.8	Low	69.3	Low	124 Å²	124	97.7 Å²	97.7	84%	0.838	52%	0.516	S	S	*	.	S	Bend	trans	-75.7	-12.6	177.2	-65.4	0	0	0	0	113.9
384	E	45.7	Very low	69.2	Low	175 Å²	175	99.8 Å²	99.8	82%	0.818	53%	0.532	S	S	*	.	S	Bend	trans	-92.6	-18.7	-164.9	-62.3	-169.9	138.9	0	0	115.1	T382	T382-E384 VanDerWaalsContact C-N 3.27Å; T382-E384 PolarHBondContact O-N 3.29Å
385	N	46	Very low	69.1	Low	116 Å²	116	99.9 Å²	99.9	62%	0.62	53%	0.53	S	S	*	.			trans	-119.4	101	176.5	-76.9	-39.9	0	0	0	110.8	N387	N385-N387 PolarHBondContact O-N 3.39Å
386	W	44.2	Very low	69.2	Low	221 Å²	221	99.7 Å²	99.7	84%	0.837	52%	0.52	S	S	*	.			trans	-70.9	68.9	161.2	-80.5	80	0	0	0	109.8
387	N	46.1	Very low	69.3	Low	131 Å²	131	98.8 Å²	98.8	70%	0.701	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-62.7	137.9	162.6	-69	-13.4	0	0	0	108	N385	N385-N387 PolarHBondContact O-N 3.39Å
388	S	52.4	Low	69.5	Low	111 Å²	111	96.4 Å²	96.4	78%	0.776	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-53.7	142.8	172.8	-56.3	0	0	0	0	110.4	E390	S388-E390 PolarHBondContact O-N 3.43Å
389	P	61.6	Low	70.1	Confident	96 Å²	96	95.4 Å²	95.4	62%	0.623	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-53.4	137.2	-179.6	21.8	-33.3	0	0	0	110.8	E378 T391	E378-P389 WeakPolarHBondContact OE1-CA 3.45Å; P389-T391 PolarHBondContact O-N 3.33Å; P389-T391 VanDerWaalsContact O-N 3.15Å
390	E	68.4	Low	71.4	Confident	89 Å²	89	91.8 Å²	91.8	42%	0.416	48%	0.483	S	S	.	.			trans	-73.2	113.9	-169.4	-169.6	178.3	171.6	0	0	109.6	E378 S388 V392 F423 H427	E378-E390 PolarHBondContact OE1-N 2.93Å; S388-E390 PolarHBondContact O-N 3.43Å; E390-V392 PolarHBondContact O-N 2.87Å; E390-F423 HydrophobicContact CB-CE2 4.16Å; E390-F423 HydrophobicContact CG-CD2 4.23Å; E390-F423 HydrophobicContact CG-CE2 4.09Å; E390-H427 IonicContact OE2-CE1 2.68Å
391	T	82.3	Confident	72.9	Confident	102 Å²	102	85.5 Å²	85.5	63%	0.626	46%	0.456	S	S	*	.			trans	-56.8	116	-179.5	56	0	0	0	0	110.7	P389	P389-T391 PolarHBondContact O-N 3.33Å; P389-T391 VanDerWaalsContact O-N 3.15Å
392	V	89.8	Confident	74.5	Confident	73 Å²	73	78.7 Å²	78.7	44%	0.442	43%	0.428	S	S	.	.			trans	-53.9	120.9	179.2	-178.4	0	0	0	0	109.5	F376 E390 P397 F423	F376-V392 HydrophobicContact CD2-CG1 4.44Å; F376-V392 HydrophobicContact CD2-CG2 3.99Å; F376-V392 HydrophobicContact CE2-CG1 3.88Å; F376-V392 HydrophobicContact CE2-CG2 4.24Å; E390-V392 PolarHBondContact O-N 2.87Å; V392-P397 HydrophobicContact CG1-CG 4.15Å; V392-F423 HydrophobicContact CG2-CZ 4.04Å
393	P	93.1	Very high	76.2	Confident	13 Å²	13	78.6 Å²	78.6	8%	0.084	42%	0.424	C	S	.	.			trans	-75.5	167.3	-176.2	31.2	-36.2	0	0	0	112.6	P395 P397 K419 V420 F423	P393-P395 CarbonylContact O-C 3.59Å; P393-P395 VanDerWaalsContact O-O 3.11Å; P393-P397 HydrophobicContact CG-CG 3.79Å; P393-P397 WeakPolarHBondContact O-CD 3.22Å; P393-K419 HydrophobicContact CB-CD 4.07Å; P393-K419 HydrophobicContact CB-CG 4.14Å; P393-K419 HydrophobicContact CG-CG 4.47Å; P393-V420 HydrophobicContact CB-CG2 4Å; P393-V420 HydrophobicContact CG-CB 4.43Å; P393-V420 HydrophobicContact CG-CG2 4.04Å; P393-F423 HydrophobicContact CG-CB 3.94Å; P393-F423 HydrophobicContact CG-CD2 4.35Å; P393-F423 HydrophobicContact CG-CG 4.13Å
394	T	90.7	Very high	78	Confident	125 Å²	125	77.6 Å²	77.6	77%	0.767	41%	0.41	S	S	*	.	S	Bend	trans	-117.2	136.2	177.6	54	0	0	0	0	110.9
395	P	92.4	Very high	80.1	Confident	14 Å²	14	69.9 Å²	69.9	9%	0.091	37%	0.374	C	S	.	.	S	Bend	cis	-57.7	157.9	-6.7	-25.3	36.2	0	0	0	113.7	P393 L405 F410 L416 V420	P393-P395 CarbonylContact O-C 3.59Å; P393-P395 VanDerWaalsContact O-O 3.11Å; P395-L405 HydrophobicContact CB-CD1 4.34Å; P395-L405 HydrophobicContact CB-CD2 3.76Å; P395-L405 HydrophobicContact CG-CD2 3.75Å; P395-F410 HydrophobicContact CG-CD2 3.8Å; P395-F410 HydrophobicContact CG-CE1 4.41Å; P395-F410 HydrophobicContact CG-CE2 3.49Å; P395-F410 VanDerWaalsContact CG-CE2 3.49Å; P395-F410 HydrophobicContact CG-CG 4.39Å; P395-F410 HydrophobicContact CG-CZ 3.83Å; P395-L416 HydrophobicContact CG-CD2 4.48Å; P395-V420 WeakPolarHBondContact O-CG1 3.44Å; P395-V420 WeakPolarHBondContact O-CG2 3.25Å
396	R	94.2	Very high	82.2	Confident	67 Å²	67	68.3 Å²	68.3	25%	0.253	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-59.8	127.8	-175.2	-177.7	-174.8	167.6	106	12.4	110.7	M372 D373 G374 G398 Q399	M372-R396 PolarHBondContact O-NH2 3.11Å; D373-R396 VanDerWaalsContact C-CZ 3.46Å; D373-R396 VanDerWaalsContact O-CZ 3.28Å; D373-R396 PolarHBondContact O-NH1 3.17Å; D373-R396 PolarHBondContact O-NH2 3.35Å; G374-R396 PolarHBondContact O-NH2 3.29Å; R396-G398 PolarHBondContact O-N 3.21Å; R396-Q399 HydrophobicContact CB-CB 4.22Å; R396-Q399 WeakPolarHBondContact O-CB 3.3Å; R396-Q399 PolarHBondContact O-N 3.29Å
397	P	95	Very high	84.3	Confident	0 Å²	0	62 Å²	62	0%	0	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	137.8	174.3	-23.6	31.9	0	0	0	112	F376 V392 P393 Q399 V420 F423 V424	F376-P397 HydrophobicContact CE1-CB 4.43Å; F376-P397 HydrophobicContact CZ-CB 3.92Å; F376-P397 HydrophobicContact CZ-CG 4.35Å; V392-P397 HydrophobicContact CG1-CG 4.15Å; P393-P397 HydrophobicContact CG-CG 3.79Å; P393-P397 WeakPolarHBondContact O-CD 3.22Å; P397-Q399 VanDerWaalsContact C-N 3.27Å; P397-Q399 PolarHBondContact O-N 3.25Å; P397-V420 HydrophobicContact CB-CG1 4.27Å; P397-V420 HydrophobicContact CG-CG1 4.15Å; P397-F423 HydrophobicContact CB-CD1 3.82Å; P397-F423 HydrophobicContact CB-CE1 4.48Å; P397-F423 HydrophobicContact CG-CB 4.21Å; P397-F423 HydrophobicContact CG-CD1 3.45Å; P397-F423 VanDerWaalsContact CG-CD1 3.45Å; P397-F423 HydrophobicContact CG-CE1 4.07Å; P397-F423 HydrophobicContact CG-CG 4.01Å; P397-V424 HydrophobicContact CB-CB 4.03Å
398	G	92.1	Very high	86.5	Confident	3 Å²	3	61 Å²	61	3%	0.031	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	5.8	177	0	0	0	0	0	116.4	R288 R396	R288-G398 PolarHBondContact NH2-O 3.08Å; R396-G398 PolarHBondContact O-N 3.21Å
399	Q	92.3	Very high	88.3	Confident	64 Å²	64	57.6 Å²	57.6	30%	0.299	33%	0.331	S	S	.	.			trans	-84.9	142.6	176.7	-164.4	-165.5	-51.4	0	0	111.7	R396 P397	R396-Q399 HydrophobicContact CB-CB 4.22Å; R396-Q399 WeakPolarHBondContact O-CB 3.3Å; R396-Q399 PolarHBondContact O-N 3.29Å; P397-Q399 VanDerWaalsContact C-N 3.27Å; P397-Q399 PolarHBondContact O-N 3.25Å
400	C	92.4	Very high	89.6	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.02	31%	0.309	C	S	.	.			trans	-70.5	155.3	171.3	-53.6	0	0	0	0	112.7	D262 D263 K265 C290 N402	D262-C400 WeakPolarHBondContact OD1-CB 3.42Å; D263-C400 HydrophobicContact CB-CB 3.89Å; K265-C400 VanDerWaalsContact CE-SG 3.57Å; C290-C400 HydrophobicContact CB-CB 3.9Å; C290-C400 WeakPolarHBondContact CB-SG 3.43Å; C290-C400 WeakPolarHBondContact SG-CA 3.37Å; C290-C400 WeakPolarHBondContact SG-CB 3.48Å; C290-C400 CovalentContact SG-SG 2.03Å; C290-C400 PolarHBondContact SG-SG 2.9Å; C400-N402 PolarHBondContact O-N 3.49Å
401	L	90.5	Very high	90.5	Very high	9 Å²	9	56.9 Å²	56.9	5%	0.047	32%	0.319	C	S	.	.			trans	-81.6	96.9	-177.8	-67.7	175.3	0	0	0	112.3	L405 K406 F410 S412 L416	L401-L405 HydrophobicContact CD2-CB 4.36Å; L401-L405 HydrophobicContact CD2-CD1 4.27Å; L401-K406 WeakPolarHBondContact O-CE 3.5Å; L401-K406 PolarHBondContact O-NZ 3.24Å; L401-F410 HydrophobicContact CD2-CB 4.17Å; L401-S412 VanDerWaalsContact CD1-C 3.48Å; L401-L416 HydrophobicContact CD2-CD2 4.33Å
402	N	90.2	Very high	90.9	Very high	30 Å²	30	53.7 Å²	53.7	16%	0.16	30%	0.301	C	S	.	.			trans	-84.6	174.1	174.5	71	14.9	0	0	0	113.1	G261 C400 N404 L405 K406	G261-N402 WeakPolarHBondContact O-CA 3.35Å; C400-N402 PolarHBondContact O-N 3.49Å; N402-N404 VanDerWaalsContact C-N 3.27Å; N402-N404 PolarHBondContact O-N 3.45Å; N402-N404 PolarHBondContact OD1-N 3.24Å; N402-L405 PolarHBondContact O-N 3.19Å; N402-L405 WeakPolarHBondContact OD1-CG 3.38Å; N402-L405 PolarHBondContact OD1-N 2.73Å; N402-K406 WeakPolarHBondContact O-CG 3.32Å; N402-K406 PolarHBondContact O-N 2.95Å; N402-K406 VanDerWaalsContact O-N 3.09Å
403	N	88.9	Confident	90.9	Very high	85 Å²	85	50.3 Å²	50.3	46%	0.455	28%	0.281	S	S	.	.	H	α-helix	trans	-61.5	-31.5	-178.7	-70.9	-17.4	0	0	0	113.6	T260 G261 K406 A407	T260-N403 WeakPolarHBondContact O-CB 3.39Å; T260-N403 PolarHBondContact O-N 2.91Å; G261-N403 WeakPolarHBondContact CA-ND2 3.46Å; N403-K406 PolarHBondContact O-N 2.92Å; N403-A407 WeakPolarHBondContact O-CB 3.42Å; N403-A407 PolarHBondContact O-N 2.95Å
404	N	90.3	Very high	90.9	Very high	102 Å²	102	53.3 Å²	53.3	55%	0.545	30%	0.295	S	S	.	.	H	α-helix	trans	-67.4	-44.4	177	-177.3	22.9	0	0	0	111.7	N402 K406 A407 Q408	N402-N404 VanDerWaalsContact C-N 3.27Å; N402-N404 PolarHBondContact O-N 3.45Å; N402-N404 PolarHBondContact OD1-N 3.24Å; N404-K406 VanDerWaalsContact C-N 3.35Å; N404-A407 PolarHBondContact O-N 3.35Å; N404-Q408 WeakPolarHBondContact O-CG 3.33Å; N404-Q408 PolarHBondContact O-N 2.87Å; N404-Q408 VanDerWaalsContact O-N 3.09Å; N404-Q408 PolarHBondContact OD1-NE2 2.84Å
405	L	89.6	Confident	91	Very high	13 Å²	13	52.4 Å²	52.4	7%	0.068	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-38	175.8	-69.6	177.3	0	0	0	111.9	P395 L401 N402 A407 Q408 G409 F410	P395-L405 HydrophobicContact CB-CD1 4.34Å; P395-L405 HydrophobicContact CB-CD2 3.76Å; P395-L405 HydrophobicContact CG-CD2 3.75Å; L401-L405 HydrophobicContact CD2-CB 4.36Å; L401-L405 HydrophobicContact CD2-CD1 4.27Å; N402-L405 PolarHBondContact O-N 3.19Å; N402-L405 WeakPolarHBondContact OD1-CG 3.38Å; N402-L405 PolarHBondContact OD1-N 2.73Å; L405-A407 VanDerWaalsContact C-N 3.35Å; L405-A407 PolarHBondContact O-N 2.91Å; L405-Q408 PolarHBondContact O-N 2.97Å; L405-Q408 VanDerWaalsContact O-N 3.15Å; L405-G409 PolarHBondContact O-N 2.94Å; L405-F410 HydrophobicContact CB-CB 4.39Å; L405-F410 HydrophobicContact CB-CD2 4.49Å; L405-F410 HydrophobicContact CD2-CD2 4.25Å; L405-F410 WeakPolarHBondContact O-CB 3.41Å; L405-F410 PolarHBondContact O-N 2.84Å
406	K	89.1	Confident	91.1	Very high	83 Å²	83	53 Å²	53	36%	0.361	28%	0.283	S	S	.	.	H	α-helix	trans	-60.7	-43.2	172.7	-68.2	164.8	-175.7	158.1	0	111.4	L401 N402 N403 N404 Q408 G409	L401-K406 WeakPolarHBondContact O-CE 3.5Å; L401-K406 PolarHBondContact O-NZ 3.24Å; N402-K406 WeakPolarHBondContact O-CG 3.32Å; N402-K406 PolarHBondContact O-N 2.95Å; N402-K406 VanDerWaalsContact O-N 3.09Å; N403-K406 PolarHBondContact O-N 2.92Å; N404-K406 VanDerWaalsContact C-N 3.35Å; K406-Q408 PolarHBondContact O-N 3.14Å; K406-G409 PolarHBondContact O-N 2.93Å
407	A	89.5	Confident	91.1	Very high	90 Å²	90	52.1 Å²	52.1	74%	0.744	29%	0.286	S	S	*	.	H	α-helix	trans	-64.5	-25.2	175.1	0	0	0	0	0	113.9	N403 N404 L405 G409	N403-A407 WeakPolarHBondContact O-CB 3.42Å; N403-A407 PolarHBondContact O-N 2.95Å; N404-A407 PolarHBondContact O-N 3.35Å; L405-A407 VanDerWaalsContact C-N 3.35Å; L405-A407 PolarHBondContact O-N 2.91Å; A407-G409 VanDerWaalsContact C-N 3.25Å; A407-G409 PolarHBondContact O-N 3.31Å
408	Q	91.4	Very high	91	Very high	108 Å²	108	54.8 Å²	54.8	51%	0.505	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	2.7	172.1	-66.1	169.1	34.8	0	0	113.4	N404 L405 K406 F410	N404-Q408 WeakPolarHBondContact O-CG 3.33Å; N404-Q408 PolarHBondContact O-N 2.87Å; N404-Q408 VanDerWaalsContact O-N 3.09Å; N404-Q408 PolarHBondContact OD1-NE2 2.84Å; L405-Q408 PolarHBondContact O-N 2.97Å; L405-Q408 VanDerWaalsContact O-N 3.15Å; K406-Q408 PolarHBondContact O-N 3.14Å; Q408-F410 HydrophobicContact CB-CD2 4.02Å; Q408-F410 HydrophobicContact CB-CE2 4.1Å
409	G	90.2	Very high	91	Very high	40 Å²	40	60 Å²	60	41%	0.412	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.3	-2.2	178.3	0	0	0	0	0	115.2	L405 K406 A407 E411	L405-G409 PolarHBondContact O-N 2.94Å; K406-G409 PolarHBondContact O-N 2.93Å; A407-G409 VanDerWaalsContact C-N 3.25Å; A407-G409 PolarHBondContact O-N 3.31Å; G409-E411 VanDerWaalsContact C-N 3.34Å; G409-E411 PolarHBondContact O-N 3.05Å; G409-E411 VanDerWaalsContact O-N 3.1Å
410	F	89.4	Confident	91.1	Very high	38 Å²	38	57.3 Å²	57.3	17%	0.167	31%	0.31	C	S	.	.			trans	-86.6	70.3	178.6	-54.5	-69	0	0	0	111.5	P395 L401 L405 Q408 S412 L416 P417	P395-F410 HydrophobicContact CG-CD2 3.8Å; P395-F410 HydrophobicContact CG-CE1 4.41Å; P395-F410 HydrophobicContact CG-CE2 3.49Å; P395-F410 VanDerWaalsContact CG-CE2 3.49Å; P395-F410 HydrophobicContact CG-CG 4.39Å; P395-F410 HydrophobicContact CG-CZ 3.83Å; L401-F410 HydrophobicContact CD2-CB 4.17Å; L405-F410 HydrophobicContact CB-CB 4.39Å; L405-F410 HydrophobicContact CB-CD2 4.49Å; L405-F410 HydrophobicContact CD2-CD2 4.25Å; L405-F410 WeakPolarHBondContact O-CB 3.41Å; L405-F410 PolarHBondContact O-N 2.84Å; Q408-F410 HydrophobicContact CB-CD2 4.02Å; Q408-F410 HydrophobicContact CB-CE2 4.1Å; F410-S412 VanDerWaalsContact C-N 3.3Å; F410-S412 PolarHBondContact O-N 3.23Å; F410-L416 HydrophobicContact CD1-CD2 4.33Å; F410-P417 HydrophobicContact CE1-CG 4.19Å; F410-P417 HydrophobicContact CZ-CG 4.49Å
411	E	87.3	Confident	91.2	Very high	132 Å²	132	57.2 Å²	57.2	62%	0.617	31%	0.309	S	S	*	.			trans	-67.9	-24.5	179.5	-66.8	169.3	-177.1	0	0	114.2	G409 K415	G409-E411 VanDerWaalsContact C-N 3.34Å; G409-E411 PolarHBondContact O-N 3.05Å; G409-E411 VanDerWaalsContact O-N 3.1Å; E411-K415 HydrophobicContact CB-CD 4.33Å; E411-K415 VanDerWaalsContact CD-NZ 3.27Å; E411-K415 IonicContact OE1-NZ 3.76Å; E411-K415 IonicContact OE2-NZ 2.63Å; E411-K415 PolarHBondContact OE2-NZ 2.85Å
412	S	89.6	Confident	91.3	Very high	35 Å²	35	59.1 Å²	59.1	25%	0.245	32%	0.321	C	S	.	.	S	Bend	trans	-154.8	156.7	-174.1	176.4	0	0	0	0	110.8	V294 L401 F410 L414 K415	V294-S412 WeakPolarHBondContact CG2-OG 3.25Å; L401-S412 VanDerWaalsContact CD1-C 3.48Å; F410-S412 VanDerWaalsContact C-N 3.3Å; F410-S412 PolarHBondContact O-N 3.23Å; S412-L414 PolarHBondContact O-N 3.34Å; S412-L414 VanDerWaalsContact O-N 3.14Å; S412-K415 PolarHBondContact O-N 2.84Å
413	S	91	Very high	91.5	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.021	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-58.7	-26	178.8	58.3	0	0	0	0	112.9	D293 V294 G295 T305 K415 L416	D293-S413 PolarHBondContact OD1-OG 2.82Å; V294-S413 WeakPolarHBondContact CG2-OG 3.46Å; V294-S413 PolarHBondContact N-OG 3.4Å; V294-S413 VanDerWaalsContact N-OG 3.15Å; G295-S413 PolarHBondContact N-OG 3.11Å; G295-S413 CarbonylContact O-C 3.44Å; G295-S413 WeakPolarHBondContact O-CB 3.49Å; G295-S413 PolarHBondContact O-OG 2.95Å; T305-S413 WeakPolarHBondContact OG1-CB 3.18Å; S413-K415 PolarHBondContact O-N 3.14Å; S413-L416 WeakPolarHBondContact O-CB 3.43Å; S413-L416 WeakPolarHBondContact O-CG 3.28Å; S413-L416 PolarHBondContact O-N 2.88Å; S413-L416 VanDerWaalsContact O-N 3.15Å
414	L	91.9	Very high	91.7	Very high	76 Å²	76	53.9 Å²	53.9	40%	0.398	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-60.6	-27	173.5	-61.5	173.1	0	0	0	113.2	V294 G295 M297 S412	V294-L414 HydrophobicContact CG2-CD1 4.12Å; V294-L414 HydrophobicContact CG2-CD2 4.3Å; V294-L414 HydrophobicContact CG2-CG 3.78Å; G295-L414 WeakPolarHBondContact O-CD2 3.37Å; G295-L414 PolarHBondContact O-N 2.62Å; M297-L414 HydrophobicContact CB-CB 4.43Å; M297-L414 VanDerWaalsContact CB-O 3.25Å; M297-L414 WeakPolarHBondContact CB-O 3.31Å; S412-L414 PolarHBondContact O-N 3.34Å; S412-L414 VanDerWaalsContact O-N 3.14Å
415	K	92.9	Very high	91.9	Very high	106 Å²	106	53.2 Å²	53.2	46%	0.461	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-89.6	0.6	179.7	-66.5	-176.5	172.9	-179.6	0	113.4	E411 S412 S413	E411-K415 HydrophobicContact CB-CD 4.33Å; E411-K415 VanDerWaalsContact CD-NZ 3.27Å; E411-K415 IonicContact OE1-NZ 3.76Å; E411-K415 IonicContact OE2-NZ 2.63Å; E411-K415 PolarHBondContact OE2-NZ 2.85Å; S412-K415 PolarHBondContact O-N 2.84Å; S413-K415 PolarHBondContact O-N 3.14Å
416	L	94.1	Very high	91.9	Very high	25 Å²	25	55 Å²	55	13%	0.131	29%	0.293	C	S	.	.	S	Bend	trans	-69.7	143.8	179	-69.4	172.1	0	0	0	111.7	P395 L401 F410 S413 L421	P395-L416 HydrophobicContact CG-CD2 4.48Å; L401-L416 HydrophobicContact CD2-CD2 4.33Å; F410-L416 HydrophobicContact CD1-CD2 4.33Å; S413-L416 WeakPolarHBondContact O-CB 3.43Å; S413-L416 WeakPolarHBondContact O-CG 3.28Å; S413-L416 PolarHBondContact O-N 2.88Å; S413-L416 VanDerWaalsContact O-N 3.15Å; L416-L421 HydrophobicContact CB-CD1 4.48Å; L416-L421 HydrophobicContact CB-CD2 3.98Å; L416-L421 HydrophobicContact CB-CG 4.21Å; L416-L421 HydrophobicContact CD1-CD2 4.13Å
417	P	94.8	Very high	92	Very high	50 Å²	50	52.4 Å²	52.4	33%	0.325	28%	0.282	S	S	.	.			trans	-65.1	139.1	179.5	-20.1	32.6	0	0	0	112.8	F410 K419 V420 L421	F410-P417 HydrophobicContact CE1-CG 4.19Å; F410-P417 HydrophobicContact CZ-CG 4.49Å; P417-K419 PolarHBondContact O-N 3.09Å; P417-V420 HydrophobicContact CB-CG2 4.25Å; P417-V420 HydrophobicContact CG-CG2 4.24Å; P417-V420 WeakPolarHBondContact O-CB 3.44Å; P417-V420 PolarHBondContact O-N 3.26Å; P417-L421 PolarHBondContact O-N 3.06Å
418	D	93	Very high	92.3	Very high	56 Å²	56	48.3 Å²	48.3	30%	0.299	25%	0.248	S	C	.	.	H	α-helix	trans	-56.8	-27.1	179.7	-79	-55.9	0	0	0	113.5	K298 T299 L421 T422	K298-D418 IonicContact NZ-OD2 3.92Å; T299-D418 VanDerWaalsContact CB-OD1 3.31Å; T299-D418 WeakPolarHBondContact CB-OD1 3.41Å; T299-D418 PolarHBondContact N-OD1 2.81Å; T299-D418 PolarHBondContact OG1-OD1 2.9Å; D418-L421 PolarHBondContact O-N 3.15Å; D418-T422 VanDerWaalsContact O-CB 3.3Å; D418-T422 WeakPolarHBondContact O-CB 3.3Å; D418-T422 PolarHBondContact O-N 2.99Å; D418-T422 PolarHBondContact O-OG1 2.86Å
419	K	92	Very high	92.4	Very high	113 Å²	113	44.3 Å²	44.3	49%	0.491	23%	0.229	S	C	.	.	H	α-helix	trans	-62.9	-42.4	172.7	-169.4	-178.2	179.6	-171.9	0	112	P393 P417 F423	P393-K419 HydrophobicContact CB-CD 4.07Å; P393-K419 HydrophobicContact CB-CG 4.14Å; P393-K419 HydrophobicContact CG-CG 4.47Å; P417-K419 PolarHBondContact O-N 3.09Å; K419-F423 WeakPolarHBondContact O-CB 3.49Å; K419-F423 PolarHBondContact O-N 2.74Å
420	V	94.3	Very high	92.7	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-66.8	-43	177.6	-179.2	0	0	0	0	110.4	P393 P395 P397 P417 F423 V424	P393-V420 HydrophobicContact CB-CG2 4Å; P393-V420 HydrophobicContact CG-CB 4.43Å; P393-V420 HydrophobicContact CG-CG2 4.04Å; P395-V420 WeakPolarHBondContact O-CG1 3.44Å; P395-V420 WeakPolarHBondContact O-CG2 3.25Å; P397-V420 HydrophobicContact CB-CG1 4.27Å; P397-V420 HydrophobicContact CG-CG1 4.15Å; P417-V420 HydrophobicContact CB-CG2 4.25Å; P417-V420 HydrophobicContact CG-CG2 4.24Å; P417-V420 WeakPolarHBondContact O-CB 3.44Å; P417-V420 PolarHBondContact O-N 3.26Å; V420-F423 PolarHBondContact O-N 2.94Å; V420-V424 PolarHBondContact O-N 3.45Å
421	L	94.9	Very high	92.8	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-68.3	-36.4	179.5	-60.8	-179.5	0	0	0	112.9	T299 L300 T305 L416 P417 D418 V424 R425	T299-L421 HydrophobicContact CG2-CB 3.85Å; L300-L421 HydrophobicContact CD1-CB 4.27Å; L300-L421 HydrophobicContact CD1-CD2 4.45Å; L300-L421 WeakPolarHBondContact CD1-O 3.47Å; T305-L421 HydrophobicContact CG2-CD2 3.45Å; T305-L421 VanDerWaalsContact CG2-CD2 3.45Å; L416-L421 HydrophobicContact CB-CD1 4.48Å; L416-L421 HydrophobicContact CB-CD2 3.98Å; L416-L421 HydrophobicContact CB-CG 4.21Å; L416-L421 HydrophobicContact CD1-CD2 4.13Å; P417-L421 PolarHBondContact O-N 3.06Å; D418-L421 PolarHBondContact O-N 3.15Å; L421-V424 WeakPolarHBondContact O-CG1 3.48Å; L421-R425 WeakPolarHBondContact O-CB 3.32Å; L421-R425 PolarHBondContact O-N 2.96Å
422	T	93.5	Very high	93.2	Very high	48 Å²	48	42.5 Å²	42.5	29%	0.294	21%	0.214	S	C	.	.	H	α-helix	trans	-68	-43.7	174	-56.7	0	0	0	0	110.4	D418 R425 D426	D418-T422 VanDerWaalsContact O-CB 3.3Å; D418-T422 WeakPolarHBondContact O-CB 3.3Å; D418-T422 PolarHBondContact O-N 2.99Å; D418-T422 PolarHBondContact O-OG1 2.86Å; T422-R425 WeakPolarHBondContact O-CB 3.45Å; T422-R425 PolarHBondContact O-N 3.45Å; T422-D426 PolarHBondContact O-N 2.75Å
423	F	93.5	Very high	93.5	Very high	4 Å²	4	43 Å²	43	2%	0.018	22%	0.217	C	C	.	.	H	α-helix	trans	-60.6	-49.1	179	-170	-77.8	0	0	0	112.3	F376 E390 V392 P393 P397 K419 V420 R425 D426 H427	F376-F423 HydrophobicContact CB-CE1 4.29Å; F376-F423 HydrophobicContact CB-CZ 4.44Å; F376-F423 HydrophobicContact CD1-CE1 4.06Å; F376-F423 AromaticContact CD2-CE1 3.63Å; F376-F423 HydrophobicContact CD2-CE1 3.63Å; F376-F423 HydrophobicContact CD2-CZ 4.04Å; F376-F423 HydrophobicContact CE1-CE1 4.26Å; F376-F423 AromaticContact CE2-CE1 3.89Å; F376-F423 HydrophobicContact CE2-CE1 3.89Å; F376-F423 AromaticContact CG-CE1 3.73Å; F376-F423 HydrophobicContact CG-CE1 3.73Å; F376-F423 HydrophobicContact CG-CZ 4.25Å; F376-F423 HydrophobicContact CZ-CE1 4.2Å; E390-F423 HydrophobicContact CB-CE2 4.16Å; E390-F423 HydrophobicContact CG-CD2 4.23Å; E390-F423 HydrophobicContact CG-CE2 4.09Å; V392-F423 HydrophobicContact CG2-CZ 4.04Å; P393-F423 HydrophobicContact CG-CB 3.94Å; P393-F423 HydrophobicContact CG-CD2 4.35Å; P393-F423 HydrophobicContact CG-CG 4.13Å; P397-F423 HydrophobicContact CB-CD1 3.82Å; P397-F423 HydrophobicContact CB-CE1 4.48Å; P397-F423 HydrophobicContact CG-CB 4.21Å; P397-F423 HydrophobicContact CG-CD1 3.45Å; P397-F423 VanDerWaalsContact CG-CD1 3.45Å; P397-F423 HydrophobicContact CG-CE1 4.07Å; P397-F423 HydrophobicContact CG-CG 4.01Å; K419-F423 WeakPolarHBondContact O-CB 3.49Å; K419-F423 PolarHBondContact O-N 2.74Å; V420-F423 PolarHBondContact O-N 2.94Å; F423-R425 VanDerWaalsContact C-N 3.32Å; F423-R425 PolarHBondContact O-N 3.37Å; F423-D426 PolarHBondContact O-N 3.39Å; F423-H427 HydrophobicContact CD1-CB 4.17Å; F423-H427 AromaticContact CD1-ND1 3.94Å; F423-H427 AromaticContact CD2-ND1 3.75Å; F423-H427 HydrophobicContact CE1-CB 3.86Å; F423-H427 AromaticContact CE1-ND1 3.92Å; F423-H427 AromaticContact CE2-ND1 3.74Å; F423-H427 AromaticContact CG-ND1 3.87Å; F423-H427 HydrophobicContact CZ-CB 4.34Å; F423-H427 AromaticContact CZ-ND1 3.82Å; F423-H427 WeakPolarHBondContact O-CB 3.44Å; F423-H427 PolarHBondContact O-N 3.04Å; F423-H427 PolarHBondContact O-ND1 2.95Å
424	V	93.6	Very high	93.7	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-32.2	179.4	71.9	0	0	0	0	112.7	L300 L308 P397 V420 L421 D426	L300-V424 HydrophobicContact CD1-CG1 3.6Å; L308-V424 HydrophobicContact CD2-CG2 4.09Å; P397-V424 HydrophobicContact CB-CB 4.03Å; V420-V424 PolarHBondContact O-N 3.45Å; L421-V424 WeakPolarHBondContact O-CG1 3.48Å; V424-D426 VanDerWaalsContact C-N 3.31Å; V424-D426 PolarHBondContact O-N 3.04Å
425	R	93.2	Very high	93.9	Very high	88 Å²	88	42.6 Å²	42.6	33%	0.332	22%	0.217	S	C	.	.	H	α-helix	trans	-60.7	-42.8	174.4	-175.8	-164.2	69.5	-155.7	-5.7	111.6	W239 L300 L421 T422 F423	W239-R425 PolarHBondContact NE1-O 2.82Å; L300-R425 HydrophobicContact CD1-CB 4.26Å; L300-R425 HydrophobicContact CD2-CB 4.07Å; L300-R425 HydrophobicContact CD2-CG 4.05Å; L300-R425 HydrophobicContact CG-CB 4.33Å; L421-R425 WeakPolarHBondContact O-CB 3.32Å; L421-R425 PolarHBondContact O-N 2.96Å; T422-R425 WeakPolarHBondContact O-CB 3.45Å; T422-R425 PolarHBondContact O-N 3.45Å; F423-R425 VanDerWaalsContact C-N 3.32Å; F423-R425 PolarHBondContact O-N 3.37Å
426	D	91.2	Very high	94	Very high	52 Å²	52	38.1 Å²	38.1	28%	0.278	20%	0.201	S	C	.	.	H	α-helix	trans	-90.7	-24.7	-172.5	-65.3	-16.2	0	0	0	112.6	T422 F423 V424 P428	T422-D426 PolarHBondContact O-N 2.75Å; F423-D426 PolarHBondContact O-N 3.39Å; V424-D426 VanDerWaalsContact C-N 3.31Å; V424-D426 PolarHBondContact O-N 3.04Å; D426-P428 WeakPolarHBondContact O-CD 3.48Å
427	H	91.6	Very high	93.9	Very high	28 Å²	28	40.5 Å²	40.5	13%	0.13	22%	0.224	C	C	.	.			trans	-122.5	62.3	179.9	-52.6	105.3	0	0	0	113.4	F376 E390 F423 L429	F376-H427 HydrophobicContact CB-CB 4.3Å; F376-H427 HydrophobicContact CD1-CB 4.34Å; F376-H427 VanDerWaalsContact CD1-O 3.27Å; F376-H427 WeakPolarHBondContact CD1-O 3.35Å; E390-H427 IonicContact OE2-CE1 2.68Å; F423-H427 HydrophobicContact CD1-CB 4.17Å; F423-H427 AromaticContact CD1-ND1 3.94Å; F423-H427 AromaticContact CD2-ND1 3.75Å; F423-H427 HydrophobicContact CE1-CB 3.86Å; F423-H427 AromaticContact CE1-ND1 3.92Å; F423-H427 AromaticContact CE2-ND1 3.74Å; F423-H427 AromaticContact CG-ND1 3.87Å; F423-H427 HydrophobicContact CZ-CB 4.34Å; F423-H427 AromaticContact CZ-ND1 3.82Å; F423-H427 WeakPolarHBondContact O-CB 3.44Å; F423-H427 PolarHBondContact O-N 3.04Å; F423-H427 PolarHBondContact O-ND1 2.95Å; H427-L429 VanDerWaalsContact C-N 3.34Å
428	P	94.2	Very high	93.8	Very high	4 Å²	4	39.4 Å²	39.4	3%	0.026	22%	0.217	C	C	.	.			trans	-78.8	-12.6	179.1	32.9	-37.5	0	0	0	114.3	N238 W239 F307 K309 D426	N238-P428 HydrophobicContact CB-CG 4.49Å; N238-P428 WeakPolarHBondContact O-CG 3.41Å; W239-P428 HydrophobicContact CG-CG 4.45Å; F307-P428 HydrophobicContact CD1-CB 3.93Å; F307-P428 HydrophobicContact CE1-CB 4.01Å; K309-P428 PolarHBondContact N-O 2.59Å; D426-P428 WeakPolarHBondContact O-CD 3.48Å
429	L	94.8	Very high	93.7	Very high	23 Å²	23	38.2 Å²	38.2	12%	0.12	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-99.7	133.4	-174.5	175.9	61.8	0	0	0	111.2	K309 K377 H427	K309-L429 HydrophobicContact CG-CB 4.23Å; K309-L429 HydrophobicContact CG-CD1 3.93Å; K309-L429 WeakPolarHBondContact O-CA 3.29Å; K377-L429 HydrophobicContact CB-CB 4.34Å; K377-L429 HydrophobicContact CB-CD2 4.26Å; K377-L429 HydrophobicContact CB-CG 4.01Å; K377-L429 WeakPolarHBondContact CB-O 3.46Å; K377-L429 HydrophobicContact CD-CD2 3.77Å; K377-L429 HydrophobicContact CD-CG 4.2Å; K377-L429 HydrophobicContact CG-CD2 4.29Å; K377-L429 PolarHBondContact N-O 2.71Å; H427-L429 VanDerWaalsContact C-N 3.34Å
430	M	95.4	Very high	93.6	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.02	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-79.3	147.6	173.1	-50.5	-44.9	-61.4	0	0	111.6	L308 K309 A310 V371 M372 G374 F376	L308-M430 HydrophobicContact CB-SD 4.35Å; L308-M430 HydrophobicContact CD1-SD 4.22Å; L308-M430 HydrophobicContact CD2-SD 4.24Å; K309-M430 WeakPolarHBondContact O-CG 3.49Å; K309-M430 PolarHBondContact O-N 3.23Å; A310-M430 HydrophobicContact CB-CB 4.31Å; A310-M430 HydrophobicContact CB-CG 4.17Å; V371-M430 HydrophobicContact CG1-CB 4.16Å; M372-M430 VanDerWaalsContact O-CE 3.3Å; M372-M430 WeakPolarHBondContact O-CE 3.25Å; M372-M430 HydrophobicContact SD-CG 4.01Å; G374-M430 VanDerWaalsContact O-CE 3.29Å; G374-M430 WeakPolarHBondContact O-CE 3.49Å; F376-M430 HydrophobicContact CD1-CE 4.1Å; F376-M430 HydrophobicContact CD1-SD 4.04Å; F376-M430 HydrophobicContact CE1-CE 4.2Å; F376-M430 HydrophobicContact CE1-SD 4.12Å; F376-M430 HydrophobicContact CG-CE 4.37Å
431	E	92.4	Very high	93.3	Very high	87 Å²	87	35.5 Å²	35.5	41%	0.407	20%	0.202	S	C	.	.	S	Bend	trans	-72.7	-41.7	179.8	178.9	56.9	-145.9	0	0	112.4	P375 K377	P375-E431 HydrophobicContact CB-CB 4.49Å; P375-E431 HydrophobicContact CG-CB 4.22Å; P375-E431 WeakPolarHBondContact O-CB 3.27Å; P375-E431 PolarHBondContact O-N 3.24Å; K377-E431 HydrophobicContact CB-CB 4.44Å; K377-E431 WeakPolarHBondContact CB-OE2 3.37Å; K377-E431 WeakPolarHBondContact CD-OE2 3.36Å; K377-E431 WeakPolarHBondContact CG-OE2 3.34Å; K377-E431 IonicContact NZ-OE1 3.99Å; K377-E431 PolarHBondContact NZ-OE1 3.18Å; K377-E431 IonicContact NZ-OE2 2.86Å; K377-E431 PolarHBondContact NZ-OE2 3.24Å
432	N	95	Very high	92.8	Very high	82 Å²	82	36.1 Å²	36.1	44%	0.439	20%	0.204	S	C	.	.	S	Bend	trans	-81.7	148.8	179.9	-67.4	-31.7	0	0	0	111.3	V371	V371-N432 HydrophobicContact CG1-CB 4.25Å; V371-N432 WeakPolarHBondContact CG1-O 3.49Å; V371-N432 HydrophobicContact CG2-CB 4.32Å
433	S	95.5	Very high	92.2	Very high	44 Å²	44	41.3 Å²	41.3	31%	0.308	22%	0.223	S	C	.	.			trans	-101.6	154.1	171.6	61.8	0	0	0	0	111.8	T435	S433-T435 PolarHBondContact OG-OG1 2.75Å
434	V	97	Very high	91.3	Very high	7 Å²	7	42.7 Å²	42.7	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	104.3	170.4	-163.9	0	0	0	0	107.3	Q311 L312 V313 F363 D367 I368 V371	Q311-V434 PolarHBondContact O-N 3Å; L312-V434 HydrophobicContact CD2-CB 3.96Å; L312-V434 HydrophobicContact CD2-CG2 4.24Å; V313-V434 PolarHBondContact N-O 3.39Å; F363-V434 HydrophobicContact CD1-CB 4.33Å; F363-V434 HydrophobicContact CD1-CG1 3.81Å; F363-V434 WeakPolarHBondContact CE1-O 3.38Å; D367-V434 HydrophobicContact CB-CG1 4.03Å; I368-V434 HydrophobicContact CG1-CG1 4.07Å; I368-V434 HydrophobicContact CG1-CG2 4.14Å; V371-V434 HydrophobicContact CB-CG2 3.95Å; V371-V434 HydrophobicContact CG1-CG2 4.1Å; V371-V434 HydrophobicContact CG2-CG2 3.93Å
435	T	95.4	Very high	90.7	Very high	64 Å²	64	42.8 Å²	42.8	39%	0.393	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	129.2	-175.9	-48.3	0	0	0	0	111.7	V313 E315 S433	V313-T435 HydrophobicContact CB-CG2 4.23Å; V313-T435 HydrophobicContact CG1-CG2 4.09Å; V313-T435 WeakPolarHBondContact O-CA 3.46Å; E315-T435 HydrophobicContact CG-CG2 3.88Å; S433-T435 PolarHBondContact OG-OG1 2.75Å
436	A	94.8	Very high	90.5	Very high	13 Å²	13	43 Å²	43	11%	0.107	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	146.7	173.3	0	0	0	0	0	110.9	V313 E315 C361 V362 F363	V313-A436 PolarHBondContact O-N 3.07Å; E315-A436 PolarHBondContact N-O 2.97Å; E315-A436 VanDerWaalsContact N-O 3.16Å; C361-A436 HydrophobicContact CB-CB 4.12Å; V362-A436 WeakPolarHBondContact O-CB 3.33Å; F363-A436 HydrophobicContact CD1-CB 3.81Å; F363-A436 HydrophobicContact CE1-CB 3.46Å; F363-A436 VanDerWaalsContact CE1-CB 3.46Å; F363-A436 HydrophobicContact CZ-CB 3.9Å
437	A	92.7	Very high	90.7	Very high	75 Å²	75	40.7 Å²	40.7	62%	0.62	23%	0.229	S	C	*	.			trans	-81.8	145.5	168.4	0	0	0	0	0	110	C361 L439	C361-A437 VanDerWaalsContact SG-C 3.59Å; A437-L439 PolarHBondContact O-N 2.77Å
438	P	92.8	Very high	90.8	Very high	27 Å²	27	41 Å²	41	18%	0.175	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.5	178	28.6	-34.6	0	0	0	111	E315 D316 Y323 A359 V360 C361 V441	E315-P438 WeakPolarHBondContact O-CD 3.32Å; D316-P438 HydrophobicContact CB-CG 3.86Å; Y323-P438 HydrophobicContact CE2-CB 4.43Å; Y323-P438 HydrophobicContact CE2-CG 4.18Å; A359-P438 HydrophobicContact CB-CB 4.23Å; V360-P438 CarbonylContact O-C 3.58Å; V360-P438 WeakPolarHBondContact O-CA 3.36Å; C361-P438 VanDerWaalsContact SG-CA 3.51Å; P438-V441 HydrophobicContact CB-CG2 3.7Å; P438-V441 HydrophobicContact CG-CG2 3.82Å
439	L	90.3	Very high	90.8	Very high	31 Å²	31	43 Å²	43	16%	0.162	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	-33.3	175.2	174.9	60.9	0	0	0	111.9	V360 V362 A437 L466 V480 Q483 A485	V360-L439 PolarHBondContact O-N 3.14Å; V362-L439 HydrophobicContact CG2-CD2 3.82Å; A437-L439 PolarHBondContact O-N 2.77Å; L439-L466 HydrophobicContact CD2-CD1 4.35Å; L439-V480 HydrophobicContact CD1-CG1 3.99Å; L439-V480 HydrophobicContact CD1-CG2 4.46Å; L439-V480 HydrophobicContact CD2-CB 4.43Å; L439-V480 HydrophobicContact CD2-CG1 3.79Å; L439-V480 HydrophobicContact CD2-CG2 3.74Å; L439-V480 HydrophobicContact CG-CG1 4.43Å; L439-V480 HydrophobicContact CG-CG2 4.27Å; L439-Q483 WeakPolarHBondContact CD1-O 3.3Å; L439-A485 HydrophobicContact CD1-CB 4.37Å; L439-A485 HydrophobicContact CG-CB 4.36Å; L439-A485 WeakPolarHBondContact O-CB 3.42Å
440	L	89.4	Confident	90.8	Very high	15 Å²	15	42.1 Å²	42.1	8%	0.079	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	138.4	176.3	178.8	67.4	0	0	0	108.8	A359 V360 R442 Y447 L468 V478 A485	A359-L440 CarbonylContact C-O 3.6Å; A359-L440 WeakPolarHBondContact CA-O 3.41Å; V360-L440 HydrophobicContact CB-CB 4.27Å; V360-L440 HydrophobicContact CG2-CB 4.34Å; V360-L440 HydrophobicContact CG2-CD2 4.42Å; V360-L440 PolarHBondContact N-O 3.24Å; L440-R442 HydrophobicContact CD1-CG 4.07Å; L440-R442 HydrophobicContact CD2-CG 4.22Å; L440-R442 HydrophobicContact CG-CG 4.08Å; L440-Y447 HydrophobicContact CD2-CE2 4.36Å; L440-L468 HydrophobicContact CD2-CD1 3.6Å; L440-V478 HydrophobicContact CD2-CG1 4.38Å; L440-V478 HydrophobicContact CD2-CG2 4.1Å; L440-A485 HydrophobicContact CB-CB 4.2Å; L440-A485 HydrophobicContact CD1-CB 4.18Å
441	V	88.4	Confident	90.8	Very high	47 Å²	47	42 Å²	42	29%	0.285	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.5	167.2	-179.1	0	0	0	0	108.1	Y323 I357 A359 P438	Y323-V441 HydrophobicContact CE1-CG1 4.48Å; Y323-V441 HydrophobicContact CE2-CG2 4.26Å; Y323-V441 WeakPolarHBondContact OH-CG1 3.49Å; I357-V441 HydrophobicContact CG2-CG1 3.91Å; A359-V441 HydrophobicContact CB-CG2 4.17Å; P438-V441 HydrophobicContact CB-CG2 3.7Å; P438-V441 HydrophobicContact CG-CG2 3.82Å
442	R	83.9	Confident	90.9	Very high	14 Å²	14	38.3 Å²	38.3	5%	0.053	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130.1	176	-65.7	-77.7	-88.2	175.6	-0.8	109	I357 S358 L440 I445 Y447 E490 Q599	I357-R442 WeakPolarHBondContact CA-O 3.44Å; S358-R442 PolarHBondContact N-O 3.21Å; S358-R442 PolarHBondContact O-N 3.03Å; L440-R442 HydrophobicContact CD1-CG 4.07Å; L440-R442 HydrophobicContact CD2-CG 4.22Å; L440-R442 HydrophobicContact CG-CG 4.08Å; R442-I445 HydrophobicContact CB-CB 4.31Å; R442-I445 HydrophobicContact CB-CD1 4.03Å; R442-I445 HydrophobicContact CB-CG1 4.07Å; R442-I445 HydrophobicContact CG-CD1 4.37Å; R442-Y447 HydrophobicContact CB-CE2 4.15Å; R442-Y447 HydrophobicContact CG-CE2 4.03Å; R442-E490 IonicContact CZ-OE1 2.75Å; R442-E490 IonicContact NH2-OE1 3.44Å; R442-E490 PolarHBondContact NH2-OE1 2.9Å; R442-Q599 VanDerWaalsContact NH1-NE2 3.16Å
443	K	80.9	Confident	90.6	Very high	158 Å²	158	35.2 Å²	35.2	69%	0.687	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	142	176.5	-57.1	-167	178.9	-167.3	0	109.7	D356 I357 I445	D356-K443 CarbonylContact O-C 3.58Å; I357-K443 HydrophobicContact CD1-CD 4.03Å; I357-K443 HydrophobicContact CD1-CG 3.99Å; I357-K443 HydrophobicContact CG1-CB 4.34Å; I357-K443 HydrophobicContact CG1-CG 4.04Å; I357-K443 HydrophobicContact CG2-CG 4.26Å; K443-I445 VanDerWaalsContact C-N 3.3Å
444	G	75.4	Confident	90.2	Very high	32 Å²	32	34.8 Å²	34.8	33%	0.33	20%	0.198	S	C	.	.	S	Bend	trans	77.2	10.6	-174.9	0	0	0	0	0	114.6	D356 H619	D356-G444 CarbonylContact O-C 3.53Å; D356-G444 WeakPolarHBondContact O-CA 3.29Å; D356-G444 PolarHBondContact O-N 3.16Å; G444-H619 PolarHBondContact O-CD2 2.92Å; G444-H619 VanDerWaalsContact O-CD2 3.24Å; G444-H619 PolarHBondContact O-NE2 2.75Å
445	I	81.1	Confident	89.2	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.021	20%	0.199	C	C	.	.			trans	-129	129.4	-179.6	-37.6	-164.5	0	0	0	109.2	D356 S358 R442 K443 Y447 T470	D356-I445 PolarHBondContact O-N 2.85Å; D356-I445 VanDerWaalsContact O-N 3.16Å; S358-I445 WeakPolarHBondContact CB-O 3.47Å; S358-I445 PolarHBondContact OG-O 3.3Å; R442-I445 HydrophobicContact CB-CB 4.31Å; R442-I445 HydrophobicContact CB-CD1 4.03Å; R442-I445 HydrophobicContact CB-CG1 4.07Å; R442-I445 HydrophobicContact CG-CD1 4.37Å; K443-I445 VanDerWaalsContact C-N 3.3Å; I445-Y447 HydrophobicContact CG2-CD1 4.02Å; I445-Y447 HydrophobicContact CG2-CE1 3.67Å; I445-T470 HydrophobicContact CG2-CG2 3.84Å
446	K	88.6	Confident	87.8	Confident	93 Å²	93	33.3 Å²	33.3	40%	0.404	19%	0.194	S	C	.	.			trans	-106.8	102.8	171.7	-172.8	176.1	-172.8	168.1	0	109.8	D356 S358 D471	D356-K446 HydrophobicContact CB-CB 4.12Å; S358-K446 WeakPolarHBondContact OG-CA 3.18Å; K446-D471 HydrophobicContact CB-CB 4.39Å; K446-D471 HydrophobicContact CD-CB 4.43Å; K446-D471 PolarHBondContact O-N 3.07Å; K446-D471 VanDerWaalsContact O-N 3.09Å
447	Y	94.3	Very high	86.2	Confident	3 Å²	3	40.6 Å²	40.6	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139.1	172.3	-64.3	-52.4	0	0	0	110.2	L347 S358 L440 R442 I445 L468 G469 T470 H476	L347-Y447 HydrophobicContact CD1-CD2 4.11Å; L347-Y447 HydrophobicContact CD1-CG 4.39Å; S358-Y447 PolarHBondContact OG-N 2.97Å; L440-Y447 HydrophobicContact CD2-CE2 4.36Å; R442-Y447 HydrophobicContact CB-CE2 4.15Å; R442-Y447 HydrophobicContact CG-CE2 4.03Å; I445-Y447 HydrophobicContact CG2-CD1 4.02Å; I445-Y447 HydrophobicContact CG2-CE1 3.67Å; Y447-L468 HydrophobicContact CD1-CB 3.78Å; Y447-L468 HydrophobicContact CD2-CD1 4.27Å; Y447-L468 HydrophobicContact CD2-CD2 4.29Å; Y447-L468 HydrophobicContact CE1-CB 3.8Å; Y447-L468 HydrophobicContact CE1-CD1 4.39Å; Y447-L468 HydrophobicContact CE2-CD1 3.87Å; Y447-L468 HydrophobicContact CG-CB 4.2Å; Y447-L468 HydrophobicContact CG-CD2 4.3Å; Y447-G469 CarbonylContact C-O 3.5Å; Y447-G469 VanDerWaalsContact CA-O 3.27Å; Y447-G469 WeakPolarHBondContact CA-O 3.14Å; Y447-T470 HydrophobicContact CD1-CG2 3.85Å; Y447-T470 HydrophobicContact CE1-CG2 3.85Å; Y447-H476 HydrophobicContact CE1-CB 4.19Å; Y447-H476 AromaticContact CE1-CD2 3.99Å; Y447-H476 AromaticContact CE1-CG 3.85Å
448	T	93.7	Very high	84.3	Confident	33 Å²	33	39.5 Å²	39.5	20%	0.202	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-34.5	-176.9	53.2	0	0	0	0	112.7	G469 D471 V500	T448-G469 PolarHBondContact N-O 2.91Å; T448-G469 PolarHBondContact OG1-O 2.85Å; T448-D471 HydrophobicContact CG2-CB 3.93Å; T448-V500 VanDerWaalsContact CB-O 3.3Å; T448-V500 WeakPolarHBondContact CB-O 3.44Å; T448-V500 PolarHBondContact OG1-O 3.03Å
449	K	95.3	Very high	82.3	Confident	47 Å²	47	47.8 Å²	47.8	20%	0.204	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	150.6	-175.5	-74.4	-59.1	-177.8	179.3	0	113.1	D328 L468 G469 V500 N501 I503	D328-K449 HydrophobicContact CB-CD 4.48Å; D328-K449 VanDerWaalsContact CG-CD 3.47Å; D328-K449 WeakPolarHBondContact OD1-CD 3.33Å; D328-K449 IonicContact OD1-NZ 3.91Å; D328-K449 PolarHBondContact OD1-NZ 2.69Å; D328-K449 WeakPolarHBondContact OD2-CA 3.38Å; D328-K449 WeakPolarHBondContact OD2-CD 3.34Å; D328-K449 IonicContact OD2-NZ 2.6Å; K449-L468 WeakPolarHBondContact O-CA 3.23Å; K449-G469 PolarHBondContact O-N 3.24Å; K449-V500 HydrophobicContact CB-CG1 4.4Å; K449-N501 WeakPolarHBondContact CE-O 3.43Å; K449-N501 WeakPolarHBondContact CG-O 3.42Å; K449-I503 HydrophobicContact CB-CD1 3.86Å; K449-I503 HydrophobicContact CB-CG1 4.01Å
450	L	95.7	Very high	80.6	Confident	5 Å²	5	49 Å²	49	3%	0.026	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133.3	-179.7	170.8	61.2	0	0	0	111	D328 F330 V360 V452 L466 H467 L468	D328-L450 PolarHBondContact OD2-N 3.29Å; F330-L450 HydrophobicContact CB-CD2 4.4Å; F330-L450 HydrophobicContact CB-CG 4.11Å; F330-L450 WeakPolarHBondContact CD2-O 3.32Å; V360-L450 HydrophobicContact CG1-CD2 4.35Å; L450-V452 HydrophobicContact CD1-CG2 4.19Å; L450-V452 HydrophobicContact CG-CG2 4.45Å; L450-L466 HydrophobicContact CD1-CB 4.06Å; L450-L466 HydrophobicContact CD1-CD2 4.36Å; L450-H467 WeakPolarHBondContact CA-O 3.39Å; L450-L468 HydrophobicContact CB-CD2 4.25Å; L450-L468 HydrophobicContact CD1-CD2 3.63Å; L450-L468 HydrophobicContact CD1-CG 4.24Å; L450-L468 HydrophobicContact CG-CD2 4.41Å
451	A	95.3	Very high	79.5	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	158	161.4	0	0	0	0	0	110.9	F330 H467 I503 M505	F330-A451 HydrophobicContact CD2-CB 4.11Å; F330-A451 HydrophobicContact CE2-CB 3.86Å; F330-A451 HydrophobicContact CZ-CB 4.4Å; A451-H467 HydrophobicContact CB-CB 4.35Å; A451-H467 PolarHBondContact N-O 2.77Å; A451-H467 PolarHBondContact O-N 2.96Å; A451-I503 HydrophobicContact CB-CB 4.07Å; A451-I503 HydrophobicContact CB-CG2 3.56Å; A451-M505 HydrophobicContact CB-CG 3.85Å; A451-M505 HydrophobicContact CB-SD 3.75Å
452	V	92.8	Very high	78.5	Confident	10 Å²	10	52 Å²	52	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.5	-176.7	-175.2	0	0	0	0	110.8	F330 Y345 L450 L454 A464 L466	F330-V452 HydrophobicContact CB-CG2 4.43Å; F330-V452 HydrophobicContact CD1-CB 3.67Å; F330-V452 HydrophobicContact CD1-CG2 3.62Å; F330-V452 HydrophobicContact CE1-CB 3.73Å; F330-V452 HydrophobicContact CE1-CG2 4.21Å; F330-V452 HydrophobicContact CG-CG2 4.24Å; Y345-V452 HydrophobicContact CD1-CG2 4.01Å; Y345-V452 HydrophobicContact CD2-CG2 3.96Å; Y345-V452 HydrophobicContact CE1-CG1 4.41Å; Y345-V452 HydrophobicContact CE1-CG2 4.36Å; Y345-V452 HydrophobicContact CE2-CG1 4.24Å; Y345-V452 HydrophobicContact CE2-CG2 4.31Å; Y345-V452 HydrophobicContact CG-CG2 3.8Å; L450-V452 HydrophobicContact CD1-CG2 4.19Å; L450-V452 HydrophobicContact CG-CG2 4.45Å; V452-L454 HydrophobicContact CG1-CD2 4.09Å; V452-A464 HydrophobicContact CG1-CB 3.89Å; V452-L466 HydrophobicContact CG1-CD2 4.16Å; V452-L466 HydrophobicContact CG2-CD2 3.74Å
453	T	89.8	Confident	78.3	Confident	18 Å²	18	51.9 Å²	51.9	11%	0.11	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122.9	170.2	-57.2	0	0	0	0	108.5	M455 A464 V465 H467 M505	T453-M455 HydrophobicContact CG2-SD 4.36Å; T453-A464 CarbonylContact O-C 3.59Å; T453-A464 VanDerWaalsContact O-CA 3.31Å; T453-A464 WeakPolarHBondContact O-CA 3.47Å; T453-V465 PolarHBondContact N-O 2.72Å; T453-V465 PolarHBondContact O-N 2.89Å; T453-H467 PolarHBondContact OG1-CD2 3.28Å; T453-H467 VanDerWaalsContact OG1-CD2 3.26Å; T453-H467 PolarHBondContact OG1-NE2 2.95Å; T453-M505 WeakPolarHBondContact OG1-CE 3.42Å
454	L	86.9	Confident	78.6	Confident	34 Å²	34	44.4 Å²	44.4	18%	0.178	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	131.3	177.7	-61.2	176.9	0	0	0	109.5	A332 Q333 V452 R461 A464	A332-L454 HydrophobicContact CB-CD1 4.42Å; Q333-L454 WeakPolarHBondContact O-CD1 3.45Å; V452-L454 HydrophobicContact CG1-CD2 4.09Å; L454-R461 VanDerWaalsContact CD1-NH1 3.3Å; L454-A464 HydrophobicContact CD2-CB 3.92Å
455	M	75.8	Confident	79.3	Confident	14 Å²	14	42.9 Å²	42.9	7%	0.069	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129.2	-172.4	-63	-68.8	-71.5	0	0	111	T453 R461 R462 G463 V465 V541	T453-M455 HydrophobicContact CG2-SD 4.36Å; M455-R461 WeakPolarHBondContact O-CA 3.47Å; M455-R462 PolarHBondContact O-N 3.31Å; M455-G463 PolarHBondContact N-O 3.47Å; M455-V465 HydrophobicContact CG-CG2 3.91Å; M455-V465 HydrophobicContact SD-CG2 4.13Å; M455-V541 HydrophobicContact CB-CB 4.22Å; M455-V541 HydrophobicContact CE-CB 4.5Å; M455-V541 HydrophobicContact CE-CG2 4.26Å; M455-V541 HydrophobicContact CG-CB 4.07Å; M455-V541 HydrophobicContact CG-CG1 4.4Å
456	G	67.1	Low	79.9	Confident	27 Å²	27	42.7 Å²	42.7	28%	0.278	22%	0.219	S	C	.	.	S	Bend	trans	104.6	162.3	-176.8	0	0	0	0	0	113.6
457	E	59.8	Low	80.2	Confident	165 Å²	165	38.2 Å²	38.2	77%	0.771	20%	0.199	S	C	*	.			trans	-69.8	162.2	174.7	-65.3	-164.5	162.2	0	0	111.3	E459 D460 R461	E457-E459 PolarHBondContact O-N 3.32Å; E457-D460 CarbonylContact O-C 3.57Å; E457-D460 VanDerWaalsContact O-C 3.27Å; E457-D460 PolarHBondContact O-N 2.87Å; E457-R461 VanDerWaalsContact O-CG 3.27Å; E457-R461 WeakPolarHBondContact O-CG 3.3Å; E457-R461 PolarHBondContact O-N 3.2Å
458	A	52.7	Low	80.3	Confident	52 Å²	52	38.1 Å²	38.1	43%	0.43	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-27	-165.9	0	0	0	0	0	115.7	P336	P336-A458 HydrophobicContact CG-CB 4.27Å
459	E	51.1	Low	80.3	Confident	202 Å²	202	36.5 Å²	36.5	94%	0.944	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-13.9	176.5	-62.2	-173.4	151.9	0	0	113.5	E457	E457-E459 PolarHBondContact O-N 3.32Å
460	D	55.6	Low	80.1	Confident	57 Å²	57	34.3 Å²	34.3	31%	0.305	18%	0.179	S	C	.	.			trans	-133.1	50.8	-172.3	-171	10.9	0	0	0	111	E457 R462	E457-D460 CarbonylContact O-C 3.57Å; E457-D460 VanDerWaalsContact O-C 3.27Å; E457-D460 PolarHBondContact O-N 2.87Å; D460-R462 VanDerWaalsContact CG-NE 3.32Å; D460-R462 PolarHBondContact O-N 3.38Å; D460-R462 VanDerWaalsContact OD1-CG 3.31Å; D460-R462 WeakPolarHBondContact OD1-CG 3.29Å; D460-R462 IonicContact OD1-CZ 3.2Å; D460-R462 IonicContact OD1-NE 3.73Å; D460-R462 PolarHBondContact OD1-NE 3.2Å; D460-R462 IonicContact OD1-NH2 3.98Å; D460-R462 IonicContact OD2-CZ 2.7Å; D460-R462 VanDerWaalsContact OD2-CZ 3.32Å; D460-R462 IonicContact OD2-NE 3.03Å; D460-R462 PolarHBondContact OD2-NE 3.4Å; D460-R462 VanDerWaalsContact OD2-NE 3.16Å; D460-R462 IonicContact OD2-NH2 3.14Å; D460-R462 PolarHBondContact OD2-NH2 2.98Å
461	R	66.6	Low	79.8	Confident	77 Å²	77	36.3 Å²	36.3	29%	0.291	19%	0.19	S	C	.	.			trans	-82.4	95.1	177	-73.1	-175.2	164.8	178.1	-8.5	111	Q333 H334 L454 M455 E457	Q333-R461 PolarHBondContact O-NH1 2.97Å; H334-R461 VanDerWaalsContact C-NH1 3.32Å; H334-R461 WeakPolarHBondContact O-CD 3.35Å; H334-R461 PolarHBondContact O-NH1 2.87Å; L454-R461 VanDerWaalsContact CD1-NH1 3.3Å; M455-R461 WeakPolarHBondContact O-CA 3.47Å; E457-R461 VanDerWaalsContact O-CG 3.27Å; E457-R461 WeakPolarHBondContact O-CG 3.3Å; E457-R461 PolarHBondContact O-N 3.2Å
462	R	66.2	Low	79.3	Confident	46 Å²	46	39.4 Å²	39.4	17%	0.174	20%	0.202	C	C	.	.			trans	-81.7	-17.2	-173	-59.8	177.2	-173.7	-160.8	-2.6	114.4	M455 D460 L556 T557	M455-R462 PolarHBondContact O-N 3.31Å; D460-R462 VanDerWaalsContact CG-NE 3.32Å; D460-R462 PolarHBondContact O-N 3.38Å; D460-R462 VanDerWaalsContact OD1-CG 3.31Å; D460-R462 WeakPolarHBondContact OD1-CG 3.29Å; D460-R462 IonicContact OD1-CZ 3.2Å; D460-R462 IonicContact OD1-NE 3.73Å; D460-R462 PolarHBondContact OD1-NE 3.2Å; D460-R462 IonicContact OD1-NH2 3.98Å; D460-R462 IonicContact OD2-CZ 2.7Å; D460-R462 VanDerWaalsContact OD2-CZ 3.32Å; D460-R462 IonicContact OD2-NE 3.03Å; D460-R462 PolarHBondContact OD2-NE 3.4Å; D460-R462 VanDerWaalsContact OD2-NE 3.16Å; D460-R462 IonicContact OD2-NH2 3.14Å; D460-R462 PolarHBondContact OD2-NH2 2.98Å; R462-L556 VanDerWaalsContact NH1-C 3.31Å; R462-L556 PolarHBondContact NH1-O 3.19Å; R462-L556 PolarHBondContact NH2-O 2.96Å; R462-T557 PolarHBondContact NH1-O 3.36Å
463	G	79.5	Confident	79	Confident	12 Å²	12	39 Å²	39	12%	0.124	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.1	-170.3	-179.1	0	0	0	0	0	113.7	M455 V480	M455-G463 PolarHBondContact N-O 3.47Å; G463-V480 CarbonylContact C-O 3.59Å; G463-V480 VanDerWaalsContact CA-O 3.23Å; G463-V480 WeakPolarHBondContact CA-O 3.2Å
464	A	87.9	Confident	78.8	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	156.3	179	0	0	0	0	0	111.1	V452 T453 L454 V480	V452-A464 HydrophobicContact CG1-CB 3.89Å; T453-A464 CarbonylContact O-C 3.59Å; T453-A464 VanDerWaalsContact O-CA 3.31Å; T453-A464 WeakPolarHBondContact O-CA 3.47Å; L454-A464 HydrophobicContact CD2-CB 3.92Å; A464-V480 HydrophobicContact CB-CB 4.48Å; A464-V480 PolarHBondContact N-O 3.15Å; A464-V480 WeakPolarHBondContact O-CB 3.45Å; A464-V480 PolarHBondContact O-N 3.38Å
465	V	90.4	Very high	79	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.6	167.5	-179.9	0	0	0	0	108.2	T453 M455 Q477 V478 V541	T453-V465 PolarHBondContact N-O 2.72Å; T453-V465 PolarHBondContact O-N 2.89Å; M455-V465 HydrophobicContact CG-CG2 3.91Å; M455-V465 HydrophobicContact SD-CG2 4.13Å; V465-Q477 HydrophobicContact CG1-CB 4.31Å; V465-V478 CarbonylContact C-O 3.6Å; V465-V478 WeakPolarHBondContact CA-O 3.25Å; V465-V541 HydrophobicContact CG2-CG2 4.45Å
466	L	93.6	Very high	79.7	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.9	172.1	-46.9	178.3	0	0	0	108.9	Y345 V360 L439 L450 V452 L468 Q477 V478 V480	Y345-L466 HydrophobicContact CD1-CD2 3.76Å; Y345-L466 HydrophobicContact CE1-CD2 3.79Å; V360-L466 HydrophobicContact CG1-CD1 4.19Å; L439-L466 HydrophobicContact CD2-CD1 4.35Å; L450-L466 HydrophobicContact CD1-CB 4.06Å; L450-L466 HydrophobicContact CD1-CD2 4.36Å; V452-L466 HydrophobicContact CG1-CD2 4.16Å; V452-L466 HydrophobicContact CG2-CD2 3.74Å; L466-L468 HydrophobicContact CB-CG 4.36Å; L466-Q477 WeakPolarHBondContact O-CA 3.27Å; L466-V478 HydrophobicContact CB-CB 4.29Å; L466-V478 PolarHBondContact N-O 3Å; L466-V478 PolarHBondContact O-N 2.96Å; L466-V480 HydrophobicContact CD1-CG2 3.77Å; L466-V480 HydrophobicContact CD2-CG2 4.23Å; L466-V480 HydrophobicContact CG-CG2 3.72Å
467	H	94.8	Very high	80.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	105.7	172.9	-60.4	-73.2	0	0	0	107.8	L450 A451 T453 L475 T523	L450-H467 WeakPolarHBondContact CA-O 3.39Å; A451-H467 HydrophobicContact CB-CB 4.35Å; A451-H467 PolarHBondContact N-O 2.77Å; A451-H467 PolarHBondContact O-N 2.96Å; T453-H467 PolarHBondContact OG1-CD2 3.28Å; T453-H467 VanDerWaalsContact OG1-CD2 3.26Å; T453-H467 PolarHBondContact OG1-NE2 2.95Å; H467-L475 HydrophobicContact CB-CD1 4.25Å; H467-T523 WeakPolarHBondContact CE1-CG2 3.18Å
468	L	95.2	Very high	82.2	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	115.1	-171.7	-70.1	164.3	0	0	0	110	L347 V360 L440 Y447 K449 L450 L466 L475 H476 V478	L347-L468 HydrophobicContact CD1-CD2 4.17Å; V360-L468 HydrophobicContact CG2-CD1 4.47Å; V360-L468 HydrophobicContact CG2-CD2 4.04Å; L440-L468 HydrophobicContact CD2-CD1 3.6Å; Y447-L468 HydrophobicContact CD1-CB 3.78Å; Y447-L468 HydrophobicContact CD2-CD1 4.27Å; Y447-L468 HydrophobicContact CD2-CD2 4.29Å; Y447-L468 HydrophobicContact CE1-CB 3.8Å; Y447-L468 HydrophobicContact CE1-CD1 4.39Å; Y447-L468 HydrophobicContact CE2-CD1 3.87Å; Y447-L468 HydrophobicContact CG-CB 4.2Å; Y447-L468 HydrophobicContact CG-CD2 4.3Å; K449-L468 WeakPolarHBondContact O-CA 3.23Å; L450-L468 HydrophobicContact CB-CD2 4.25Å; L450-L468 HydrophobicContact CD1-CD2 3.63Å; L450-L468 HydrophobicContact CD1-CG 4.24Å; L450-L468 HydrophobicContact CG-CD2 4.41Å; L466-L468 HydrophobicContact CB-CG 4.36Å; L468-L475 WeakPolarHBondContact O-CA 3.45Å; L468-H476 HydrophobicContact CB-CB 4.23Å; L468-H476 PolarHBondContact N-O 2.91Å; L468-H476 PolarHBondContact O-N 3.2Å; L468-V478 HydrophobicContact CD1-CG2 3.98Å
469	G	94.8	Very high	83.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	140.3	174.6	0	0	0	0	0	111.9	Y447 T448 K449 E474	Y447-G469 CarbonylContact C-O 3.5Å; Y447-G469 VanDerWaalsContact CA-O 3.27Å; Y447-G469 WeakPolarHBondContact CA-O 3.14Å; T448-G469 PolarHBondContact N-O 2.91Å; T448-G469 PolarHBondContact OG1-O 2.85Å; K449-G469 PolarHBondContact O-N 3.24Å; G469-E474 WeakPolarHBondContact CA-O 3.47Å
470	T	91.1	Very high	85.4	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	166.5	175.2	69.8	0	0	0	0	113.2	I445 Y447 R472 G473 E474 H476 V500	I445-T470 HydrophobicContact CG2-CG2 3.84Å; Y447-T470 HydrophobicContact CD1-CG2 3.85Å; Y447-T470 HydrophobicContact CE1-CG2 3.85Å; T470-R472 PolarHBondContact O-N 2.99Å; T470-R472 PolarHBondContact OG1-N 2.8Å; T470-G473 PolarHBondContact OG1-N 2.87Å; T470-E474 HydrophobicContact CG2-CB 4.12Å; T470-E474 PolarHBondContact N-O 2.82Å; T470-E474 WeakPolarHBondContact OG1-CB 3.48Å; T470-E474 PolarHBondContact OG1-N 2.82Å; T470-E474 PolarHBondContact OG1-OE2 3.29Å; T470-H476 VanDerWaalsContact CG2-CD2 3.44Å; T470-H476 WeakPolarHBondContact CG2-CD2 3.42Å; T470-H476 WeakPolarHBondContact CG2-NE2 3.36Å; T470-V500 PolarHBondContact O-N 2.9Å
471	D	89.8	Confident	86.6	Confident	47 Å²	47	15.9 Å²	15.9	25%	0.251	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-3.8	167.6	67.7	-26.1	0	0	0	114.3	K446 T448	K446-D471 HydrophobicContact CB-CB 4.39Å; K446-D471 HydrophobicContact CD-CB 4.43Å; K446-D471 PolarHBondContact O-N 3.07Å; K446-D471 VanDerWaalsContact O-N 3.09Å; T448-D471 HydrophobicContact CG2-CB 3.93Å
472	R	83.8	Confident	86.9	Confident	66 Å²	66	19 Å²	19	25%	0.249	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	16.8	179.2	-60.1	-175.9	-171.1	153.6	9.8	114.3	T470 E474 H618	T470-R472 PolarHBondContact O-N 2.99Å; T470-R472 PolarHBondContact OG1-N 2.8Å; R472-E474 PolarHBondContact O-N 3.15Å; R472-H618 PolarHBondContact NH1-ND1 2.84Å
473	G	86	Confident	87.1	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	78.5	17.9	173.7	0	0	0	0	0	115.2	T470 L493 F494 E498	T470-G473 PolarHBondContact OG1-N 2.87Å; G473-L493 PolarHBondContact O-N 3.08Å; G473-F494 PolarHBondContact O-N 3.42Å; G473-E498 WeakPolarHBondContact CA-O 3.46Å; G473-E498 PolarHBondContact N-O 2.82Å; G473-E498 VanDerWaalsContact N-O 3.13Å
474	E	86.8	Confident	87	Confident	47 Å²	47	29.4 Å²	29.4	22%	0.22	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	148	178	-57	153.7	139.3	0	0	110.4	G469 T470 R472 H476 I491 H619	G469-E474 WeakPolarHBondContact CA-O 3.47Å; T470-E474 HydrophobicContact CG2-CB 4.12Å; T470-E474 PolarHBondContact N-O 2.82Å; T470-E474 WeakPolarHBondContact OG1-CB 3.48Å; T470-E474 PolarHBondContact OG1-N 2.82Å; T470-E474 PolarHBondContact OG1-OE2 3.29Å; R472-E474 PolarHBondContact O-N 3.15Å; E474-H476 IonicContact OE2-NE2 3.5Å; E474-I491 CarbonylContact C-O 3.56Å; E474-I491 WeakPolarHBondContact CA-O 3.1Å; E474-H619 IonicContact OE2-CE1 3.31Å; E474-H619 PolarHBondContact OE2-CE1 3.39Å
475	L	90.8	Very high	86.7	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	114.6	171.9	-173.8	77.7	0	0	0	109.9	H467 L468 I491 L493 I503 V512 V521	H467-L475 HydrophobicContact CB-CD1 4.25Å; L468-L475 WeakPolarHBondContact O-CA 3.45Å; L475-I491 HydrophobicContact CB-CB 4.47Å; L475-I491 PolarHBondContact N-O 2.93Å; L475-I491 PolarHBondContact O-N 2.85Å; L475-L493 HydrophobicContact CB-CD1 3.62Å; L475-L493 HydrophobicContact CB-CG 4.21Å; L475-L493 HydrophobicContact CD2-CD1 4.24Å; L475-L493 HydrophobicContact CG-CD1 4.45Å; L475-I503 HydrophobicContact CD1-CD1 3.85Å; L475-V512 HydrophobicContact CD1-CG2 4.29Å; L475-V512 HydrophobicContact CD2-CG2 4.14Å; L475-V521 HydrophobicContact CD2-CB 4.45Å; L475-V521 HydrophobicContact CD2-CG1 4.3Å; L475-V521 HydrophobicContact CD2-CG2 4.3Å
476	H	90.4	Very high	86.2	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128	178.4	-61.8	-130.4	0	0	0	108.8	Y447 L468 T470 E474 L487 Q489 E490	Y447-H476 HydrophobicContact CE1-CB 4.19Å; Y447-H476 AromaticContact CE1-CD2 3.99Å; Y447-H476 AromaticContact CE1-CG 3.85Å; L468-H476 HydrophobicContact CB-CB 4.23Å; L468-H476 PolarHBondContact N-O 2.91Å; L468-H476 PolarHBondContact O-N 3.2Å; T470-H476 VanDerWaalsContact CG2-CD2 3.44Å; T470-H476 WeakPolarHBondContact CG2-CD2 3.42Å; T470-H476 WeakPolarHBondContact CG2-NE2 3.36Å; E474-H476 IonicContact OE2-NE2 3.5Å; H476-L487 HydrophobicContact CB-CD1 4.23Å; H476-Q489 WeakPolarHBondContact CA-O 3.38Å; H476-E490 IonicContact CE1-OE1 2.99Å; H476-E490 PolarHBondContact CE1-OE1 2.85Å; H476-E490 IonicContact CG-OE1 2.73Å; H476-E490 VanDerWaalsContact ND1-CD 3.33Å; H476-E490 WeakPolarHBondContact ND1-CG 3.32Å; H476-E490 IonicContact ND1-OE1 2.69Å; H476-E490 PolarHBondContact ND1-OE1 2.94Å
477	Q	89.1	Confident	85.7	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	123	173.7	-63.8	-167.4	-9.2	0	0	109.7	V465 L466 L488 Q489 I491	V465-Q477 HydrophobicContact CG1-CB 4.31Å; L466-Q477 WeakPolarHBondContact O-CA 3.27Å; Q477-L488 HydrophobicContact CB-CB 4.33Å; Q477-L488 WeakPolarHBondContact O-CB 3.43Å; Q477-L488 PolarHBondContact O-N 2.87Å; Q477-Q489 PolarHBondContact N-O 2.88Å; Q477-Q489 PolarHBondContact O-N 3.46Å; Q477-I491 HydrophobicContact CG-CD1 4.1Å
478	V	89.2	Confident	84.9	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	115.6	-176.8	-177.7	0	0	0	0	110	L440 V465 L466 L468 A485 T486 L487	L440-V478 HydrophobicContact CD2-CG1 4.38Å; L440-V478 HydrophobicContact CD2-CG2 4.1Å; V465-V478 CarbonylContact C-O 3.6Å; V465-V478 WeakPolarHBondContact CA-O 3.25Å; L466-V478 HydrophobicContact CB-CB 4.29Å; L466-V478 PolarHBondContact N-O 3Å; L466-V478 PolarHBondContact O-N 2.96Å; L468-V478 HydrophobicContact CD1-CG2 3.98Å; V478-A485 HydrophobicContact CG1-CB 3.88Å; V478-T486 CarbonylContact C-O 3.58Å; V478-T486 WeakPolarHBondContact CA-O 3.39Å; V478-L487 HydrophobicContact CG2-CD1 3.91Å
479	A	86.5	Confident	84.1	Confident	4 Å²	4	34.6 Å²	34.6	3%	0.033	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	137.7	170.9	0	0	0	0	0	110.7	A485 T486 L488 V541	A479-A485 CarbonylContact O-C 3.55Å; A479-A485 WeakPolarHBondContact O-CA 3.36Å; A479-T486 PolarHBondContact N-O 2.84Å; A479-T486 PolarHBondContact O-N 3.01Å; A479-L488 HydrophobicContact CB-CD1 3.97Å; A479-L488 HydrophobicContact CB-CD2 3.77Å; A479-L488 HydrophobicContact CB-CG 3.92Å; A479-V541 HydrophobicContact CB-CG1 3.92Å; A479-V541 HydrophobicContact CB-CG2 4.39Å
480	V	86.5	Confident	83.4	Confident	16 Å²	16	37.7 Å²	37.7	10%	0.097	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.9	177.4	170.7	0	0	0	0	108	L439 G463 A464 L466 N484	L439-V480 HydrophobicContact CD1-CG1 3.99Å; L439-V480 HydrophobicContact CD1-CG2 4.46Å; L439-V480 HydrophobicContact CD2-CB 4.43Å; L439-V480 HydrophobicContact CD2-CG1 3.79Å; L439-V480 HydrophobicContact CD2-CG2 3.74Å; L439-V480 HydrophobicContact CG-CG1 4.43Å; L439-V480 HydrophobicContact CG-CG2 4.27Å; G463-V480 CarbonylContact C-O 3.59Å; G463-V480 VanDerWaalsContact CA-O 3.23Å; G463-V480 WeakPolarHBondContact CA-O 3.2Å; A464-V480 HydrophobicContact CB-CB 4.48Å; A464-V480 PolarHBondContact N-O 3.15Å; A464-V480 WeakPolarHBondContact O-CB 3.45Å; A464-V480 PolarHBondContact O-N 3.38Å; L466-V480 HydrophobicContact CD1-CG2 3.77Å; L466-V480 HydrophobicContact CD2-CG2 4.23Å; L466-V480 HydrophobicContact CG-CG2 3.72Å; V480-N484 WeakPolarHBondContact CA-O 3.22Å
481	A	80.4	Confident	83	Confident	15 Å²	15	38.3 Å²	38.3	12%	0.124	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	132.5	177.4	0	0	0	0	0	109.5	Q483 N484 G540	A481-Q483 VanDerWaalsContact C-N 3.27Å; A481-Q483 PolarHBondContact O-N 2.98Å; A481-N484 PolarHBondContact N-O 2.92Å; A481-N484 VanDerWaalsContact N-O 3.09Å; A481-N484 PolarHBondContact O-N 2.89Å; A481-G540 WeakPolarHBondContact CB-O 3.41Å
482	N	71.8	Confident	82.7	Confident	144 Å²	144	40.9 Å²	40.9	77%	0.77	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.7	46.3	178.5	-61.6	-31	0	0	0	113.7	N484	N482-N484 PolarHBondContact O-N 2.93Å; N482-N484 VanDerWaalsContact O-N 3.1Å
483	Q	70.8	Confident	82.8	Confident	178 Å²	178	38.1 Å²	38.1	83%	0.832	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	3.4	-176.9	-52.3	176.5	9.1	0	0	116.1	L439 A481	L439-Q483 WeakPolarHBondContact CD1-O 3.3Å; A481-Q483 VanDerWaalsContact C-N 3.27Å; A481-Q483 PolarHBondContact O-N 2.98Å
484	N	76.8	Confident	82.9	Confident	98 Å²	98	39 Å²	39	52%	0.524	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	131.3	172	-68.3	-58.8	0	0	0	110.9	V480 A481 N482	V480-N484 WeakPolarHBondContact CA-O 3.22Å; A481-N484 PolarHBondContact N-O 2.92Å; A481-N484 VanDerWaalsContact N-O 3.09Å; A481-N484 PolarHBondContact O-N 2.89Å; N482-N484 PolarHBondContact O-N 2.93Å; N482-N484 VanDerWaalsContact O-N 3.1Å
485	A	82.9	Confident	82.7	Confident	19 Å²	19	39.1 Å²	39.1	16%	0.157	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.4	172.4	0	0	0	0	0	111.3	L439 L440 V478 A479	L439-A485 HydrophobicContact CD1-CB 4.37Å; L439-A485 HydrophobicContact CG-CB 4.36Å; L439-A485 WeakPolarHBondContact O-CB 3.42Å; L440-A485 HydrophobicContact CB-CB 4.2Å; L440-A485 HydrophobicContact CD1-CB 4.18Å; V478-A485 HydrophobicContact CG1-CB 3.88Å; A479-A485 CarbonylContact O-C 3.55Å; A479-A485 WeakPolarHBondContact O-CA 3.36Å
486	T	80.3	Confident	82.2	Confident	36 Å²	36	43.2 Å²	43.2	22%	0.221	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	120	179.3	-57.8	0	0	0	0	110.2	V478 A479 L488 R537	V478-T486 CarbonylContact C-O 3.58Å; V478-T486 WeakPolarHBondContact CA-O 3.39Å; A479-T486 PolarHBondContact N-O 2.84Å; A479-T486 PolarHBondContact O-N 3.01Å; T486-L488 PolarHBondContact O-N 2.87Å; T486-R537 HydrophobicContact CG2-CB 3.9Å; T486-R537 HydrophobicContact CG2-CG 4.04Å
487	L	81.4	Confident	81.9	Confident	17 Å²	17	50.2 Å²	50.2	9%	0.089	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	124.1	174.8	-179.7	72.4	0	0	0	110.4	H476 V478 E490 R537	H476-L487 HydrophobicContact CB-CD1 4.23Å; V478-L487 HydrophobicContact CG2-CD1 3.91Å; L487-E490 HydrophobicContact CD1-CG 3.9Å; L487-E490 HydrophobicContact CD2-CG 3.99Å; L487-E490 WeakPolarHBondContact CD2-OE1 3.46Å; L487-E490 HydrophobicContact CG-CG 4.32Å; L487-R537 PolarHBondContact O-NH1 2.9Å
488	L	79.6	Confident	81.9	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-58.2	178.5	-57.3	-176	0	0	0	111.3	Q477 A479 T486 Y529 V534 R537 A538	Q477-L488 HydrophobicContact CB-CB 4.33Å; Q477-L488 WeakPolarHBondContact O-CB 3.43Å; Q477-L488 PolarHBondContact O-N 2.87Å; A479-L488 HydrophobicContact CB-CD1 3.97Å; A479-L488 HydrophobicContact CB-CD2 3.77Å; A479-L488 HydrophobicContact CB-CG 3.92Å; T486-L488 PolarHBondContact O-N 2.87Å; L488-Y529 HydrophobicContact CD1-CE1 4.13Å; L488-Y529 HydrophobicContact CD1-CE2 4.33Å; L488-Y529 VanDerWaalsContact CD1-OH 3.26Å; L488-Y529 WeakPolarHBondContact CD1-OH 3.45Å; L488-V534 HydrophobicContact CB-CG1 4.22Å; L488-R537 HydrophobicContact CD2-CB 3.79Å; L488-R537 VanDerWaalsContact O-CZ 3.29Å; L488-R537 PolarHBondContact O-NH1 3.05Å; L488-R537 PolarHBondContact O-NH2 2.94Å; L488-A538 HydrophobicContact CD1-CB 4.3Å; L488-A538 HydrophobicContact CD2-CB 4.03Å
489	Q	77.2	Confident	82	Confident	36 Å²	36	53 Å²	53	17%	0.168	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	153.8	-174.1	-65.3	-172.4	-10.5	0	0	110.8	H476 Q477 I491 V534	H476-Q489 WeakPolarHBondContact CA-O 3.38Å; Q477-Q489 PolarHBondContact N-O 2.88Å; Q477-Q489 PolarHBondContact O-N 3.46Å; Q489-I491 HydrophobicContact CB-CG1 4.21Å; Q489-V534 HydrophobicContact CG-CG1 3.75Å; Q489-V534 HydrophobicContact CG-CG2 4.23Å
490	E	80.9	Confident	82.4	Confident	66 Å²	66	52.8 Å²	52.8	31%	0.308	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	117	169.4	-58.6	-175.6	143.3	0	0	105.5	R442 H476 L487	R442-E490 IonicContact CZ-OE1 2.75Å; R442-E490 IonicContact NH2-OE1 3.44Å; R442-E490 PolarHBondContact NH2-OE1 2.9Å; H476-E490 IonicContact CE1-OE1 2.99Å; H476-E490 PolarHBondContact CE1-OE1 2.85Å; H476-E490 IonicContact CG-OE1 2.73Å; H476-E490 VanDerWaalsContact ND1-CD 3.33Å; H476-E490 WeakPolarHBondContact ND1-CG 3.32Å; H476-E490 IonicContact ND1-OE1 2.69Å; H476-E490 PolarHBondContact ND1-OE1 2.94Å; L487-E490 HydrophobicContact CD1-CG 3.9Å; L487-E490 HydrophobicContact CD2-CG 3.99Å; L487-E490 WeakPolarHBondContact CD2-OE1 3.46Å; L487-E490 HydrophobicContact CG-CG 4.32Å
491	I	82.6	Confident	82.7	Confident	12 Å²	12	54.5 Å²	54.5	6%	0.062	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	107.7	-168.3	-54.9	159.5	0	0	0	107.7	L33 V35 E474 L475 Q477 Q489 L493 V521	L33-I491 HydrophobicContact CD2-CD1 3.66Å; L33-I491 HydrophobicContact CD2-CG1 3.98Å; L33-I491 HydrophobicContact CD2-CG2 4.03Å; V35-I491 HydrophobicContact CG2-CG2 4.27Å; E474-I491 CarbonylContact C-O 3.56Å; E474-I491 WeakPolarHBondContact CA-O 3.1Å; L475-I491 HydrophobicContact CB-CB 4.47Å; L475-I491 PolarHBondContact N-O 2.93Å; L475-I491 PolarHBondContact O-N 2.85Å; Q477-I491 HydrophobicContact CG-CD1 4.1Å; Q489-I491 HydrophobicContact CB-CG1 4.21Å; I491-L493 HydrophobicContact CG2-CD2 3.63Å; I491-L493 HydrophobicContact CG2-CG 4.27Å; I491-L493 PolarHBondContact O-N 3.26Å; I491-V521 HydrophobicContact CD1-CG1 4.17Å
492	P	83.1	Confident	83.3	Confident	101 Å²	101	55.4 Å²	55.4	66%	0.656	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	117.5	173.5	28.4	-32.4	0	0	0	109.3
493	L	86.3	Confident	84.3	Confident	8 Å²	8	49.2 Å²	49.2	4%	0.042	27%	0.268	C	S	.	.			trans	-106.6	-34	-178.2	-62.5	178.3	0	0	0	112.8	V35 Q37 G473 L475 I491 V512 A519 V521	V35-L493 HydrophobicContact CG1-CD2 3.7Å; V35-L493 HydrophobicContact CG2-CD2 4.14Å; Q37-L493 PolarHBondContact NE2-O 3.5Å; G473-L493 PolarHBondContact O-N 3.08Å; L475-L493 HydrophobicContact CB-CD1 3.62Å; L475-L493 HydrophobicContact CB-CG 4.21Å; L475-L493 HydrophobicContact CD2-CD1 4.24Å; L475-L493 HydrophobicContact CG-CD1 4.45Å; I491-L493 HydrophobicContact CG2-CD2 3.63Å; I491-L493 HydrophobicContact CG2-CG 4.27Å; I491-L493 PolarHBondContact O-N 3.26Å; L493-V512 HydrophobicContact CD1-CB 3.81Å; L493-V512 HydrophobicContact CD1-CG1 3.83Å; L493-V512 HydrophobicContact CD1-CG2 3.74Å; L493-A519 HydrophobicContact CB-CB 4.29Å; L493-A519 HydrophobicContact CD1-CB 4.38Å; L493-A519 HydrophobicContact CD2-CB 4.29Å; L493-V521 HydrophobicContact CD1-CG2 3.9Å; L493-V521 HydrophobicContact CD2-CG2 3.55Å; L493-V521 HydrophobicContact CG-CG2 4.4Å
494	F	88.1	Confident	85.3	Confident	19 Å²	19	42.3 Å²	42.3	8%	0.083	24%	0.236	C	C	.	.	S	Bend	trans	-127.7	178.5	-177.3	-47.2	-60	0	0	0	110.8	Q37 G473 E498 V500 V512 S517 A519	Q37-F494 HydrophobicContact CG-CE1 4.48Å; G473-F494 PolarHBondContact O-N 3.42Å; F494-E498 HydrophobicContact CB-CB 3.84Å; F494-V500 HydrophobicContact CD2-CG2 4.28Å; F494-V500 HydrophobicContact CE2-CG2 4.24Å; F494-V512 HydrophobicContact CE2-CG1 3.85Å; F494-V512 HydrophobicContact CZ-CB 4.4Å; F494-V512 HydrophobicContact CZ-CG1 4.2Å; F494-S517 WeakPolarHBondContact CD1-OG 3.45Å; F494-S517 WeakPolarHBondContact CE1-OG 3.37Å; F494-A519 HydrophobicContact CE1-CB 3.79Å; F494-A519 HydrophobicContact CZ-CB 3.84Å
495	S	82.6	Confident	85.9	Confident	50 Å²	50	40 Å²	40	35%	0.35	22%	0.222	S	C	.	.			trans	-73.9	157.9	173.5	79.7	0	0	0	0	110.7	E497 E498	S495-E497 WeakPolarHBondContact CB-OE2 3.47Å; S495-E497 PolarHBondContact O-N 3.03Å; S495-E497 PolarHBondContact OG-OE2 2.97Å; S495-E498 PolarHBondContact O-N 3.49Å
496	P	79.3	Confident	86	Confident	86 Å²	86	40 Å²	40	56%	0.558	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-15.1	-177.2	-25.8	36.4	0	0	0	115.4
497	E	83.7	Confident	86	Confident	146 Å²	146	44.7 Å²	44.7	68%	0.682	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-11.2	177.2	-49.8	75.2	-162.5	0	0	113.4	S495 P499	S495-E497 WeakPolarHBondContact CB-OE2 3.47Å; S495-E497 PolarHBondContact O-N 3.03Å; S495-E497 PolarHBondContact OG-OE2 2.97Å; E497-P499 WeakPolarHBondContact O-CD 3.48Å
498	E	89	Confident	85.9	Confident	24 Å²	24	44.7 Å²	44.7	11%	0.112	24%	0.243	C	C	.	.	S	Bend	trans	-104.5	102.2	-179.1	-74.1	-163.3	-176.6	0	0	111.7	G473 F494 S495 S514 Q516 S517	G473-E498 WeakPolarHBondContact CA-O 3.46Å; G473-E498 PolarHBondContact N-O 2.82Å; G473-E498 VanDerWaalsContact N-O 3.13Å; F494-E498 HydrophobicContact CB-CB 3.84Å; S495-E498 PolarHBondContact O-N 3.49Å; E498-S514 WeakPolarHBondContact OE2-CB 3.47Å; E498-S514 PolarHBondContact OE2-OG 2.85Å; E498-Q516 WeakPolarHBondContact OE1-CB 3.44Å; E498-Q516 VanDerWaalsContact OE1-CD 3.27Å; E498-Q516 WeakPolarHBondContact OE1-CG 3.44Å; E498-Q516 PolarHBondContact OE1-NE2 2.87Å; E498-S517 PolarHBondContact OE2-OG 3.06Å
499	P	92.7	Very high	86.3	Confident	36 Å²	36	47.5 Å²	47.5	23%	0.234	25%	0.253	C	S	.	.			trans	-69.3	153.1	178.3	29.7	-36.6	0	0	0	112	E497 N501 P515	E497-P499 WeakPolarHBondContact O-CD 3.48Å; P499-N501 PolarHBondContact O-N 3Å; P499-P515 HydrophobicContact CG-CG 4.25Å; P499-P515 WeakPolarHBondContact O-CD 3.49Å
500	V	94.9	Very high	86.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.245	C	C	.	.			trans	-72.2	114.8	167.9	179	0	0	0	0	109.2	T448 K449 T470 F494 I503 V512	T448-V500 VanDerWaalsContact CB-O 3.3Å; T448-V500 WeakPolarHBondContact CB-O 3.44Å; T448-V500 PolarHBondContact OG1-O 3.03Å; K449-V500 HydrophobicContact CB-CG1 4.4Å; T470-V500 PolarHBondContact O-N 2.9Å; F494-V500 HydrophobicContact CD2-CG2 4.28Å; F494-V500 HydrophobicContact CE2-CG2 4.24Å; V500-I503 HydrophobicContact CG1-CD1 4.22Å; V500-I503 HydrophobicContact CG1-CG1 3.87Å; V500-V512 HydrophobicContact CB-CG1 4.45Å; V500-V512 HydrophobicContact CG1-CG1 3.51Å; V500-V512 HydrophobicContact CG2-CG1 4.15Å
501	N	91.8	Very high	87.5	Confident	53 Å²	53	42.7 Å²	42.7	28%	0.283	23%	0.231	S	C	.	.			trans	-95.3	-28.3	-178.8	-83.9	-2	0	0	0	113.6	F46 K449 P499 G513	F46-N501 PolarHBondContact O-ND2 2.73Å; K449-N501 WeakPolarHBondContact CE-O 3.43Å; K449-N501 WeakPolarHBondContact CG-O 3.42Å; P499-N501 PolarHBondContact O-N 3Å; N501-G513 PolarHBondContact N-O 2.81Å
502	N	92.9	Very high	88	Confident	33 Å²	33	42.1 Å²	42.1	18%	0.176	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	149.7	-175.5	-153.2	-69.9	0	0	0	111.6	F49 I504 V512 G513	F49-N502 HydrophobicContact CB-CB 4.37Å; F49-N502 HydrophobicContact CD1-CB 4.23Å; F49-N502 HydrophobicContact CD2-CB 3.56Å; F49-N502 HydrophobicContact CE1-CB 4.47Å; F49-N502 HydrophobicContact CE2-CB 3.86Å; F49-N502 HydrophobicContact CG-CB 3.82Å; F49-N502 HydrophobicContact CZ-CB 4.33Å; N502-I504 VanDerWaalsContact OD1-CG1 3.32Å; N502-I504 WeakPolarHBondContact OD1-CG1 3.1Å; N502-V512 WeakPolarHBondContact O-CA 3.48Å; N502-G513 PolarHBondContact N-O 3.08Å; N502-G513 PolarHBondContact O-N 3.43Å
503	I	94.4	Very high	88.5	Confident	15 Å²	15	37.3 Å²	37.3	8%	0.077	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	118.3	173.8	-52.5	173.3	0	0	0	107.3	K449 A451 L475 V500 M505 A510 L511 V512	K449-I503 HydrophobicContact CB-CD1 3.86Å; K449-I503 HydrophobicContact CB-CG1 4.01Å; A451-I503 HydrophobicContact CB-CB 4.07Å; A451-I503 HydrophobicContact CB-CG2 3.56Å; L475-I503 HydrophobicContact CD1-CD1 3.85Å; V500-I503 HydrophobicContact CG1-CD1 4.22Å; V500-I503 HydrophobicContact CG1-CG1 3.87Å; I503-M505 HydrophobicContact CG2-SD 4.33Å; I503-A510 HydrophobicContact CG2-CB 4.44Å; I503-L511 WeakPolarHBondContact CA-O 3.2Å; I503-V512 HydrophobicContact CG1-CG1 4.32Å
504	I	91.7	Very high	88.8	Confident	32 Å²	32	37 Å²	37	16%	0.164	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	128.4	175.6	-59.1	-175.4	0	0	0	109.4	F49 L51 L58 N502 A510 L511	F49-I504 HydrophobicContact CB-CD1 3.68Å; L51-I504 HydrophobicContact CB-CD1 4.28Å; L51-I504 HydrophobicContact CB-CG2 4.1Å; L51-I504 HydrophobicContact CD2-CG2 3.79Å; L58-I504 HydrophobicContact CD1-CD1 4.12Å; N502-I504 VanDerWaalsContact OD1-CG1 3.32Å; N502-I504 WeakPolarHBondContact OD1-CG1 3.1Å; I504-A510 WeakPolarHBondContact O-CA 3.46Å; I504-L511 HydrophobicContact CB-CB 4.46Å; I504-L511 PolarHBondContact N-O 3.16Å; I504-L511 PolarHBondContact O-N 3.05Å
505	M	88.7	Confident	89	Confident	49 Å²	49	37.1 Å²	37.1	24%	0.241	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	131.2	174.3	-54.9	-53.6	-55.1	0	0	110.4	A451 T453 I503 A510 T523	A451-M505 HydrophobicContact CB-CG 3.85Å; A451-M505 HydrophobicContact CB-SD 3.75Å; T453-M505 WeakPolarHBondContact OG1-CE 3.42Å; I503-M505 HydrophobicContact CG2-SD 4.33Å; M505-A510 HydrophobicContact CE-CB 4.01Å; M505-A510 HydrophobicContact SD-CB 3.8Å; M505-T523 HydrophobicContact CE-CG2 4.01Å; M505-T523 WeakPolarHBondContact CE-OG1 3.18Å
506	H	84.8	Confident	89.3	Confident	19 Å²	19	38.8 Å²	38.8	9%	0.088	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	126.5	-179.8	-174.1	63.5	0	0	0	112.4	L51 S53 G508 R509	L51-H506 HydrophobicContact CD2-CB 3.37Å; S53-H506 WeakPolarHBondContact CA-CE1 3.24Å; S53-H506 PolarHBondContact O-CE1 2.86Å; S53-H506 VanDerWaalsContact O-CE1 3.29Å; S53-H506 PolarHBondContact OG-ND1 2.6Å; H506-G508 PolarHBondContact O-N 2.93Å; H506-G508 VanDerWaalsContact O-N 3.14Å; H506-R509 PolarHBondContact N-O 3.12Å; H506-R509 WeakPolarHBondContact O-CA 3.47Å; H506-R509 WeakPolarHBondContact O-CB 3.49Å; H506-R509 WeakPolarHBondContact O-CG 3.44Å; H506-R509 PolarHBondContact O-N 2.81Å; H506-R509 VanDerWaalsContact O-O 3.11Å
507	Q	80.1	Confident	89.9	Confident	135 Å²	135	34.7 Å²	34.7	63%	0.631	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.6	42.1	175.8	-63	179.3	12.2	0	0	114.1	R509	Q507-R509 VanDerWaalsContact C-N 3.29Å; Q507-R509 WeakPolarHBondContact O-CG 3.32Å; Q507-R509 PolarHBondContact O-N 3.46Å
508	G	79.3	Confident	90.3	Very high	17 Å²	17	27.9 Å²	27.9	18%	0.175	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	8.4	-178.7	0	0	0	0	0	115.9	H506 T523 E524	H506-G508 PolarHBondContact O-N 2.93Å; H506-G508 VanDerWaalsContact O-N 3.14Å; G508-T523 VanDerWaalsContact C-OG1 3.27Å; G508-T523 PolarHBondContact O-N 2.74Å; G508-T523 PolarHBondContact O-OG1 3.17Å; G508-E524 VanDerWaalsContact CA-CB 3.48Å; G508-E524 WeakPolarHBondContact CA-OE2 3.26Å; G508-E524 PolarHBondContact O-N 3.38Å
509	R	87.3	Confident	90.4	Very high	60 Å²	60	26.7 Å²	26.7	23%	0.226	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	146.1	-178.2	-25	-176.4	80.8	-158.3	-12.6	109.6	H506 Q507 E520 V521 Q522	H506-R509 PolarHBondContact N-O 3.12Å; H506-R509 WeakPolarHBondContact O-CA 3.47Å; H506-R509 WeakPolarHBondContact O-CB 3.49Å; H506-R509 WeakPolarHBondContact O-CG 3.44Å; H506-R509 PolarHBondContact O-N 2.81Å; H506-R509 VanDerWaalsContact O-O 3.11Å; Q507-R509 VanDerWaalsContact C-N 3.29Å; Q507-R509 WeakPolarHBondContact O-CG 3.32Å; Q507-R509 PolarHBondContact O-N 3.46Å; R509-E520 HydrophobicContact CB-CG 4.45Å; R509-E520 IonicContact CZ-OE1 3.58Å; R509-E520 IonicContact CZ-OE2 2.92Å; R509-E520 IonicContact NE-OE1 2.95Å; R509-E520 PolarHBondContact NE-OE1 2.84Å; R509-E520 IonicContact NE-OE2 3.21Å; R509-E520 IonicContact NH1-OE1 3.96Å; R509-E520 PolarHBondContact NH1-OE1 2.97Å; R509-E520 IonicContact NH1-OE2 2.75Å; R509-E520 PolarHBondContact NH1-OE2 3.23Å; R509-E520 IonicContact NH2-OE1 2.96Å; R509-E520 IonicContact NH2-OE2 2.71Å; R509-E520 PolarHBondContact NH2-OE2 3.08Å; R509-V521 CarbonylContact C-O 3.39Å; R509-Q522 VanDerWaalsContact CG-OE1 3.28Å
510	A	91.2	Very high	90.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.2	170	0	0	0	0	0	110.4	I503 I504 M505 V512 V521 T523	I503-A510 HydrophobicContact CG2-CB 4.44Å; I504-A510 WeakPolarHBondContact O-CA 3.46Å; M505-A510 HydrophobicContact CE-CB 4.01Å; M505-A510 HydrophobicContact SD-CB 3.8Å; A510-V512 HydrophobicContact CB-CG2 4.43Å; A510-V521 PolarHBondContact N-O 2.79Å; A510-V521 PolarHBondContact O-N 3.5Å; A510-T523 HydrophobicContact CB-CG2 3.49Å; A510-T523 VanDerWaalsContact CB-CG2 3.49Å
511	L	92.8	Very high	90	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	107.9	170.6	-60.2	170.6	0	0	0	107.7	L51 L58 T71 I503 I504 E520	L51-L511 HydrophobicContact CD1-CD1 4.02Å; L51-L511 HydrophobicContact CD2-CD1 3.87Å; L58-L511 HydrophobicContact CD2-CD1 4.44Å; T71-L511 HydrophobicContact CG2-CD1 3.6Å; T71-L511 HydrophobicContact CG2-CD2 4.18Å; I503-L511 WeakPolarHBondContact CA-O 3.2Å; I504-L511 HydrophobicContact CB-CB 4.46Å; I504-L511 PolarHBondContact N-O 3.16Å; I504-L511 PolarHBondContact O-N 3.05Å; L511-E520 HydrophobicContact CD2-CB 4.07Å; L511-E520 HydrophobicContact CD2-CG 4.05Å
512	V	94.4	Very high	89.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.5	-177.6	-168.9	0	0	0	0	109	L475 L493 F494 V500 N502 I503 A510 V518 A519 V521	L475-V512 HydrophobicContact CD1-CG2 4.29Å; L475-V512 HydrophobicContact CD2-CG2 4.14Å; L493-V512 HydrophobicContact CD1-CB 3.81Å; L493-V512 HydrophobicContact CD1-CG1 3.83Å; L493-V512 HydrophobicContact CD1-CG2 3.74Å; F494-V512 HydrophobicContact CE2-CG1 3.85Å; F494-V512 HydrophobicContact CZ-CB 4.4Å; F494-V512 HydrophobicContact CZ-CG1 4.2Å; V500-V512 HydrophobicContact CB-CG1 4.45Å; V500-V512 HydrophobicContact CG1-CG1 3.51Å; V500-V512 HydrophobicContact CG2-CG1 4.15Å; N502-V512 WeakPolarHBondContact O-CA 3.48Å; I503-V512 HydrophobicContact CG1-CG1 4.32Å; A510-V512 HydrophobicContact CB-CG2 4.43Å; V512-V518 CarbonylContact O-C 3.47Å; V512-V518 WeakPolarHBondContact O-CA 3.44Å; V512-A519 PolarHBondContact N-O 2.86Å; V512-A519 PolarHBondContact O-N 3.22Å; V512-V521 HydrophobicContact CG2-CG2 4.36Å
513	G	93.1	Very high	89.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.5	-177.9	0	0	0	0	0	113.5	N501 N502	N501-G513 PolarHBondContact N-O 2.81Å; N502-G513 PolarHBondContact N-O 3.08Å; N502-G513 PolarHBondContact O-N 3.43Å
514	S	93.2	Very high	88.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.145	C	C	.	.			trans	-103.5	175.3	165.1	95.8	0	0	0	0	110.7	E498 Q516 S517	E498-S514 WeakPolarHBondContact OE2-CB 3.47Å; E498-S514 PolarHBondContact OE2-OG 2.85Å; S514-Q516 PolarHBondContact O-N 3.22Å; S514-Q516 VanDerWaalsContact O-N 3.15Å; S514-Q516 PolarHBondContact OG-N 3.16Å; S514-S517 PolarHBondContact N-O 3.27Å; S514-S517 PolarHBondContact OG-N 2.92Å; S514-S517 PolarHBondContact OG-O 3.37Å; S514-S517 PolarHBondContact OG-OG 3.44Å
515	P	91.2	Very high	87.6	Confident	23 Å²	23	29.9 Å²	29.9	15%	0.149	15%	0.154	C	C	.	.	S	Bend	trans	-58.5	-17.9	171.2	-22.2	31.2	0	0	0	115.7	N45 F46 P499	N45-P515 WeakPolarHBondContact CA-O 3.34Å; N45-P515 PolarHBondContact N-O 2.95Å; F46-P515 WeakPolarHBondContact CD2-O 3.04Å; F46-P515 PolarHBondContact N-O 2.98Å; F46-P515 VanDerWaalsContact N-O 3.1Å; P499-P515 HydrophobicContact CG-CG 4.25Å; P499-P515 WeakPolarHBondContact O-CD 3.49Å
516	Q	89.7	Confident	87.2	Confident	84 Å²	84	27.7 Å²	27.7	39%	0.393	14%	0.143	S	C	.	.	S	Bend	trans	-132.4	-17.5	-173.7	-54.3	-167.4	72.3	0	0	115	F40 E498 S514	F40-Q516 PolarHBondContact N-O 3.31Å; E498-Q516 WeakPolarHBondContact OE1-CB 3.44Å; E498-Q516 VanDerWaalsContact OE1-CD 3.27Å; E498-Q516 WeakPolarHBondContact OE1-CG 3.44Å; E498-Q516 PolarHBondContact OE1-NE2 2.87Å; S514-Q516 PolarHBondContact O-N 3.22Å; S514-Q516 VanDerWaalsContact O-N 3.15Å; S514-Q516 PolarHBondContact OG-N 3.16Å
517	S	90.3	Very high	87	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.007	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	162.9	-175	67.4	0	0	0	0	112.9	Q37 K38 F494 E498 S514	Q37-S517 PolarHBondContact NE2-OG 2.04Å; K38-S517 CarbonylContact O-C 3.54Å; K38-S517 VanDerWaalsContact O-CA 3.27Å; K38-S517 WeakPolarHBondContact O-CA 3.03Å; K38-S517 WeakPolarHBondContact O-CB 3.45Å; F494-S517 WeakPolarHBondContact CD1-OG 3.45Å; F494-S517 WeakPolarHBondContact CE1-OG 3.37Å; E498-S517 PolarHBondContact OE2-OG 3.06Å; S514-S517 PolarHBondContact N-O 3.27Å; S514-S517 PolarHBondContact OG-N 2.92Å; S514-S517 PolarHBondContact OG-O 3.37Å; S514-S517 PolarHBondContact OG-OG 3.44Å
518	V	92.3	Very high	87	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.012	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	133.7	174.7	178.1	0	0	0	0	108.1	Q37 K38 F40 F49 L58 L60 V512	Q37-V518 WeakPolarHBondContact CA-O 3.41Å; K38-V518 PolarHBondContact N-O 3.01Å; K38-V518 PolarHBondContact O-N 3.4Å; F40-V518 HydrophobicContact CE2-CB 4.2Å; F40-V518 HydrophobicContact CE2-CG2 3.9Å; F49-V518 HydrophobicContact CE1-CG2 3.78Å; F49-V518 HydrophobicContact CZ-CG2 4.26Å; L58-V518 HydrophobicContact CD2-CG1 4.19Å; L60-V518 HydrophobicContact CD1-CG2 4.09Å; L60-V518 HydrophobicContact CD2-CG2 4.41Å; V512-V518 CarbonylContact O-C 3.47Å; V512-V518 WeakPolarHBondContact O-CA 3.44Å
519	A	91.3	Very high	87.1	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	137.1	176.5	0	0	0	0	0	110.1	V35 E36 Q37 L493 F494 V512	V35-A519 HydrophobicContact CG1-CB 4.34Å; E36-A519 WeakPolarHBondContact O-CA 3.18Å; Q37-A519 HydrophobicContact CB-CB 4.48Å; Q37-A519 HydrophobicContact CG-CB 4.35Å; L493-A519 HydrophobicContact CB-CB 4.29Å; L493-A519 HydrophobicContact CD1-CB 4.38Å; L493-A519 HydrophobicContact CD2-CB 4.29Å; F494-A519 HydrophobicContact CE1-CB 3.79Å; F494-A519 HydrophobicContact CZ-CB 3.84Å; V512-A519 PolarHBondContact N-O 2.86Å; V512-A519 PolarHBondContact O-N 3.22Å
520	E	90.3	Very high	86.4	Confident	9 Å²	9	25.7 Å²	25.7	4%	0.042	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.9	170.7	-179	173	-120.3	0	0	109.9	E36 L74 R509 L511	E36-E520 PolarHBondContact N-O 2.84Å; E36-E520 PolarHBondContact O-N 3.46Å; L74-E520 HydrophobicContact CD1-CB 3.91Å; R509-E520 HydrophobicContact CB-CG 4.45Å; R509-E520 IonicContact CZ-OE1 3.58Å; R509-E520 IonicContact CZ-OE2 2.92Å; R509-E520 IonicContact NE-OE1 2.95Å; R509-E520 PolarHBondContact NE-OE1 2.84Å; R509-E520 IonicContact NE-OE2 3.21Å; R509-E520 IonicContact NH1-OE1 3.96Å; R509-E520 PolarHBondContact NH1-OE1 2.97Å; R509-E520 IonicContact NH1-OE2 2.75Å; R509-E520 PolarHBondContact NH1-OE2 3.23Å; R509-E520 IonicContact NH2-OE1 2.96Å; R509-E520 IonicContact NH2-OE2 2.71Å; R509-E520 PolarHBondContact NH2-OE2 3.08Å; L511-E520 HydrophobicContact CD2-CB 4.07Å; L511-E520 HydrophobicContact CD2-CG 4.05Å
521	V	89.2	Confident	85.9	Confident	0 Å²	0	28 Å²	28	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	130.4	-178.8	-174	0	0	0	0	108.4	L33 L475 I491 L493 R509 A510 V512	L33-V521 HydrophobicContact CD2-CG1 4.37Å; L475-V521 HydrophobicContact CD2-CB 4.45Å; L475-V521 HydrophobicContact CD2-CG1 4.3Å; L475-V521 HydrophobicContact CD2-CG2 4.3Å; I491-V521 HydrophobicContact CD1-CG1 4.17Å; L493-V521 HydrophobicContact CD1-CG2 3.9Å; L493-V521 HydrophobicContact CD2-CG2 3.55Å; L493-V521 HydrophobicContact CG-CG2 4.4Å; R509-V521 CarbonylContact C-O 3.39Å; A510-V521 PolarHBondContact N-O 2.79Å; A510-V521 PolarHBondContact O-N 3.5Å; V512-V521 HydrophobicContact CG2-CG2 4.36Å
522	Q	86.9	Confident	85.3	Confident	63 Å²	63	28.6 Å²	28.6	29%	0.294	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	138.6	172.7	-58.5	-68.2	44.9	0	0	110.2	R509 L528	R509-Q522 VanDerWaalsContact CG-OE1 3.28Å; Q522-L528 HydrophobicContact CB-CD1 4.08Å; Q522-L528 HydrophobicContact CB-CD2 3.44Å; Q522-L528 VanDerWaalsContact CB-CD2 3.44Å; Q522-L528 HydrophobicContact CB-CG 4.42Å; Q522-L528 HydrophobicContact CG-CD2 4.29Å; Q522-L528 WeakPolarHBondContact O-CD1 3.49Å
523	T	81	Confident	84.4	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.012	19%	0.191	C	C	.	.			trans	-130.6	-19.3	-173.2	46.2	0	0	0	0	115	H467 M505 G508 A510 L528	H467-T523 WeakPolarHBondContact CE1-CG2 3.18Å; M505-T523 HydrophobicContact CE-CG2 4.01Å; M505-T523 WeakPolarHBondContact CE-OG1 3.18Å; G508-T523 VanDerWaalsContact C-OG1 3.27Å; G508-T523 PolarHBondContact O-N 2.74Å; G508-T523 PolarHBondContact O-OG1 3.17Å; A510-T523 HydrophobicContact CB-CG2 3.49Å; A510-T523 VanDerWaalsContact CB-CG2 3.49Å; T523-L528 VanDerWaalsContact C-CD1 3.5Å
524	E	77.4	Confident	83.6	Confident	129 Å²	129	32.8 Å²	32.8	60%	0.603	20%	0.195	S	C	*	.	S	Bend	trans	-102.7	137.1	-179.3	-169.6	173.1	174.9	0	0	112.1	G508 L528	G508-E524 VanDerWaalsContact CA-CB 3.48Å; G508-E524 WeakPolarHBondContact CA-OE2 3.26Å; G508-E524 PolarHBondContact O-N 3.38Å; E524-L528 WeakPolarHBondContact O-CD1 3.22Å
525	G	75.4	Confident	83.2	Confident	33 Å²	33	32.8 Å²	32.8	34%	0.34	20%	0.195	S	C	.	.	S	Bend	trans	98.2	132.6	176.6	0	0	0	0	0	114.5	A527 L528	G525-A527 PolarHBondContact O-N 2.67Å; G525-A527 VanDerWaalsContact O-N 3.14Å; G525-L528 VanDerWaalsContact O-CG 3.24Å; G525-L528 WeakPolarHBondContact O-CG 3.11Å; G525-L528 PolarHBondContact O-N 2.89Å
526	C	80.5	Confident	82.6	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.02	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-60.7	-24.4	178.4	-63.7	0	0	0	0	113.7	L528 Y529 C543 C552	C526-L528 PolarHBondContact O-N 3.23Å; C526-Y529 WeakPolarHBondContact O-CD2 3.36Å; C526-Y529 PolarHBondContact O-N 3.43Å; C526-C543 HydrophobicContact CB-CB 3.73Å; C526-C543 WeakPolarHBondContact CB-SG 3.35Å; C526-C543 WeakPolarHBondContact SG-CA 3.49Å; C526-C543 WeakPolarHBondContact SG-CB 3.48Å; C526-C543 CovalentContact SG-SG 2.04Å; C526-C543 PolarHBondContact SG-SG 3.22Å; C526-C552 CarbonylContact C-O 3.57Å; C526-C552 VanDerWaalsContact O-CB 3.23Å; C526-C552 WeakPolarHBondContact O-CB 3.17Å; C526-C552 PolarHBondContact O-SG 3.01Å; C526-C552 VanDerWaalsContact O-SG 3.4Å
527	A	80.9	Confident	82.1	Confident	81 Å²	81	28.8 Å²	28.8	67%	0.669	17%	0.174	S	C	*	.	G	3₁₀ helix	trans	-61.2	-13.5	179.9	0	0	0	0	0	114.3	G525 Y529 C552	G525-A527 PolarHBondContact O-N 2.67Å; G525-A527 VanDerWaalsContact O-N 3.14Å; A527-Y529 PolarHBondContact O-N 2.93Å; A527-C552 VanDerWaalsContact CA-O 3.32Å; A527-C552 WeakPolarHBondContact CA-O 3.42Å; A527-C552 PolarHBondContact N-O 2.87Å
528	L	78.5	Confident	81.6	Confident	34 Å²	34	28.7 Å²	28.7	18%	0.178	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-66	-23	171.3	-59.8	177	0	0	0	113.1	Q522 T523 E524 G525 C526 S530	Q522-L528 HydrophobicContact CB-CD1 4.08Å; Q522-L528 HydrophobicContact CB-CD2 3.44Å; Q522-L528 VanDerWaalsContact CB-CD2 3.44Å; Q522-L528 HydrophobicContact CB-CG 4.42Å; Q522-L528 HydrophobicContact CG-CD2 4.29Å; Q522-L528 WeakPolarHBondContact O-CD1 3.49Å; T523-L528 VanDerWaalsContact C-CD1 3.5Å; E524-L528 WeakPolarHBondContact O-CD1 3.22Å; G525-L528 VanDerWaalsContact O-CG 3.24Å; G525-L528 WeakPolarHBondContact O-CG 3.11Å; G525-L528 PolarHBondContact O-N 2.89Å; C526-L528 PolarHBondContact O-N 3.23Å; L528-S530 PolarHBondContact O-N 3.15Å
529	Y	81.4	Confident	81	Confident	3 Å²	3	29.8 Å²	29.8	1%	0.012	18%	0.178	C	C	.	.			trans	-90.5	81.9	-178.4	-51.5	-44.1	0	0	0	110.6	L488 C526 A527 S531 V534 A538 C552	L488-Y529 HydrophobicContact CD1-CE1 4.13Å; L488-Y529 HydrophobicContact CD1-CE2 4.33Å; L488-Y529 VanDerWaalsContact CD1-OH 3.26Å; L488-Y529 WeakPolarHBondContact CD1-OH 3.45Å; C526-Y529 WeakPolarHBondContact O-CD2 3.36Å; C526-Y529 PolarHBondContact O-N 3.43Å; A527-Y529 PolarHBondContact O-N 2.93Å; Y529-S531 PolarHBondContact O-N 3.29Å; Y529-V534 HydrophobicContact CD1-CB 4.46Å; Y529-V534 HydrophobicContact CD1-CG1 3.4Å; Y529-V534 VanDerWaalsContact CD1-CG1 3.4Å; Y529-V534 HydrophobicContact CE1-CG1 4.08Å; Y529-V534 HydrophobicContact CG-CG1 3.76Å; Y529-A538 HydrophobicContact CD2-CB 3.69Å; Y529-A538 HydrophobicContact CE2-CB 3.51Å; Y529-C552 VanDerWaalsContact O-CB 3.28Å; Y529-C552 WeakPolarHBondContact O-CB 3.16Å
530	S	73.8	Confident	80.1	Confident	70 Å²	70	31 Å²	31	49%	0.49	19%	0.19	S	C	.	.			trans	-71.4	-12.9	179.2	53.4	0	0	0	0	115	G31 L528 W545	G31-S530 WeakPolarHBondContact O-CB 3.47Å; G31-S530 PolarHBondContact O-OG 2.96Å; L528-S530 PolarHBondContact O-N 3.15Å; S530-W545 WeakPolarHBondContact O-CH2 3.05Å
531	S	79.6	Confident	79.6	Confident	49 Å²	49	30.6 Å²	30.6	34%	0.343	19%	0.188	S	C	.	.	S	Bend	trans	-100.6	131.1	170.8	170.4	0	0	0	0	110.9	Y529 E533 V534 C535	Y529-S531 PolarHBondContact O-N 3.29Å; S531-E533 PolarHBondContact O-N 2.89Å; S531-E533 PolarHBondContact OG-N 2.83Å; S531-V534 PolarHBondContact O-N 3.28Å; S531-C535 PolarHBondContact O-N 2.03Å
532	C	79.9	Confident	79.1	Confident	15 Å²	15	30.7 Å²	30.7	10%	0.101	19%	0.19	C	C	.	.	H	α-helix	trans	-53.6	-39.7	174.1	-168.7	0	0	0	0	111.7	V534 C535 A536 W545 C572	C532-V534 VanDerWaalsContact C-N 3.27Å; C532-V534 PolarHBondContact O-N 3.44Å; C532-C535 PolarHBondContact O-N 2.76Å; C532-A536 VanDerWaalsContact O-CB 3.28Å; C532-A536 WeakPolarHBondContact O-CB 3.29Å; C532-A536 PolarHBondContact O-N 3.3Å; C532-W545 HydrophobicContact CB-CD2 3.66Å; C532-W545 HydrophobicContact CB-CE3 4.07Å; C532-W545 HydrophobicContact CB-CG 3.97Å; C532-W545 HydrophobicContact CB-CH2 4.46Å; C532-W545 HydrophobicContact CB-CZ2 4.09Å; C532-W545 HydrophobicContact CB-CZ3 4.45Å; C532-C572 HydrophobicContact CB-CB 3.66Å; C532-C572 WeakPolarHBondContact CB-SG 3.37Å; C532-C572 PolarHBondContact O-SG 2.95Å; C532-C572 WeakPolarHBondContact SG-CA 3.37Å; C532-C572 WeakPolarHBondContact SG-CB 3.3Å; C532-C572 CovalentContact SG-SG 2.04Å; C532-C572 PolarHBondContact SG-SG 2.97Å
533	E	75.5	Confident	78.9	Confident	75 Å²	75	27.7 Å²	27.7	35%	0.35	18%	0.176	S	C	.	.	H	α-helix	trans	-64.8	-28.9	179.5	-60.4	-177.6	174	0	0	113.5	S531 R537 L569	S531-E533 PolarHBondContact O-N 2.89Å; S531-E533 PolarHBondContact OG-N 2.83Å; E533-R537 WeakPolarHBondContact O-CG 3.27Å; E533-R537 PolarHBondContact O-N 2.85Å; E533-R537 PolarHBondContact O-NE 2.99Å; E533-L569 HydrophobicContact CB-CD2 4.18Å
534	V	77.8	Confident	79.1	Confident	12 Å²	12	30.8 Å²	30.8	7%	0.073	19%	0.19	C	C	.	.	H	α-helix	trans	-79.1	-45.3	173.5	-175.9	0	0	0	0	109.5	L488 Q489 Y529 S531 C532 A536 R537 A538	L488-V534 HydrophobicContact CB-CG1 4.22Å; Q489-V534 HydrophobicContact CG-CG1 3.75Å; Q489-V534 HydrophobicContact CG-CG2 4.23Å; Y529-V534 HydrophobicContact CD1-CB 4.46Å; Y529-V534 HydrophobicContact CD1-CG1 3.4Å; Y529-V534 VanDerWaalsContact CD1-CG1 3.4Å; Y529-V534 HydrophobicContact CE1-CG1 4.08Å; Y529-V534 HydrophobicContact CG-CG1 3.76Å; S531-V534 PolarHBondContact O-N 3.28Å; C532-V534 VanDerWaalsContact C-N 3.27Å; C532-V534 PolarHBondContact O-N 3.44Å; V534-A536 VanDerWaalsContact C-N 3.32Å; V534-A536 PolarHBondContact O-N 3.34Å; V534-R537 PolarHBondContact O-N 3.03Å; V534-R537 VanDerWaalsContact O-N 3.11Å; V534-A538 PolarHBondContact O-N 2.91Å
535	C	83.6	Confident	79.4	Confident	0 Å²	0	27 Å²	27	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58	-43.3	177.7	-172	0	0	0	0	112.4	S531 C532 R537 A538 R539 E544 W545 C552	S531-C535 PolarHBondContact O-N 2.03Å; C532-C535 PolarHBondContact O-N 2.76Å; C535-R537 VanDerWaalsContact C-N 3.34Å; C535-R537 PolarHBondContact O-N 3.05Å; C535-A538 CarbonylContact O-C 3.58Å; C535-A538 WeakPolarHBondContact O-CA 3.36Å; C535-A538 WeakPolarHBondContact O-CB 3.45Å; C535-A538 PolarHBondContact O-N 3.5Å; C535-A538 VanDerWaalsContact O-N 3.08Å; C535-R539 PolarHBondContact O-N 3.3Å; C535-R539 VanDerWaalsContact O-N 3.17Å; C535-E544 PolarHBondContact SG-O 2.79Å; C535-W545 HydrophobicContact CB-CB 4.34Å; C535-W545 HydrophobicContact CB-CE3 3.79Å; C535-W545 PolarHBondContact SG-N 3.19Å; C535-C552 HydrophobicContact CB-CB 3.65Å; C535-C552 WeakPolarHBondContact CB-SG 3.27Å; C535-C552 VanDerWaalsContact SG-CA 3.59Å; C535-C552 WeakPolarHBondContact SG-CB 3.4Å; C535-C552 CovalentContact SG-SG 2.03Å; C535-C552 PolarHBondContact SG-SG 3.31Å
536	A	79.6	Confident	79.8	Confident	5 Å²	5	26.6 Å²	26.6	4%	0.041	16%	0.162	C	C	.	.	H	α-helix	trans	-64.4	-34.8	175.8	0	0	0	0	0	112.9	C532 V534 A538 R539 A568 L569	C532-A536 VanDerWaalsContact O-CB 3.28Å; C532-A536 WeakPolarHBondContact O-CB 3.29Å; C532-A536 PolarHBondContact O-N 3.3Å; V534-A536 VanDerWaalsContact C-N 3.32Å; V534-A536 PolarHBondContact O-N 3.34Å; A536-A538 VanDerWaalsContact C-N 3.34Å; A536-R539 WeakPolarHBondContact O-CB 3.47Å; A536-R539 PolarHBondContact O-N 2.85Å; A536-A568 HydrophobicContact CB-CB 3.64Å; A536-L569 HydrophobicContact CB-CD2 3.8Å; A536-L569 HydrophobicContact CB-CG 3.95Å
537	R	78.7	Confident	79.7	Confident	18 Å²	18	31.3 Å²	31.3	7%	0.068	19%	0.191	C	C	.	.	H	α-helix	trans	-70.3	-31.3	170.5	-76.8	179.7	-72.9	150.4	-5.8	112.4	T486 L487 L488 E533 V534 C535 R539 V565	T486-R537 HydrophobicContact CG2-CB 3.9Å; T486-R537 HydrophobicContact CG2-CG 4.04Å; L487-R537 PolarHBondContact O-NH1 2.9Å; L488-R537 HydrophobicContact CD2-CB 3.79Å; L488-R537 VanDerWaalsContact O-CZ 3.29Å; L488-R537 PolarHBondContact O-NH1 3.05Å; L488-R537 PolarHBondContact O-NH2 2.94Å; E533-R537 WeakPolarHBondContact O-CG 3.27Å; E533-R537 PolarHBondContact O-N 2.85Å; E533-R537 PolarHBondContact O-NE 2.99Å; V534-R537 PolarHBondContact O-N 3.03Å; V534-R537 VanDerWaalsContact O-N 3.11Å; C535-R537 VanDerWaalsContact C-N 3.34Å; C535-R537 PolarHBondContact O-N 3.05Å; R537-R539 PolarHBondContact O-N 3.46Å; R537-V565 HydrophobicContact CB-CG1 4.35Å; R537-V565 HydrophobicContact CG-CG1 3.8Å
538	A	80.4	Confident	79.6	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-76.9	2.8	171.6	0	0	0	0	0	114	L488 Y529 V534 C535 A536 G540 V541 C543	L488-A538 HydrophobicContact CD1-CB 4.3Å; L488-A538 HydrophobicContact CD2-CB 4.03Å; Y529-A538 HydrophobicContact CD2-CB 3.69Å; Y529-A538 HydrophobicContact CE2-CB 3.51Å; V534-A538 PolarHBondContact O-N 2.91Å; C535-A538 CarbonylContact O-C 3.58Å; C535-A538 WeakPolarHBondContact O-CA 3.36Å; C535-A538 WeakPolarHBondContact O-CB 3.45Å; C535-A538 PolarHBondContact O-N 3.5Å; C535-A538 VanDerWaalsContact O-N 3.08Å; A536-A538 VanDerWaalsContact C-N 3.34Å; A538-G540 PolarHBondContact O-N 3.25Å; A538-V541 HydrophobicContact CB-CG2 4.08Å; A538-V541 WeakPolarHBondContact O-CG2 3.41Å; A538-V541 PolarHBondContact O-N 2.78Å; A538-C543 HydrophobicContact CB-CB 3.81Å; A538-C543 PolarHBondContact O-N 3.02Å
539	R	79.1	Confident	79.5	Confident	24 Å²	24	37.9 Å²	37.9	9%	0.091	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-55	-36.9	176.7	-176.4	55.9	170.8	178	-11.2	112.9	C535 A536 R537 V541 G542 C543 E544 T555 A568	C535-R539 PolarHBondContact O-N 3.3Å; C535-R539 VanDerWaalsContact O-N 3.17Å; A536-R539 WeakPolarHBondContact O-CB 3.47Å; A536-R539 PolarHBondContact O-N 2.85Å; R537-R539 PolarHBondContact O-N 3.46Å; R539-V541 PolarHBondContact O-N 3.25Å; R539-G542 PolarHBondContact O-N 3.18Å; R539-G542 VanDerWaalsContact O-N 3.14Å; R539-C543 WeakPolarHBondContact CA-O 3.47Å; R539-C543 WeakPolarHBondContact CD-O 3.45Å; R539-C543 PolarHBondContact NH1-O 2.89Å; R539-E544 IonicContact CZ-OE2 2.66Å; R539-E544 VanDerWaalsContact NH1-CD 3.28Å; R539-E544 IonicContact NH1-OE2 2.77Å; R539-E544 PolarHBondContact NH1-OE2 3.2Å; R539-E544 IonicContact NH2-OE1 2.71Å; R539-E544 IonicContact NH2-OE2 3.89Å; R539-E544 PolarHBondContact NH2-OE2 3.33Å; R539-T555 PolarHBondContact NH1-OG1 3.41Å; R539-A568 HydrophobicContact CB-CB 4.31Å; R539-A568 HydrophobicContact CG-CB 4.38Å
540	G	72.9	Confident	79.4	Confident	25 Å²	25	43 Å²	43	26%	0.258	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-61.9	-24.6	177.5	0	0	0	0	0	114.6	A481 A538	A481-G540 WeakPolarHBondContact CB-O 3.41Å; A538-G540 PolarHBondContact O-N 3.25Å
541	V	79.3	Confident	79.9	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-102.8	19.6	177.4	-63.8	0	0	0	0	113.1	M455 V465 A479 A538 R539	M455-V541 HydrophobicContact CB-CB 4.22Å; M455-V541 HydrophobicContact CE-CB 4.5Å; M455-V541 HydrophobicContact CE-CG2 4.26Å; M455-V541 HydrophobicContact CG-CB 4.07Å; M455-V541 HydrophobicContact CG-CG1 4.4Å; V465-V541 HydrophobicContact CG2-CG2 4.45Å; A479-V541 HydrophobicContact CB-CG1 3.92Å; A479-V541 HydrophobicContact CB-CG2 4.39Å; A538-V541 HydrophobicContact CB-CG2 4.08Å; A538-V541 WeakPolarHBondContact O-CG2 3.41Å; A538-V541 PolarHBondContact O-N 2.78Å; R539-V541 PolarHBondContact O-N 3.25Å
542	G	78.9	Confident	80.1	Confident	3 Å²	3	40.2 Å²	40.2	3%	0.031	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	16.1	173.7	0	0	0	0	0	115.6	R539 F554 T555	R539-G542 PolarHBondContact O-N 3.18Å; R539-G542 VanDerWaalsContact O-N 3.14Å; G542-F554 WeakPolarHBondContact O-CA 3.1Å; G542-F554 VanDerWaalsContact O-CD2 3.3Å; G542-F554 WeakPolarHBondContact O-CD2 3.25Å; G542-T555 PolarHBondContact O-N 2.88Å; G542-T555 PolarHBondContact O-OG1 2.87Å
543	C	83.7	Confident	80.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	145.5	174.3	-60	0	0	0	0	112.7	C526 A538 R539 R553	C526-C543 HydrophobicContact CB-CB 3.73Å; C526-C543 WeakPolarHBondContact CB-SG 3.35Å; C526-C543 WeakPolarHBondContact SG-CA 3.49Å; C526-C543 WeakPolarHBondContact SG-CB 3.48Å; C526-C543 CovalentContact SG-SG 2.04Å; C526-C543 PolarHBondContact SG-SG 3.22Å; A538-C543 HydrophobicContact CB-CB 3.81Å; A538-C543 PolarHBondContact O-N 3.02Å; R539-C543 WeakPolarHBondContact CA-O 3.47Å; R539-C543 WeakPolarHBondContact CD-O 3.45Å; R539-C543 PolarHBondContact NH1-O 2.89Å; C543-R553 CarbonylContact C-O 3.59Å; C543-R553 WeakPolarHBondContact CA-O 3.32Å
544	E	85	Confident	80.6	Confident	67 Å²	67	46 Å²	46	31%	0.313	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	143.8	174.8	-161.8	155	179.9	0	0	111.4	C535 R539 C552 R553 T555	C535-E544 PolarHBondContact SG-O 2.79Å; R539-E544 IonicContact CZ-OE2 2.66Å; R539-E544 VanDerWaalsContact NH1-CD 3.28Å; R539-E544 IonicContact NH1-OE2 2.77Å; R539-E544 PolarHBondContact NH1-OE2 3.2Å; R539-E544 IonicContact NH2-OE1 2.71Å; R539-E544 IonicContact NH2-OE2 3.89Å; R539-E544 PolarHBondContact NH2-OE2 3.33Å; E544-C552 CarbonylContact O-C 3.55Å; E544-C552 WeakPolarHBondContact O-CA 3.45Å; E544-R553 PolarHBondContact N-O 3.09Å; E544-R553 PolarHBondContact O-N 2.84Å; E544-T555 HydrophobicContact CB-CG2 3.57Å
545	W	83.8	Confident	80.3	Confident	49 Å²	49	46.9 Å²	46.9	19%	0.186	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	119.7	178.7	-177.1	-97.3	0	0	0	111.1	S530 C532 C535 T547 N550 C552	S530-W545 WeakPolarHBondContact O-CH2 3.05Å; C532-W545 HydrophobicContact CB-CD2 3.66Å; C532-W545 HydrophobicContact CB-CE3 4.07Å; C532-W545 HydrophobicContact CB-CG 3.97Å; C532-W545 HydrophobicContact CB-CH2 4.46Å; C532-W545 HydrophobicContact CB-CZ2 4.09Å; C532-W545 HydrophobicContact CB-CZ3 4.45Å; C535-W545 HydrophobicContact CB-CB 4.34Å; C535-W545 HydrophobicContact CB-CE3 3.79Å; C535-W545 PolarHBondContact SG-N 3.19Å; W545-T547 PolarHBondContact O-N 2.84Å; W545-N550 VanDerWaalsContact CH2-C 3.48Å; W545-N550 WeakPolarHBondContact CH2-O 3.46Å; W545-N550 VanDerWaalsContact CZ2-C 3.44Å; W545-N550 HydrophobicContact CZ2-CB 3.98Å; W545-C552 HydrophobicContact CE3-CB 3.98Å; W545-C552 HydrophobicContact CZ3-CB 4.29Å
546	S	83.1	Confident	79.3	Confident	24 Å²	24	52.6 Å²	52.6	17%	0.168	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	112.9	168.1	178.3	0	0	0	0	109.6	E548 D549 N550 T551	S546-E548 VanDerWaalsContact C-N 3.25Å; S546-E548 PolarHBondContact O-N 3.41Å; S546-E548 PolarHBondContact OG-N 2.88Å; S546-D549 PolarHBondContact OG-N 2.03Å; S546-D549 PolarHBondContact OG-OD2 2.94Å; S546-N550 VanDerWaalsContact O-CA 3.31Å; S546-N550 WeakPolarHBondContact O-CA 3.3Å; S546-N550 PolarHBondContact O-N 2.83Å; S546-T551 WeakPolarHBondContact CB-O 3.12Å; S546-T551 PolarHBondContact N-O 3.48Å; S546-T551 PolarHBondContact O-N 2.91Å
547	T	79.3	Confident	78.3	Confident	102 Å²	102	56.3 Å²	56.3	63%	0.626	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-19.8	172.2	50.5	0	0	0	0	113.2	W545	W545-T547 PolarHBondContact O-N 2.84Å
548	E	77	Confident	77.2	Confident	179 Å²	179	61.6 Å²	61.6	84%	0.836	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-42.9	177.8	-61.7	-176	169.6	0	0	111	S546	S546-E548 VanDerWaalsContact C-N 3.25Å; S546-E548 PolarHBondContact O-N 3.41Å; S546-E548 PolarHBondContact OG-N 2.88Å
549	D	76.4	Confident	75.8	Confident	74 Å²	74	63.8 Å²	63.8	40%	0.396	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-10.1	-176.8	-58.4	-88.7	0	0	0	113.9	S546 T551 R553	S546-D549 PolarHBondContact OG-N 2.03Å; S546-D549 PolarHBondContact OG-OD2 2.94Å; D549-T551 VanDerWaalsContact CB-OG1 3.26Å; D549-T551 WeakPolarHBondContact CB-OG1 3.41Å; D549-T551 PolarHBondContact O-N 3.02Å; D549-R553 IonicContact OD1-CZ 3.3Å; D549-R553 IonicContact OD1-NH1 3.16Å; D549-R553 IonicContact OD1-NH2 2.97Å; D549-R553 PolarHBondContact OD1-NH2 2.78Å; D549-R553 IonicContact OD2-CZ 2.73Å; D549-R553 IonicContact OD2-NH1 2.72Å; D549-R553 PolarHBondContact OD2-NH1 3.36Å; D549-R553 IonicContact OD2-NH2 2.67Å; D549-R553 PolarHBondContact OD2-NH2 2.98Å
550	N	80	Confident	74.3	Confident	112 Å²	112	64.3 Å²	64.3	60%	0.599	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	42.2	-166.3	-69.4	-60.9	0	0	0	113.1	W545 S546	W545-N550 VanDerWaalsContact CH2-C 3.48Å; W545-N550 WeakPolarHBondContact CH2-O 3.46Å; W545-N550 VanDerWaalsContact CZ2-C 3.44Å; W545-N550 HydrophobicContact CZ2-CB 3.98Å; S546-N550 VanDerWaalsContact O-CA 3.31Å; S546-N550 WeakPolarHBondContact O-CA 3.3Å; S546-N550 PolarHBondContact O-N 2.83Å
551	T	84.6	Confident	72.9	Confident	57 Å²	57	70 Å²	70	35%	0.35	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	147.9	179.1	51.7	0	0	0	0	111.7	S546 D549	S546-T551 WeakPolarHBondContact CB-O 3.12Å; S546-T551 PolarHBondContact N-O 3.48Å; S546-T551 PolarHBondContact O-N 2.91Å; D549-T551 VanDerWaalsContact CB-OG1 3.26Å; D549-T551 WeakPolarHBondContact CB-OG1 3.41Å; D549-T551 PolarHBondContact O-N 3.02Å
552	C	84.7	Confident	71.2	Confident	3 Å²	3	72.5 Å²	72.5	2%	0.02	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.1	173	-167.2	0	0	0	0	110.1	C526 A527 Y529 C535 E544 W545	C526-C552 CarbonylContact C-O 3.57Å; C526-C552 VanDerWaalsContact O-CB 3.23Å; C526-C552 WeakPolarHBondContact O-CB 3.17Å; C526-C552 PolarHBondContact O-SG 3.01Å; C526-C552 VanDerWaalsContact O-SG 3.4Å; A527-C552 VanDerWaalsContact CA-O 3.32Å; A527-C552 WeakPolarHBondContact CA-O 3.42Å; A527-C552 PolarHBondContact N-O 2.87Å; Y529-C552 VanDerWaalsContact O-CB 3.28Å; Y529-C552 WeakPolarHBondContact O-CB 3.16Å; C535-C552 HydrophobicContact CB-CB 3.65Å; C535-C552 WeakPolarHBondContact CB-SG 3.27Å; C535-C552 VanDerWaalsContact SG-CA 3.59Å; C535-C552 WeakPolarHBondContact SG-CB 3.4Å; C535-C552 CovalentContact SG-SG 2.03Å; C535-C552 PolarHBondContact SG-SG 3.31Å; E544-C552 CarbonylContact O-C 3.55Å; E544-C552 WeakPolarHBondContact O-CA 3.45Å; W545-C552 HydrophobicContact CE3-CB 3.98Å; W545-C552 HydrophobicContact CZ3-CB 4.29Å
553	R	84.6	Confident	69.8	Low	124 Å²	124	75.8 Å²	75.8	47%	0.468	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	157.8	-179.7	-68.8	-174	176.6	144.4	7.4	110.6	C543 E544 D549	C543-R553 CarbonylContact C-O 3.59Å; C543-R553 WeakPolarHBondContact CA-O 3.32Å; E544-R553 PolarHBondContact N-O 3.09Å; E544-R553 PolarHBondContact O-N 2.84Å; D549-R553 IonicContact OD1-CZ 3.3Å; D549-R553 IonicContact OD1-NH1 3.16Å; D549-R553 IonicContact OD1-NH2 2.97Å; D549-R553 PolarHBondContact OD1-NH2 2.78Å; D549-R553 IonicContact OD2-CZ 2.73Å; D549-R553 IonicContact OD2-NH1 2.72Å; D549-R553 PolarHBondContact OD2-NH1 3.36Å; D549-R553 IonicContact OD2-NH2 2.67Å; D549-R553 PolarHBondContact OD2-NH2 2.98Å
554	F	79.6	Confident	68.9	Low	87 Å²	87	79.9 Å²	79.9	38%	0.382	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	140.2	170.7	-177.1	-102	0	0	0	109.8	G542 L556	G542-F554 WeakPolarHBondContact O-CA 3.1Å; G542-F554 VanDerWaalsContact O-CD2 3.3Å; G542-F554 WeakPolarHBondContact O-CD2 3.25Å; F554-L556 HydrophobicContact CE1-CD2 3.95Å; F554-L556 HydrophobicContact CE1-CG 4.24Å
555	T	72.4	Confident	67.9	Low	30 Å²	30	78.2 Å²	78.2	18%	0.184	45%	0.446	C	S	.	.			trans	-133.1	127.1	-176.9	53.9	0	0	0	0	111.5	R539 G542 E544 T557	R539-T555 PolarHBondContact NH1-OG1 3.41Å; G542-T555 PolarHBondContact O-N 2.88Å; G542-T555 PolarHBondContact O-OG1 2.87Å; E544-T555 HydrophobicContact CB-CG2 3.57Å; T555-T557 VanDerWaalsContact C-N 3.26Å; T555-T557 WeakPolarHBondContact CB-OG1 3.34Å; T555-T557 PolarHBondContact O-N 2.77Å
556	L	62.6	Low	66.9	Low	120 Å²	120	78.5 Å²	78.5	63%	0.628	45%	0.451	S	S	*	.			trans	-77.8	-4.5	176	-71.7	165.4	0	0	0	113.7	R462 F554 D558	R462-L556 VanDerWaalsContact NH1-C 3.31Å; R462-L556 PolarHBondContact NH1-O 3.19Å; R462-L556 PolarHBondContact NH2-O 2.96Å; F554-L556 HydrophobicContact CE1-CD2 3.95Å; F554-L556 HydrophobicContact CE1-CG 4.24Å; L556-D558 PolarHBondContact O-N 3.43Å
557	T	59	Low	66.1	Low	84 Å²	84	81.7 Å²	81.7	52%	0.515	46%	0.463	S	S	.	.	S	Bend	trans	-61.8	134.2	170.6	35.1	0	0	0	0	110.2	R462 T555	R462-T557 PolarHBondContact NH1-O 3.36Å; T555-T557 VanDerWaalsContact C-N 3.26Å; T555-T557 WeakPolarHBondContact CB-OG1 3.34Å; T555-T557 PolarHBondContact O-N 2.77Å
558	D	53.9	Low	65.5	Low	129 Å²	129	77.9 Å²	77.9	69%	0.69	44%	0.442	S	S	*	.			trans	-59.3	132.3	174.7	-73.6	-40	0	0	0	109.8	L556 G560	L556-D558 PolarHBondContact O-N 3.43Å; D558-G560 PolarHBondContact O-N 3.39Å
559	P	52.7	Low	65.1	Low	46 Å²	46	70.3 Å²	70.3	30%	0.299	41%	0.407	S	S	.	.			trans	-63.6	109.6	159.8	28.2	-30.2	0	0	0	106.4
560	G	47.4	Very low	64.7	Low	35 Å²	35	74.1 Å²	74.1	36%	0.361	42%	0.42	S	S	.	.			trans	-52.4	149.5	179.5	0	0	0	0	0	110.7	D558 G562 D563	D558-G560 PolarHBondContact O-N 3.39Å; G560-G562 PolarHBondContact O-N 3.35Å; G560-D563 PolarHBondContact O-N 2.81Å
561	S	42.1	Very low	64.1	Low	145 Å²	145	75.4 Å²	75.4	100%	1.014	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	11.5	-173.4	65.1	0	0	0	0	116.6
562	G	45.3	Very low	63.4	Low	53 Å²	53	74 Å²	74	55%	0.546	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.8	5.9	172.6	0	0	0	0	0	115.2	G560 V564	G560-G562 PolarHBondContact O-N 3.35Å; G562-V564 WeakPolarHBondContact O-CG2 3.23Å; G562-V564 PolarHBondContact O-N 3.12Å
563	D	49.1	Very low	62.3	Low	72 Å²	72	78.1 Å²	78.1	39%	0.385	44%	0.435	S	S	.	.			trans	-77.9	70.2	-178.8	-81.2	31.8	0	0	0	110.7	G560	G560-D563 PolarHBondContact O-N 2.81Å
564	V	65.4	Low	60.8	Low	85 Å²	85	78.1 Å²	78.1	52%	0.515	45%	0.454	S	S	.	.			trans	-57.7	144.3	178.6	-169.7	0	0	0	0	109.6	G562 D566 E567	G562-V564 WeakPolarHBondContact O-CG2 3.23Å; G562-V564 PolarHBondContact O-N 3.12Å; V564-D566 HydrophobicContact CB-CB 4.44Å; V564-D566 HydrophobicContact CG1-CB 4.1Å; V564-D566 PolarHBondContact O-N 2.89Å; V564-E567 PolarHBondContact O-N 3.05Å
565	V	64.1	Low	59.3	Low	32 Å²	32	81.4 Å²	81.4	19%	0.194	47%	0.47	C	S	.	.	H	α-helix	trans	-41.9	-34	169.1	163.5	0	0	0	0	112.8	R537 E567 A568 L569	R537-V565 HydrophobicContact CB-CG1 4.35Å; R537-V565 HydrophobicContact CG-CG1 3.8Å; V565-E567 VanDerWaalsContact C-N 3.33Å; V565-E567 PolarHBondContact O-N 3.26Å; V565-A568 PolarHBondContact O-N 3.02Å; V565-L569 HydrophobicContact CG1-CD1 3.74Å; V565-L569 HydrophobicContact CG1-CG 4.16Å; V565-L569 WeakPolarHBondContact O-CB 3.24Å; V565-L569 VanDerWaalsContact O-CG 3.3Å; V565-L569 WeakPolarHBondContact O-CG 3.31Å; V565-L569 PolarHBondContact O-N 3.07Å
566	D	62.6	Low	58.3	Low	56 Å²	56	82.8 Å²	82.8	30%	0.299	49%	0.49	S	S	.	.	H	α-helix	trans	-59.8	-31.6	174.7	-76.9	-52.6	0	0	0	115.3	V564 K570 R577	V564-D566 HydrophobicContact CB-CB 4.44Å; V564-D566 HydrophobicContact CG1-CB 4.1Å; V564-D566 PolarHBondContact O-N 2.89Å; D566-K570 VanDerWaalsContact O-CG 3.31Å; D566-K570 WeakPolarHBondContact O-CG 3.35Å; D566-K570 PolarHBondContact O-N 3.35Å; D566-R577 IonicContact OD1-CZ 2.92Å; D566-R577 IonicContact OD1-NH1 2.77Å; D566-R577 PolarHBondContact OD1-NH1 3.21Å; D566-R577 IonicContact OD1-NH2 2.87Å; D566-R577 PolarHBondContact OD1-NH2 2.94Å
567	E	65.5	Low	58.2	Low	90 Å²	90	81.5 Å²	81.5	42%	0.421	48%	0.477	S	S	.	.	H	α-helix	trans	-77.9	-38.4	176.2	-174.5	161.3	172	0	0	112	V564 V565 L569 K570 K571	V564-E567 PolarHBondContact O-N 3.05Å; V565-E567 VanDerWaalsContact C-N 3.33Å; V565-E567 PolarHBondContact O-N 3.26Å; E567-L569 VanDerWaalsContact C-N 3.31Å; E567-L569 PolarHBondContact O-N 3.28Å; E567-K570 PolarHBondContact O-N 3.2Å; E567-K571 PolarHBondContact O-N 2.87Å
568	A	67	Low	58.5	Low	22 Å²	22	79.8 Å²	79.8	18%	0.182	47%	0.468	C	S	.	.	H	α-helix	trans	-61.5	-41.5	168.8	0	0	0	0	0	111	A536 R539 V565 K570 K571 C572	A536-A568 HydrophobicContact CB-CB 3.64Å; R539-A568 HydrophobicContact CB-CB 4.31Å; R539-A568 HydrophobicContact CG-CB 4.38Å; V565-A568 PolarHBondContact O-N 3.02Å; A568-K570 VanDerWaalsContact C-N 3.35Å; A568-K570 PolarHBondContact O-N 3.21Å; A568-K571 WeakPolarHBondContact O-CB 3.48Å; A568-K571 PolarHBondContact O-N 3.21Å; A568-K571 VanDerWaalsContact O-N 3.16Å; A568-C572 PolarHBondContact O-N 2.91Å
569	L	68	Low	58.9	Low	21 Å²	21	78.9 Å²	78.9	11%	0.11	46%	0.463	C	S	.	.	H	α-helix	trans	-64.3	-34	175.9	-75.1	170.2	0	0	0	113.1	E533 A536 V565 E567 K571 C572	E533-L569 HydrophobicContact CB-CD2 4.18Å; A536-L569 HydrophobicContact CB-CD2 3.8Å; A536-L569 HydrophobicContact CB-CG 3.95Å; V565-L569 HydrophobicContact CG1-CD1 3.74Å; V565-L569 HydrophobicContact CG1-CG 4.16Å; V565-L569 WeakPolarHBondContact O-CB 3.24Å; V565-L569 VanDerWaalsContact O-CG 3.3Å; V565-L569 WeakPolarHBondContact O-CG 3.31Å; V565-L569 PolarHBondContact O-N 3.07Å; E567-L569 VanDerWaalsContact C-N 3.31Å; E567-L569 PolarHBondContact O-N 3.28Å; L569-K571 VanDerWaalsContact C-N 3.27Å; L569-K571 PolarHBondContact O-N 3.25Å; L569-C572 WeakPolarHBondContact O-CB 3.41Å; L569-C572 PolarHBondContact O-N 3Å
570	K	67.7	Low	60	Low	153 Å²	153	78.4 Å²	78.4	67%	0.665	46%	0.46	S	S	*	.	H	α-helix	trans	-62.9	-32.2	173.4	-76.2	167.8	-169	170.8	0	112.6	D566 E567 A568 C572	D566-K570 VanDerWaalsContact O-CG 3.31Å; D566-K570 WeakPolarHBondContact O-CG 3.35Å; D566-K570 PolarHBondContact O-N 3.35Å; E567-K570 PolarHBondContact O-N 3.2Å; A568-K570 VanDerWaalsContact C-N 3.35Å; A568-K570 PolarHBondContact O-N 3.21Å; K570-C572 VanDerWaalsContact C-N 3.27Å; K570-C572 PolarHBondContact O-N 3.19Å
571	K	68.3	Low	61.3	Low	139 Å²	139	81.7 Å²	81.7	60%	0.604	48%	0.477	S	S	*	.	H	α-helix	trans	-73.4	-19	176.8	-64	174.4	-176.1	174	0	112.7	E567 A568 L569	E567-K571 PolarHBondContact O-N 2.87Å; A568-K571 WeakPolarHBondContact O-CB 3.48Å; A568-K571 PolarHBondContact O-N 3.21Å; A568-K571 VanDerWaalsContact O-N 3.16Å; L569-K571 VanDerWaalsContact C-N 3.27Å; L569-K571 PolarHBondContact O-N 3.25Å
572	C	69.1	Low	63.2	Low	28 Å²	28	77.2 Å²	77.2	19%	0.189	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-20.1	-175.7	-72.4	0	0	0	0	116	C532 A568 L569 K570	C532-C572 HydrophobicContact CB-CB 3.66Å; C532-C572 WeakPolarHBondContact CB-SG 3.37Å; C532-C572 PolarHBondContact O-SG 2.95Å; C532-C572 WeakPolarHBondContact SG-CA 3.37Å; C532-C572 WeakPolarHBondContact SG-CB 3.3Å; C532-C572 CovalentContact SG-SG 2.04Å; C532-C572 PolarHBondContact SG-SG 2.97Å; A568-C572 PolarHBondContact O-N 2.91Å; L569-C572 WeakPolarHBondContact O-CB 3.41Å; L569-C572 PolarHBondContact O-N 3Å; K570-C572 VanDerWaalsContact C-N 3.27Å; K570-C572 PolarHBondContact O-N 3.19Å
573	N	63.1	Low	65.1	Low	89 Å²	89	80.7 Å²	80.7	48%	0.476	44%	0.444	S	S	.	.			trans	-154	127.2	-175.3	-146.8	-22.4	0	0	0	113.8	Q575	N573-Q575 PolarHBondContact OD1-N 3.49Å
574	S	51.6	Low	66.8	Low	124 Å²	124	85.3 Å²	85.3	87%	0.867	46%	0.456	S	S	*	.	S	Bend	trans	-91.1	2.6	176	49	0	0	0	0	113.4
575	Q	48.3	Very low	67.7	Low	157 Å²	157	84 Å²	84	73%	0.734	45%	0.446	S	S	*	.	S	Bend	trans	-132.9	124.7	175.5	-82.4	172.4	-42.9	0	0	113.2	N573 R577	N573-Q575 PolarHBondContact OD1-N 3.49Å; Q575-R577 PolarHBondContact O-N 2.85Å
576	G	52.4	Low	68.7	Low	58 Å²	58	89.7 Å²	89.7	60%	0.598	47%	0.468	S	S	*	.			trans	64.7	42.5	143.3	0	0	0	0	0	120.4	C578 D579	G576-C578 PolarHBondContact O-N 3.39Å; G576-D579 PolarHBondContact O-N 2.99Å
577	R	59.5	Low	69.8	Low	94 Å²	94	87.2 Å²	87.2	36%	0.355	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-24.4	179	-178.6	171.1	168.7	165.5	-1.3	116.1	D566 Q575 E640 C651 R653	D566-R577 IonicContact OD1-CZ 2.92Å; D566-R577 IonicContact OD1-NH1 2.77Å; D566-R577 PolarHBondContact OD1-NH1 3.21Å; D566-R577 IonicContact OD1-NH2 2.87Å; D566-R577 PolarHBondContact OD1-NH2 2.94Å; Q575-R577 PolarHBondContact O-N 2.85Å; R577-E640 IonicContact CZ-OE1 3.02Å; R577-E640 IonicContact CZ-OE2 3.12Å; R577-E640 IonicContact NE-OE1 3.51Å; R577-E640 PolarHBondContact NE-OE1 3.44Å; R577-E640 VanDerWaalsContact NE-OE1 3.08Å; R577-E640 IonicContact NE-OE2 3.33Å; R577-E640 PolarHBondContact NE-OE2 3.17Å; R577-E640 VanDerWaalsContact NH2-CD 3.32Å; R577-E640 IonicContact NH2-OE1 3.55Å; R577-E640 PolarHBondContact NH2-OE1 3.41Å; R577-E640 IonicContact NH2-OE2 3.68Å; R577-E640 PolarHBondContact NH2-OE2 3.23Å; R577-C651 PolarHBondContact O-SG 3.48Å; R577-C651 VanDerWaalsContact O-SG 3.34Å; R577-R653 PolarHBondContact O-NH1 3.09Å
578	C	64.6	Low	70.6	Confident	48 Å²	48	85.5 Å²	85.5	32%	0.324	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134	22.9	-174.3	-60.9	0	0	0	0	114.8	G576 C651 R652	G576-C578 PolarHBondContact O-N 3.39Å; C578-C651 WeakPolarHBondContact CA-SG 3.42Å; C578-C651 HydrophobicContact CB-CB 3.91Å; C578-C651 WeakPolarHBondContact CB-SG 3.47Å; C578-C651 WeakPolarHBondContact SG-CB 3.3Å; C578-C651 CovalentContact SG-SG 2.04Å; C578-C651 PolarHBondContact SG-SG 2.77Å; C578-R652 CarbonylContact C-O 3.2Å; C578-R652 WeakPolarHBondContact CA-O 3.22Å; C578-R652 VanDerWaalsContact O-CB 3.29Å; C578-R652 WeakPolarHBondContact O-CB 3.33Å
579	D	64.3	Low	71.4	Confident	110 Å²	110	88.3 Å²	88.3	59%	0.588	47%	0.47	S	S	*	.			trans	-140.4	83.2	171.4	-167.3	27.7	0	0	0	112.2	G576 R652	G576-D579 PolarHBondContact O-N 2.99Å; D579-R652 IonicContact OD1-NH1 3.62Å; D579-R652 PolarHBondContact OD1-NH1 2.94Å
580	P	74.4	Confident	71.8	Confident	36 Å²	36	90 Å²	90	23%	0.234	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-73.7	142	178.9	31.2	-37	0	0	0	111.3	T582 R652 A655	P580-T582 PolarHBondContact O-N 3.11Å; P580-R652 VanDerWaalsContact CD-O 3.27Å; P580-R652 WeakPolarHBondContact CD-O 3.43Å; P580-R652 HydrophobicContact CG-CG 4.03Å; P580-A655 HydrophobicContact CG-CB 4.2Å
581	S	74.6	Confident	72.4	Confident	103 Å²	103	86.4 Å²	86.4	72%	0.72	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-62.9	132.5	171.6	55.4	0	0	0	0	111.5	K583	S581-K583 PolarHBondContact O-N 2.68Å
582	T	83.4	Confident	72.9	Confident	51 Å²	51	87.3 Å²	87.3	31%	0.313	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-67.1	121.1	-178.8	-54.6	0	0	0	0	111.3	P580 A655	P580-T582 PolarHBondContact O-N 3.11Å; T582-A655 WeakPolarHBondContact CA-O 3.4Å; T582-A655 HydrophobicContact CG2-CB 4.39Å
583	K	83.6	Confident	73.4	Confident	126 Å²	126	87.3 Å²	87.3	55%	0.548	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	124.9	177.6	-65.7	178.6	-179.6	177.5	0	110.9	S581 A655 F656 Y657	S581-K583 PolarHBondContact O-N 2.68Å; K583-A655 PolarHBondContact N-O 3.11Å; K583-F656 HydrophobicContact CB-CD1 3.81Å; K583-F656 HydrophobicContact CB-CE1 4.19Å; K583-F656 HydrophobicContact CD-CD1 4.33Å; K583-F656 HydrophobicContact CD-CE1 3.84Å; K583-F656 CarbonylContact O-C 3.58Å; K583-F656 VanDerWaalsContact O-CA 3.23Å; K583-F656 WeakPolarHBondContact O-CA 3.36Å; K583-Y657 PolarHBondContact O-N 3.11Å
584	W	85.9	Confident	74.1	Confident	169 Å²	169	87.8 Å²	87.8	64%	0.64	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.2	-179.9	-61.9	78.3	0	0	0	110.3	Y657	W584-Y657 HydrophobicContact CD2-CG 4.47Å; W584-Y657 AromaticContact CE3-CD1 3.53Å; W584-Y657 HydrophobicContact CE3-CD1 3.53Å; W584-Y657 HydrophobicContact CE3-CE1 4.3Å; W584-Y657 AromaticContact CE3-CG 3.79Å; W584-Y657 HydrophobicContact CE3-CG 3.79Å; W584-Y657 HydrophobicContact CH2-CD1 4.19Å; W584-Y657 HydrophobicContact CH2-CD2 4.27Å; W584-Y657 HydrophobicContact CH2-CE1 4.49Å; W584-Y657 HydrophobicContact CH2-CG 4.07Å; W584-Y657 AromaticContact CZ3-CD1 3.3Å; W584-Y657 HydrophobicContact CZ3-CD1 3.3Å; W584-Y657 HydrophobicContact CZ3-CD2 4.16Å; W584-Y657 AromaticContact CZ3-CE1 3.68Å; W584-Y657 HydrophobicContact CZ3-CE1 3.68Å; W584-Y657 HydrophobicContact CZ3-CE2 4.46Å; W584-Y657 AromaticContact CZ3-CG 3.57Å; W584-Y657 HydrophobicContact CZ3-CG 3.57Å
585	L	84	Confident	75.6	Confident	59 Å²	59	82 Å²	82	31%	0.309	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.3	-176.5	-65.2	174.5	0	0	0	110.9	V587 L595 F656 Y657 L658 H659	L585-V587 HydrophobicContact CB-CG1 4.41Å; L585-L595 HydrophobicContact CD1-CD2 3.5Å; L585-L595 VanDerWaalsContact CD1-CD2 3.5Å; L585-F656 HydrophobicContact CD1-CB 4.36Å; L585-F656 HydrophobicContact CD1-CD1 3.73Å; L585-F656 HydrophobicContact CD1-CE1 4.44Å; L585-F656 HydrophobicContact CD1-CG 4.35Å; L585-F656 HydrophobicContact CG-CD1 4.34Å; L585-Y657 PolarHBondContact N-O 2.76Å; L585-L658 HydrophobicContact CB-CD2 3.82Å; L585-L658 HydrophobicContact CD1-CD2 3.83Å; L585-L658 HydrophobicContact CG-CD2 4.41Å; L585-H659 PolarHBondContact O-N 3.39Å; L585-H659 PolarHBondContact O-ND1 3.06Å
586	K	85.9	Confident	76.7	Confident	150 Å²	150	77.7 Å²	77.7	65%	0.652	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	122.7	170.6	-49	-115.6	175.8	175.9	0	107.7
587	V	85.3	Confident	77.9	Confident	5 Å²	5	75 Å²	75	3%	0.03	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.3	-177.8	-66.2	0	0	0	0	112.5	L585 L591 I593 V626 L631 L658 H659 L660 E661	L585-V587 HydrophobicContact CB-CG1 4.41Å; V587-L591 HydrophobicContact CB-CD2 4.5Å; V587-L591 HydrophobicContact CG1-CD2 4.38Å; V587-I593 HydrophobicContact CG1-CD1 4.16Å; V587-I593 HydrophobicContact CG1-CG2 4.25Å; V587-V626 HydrophobicContact CB-CG1 4.03Å; V587-V626 HydrophobicContact CB-CG2 3.96Å; V587-V626 HydrophobicContact CG1-CG2 4.23Å; V587-V626 HydrophobicContact CG2-CG1 3.67Å; V587-V626 HydrophobicContact CG2-CG2 4.13Å; V587-L631 HydrophobicContact CG2-CD2 4.23Å; V587-L658 HydrophobicContact CG1-CD2 4.29Å; V587-L658 HydrophobicContact CG2-CB 4.21Å; V587-H659 WeakPolarHBondContact CG2-O 3.2Å; V587-H659 PolarHBondContact N-O 3.23Å; V587-H659 VanDerWaalsContact N-O 3.14Å; V587-L660 WeakPolarHBondContact O-CA 3.44Å; V587-E661 PolarHBondContact O-N 3.25Å
588	S	82.7	Confident	77.9	Confident	54 Å²	54	75.1 Å²	75.1	38%	0.378	41%	0.414	S	S	.	.			trans	-114.2	148.7	176.8	53.2	0	0	0	0	111.1	G590 L591 V626	S588-G590 PolarHBondContact O-N 3.33Å; S588-L591 VanDerWaalsContact O-CB 3.23Å; S588-L591 WeakPolarHBondContact O-CB 3.43Å; S588-L591 PolarHBondContact O-N 3.09Å; S588-V626 WeakPolarHBondContact O-CB 3.48Å; S588-V626 WeakPolarHBondContact O-CG1 3.42Å
589	P	83.8	Confident	77.9	Confident	81 Å²	81	73.7 Å²	73.7	53%	0.526	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	136.9	178.6	-24.7	34.9	0	0	0	112.5	L591 L660	P589-L591 VanDerWaalsContact C-N 3.31Å; P589-L660 HydrophobicContact CG-CD2 3.79Å
590	G	74.8	Confident	77.4	Confident	57 Å²	57	69.6 Å²	69.6	59%	0.588	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	-7.8	-177.5	0	0	0	0	0	115.2	S588 V626	S588-G590 PolarHBondContact O-N 3.33Å; G590-V626 PolarHBondContact N-O 2.95Å
591	L	80.3	Confident	76.5	Confident	76 Å²	76	68.5 Å²	68.5	40%	0.398	37%	0.374	S	S	.	.			trans	-67	132.4	173	-175.4	65.4	0	0	0	110.5	V587 S588 P589 I593 V626	V587-L591 HydrophobicContact CB-CD2 4.5Å; V587-L591 HydrophobicContact CG1-CD2 4.38Å; S588-L591 VanDerWaalsContact O-CB 3.23Å; S588-L591 WeakPolarHBondContact O-CB 3.43Å; S588-L591 PolarHBondContact O-N 3.09Å; P589-L591 VanDerWaalsContact C-N 3.31Å; L591-I593 HydrophobicContact CD2-CG2 3.64Å; L591-I593 HydrophobicContact CG-CG2 3.78Å; L591-V626 HydrophobicContact CB-CG2 4.41Å; L591-V626 WeakPolarHBondContact O-CG2 3.38Å; L591-V626 PolarHBondContact O-N 3.35Å
592	Q	78.8	Confident	75.5	Confident	158 Å²	158	68 Å²	68	74%	0.738	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	122.2	167.3	-67.8	-176.6	2.6	0	0	109.1	T625	Q592-T625 HydrophobicContact CG-CG2 4.33Å
593	I	80.2	Confident	74.5	Confident	28 Å²	28	68.5 Å²	68.5	14%	0.144	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	146.4	176.6	66	178.1	0	0	0	109.9	V587 L591 L595 A623 V624 V626 L658	V587-I593 HydrophobicContact CG1-CD1 4.16Å; V587-I593 HydrophobicContact CG1-CG2 4.25Å; L591-I593 HydrophobicContact CD2-CG2 3.64Å; L591-I593 HydrophobicContact CG-CG2 3.78Å; I593-L595 HydrophobicContact CD1-CD2 3.97Å; I593-L595 HydrophobicContact CD1-CG 4.35Å; I593-L595 HydrophobicContact CG1-CD2 4.49Å; I593-A623 WeakPolarHBondContact O-CA 3.48Å; I593-V624 HydrophobicContact CD1-CB 4.31Å; I593-V624 HydrophobicContact CG1-CB 3.83Å; I593-V624 PolarHBondContact N-O 2.81Å; I593-V624 PolarHBondContact O-N 2.87Å; I593-V626 HydrophobicContact CD1-CG2 3.96Å; I593-V626 HydrophobicContact CG1-CG2 4.19Å; I593-V626 HydrophobicContact CG2-CG2 4.32Å; I593-L658 HydrophobicContact CD1-CD1 3.62Å; I593-L658 HydrophobicContact CD1-CD2 3.57Å; I593-L658 HydrophobicContact CD1-CG 4.26Å
594	L	78.7	Confident	73.6	Confident	99 Å²	99	66.9 Å²	66.9	52%	0.518	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.4	168.8	-171.3	68.8	0	0	0	107.8	P596 D621 A623	L594-P596 WeakPolarHBondContact O-CD 3.39Å; L594-D621 HydrophobicContact CD1-CB 3.8Å; L594-D621 HydrophobicContact CD2-CB 4.46Å; L594-D621 HydrophobicContact CG-CB 4.07Å; L594-A623 HydrophobicContact CD1-CB 4.1Å
595	L	83	Confident	73.1	Confident	2 Å²	2	59.2 Å²	59.2	1%	0.01	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	109	176.2	-61.4	-178.9	0	0	0	108.8	L585 I593 W607 D621 L622 V624 Y634 F656 L658	L585-L595 HydrophobicContact CD1-CD2 3.5Å; L585-L595 VanDerWaalsContact CD1-CD2 3.5Å; I593-L595 HydrophobicContact CD1-CD2 3.97Å; I593-L595 HydrophobicContact CD1-CG 4.35Å; I593-L595 HydrophobicContact CG1-CD2 4.49Å; L595-W607 HydrophobicContact CB-CH2 3.72Å; L595-W607 HydrophobicContact CB-CZ2 4.36Å; L595-W607 HydrophobicContact CB-CZ3 4.26Å; L595-W607 WeakPolarHBondContact O-CH2 3.46Å; L595-W607 VanDerWaalsContact O-CZ2 3.23Å; L595-W607 WeakPolarHBondContact O-CZ2 3.47Å; L595-D621 WeakPolarHBondContact O-CA 3.33Å; L595-L622 HydrophobicContact CB-CB 4.36Å; L595-L622 PolarHBondContact N-O 3.41Å; L595-L622 PolarHBondContact O-N 3.43Å; L595-V624 HydrophobicContact CD1-CG2 4.13Å; L595-Y634 HydrophobicContact CD1-CD1 3.48Å; L595-Y634 VanDerWaalsContact CD1-CD1 3.48Å; L595-Y634 HydrophobicContact CD1-CD2 4.18Å; L595-Y634 HydrophobicContact CD1-CE1 4.09Å; L595-Y634 HydrophobicContact CD1-CG 3.51Å; L595-F656 HydrophobicContact CB-CD2 4.11Å; L595-F656 HydrophobicContact CB-CE2 4.07Å; L595-F656 HydrophobicContact CD1-CD2 4.43Å; L595-F656 HydrophobicContact CD2-CB 4.31Å; L595-F656 HydrophobicContact CD2-CD1 4.18Å; L595-F656 HydrophobicContact CD2-CD2 4.22Å; L595-F656 HydrophobicContact CD2-CG 3.99Å; L595-F656 HydrophobicContact CG-CD2 4.5Å; L595-L658 HydrophobicContact CD2-CD2 4.35Å
596	P	71.4	Confident	72.7	Confident	67 Å²	67	59.5 Å²	59.5	44%	0.435	35%	0.345	S	S	.	.			trans	-77.8	140.5	-174.7	29.1	-34.6	0	0	0	112.6	L594 D621 A654 F656	L594-P596 WeakPolarHBondContact O-CD 3.39Å; P596-D621 VanDerWaalsContact CA-OD1 3.27Å; P596-D621 WeakPolarHBondContact CA-OD1 3.39Å; P596-A654 WeakPolarHBondContact O-CB 3.28Å; P596-F656 HydrophobicContact CG-CZ 4.04Å; P596-F656 WeakPolarHBondContact O-CE2 3.21Å; P596-F656 WeakPolarHBondContact O-CZ 3.39Å
597	C	76	Confident	72.6	Confident	3 Å²	3	53.3 Å²	53.3	2%	0.02	32%	0.318	C	S	.	.			trans	-136.9	129.8	168.2	175.4	0	0	0	0	110.5	Q599 W607 S620 D621 C636 R653 A654	C597-Q599 PolarHBondContact O-N 3Å; C597-W607 HydrophobicContact CB-CH2 4.09Å; C597-W607 HydrophobicContact CB-CZ2 3.46Å; C597-W607 VanDerWaalsContact CB-CZ2 3.46Å; C597-S620 WeakPolarHBondContact CB-O 3.06Å; C597-S620 WeakPolarHBondContact O-CB 3.45Å; C597-S620 PolarHBondContact O-OG 2.68Å; C597-D621 PolarHBondContact N-OD1 2.77Å; C597-C636 HydrophobicContact CB-CB 3.47Å; C597-C636 VanDerWaalsContact CB-CB 3.47Å; C597-C636 WeakPolarHBondContact CB-SG 3.3Å; C597-C636 WeakPolarHBondContact SG-CB 3.28Å; C597-C636 CovalentContact SG-SG 2.02Å; C597-C636 PolarHBondContact SG-SG 2.84Å; C597-R653 VanDerWaalsContact SG-CB 3.54Å; C597-A654 HydrophobicContact CB-CB 4.12Å
598	V	61	Low	72.6	Confident	95 Å²	95	59 Å²	59	58%	0.576	34%	0.344	S	S	*	.			trans	-88.6	106.6	-174.1	-169.6	0	0	0	0	110.6	L600	V598-L600 HydrophobicContact CG1-CD2 3.5Å; V598-L600 HydrophobicContact CG1-CG 4.19Å; V598-L600 PolarHBondContact O-N 3.26Å
599	Q	63.3	Low	72.7	Confident	19 Å²	19	60.5 Å²	60.5	9%	0.089	34%	0.342	C	S	.	.			trans	-80.5	92.9	173.4	-179.9	176	-10.3	0	0	111.2	R442 C597 S601 R603	R442-Q599 VanDerWaalsContact NH1-NE2 3.16Å; C597-Q599 PolarHBondContact O-N 3Å; Q599-S601 VanDerWaalsContact C-N 3.33Å; Q599-S601 WeakPolarHBondContact CG-O 3.31Å; Q599-S601 PolarHBondContact NE2-O 2.97Å; Q599-R603 PolarHBondContact NE2-O 2.86Å
600	L	54.7	Low	72.5	Confident	24 Å²	24	58 Å²	58	13%	0.126	33%	0.326	C	S	.	.			trans	-78.1	-13.4	176.3	-55.6	-176.1	0	0	0	114.3	V598	V598-L600 HydrophobicContact CG1-CD2 3.5Å; V598-L600 HydrophobicContact CG1-CG 4.19Å; V598-L600 PolarHBondContact O-N 3.26Å
601	S	55.3	Low	71.9	Confident	13 Å²	13	61.4 Å²	61.4	9%	0.091	34%	0.338	C	S	.	.	S	Bend	trans	-112.3	149.4	-174.8	53.1	0	0	0	0	112.3	Q599 R603 Q639	Q599-S601 VanDerWaalsContact C-N 3.33Å; Q599-S601 WeakPolarHBondContact CG-O 3.31Å; Q599-S601 PolarHBondContact NE2-O 2.97Å; S601-R603 PolarHBondContact O-N 3.14Å; S601-R603 VanDerWaalsContact O-O 3.09Å; S601-R603 PolarHBondContact OG-O 3.45Å; S601-Q639 PolarHBondContact OG-O 3.46Å
602	P	53.9	Low	71.3	Confident	91 Å²	91	59.5 Å²	59.5	59%	0.591	33%	0.327	S	S	*	.	S	Bend	trans	-64.4	-22.8	171.1	26.8	-34	0	0	0	112.9
603	R	62.9	Low	70.2	Confident	62 Å²	62	63.3 Å²	63.3	23%	0.234	33%	0.334	C	S	.	.	S	Bend	trans	-67.1	140.2	170.7	-60.5	-176.3	-173.7	-122.9	7.3	110.8	Q599 S601 Q639 G641 G642 V645	Q599-R603 PolarHBondContact NE2-O 2.86Å; S601-R603 PolarHBondContact O-N 3.14Å; S601-R603 VanDerWaalsContact O-O 3.09Å; S601-R603 PolarHBondContact OG-O 3.45Å; R603-Q639 HydrophobicContact CB-CB 4.12Å; R603-G641 PolarHBondContact NE-O 3.39Å; R603-G641 VanDerWaalsContact NE-O 3.08Å; R603-G641 PolarHBondContact NH2-O 2.82Å; R603-G642 PolarHBondContact NH2-O 3.34Å; R603-V645 PolarHBondContact NH2-O 2.98Å
604	P	63.5	Low	69.2	Low	93 Å²	93	67.2 Å²	67.2	60%	0.604	35%	0.352	S	S	*	.			trans	-69.4	160.4	-174.6	29.9	-36.5	0	0	0	113.3
605	C	75.4	Confident	68.5	Low	8 Å²	8	63.4 Å²	63.4	5%	0.054	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	143.1	172.8	-54.1	0	0	0	0	111.3	Q617 T637 C638	C605-Q617 PolarHBondContact O-NE2 3Å; C605-T637 CarbonylContact C-O 3.43Å; C605-T637 WeakPolarHBondContact CA-O 3.22Å; C605-C638 HydrophobicContact CB-CB 4.05Å; C605-C638 WeakPolarHBondContact CB-SG 3.17Å; C605-C638 WeakPolarHBondContact SG-CB 3.16Å; C605-C638 CovalentContact SG-SG 2.03Å; C605-C638 PolarHBondContact SG-SG 3.04Å
606	S	77	Confident	67.3	Low	64 Å²	64	72.3 Å²	72.3	45%	0.448	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	150.1	175.3	41.8	0	0	0	0	111.1	C636 T637	S606-C636 WeakPolarHBondContact O-CA 3.36Å; S606-T637 PolarHBondContact N-O 2.84Å; S606-T637 PolarHBondContact O-N 3.39Å; S606-T637 PolarHBondContact O-OG1 3.27Å; S606-T637 PolarHBondContact OG-O 2.87Å; S606-T637 PolarHBondContact OG-OG1 2.67Å
607	W	83.5	Confident	67	Low	20 Å²	20	73.4 Å²	73.4	8%	0.076	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.6	170.1	-74	88.3	0	0	0	111.7	L595 C597 Y609 S620 L622 V635 C636 A654 F656	L595-W607 HydrophobicContact CB-CH2 3.72Å; L595-W607 HydrophobicContact CB-CZ2 4.36Å; L595-W607 HydrophobicContact CB-CZ3 4.26Å; L595-W607 WeakPolarHBondContact O-CH2 3.46Å; L595-W607 VanDerWaalsContact O-CZ2 3.23Å; L595-W607 WeakPolarHBondContact O-CZ2 3.47Å; C597-W607 HydrophobicContact CB-CH2 4.09Å; C597-W607 HydrophobicContact CB-CZ2 3.46Å; C597-W607 VanDerWaalsContact CB-CZ2 3.46Å; W607-Y609 HydrophobicContact CB-CD1 3.6Å; W607-Y609 HydrophobicContact CB-CE1 3.89Å; W607-S620 PolarHBondContact NE1-O 3.47Å; W607-L622 HydrophobicContact CB-CD2 4.47Å; W607-L622 HydrophobicContact CD2-CB 3.89Å; W607-L622 HydrophobicContact CD2-CD2 4.23Å; W607-L622 HydrophobicContact CE3-CB 4.39Å; W607-L622 HydrophobicContact CE3-CD2 4.31Å; W607-L622 HydrophobicContact CG-CB 4.23Å; W607-L622 HydrophobicContact CG-CD1 4.36Å; W607-L622 HydrophobicContact CG-CD2 4.33Å; W607-L622 HydrophobicContact CH2-CB 4.42Å; W607-L622 HydrophobicContact CZ2-CB 3.94Å; W607-V635 CarbonylContact C-O 3.6Å; W607-V635 WeakPolarHBondContact CA-O 3.22Å; W607-C636 HydrophobicContact CD2-CB 3.87Å; W607-C636 HydrophobicContact CE3-CB 3.89Å; W607-C636 HydrophobicContact CH2-CB 3.91Å; W607-C636 HydrophobicContact CZ2-CB 3.85Å; W607-C636 HydrophobicContact CZ3-CB 3.91Å; W607-A654 HydrophobicContact CH2-CB 4.38Å; W607-F656 HydrophobicContact CH2-CD2 4.09Å; W607-F656 AromaticContact CH2-CE2 3.88Å; W607-F656 HydrophobicContact CH2-CE2 3.88Å; W607-F656 HydrophobicContact CZ3-CD2 4.09Å; W607-F656 HydrophobicContact CZ3-CE2 4.33Å
608	E	83.8	Confident	66	Low	126 Å²	126	76.4 Å²	76.4	59%	0.589	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.8	163	-66	173.9	-172.5	0	0	108.2	Y634 V635	E608-Y634 WeakPolarHBondContact O-CA 3.2Å; E608-V635 HydrophobicContact CB-CB 4.4Å; E608-V635 PolarHBondContact N-O 3.09Å; E608-V635 PolarHBondContact O-N 3.01Å
609	Y	85.7	Confident	66.1	Low	84 Å²	84	73.6 Å²	73.6	33%	0.329	36%	0.359	S	S	.	.			trans	-159	163	-176.5	59.5	-86.7	0	0	0	111.6	W607 T615 L622 Y634	W607-Y609 HydrophobicContact CB-CD1 3.6Å; W607-Y609 HydrophobicContact CB-CE1 3.89Å; Y609-T615 HydrophobicContact CD2-CG2 3.91Å; Y609-T615 HydrophobicContact CE2-CG2 3.78Å; Y609-T615 WeakPolarHBondContact CE2-OG1 3.43Å; Y609-T615 PolarHBondContact OH-OG1 3.23Å; Y609-L622 HydrophobicContact CD1-CD2 3.98Å; Y609-L622 HydrophobicContact CE1-CD1 4.24Å; Y609-L622 HydrophobicContact CE1-CD2 4.38Å; Y609-L622 HydrophobicContact CG-CD2 4.04Å; Y609-Y634 VanDerWaalsContact CB-CE1 3.47Å; Y609-Y634 HydrophobicContact CD2-CE1 4.44Å; Y609-Y634 HydrophobicContact CG-CD1 4.32Å; Y609-Y634 HydrophobicContact CG-CE1 4.2Å
610	P	79.6	Confident	66	Low	28 Å²	28	72.9 Å²	72.9	18%	0.182	36%	0.356	C	S	.	.			trans	-62	128.5	177.1	-21.1	33.4	0	0	0	111.6	H612 L631 Y634	P610-H612 PolarHBondContact O-N 3.43Å; P610-H612 VanDerWaalsContact O-N 3.1Å; P610-L631 WeakPolarHBondContact CG-O 3.25Å; P610-Y634 HydrophobicContact CG-CE2 4.49Å
611	P	62.2	Low	66.9	Low	130 Å²	130	73.6 Å²	73.6	84%	0.844	36%	0.36	S	S	*	.			trans	-69.5	109.3	-170.6	26.8	-34.9	0	0	0	112.2
612	H	67.6	Low	68.2	Low	36 Å²	36	73 Å²	73	17%	0.167	36%	0.356	C	S	.	.			trans	-145	151.9	-177.2	-164.8	62.7	0	0	0	113.1	P610 H614 T615 T627 E629 N630	P610-H612 PolarHBondContact O-N 3.43Å; P610-H612 VanDerWaalsContact O-N 3.1Å; H612-H614 VanDerWaalsContact C-N 3.28Å; H612-H614 AromaticContact NE2-CD2 3.59Å; H612-H614 PolarHBondContact O-N 2.9Å; H612-T615 PolarHBondContact O-OG1 3.03Å; H612-T627 PolarHBondContact CD2-OG1 3.2Å; H612-T627 PolarHBondContact NE2-OG1 2.73Å; H612-E629 IonicContact CE1-OE2 2.88Å; H612-E629 PolarHBondContact CE1-OE2 3.1Å; H612-E629 IonicContact ND1-OE2 2.77Å; H612-E629 PolarHBondContact ND1-OE2 3.24Å; H612-E629 VanDerWaalsContact ND1-OE2 3.12Å; H612-N630 HydrophobicContact CB-CB 4.11Å
613	R	55.7	Low	69.4	Low	237 Å²	237	69.9 Å²	69.9	89%	0.894	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-8.2	-171.7	-71.2	-174.4	177.7	-170.2	-0.5	115.5
614	H	59.3	Low	70.3	Confident	111 Å²	111	67 Å²	67	51%	0.514	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	23.9	-173	-61.3	-65.4	0	0	0	114	H612 T625	H612-H614 VanDerWaalsContact C-N 3.28Å; H612-H614 AromaticContact NE2-CD2 3.59Å; H612-H614 PolarHBondContact O-N 2.9Å; H614-T625 PolarHBondContact O-N 3.44Å
615	T	63.9	Low	71.3	Confident	18 Å²	18	64.7 Å²	64.7	11%	0.11	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.1	169.5	55.5	0	0	0	0	110.2	Y609 H612 A623 V624	Y609-T615 HydrophobicContact CD2-CG2 3.91Å; Y609-T615 HydrophobicContact CE2-CG2 3.78Å; Y609-T615 WeakPolarHBondContact CE2-OG1 3.43Å; Y609-T615 PolarHBondContact OH-OG1 3.23Å; H612-T615 PolarHBondContact O-OG1 3.03Å; T615-A623 WeakPolarHBondContact CA-O 3.3Å; T615-V624 HydrophobicContact CG2-CG1 4.38Å; T615-V624 HydrophobicContact CG2-CG2 4.3Å
616	R	58.5	Low	71.6	Confident	189 Å²	189	64.4 Å²	64.4	71%	0.713	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	128	170.5	-82.2	-171.1	169.6	-153.1	-2.9	110	A623	R616-A623 PolarHBondContact N-O 3.37Å; R616-A623 WeakPolarHBondContact O-CB 3.35Å; R616-A623 PolarHBondContact O-N 2.89Å
617	Q	63.5	Low	71.8	Confident	90 Å²	90	63 Å²	63	42%	0.421	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	124.8	170.8	-174.3	171	-17.5	0	0	109.4	C605 H619 D621 L622	C605-Q617 PolarHBondContact O-NE2 3Å; Q617-H619 WeakPolarHBondContact CG-O 3.47Å; Q617-H619 PolarHBondContact NE2-O 3.18Å; Q617-D621 CarbonylContact C-O 3.48Å; Q617-D621 WeakPolarHBondContact CA-O 3.39Å; Q617-L622 HydrophobicContact CB-CD1 4.07Å
618	H	55.9	Low	71.5	Confident	67 Å²	67	69.2 Å²	69.2	31%	0.31	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	103.2	175.2	-79.9	-106.2	0	0	0	107.6	R472 S620 D621	R472-H618 PolarHBondContact NH1-ND1 2.84Å; H618-S620 PolarHBondContact O-N 2.75Å; H618-D621 CarbonylContact C-O 3.57Å; H618-D621 PolarHBondContact N-O 2.97Å; H618-D621 WeakPolarHBondContact O-CA 3.4Å; H618-D621 WeakPolarHBondContact O-CB 3.44Å; H618-D621 PolarHBondContact O-N 3.42Å; H618-D621 VanDerWaalsContact O-O 3.14Å
619	H	63.6	Low	71.1	Confident	35 Å²	35	70.2 Å²	70.2	16%	0.162	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.7	-121.1	-171.2	-51.2	141.5	0	0	0	111.4	G444 E474 Q617	G444-H619 PolarHBondContact O-CD2 2.92Å; G444-H619 VanDerWaalsContact O-CD2 3.24Å; G444-H619 PolarHBondContact O-NE2 2.75Å; E474-H619 IonicContact OE2-CE1 3.31Å; E474-H619 PolarHBondContact OE2-CE1 3.39Å; Q617-H619 WeakPolarHBondContact CG-O 3.47Å; Q617-H619 PolarHBondContact NE2-O 3.18Å
620	S	60.9	Low	70.8	Confident	4 Å²	4	66.2 Å²	66.2	3%	0.028	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-12.6	169.1	47.1	0	0	0	0	113.3	C597 W607 H618	C597-S620 WeakPolarHBondContact CB-O 3.06Å; C597-S620 WeakPolarHBondContact O-CB 3.45Å; C597-S620 PolarHBondContact O-OG 2.68Å; W607-S620 PolarHBondContact NE1-O 3.47Å; H618-S620 PolarHBondContact O-N 2.75Å
621	D	73.7	Confident	71	Confident	39 Å²	39	67.3 Å²	67.3	21%	0.209	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	158.1	-178.2	-67.6	0.4	0	0	0	111.7	L594 L595 P596 C597 Q617 H618	L594-D621 HydrophobicContact CD1-CB 3.8Å; L594-D621 HydrophobicContact CD2-CB 4.46Å; L594-D621 HydrophobicContact CG-CB 4.07Å; L595-D621 WeakPolarHBondContact O-CA 3.33Å; P596-D621 VanDerWaalsContact CA-OD1 3.27Å; P596-D621 WeakPolarHBondContact CA-OD1 3.39Å; C597-D621 PolarHBondContact N-OD1 2.77Å; Q617-D621 CarbonylContact C-O 3.48Å; Q617-D621 WeakPolarHBondContact CA-O 3.39Å; H618-D621 CarbonylContact C-O 3.57Å; H618-D621 PolarHBondContact N-O 2.97Å; H618-D621 WeakPolarHBondContact O-CA 3.4Å; H618-D621 WeakPolarHBondContact O-CB 3.44Å; H618-D621 PolarHBondContact O-N 3.42Å; H618-D621 VanDerWaalsContact O-O 3.14Å
622	L	81.4	Confident	72.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113.7	178	-167.3	74.9	0	0	0	111.1	L595 W607 Y609 Q617 V624 Y634	L595-L622 HydrophobicContact CB-CB 4.36Å; L595-L622 PolarHBondContact N-O 3.41Å; L595-L622 PolarHBondContact O-N 3.43Å; W607-L622 HydrophobicContact CB-CD2 4.47Å; W607-L622 HydrophobicContact CD2-CB 3.89Å; W607-L622 HydrophobicContact CD2-CD2 4.23Å; W607-L622 HydrophobicContact CE3-CB 4.39Å; W607-L622 HydrophobicContact CE3-CD2 4.31Å; W607-L622 HydrophobicContact CG-CB 4.23Å; W607-L622 HydrophobicContact CG-CD1 4.36Å; W607-L622 HydrophobicContact CG-CD2 4.33Å; W607-L622 HydrophobicContact CH2-CB 4.42Å; W607-L622 HydrophobicContact CZ2-CB 3.94Å; Y609-L622 HydrophobicContact CD1-CD2 3.98Å; Y609-L622 HydrophobicContact CE1-CD1 4.24Å; Y609-L622 HydrophobicContact CE1-CD2 4.38Å; Y609-L622 HydrophobicContact CG-CD2 4.04Å; Q617-L622 HydrophobicContact CB-CD1 4.07Å; L622-V624 HydrophobicContact CD2-CG2 3.82Å; L622-V624 HydrophobicContact CG-CG2 3.93Å; L622-Y634 HydrophobicContact CD2-CD1 3.47Å; L622-Y634 VanDerWaalsContact CD2-CD1 3.47Å; L622-Y634 HydrophobicContact CD2-CE1 3.63Å
623	A	79.6	Confident	73.1	Confident	26 Å²	26	62.3 Å²	62.3	22%	0.215	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	124.5	169.9	0	0	0	0	0	109.7	I593 L594 T615 R616	I593-A623 WeakPolarHBondContact O-CA 3.48Å; L594-A623 HydrophobicContact CD1-CB 4.1Å; T615-A623 WeakPolarHBondContact CA-O 3.3Å; R616-A623 PolarHBondContact N-O 3.37Å; R616-A623 WeakPolarHBondContact O-CB 3.35Å; R616-A623 PolarHBondContact O-N 2.89Å
624	V	82.5	Confident	74.7	Confident	2 Å²	2	51 Å²	51	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.7	-176.9	-177.1	0	0	0	0	108.6	I593 L595 T615 L622 N630 Y634 L658	I593-V624 HydrophobicContact CD1-CB 4.31Å; I593-V624 HydrophobicContact CG1-CB 3.83Å; I593-V624 PolarHBondContact N-O 2.81Å; I593-V624 PolarHBondContact O-N 2.87Å; L595-V624 HydrophobicContact CD1-CG2 4.13Å; T615-V624 HydrophobicContact CG2-CG1 4.38Å; T615-V624 HydrophobicContact CG2-CG2 4.3Å; L622-V624 HydrophobicContact CD2-CG2 3.82Å; L622-V624 HydrophobicContact CG-CG2 3.93Å; V624-N630 WeakPolarHBondContact CG1-ND2 3.2Å; V624-Y634 HydrophobicContact CG1-CE1 4.45Å; V624-Y634 HydrophobicContact CG2-CD1 4.39Å; V624-Y634 HydrophobicContact CG2-CE1 3.67Å; V624-L658 HydrophobicContact CG1-CD1 4.32Å
625	T	83.1	Confident	76	Confident	45 Å²	45	46.5 Å²	46.5	28%	0.276	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	113.1	164	-54.3	0	0	0	0	108	Q592 H614 T627 N630	Q592-T625 HydrophobicContact CG-CG2 4.33Å; H614-T625 PolarHBondContact O-N 3.44Å; T625-T627 PolarHBondContact O-N 3.36Å; T625-N630 PolarHBondContact O-ND2 2.82Å
626	V	82.3	Confident	77	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	23%	0.228	C	C	.	.			trans	-66.4	128.7	-170.1	175.9	0	0	0	0	111.6	V587 S588 G590 L591 I593	V587-V626 HydrophobicContact CB-CG1 4.03Å; V587-V626 HydrophobicContact CB-CG2 3.96Å; V587-V626 HydrophobicContact CG1-CG2 4.23Å; V587-V626 HydrophobicContact CG2-CG1 3.67Å; V587-V626 HydrophobicContact CG2-CG2 4.13Å; S588-V626 WeakPolarHBondContact O-CB 3.48Å; S588-V626 WeakPolarHBondContact O-CG1 3.42Å; G590-V626 PolarHBondContact N-O 2.95Å; L591-V626 HydrophobicContact CB-CG2 4.41Å; L591-V626 WeakPolarHBondContact O-CG2 3.38Å; L591-V626 PolarHBondContact O-N 3.35Å; I593-V626 HydrophobicContact CD1-CG2 3.96Å; I593-V626 HydrophobicContact CG1-CG2 4.19Å; I593-V626 HydrophobicContact CG2-CG2 4.32Å
627	T	80.7	Confident	78.2	Confident	35 Å²	35	37.9 Å²	37.9	22%	0.215	20%	0.201	C	C	.	.			trans	-136.3	161.9	175.5	62.8	0	0	0	0	109.1	H612 T625 E629 N630	H612-T627 PolarHBondContact CD2-OG1 3.2Å; H612-T627 PolarHBondContact NE2-OG1 2.73Å; T625-T627 PolarHBondContact O-N 3.36Å; T627-E629 PolarHBondContact O-N 2.85Å; T627-N630 PolarHBondContact N-OD1 2.84Å; T627-N630 PolarHBondContact O-N 2.86Å; T627-N630 PolarHBondContact O-OD1 2.95Å; T627-N630 PolarHBondContact OG1-ND2 2.9Å
628	E	78.7	Confident	78.8	Confident	150 Å²	150	33.6 Å²	33.6	70%	0.701	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-62.6	-24.2	177.2	-59.8	-172.3	161.7	0	0	112.4	L660	E628-L660 HydrophobicContact CG-CD1 4.43Å
629	E	74.6	Confident	79.5	Confident	148 Å²	148	34.5 Å²	34.5	69%	0.692	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-80	-14.4	178.6	-62.7	-177.8	-174.8	0	0	114.3	H612 T627	H612-E629 IonicContact CE1-OE2 2.88Å; H612-E629 PolarHBondContact CE1-OE2 3.1Å; H612-E629 IonicContact ND1-OE2 2.77Å; H612-E629 PolarHBondContact ND1-OE2 3.24Å; H612-E629 VanDerWaalsContact ND1-OE2 3.12Å; T627-E629 PolarHBondContact O-N 2.85Å
630	N	80.1	Confident	79.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-114	18.2	-175.4	76.4	12.8	0	0	0	115	H612 V624 T625 T627 Y634	H612-N630 HydrophobicContact CB-CB 4.11Å; V624-N630 WeakPolarHBondContact CG1-ND2 3.2Å; T625-N630 PolarHBondContact O-ND2 2.82Å; T627-N630 PolarHBondContact N-OD1 2.84Å; T627-N630 PolarHBondContact O-N 2.86Å; T627-N630 PolarHBondContact O-OD1 2.95Å; T627-N630 PolarHBondContact OG1-ND2 2.9Å; N630-Y634 VanDerWaalsContact O-CE2 3.31Å; N630-Y634 WeakPolarHBondContact O-CE2 3.43Å; N630-Y634 PolarHBondContact O-OH 2.66Å
631	L	83.9	Confident	79.1	Confident	50 Å²	50	35.3 Å²	35.3	26%	0.262	20%	0.198	S	C	.	.			trans	-72.8	152	169.8	-56	168.6	0	0	0	110.9	V587 P610 L658 L660	V587-L631 HydrophobicContact CG2-CD2 4.23Å; P610-L631 WeakPolarHBondContact CG-O 3.25Å; L631-L658 HydrophobicContact CD2-CB 4.48Å; L631-L660 HydrophobicContact CD1-CD1 3.66Å; L631-L660 HydrophobicContact CD1-CD2 4.43Å; L631-L660 HydrophobicContact CD1-CG 3.57Å; L631-L660 HydrophobicContact CD2-CD2 4.31Å; L631-L660 HydrophobicContact CD2-CG 3.98Å; L631-L660 HydrophobicContact CG-CG 4.4Å
632	G	85.2	Confident	77.9	Confident	12 Å²	12	34.8 Å²	34.8	12%	0.124	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	125.6	-157.6	-179.5	0	0	0	0	0	113.6	Y657 L658	G632-Y657 CarbonylContact O-C 3.54Å; G632-Y657 WeakPolarHBondContact O-CA 3.34Å; G632-L658 PolarHBondContact N-O 3.16Å; G632-L658 PolarHBondContact O-N 3.01Å
633	S	88	Confident	76	Confident	50 Å²	50	40 Å²	40	35%	0.35	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	138.9	-173.9	-162.9	0	0	0	0	112.9	F656	S633-F656 WeakPolarHBondContact CA-O 3.48Å; S633-F656 PolarHBondContact OG-O 3.27Å
634	Y	88.3	Confident	74.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	118.5	175.7	-73.5	-103	0	0	0	108.2	L595 E608 Y609 P610 L622 V624 N630 A655 F656 L658	L595-Y634 HydrophobicContact CD1-CD1 3.48Å; L595-Y634 VanDerWaalsContact CD1-CD1 3.48Å; L595-Y634 HydrophobicContact CD1-CD2 4.18Å; L595-Y634 HydrophobicContact CD1-CE1 4.09Å; L595-Y634 HydrophobicContact CD1-CG 3.51Å; E608-Y634 WeakPolarHBondContact O-CA 3.2Å; Y609-Y634 VanDerWaalsContact CB-CE1 3.47Å; Y609-Y634 HydrophobicContact CD2-CE1 4.44Å; Y609-Y634 HydrophobicContact CG-CD1 4.32Å; Y609-Y634 HydrophobicContact CG-CE1 4.2Å; P610-Y634 HydrophobicContact CG-CE2 4.49Å; L622-Y634 HydrophobicContact CD2-CD1 3.47Å; L622-Y634 VanDerWaalsContact CD2-CD1 3.47Å; L622-Y634 HydrophobicContact CD2-CE1 3.63Å; V624-Y634 HydrophobicContact CG1-CE1 4.45Å; V624-Y634 HydrophobicContact CG2-CD1 4.39Å; V624-Y634 HydrophobicContact CG2-CE1 3.67Å; N630-Y634 VanDerWaalsContact O-CE2 3.31Å; N630-Y634 WeakPolarHBondContact O-CE2 3.43Å; N630-Y634 PolarHBondContact O-OH 2.66Å; Y634-A655 WeakPolarHBondContact O-CA 3.2Å; Y634-F656 PolarHBondContact N-O 2.72Å; Y634-F656 PolarHBondContact O-N 3.07Å; Y634-L658 HydrophobicContact CD2-CD1 3.96Å; Y634-L658 HydrophobicContact CD2-CG 3.75Å; Y634-L658 HydrophobicContact CE2-CB 4.24Å; Y634-L658 HydrophobicContact CE2-CD1 3.3Å; Y634-L658 HydrophobicContact CE2-CG 3.54Å
635	V	87.6	Confident	72.6	Confident	16 Å²	16	49.6 Å²	49.6	10%	0.097	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.3	-175.7	-179.1	0	0	0	0	109.7	W607 E608 T637 R652 A654	W607-V635 CarbonylContact C-O 3.6Å; W607-V635 WeakPolarHBondContact CA-O 3.22Å; E608-V635 HydrophobicContact CB-CB 4.4Å; E608-V635 PolarHBondContact N-O 3.09Å; E608-V635 PolarHBondContact O-N 3.01Å; V635-T637 HydrophobicContact CG1-CG2 4.33Å; V635-R652 HydrophobicContact CG1-CG 3.6Å; V635-A654 WeakPolarHBondContact CA-O 3.12Å
636	C	85.1	Confident	70.7	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	128.6	172.9	-176.3	0	0	0	0	110.3	C597 S606 W607 R652 R653 A654	C597-C636 HydrophobicContact CB-CB 3.47Å; C597-C636 VanDerWaalsContact CB-CB 3.47Å; C597-C636 WeakPolarHBondContact CB-SG 3.3Å; C597-C636 WeakPolarHBondContact SG-CB 3.28Å; C597-C636 CovalentContact SG-SG 2.02Å; C597-C636 PolarHBondContact SG-SG 2.84Å; S606-C636 WeakPolarHBondContact O-CA 3.36Å; W607-C636 HydrophobicContact CD2-CB 3.87Å; W607-C636 HydrophobicContact CE3-CB 3.89Å; W607-C636 HydrophobicContact CH2-CB 3.91Å; W607-C636 HydrophobicContact CZ2-CB 3.85Å; W607-C636 HydrophobicContact CZ3-CB 3.91Å; C636-R652 WeakPolarHBondContact O-CA 3.26Å; C636-R653 PolarHBondContact O-N 2.8Å; C636-A654 HydrophobicContact CB-CB 3.97Å; C636-A654 PolarHBondContact N-O 3.33Å
637	T	83.3	Confident	69	Low	25 Å²	25	65.4 Å²	65.4	15%	0.153	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	126.8	177.1	45.8	0	0	0	0	110	C605 S606 V635 C651	C605-T637 CarbonylContact C-O 3.43Å; C605-T637 WeakPolarHBondContact CA-O 3.22Å; S606-T637 PolarHBondContact N-O 2.84Å; S606-T637 PolarHBondContact O-N 3.39Å; S606-T637 PolarHBondContact O-OG1 3.27Å; S606-T637 PolarHBondContact OG-O 2.87Å; S606-T637 PolarHBondContact OG-OG1 2.67Å; V635-T637 HydrophobicContact CG1-CG2 4.33Å; T637-C651 WeakPolarHBondContact CA-O 3.36Å
638	C	75.4	Confident	67.9	Low	1 Å²	1	65.4 Å²	65.4	1%	0.007	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144.9	176.7	-57.7	0	0	0	0	110	C605 E640 C651 R653	C605-C638 HydrophobicContact CB-CB 4.05Å; C605-C638 WeakPolarHBondContact CB-SG 3.17Å; C605-C638 WeakPolarHBondContact SG-CB 3.16Å; C605-C638 CovalentContact SG-SG 2.03Å; C605-C638 PolarHBondContact SG-SG 3.04Å; C638-E640 PolarHBondContact O-N 3.42Å; C638-C651 PolarHBondContact N-O 3.37Å; C638-C651 WeakPolarHBondContact O-CB 3.43Å; C638-C651 PolarHBondContact O-N 3.28Å; C638-R653 HydrophobicContact CB-CG 3.91Å; C638-R653 WeakPolarHBondContact SG-CG 3.3Å
639	Q	71	Confident	67.2	Low	85 Å²	85	62.8 Å²	62.8	40%	0.397	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	109.1	177.8	-74.3	-176.8	8.1	0	0	111.4	S601 R603 P648	S601-Q639 PolarHBondContact OG-O 3.46Å; R603-Q639 HydrophobicContact CB-CB 4.12Å; Q639-P648 HydrophobicContact CB-CB 3.93Å; Q639-P648 HydrophobicContact CB-CG 4.32Å; Q639-P648 HydrophobicContact CG-CB 4.23Å; Q639-P648 HydrophobicContact CG-CG 4.12Å
640	E	62.8	Low	66.9	Low	25 Å²	25	60.4 Å²	60.4	12%	0.117	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	128.2	171.7	-72.3	-157.7	127.2	0	0	111.7	R577 C638 T649 C651 R653	R577-E640 IonicContact CZ-OE1 3.02Å; R577-E640 IonicContact CZ-OE2 3.12Å; R577-E640 IonicContact NE-OE1 3.51Å; R577-E640 PolarHBondContact NE-OE1 3.44Å; R577-E640 VanDerWaalsContact NE-OE1 3.08Å; R577-E640 IonicContact NE-OE2 3.33Å; R577-E640 PolarHBondContact NE-OE2 3.17Å; R577-E640 VanDerWaalsContact NH2-CD 3.32Å; R577-E640 IonicContact NH2-OE1 3.55Å; R577-E640 PolarHBondContact NH2-OE1 3.41Å; R577-E640 IonicContact NH2-OE2 3.68Å; R577-E640 PolarHBondContact NH2-OE2 3.23Å; C638-E640 PolarHBondContact O-N 3.42Å; E640-T649 PolarHBondContact N-O 3.09Å; E640-T649 PolarHBondContact O-N 3.26Å; E640-C651 HydrophobicContact CB-CB 4.37Å; E640-C651 HydrophobicContact CG-CB 3.82Å; E640-C651 PolarHBondContact OE2-SG 3.38Å; E640-R653 IonicContact OE1-CZ 3.51Å; E640-R653 IonicContact OE1-NH1 3.08Å; E640-R653 IonicContact OE1-NH2 3.89Å; E640-R653 PolarHBondContact OE1-NH2 3.47Å
641	G	54.5	Low	66.6	Low	32 Å²	32	60.4 Å²	60.4	33%	0.33	34%	0.343	S	S	.	.			trans	165.4	136.8	174.3	0	0	0	0	0	112.3	R603	R603-G641 PolarHBondContact NE-O 3.39Å; R603-G641 VanDerWaalsContact NE-O 3.08Å; R603-G641 PolarHBondContact NH2-O 2.82Å
642	G	48.2	Very low	66.4	Low	28 Å²	28	61.1 Å²	61.1	29%	0.289	34%	0.343	S	S	.	.			trans	-60.2	172.6	178	0	0	0	0	0	113.9	R603 N644 V645	R603-G642 PolarHBondContact NH2-O 3.34Å; G642-N644 PolarHBondContact O-N 2.88Å; G642-N644 VanDerWaalsContact O-N 3.12Å; G642-V645 PolarHBondContact O-N 2.82Å
643	P	40.4	Very low	66	Low	109 Å²	109	62.5 Å²	62.5	71%	0.708	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-26.6	-171.9	21.3	-32.3	0	0	0	114.2
644	N	41.5	Very low	65.6	Low	157 Å²	157	60.5 Å²	60.5	84%	0.84	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.7	3.4	-175.6	-65.4	-26.6	0	0	0	114.9	G642	G642-N644 PolarHBondContact O-N 2.88Å; G642-N644 VanDerWaalsContact O-N 3.12Å
645	V	49.4	Very low	65.4	Low	72 Å²	72	60.7 Å²	60.7	44%	0.436	33%	0.332	S	S	.	.			trans	-89	119.9	-179.8	-173.5	0	0	0	0	110.1	R603 G642 D647	R603-V645 PolarHBondContact NH2-O 2.98Å; G642-V645 PolarHBondContact O-N 2.82Å; V645-D647 WeakPolarHBondContact CG1-O 3.44Å
646	R	43.4	Very low	65.5	Low	237 Å²	237	60.5 Å²	60.5	89%	0.894	33%	0.33	S	S	*	.	S	Bend	trans	-72.4	-38.6	-178.3	-71.8	-173	175.3	-164.2	-2.3	113.4	P648	R646-P648 WeakPolarHBondContact O-CD 3.5Å
647	D	47.6	Very low	65.6	Low	141 Å²	141	64.6 Å²	64.6	75%	0.754	35%	0.346	S	S	*	.	S	Bend	trans	-109.2	98.3	178.8	-61.4	-49.7	0	0	0	109.7	V645	V645-D647 WeakPolarHBondContact CG1-O 3.44Å
648	P	56.3	Low	65.9	Low	36 Å²	36	63.4 Å²	63.4	23%	0.234	34%	0.338	C	S	.	.			trans	-72.9	145	179.9	29.4	-33.5	0	0	0	111.6	Q639 R646 P650	Q639-P648 HydrophobicContact CB-CB 3.93Å; Q639-P648 HydrophobicContact CB-CG 4.32Å; Q639-P648 HydrophobicContact CG-CB 4.23Å; Q639-P648 HydrophobicContact CG-CG 4.12Å; R646-P648 WeakPolarHBondContact O-CD 3.5Å; P648-P650 WeakPolarHBondContact O-CD 3.43Å
649	T	63.9	Low	66.4	Low	94 Å²	94	66.3 Å²	66.3	58%	0.577	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	122.7	-179.4	-27.6	0	0	0	0	109.3	E640 C651	E640-T649 PolarHBondContact N-O 3.09Å; E640-T649 PolarHBondContact O-N 3.26Å; T649-C651 PolarHBondContact O-N 3.26Å
650	P	69.2	Low	67	Low	99 Å²	99	65 Å²	65	64%	0.643	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.3	115.9	175.4	28.2	-32.5	0	0	0	109.7	P648	P648-P650 WeakPolarHBondContact O-CD 3.43Å
651	C	74.3	Confident	67.8	Low	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	115.3	-177.8	-171.1	0	0	0	0	109.9	R577 C578 T637 C638 E640 T649 R653	R577-C651 PolarHBondContact O-SG 3.48Å; R577-C651 VanDerWaalsContact O-SG 3.34Å; C578-C651 WeakPolarHBondContact CA-SG 3.42Å; C578-C651 HydrophobicContact CB-CB 3.91Å; C578-C651 WeakPolarHBondContact CB-SG 3.47Å; C578-C651 WeakPolarHBondContact SG-CB 3.3Å; C578-C651 CovalentContact SG-SG 2.04Å; C578-C651 PolarHBondContact SG-SG 2.77Å; T637-C651 WeakPolarHBondContact CA-O 3.36Å; C638-C651 PolarHBondContact N-O 3.37Å; C638-C651 WeakPolarHBondContact O-CB 3.43Å; C638-C651 PolarHBondContact O-N 3.28Å; E640-C651 HydrophobicContact CB-CB 4.37Å; E640-C651 HydrophobicContact CG-CB 3.82Å; E640-C651 PolarHBondContact OE2-SG 3.38Å; T649-C651 PolarHBondContact O-N 3.26Å; C651-R653 PolarHBondContact O-N 2.96Å
652	R	79.3	Confident	68.1	Low	65 Å²	65	75.6 Å²	75.6	25%	0.245	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	125.3	175.3	-163.8	-179.6	179.7	-147.9	3	108.5	C578 D579 P580 V635 C636 A655	C578-R652 CarbonylContact C-O 3.2Å; C578-R652 WeakPolarHBondContact CA-O 3.22Å; C578-R652 VanDerWaalsContact O-CB 3.29Å; C578-R652 WeakPolarHBondContact O-CB 3.33Å; D579-R652 IonicContact OD1-NH1 3.62Å; D579-R652 PolarHBondContact OD1-NH1 2.94Å; P580-R652 VanDerWaalsContact CD-O 3.27Å; P580-R652 WeakPolarHBondContact CD-O 3.43Å; P580-R652 HydrophobicContact CG-CG 4.03Å; V635-R652 HydrophobicContact CG1-CG 3.6Å; C636-R652 WeakPolarHBondContact O-CA 3.26Å; R652-A655 VanDerWaalsContact NH2-CB 3.28Å
653	R	76.6	Confident	68.3	Low	41 Å²	41	80.1 Å²	80.1	16%	0.155	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-35.2	-174.9	-73.6	-54	-160.6	-163.9	-3.2	114.3	R577 C597 C636 C638 E640 C651	R577-R653 PolarHBondContact O-NH1 3.09Å; C597-R653 VanDerWaalsContact SG-CB 3.54Å; C636-R653 PolarHBondContact O-N 2.8Å; C638-R653 HydrophobicContact CB-CG 3.91Å; C638-R653 WeakPolarHBondContact SG-CG 3.3Å; E640-R653 IonicContact OE1-CZ 3.51Å; E640-R653 IonicContact OE1-NH1 3.08Å; E640-R653 IonicContact OE1-NH2 3.89Å; E640-R653 PolarHBondContact OE1-NH2 3.47Å; C651-R653 PolarHBondContact O-N 2.96Å
654	A	78.8	Confident	68.3	Low	8 Å²	8	81.4 Å²	81.4	7%	0.066	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	148.4	176.2	0	0	0	0	0	110.2	P596 C597 W607 V635 C636 F656	P596-A654 WeakPolarHBondContact O-CB 3.28Å; C597-A654 HydrophobicContact CB-CB 4.12Å; W607-A654 HydrophobicContact CH2-CB 4.38Å; V635-A654 WeakPolarHBondContact CA-O 3.12Å; C636-A654 HydrophobicContact CB-CB 3.97Å; C636-A654 PolarHBondContact N-O 3.33Å; A654-F656 HydrophobicContact CB-CD2 4.32Å; A654-F656 HydrophobicContact CB-CE2 3.59Å; A654-F656 HydrophobicContact CB-CZ 4.28Å
655	A	85.7	Confident	68.8	Low	3 Å²	3	78.2 Å²	78.2	3%	0.025	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	118.1	178.6	0	0	0	0	0	108.1	P580 T582 K583 Y634 R652	P580-A655 HydrophobicContact CG-CB 4.2Å; T582-A655 WeakPolarHBondContact CA-O 3.4Å; T582-A655 HydrophobicContact CG2-CB 4.39Å; K583-A655 PolarHBondContact N-O 3.11Å; Y634-A655 WeakPolarHBondContact O-CA 3.2Å; R652-A655 VanDerWaalsContact NH2-CB 3.28Å
656	F	88.3	Confident	68.5	Low	12 Å²	12	80.8 Å²	80.8	5%	0.053	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	156.5	176.6	-55.4	-89.1	0	0	0	110.3	K583 L585 L595 P596 W607 S633 Y634 A654	K583-F656 HydrophobicContact CB-CD1 3.81Å; K583-F656 HydrophobicContact CB-CE1 4.19Å; K583-F656 HydrophobicContact CD-CD1 4.33Å; K583-F656 HydrophobicContact CD-CE1 3.84Å; K583-F656 CarbonylContact O-C 3.58Å; K583-F656 VanDerWaalsContact O-CA 3.23Å; K583-F656 WeakPolarHBondContact O-CA 3.36Å; L585-F656 HydrophobicContact CD1-CB 4.36Å; L585-F656 HydrophobicContact CD1-CD1 3.73Å; L585-F656 HydrophobicContact CD1-CE1 4.44Å; L585-F656 HydrophobicContact CD1-CG 4.35Å; L585-F656 HydrophobicContact CG-CD1 4.34Å; L595-F656 HydrophobicContact CB-CD2 4.11Å; L595-F656 HydrophobicContact CB-CE2 4.07Å; L595-F656 HydrophobicContact CD1-CD2 4.43Å; L595-F656 HydrophobicContact CD2-CB 4.31Å; L595-F656 HydrophobicContact CD2-CD1 4.18Å; L595-F656 HydrophobicContact CD2-CD2 4.22Å; L595-F656 HydrophobicContact CD2-CG 3.99Å; L595-F656 HydrophobicContact CG-CD2 4.5Å; P596-F656 HydrophobicContact CG-CZ 4.04Å; P596-F656 WeakPolarHBondContact O-CE2 3.21Å; P596-F656 WeakPolarHBondContact O-CZ 3.39Å; W607-F656 HydrophobicContact CH2-CD2 4.09Å; W607-F656 AromaticContact CH2-CE2 3.88Å; W607-F656 HydrophobicContact CH2-CE2 3.88Å; W607-F656 HydrophobicContact CZ3-CD2 4.09Å; W607-F656 HydrophobicContact CZ3-CE2 4.33Å; S633-F656 WeakPolarHBondContact CA-O 3.48Å; S633-F656 PolarHBondContact OG-O 3.27Å; Y634-F656 PolarHBondContact N-O 2.72Å; Y634-F656 PolarHBondContact O-N 3.07Å; A654-F656 HydrophobicContact CB-CD2 4.32Å; A654-F656 HydrophobicContact CB-CE2 3.59Å; A654-F656 HydrophobicContact CB-CZ 4.28Å
657	Y	88.1	Confident	68.1	Low	86 Å²	86	72 Å²	72	34%	0.337	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	117.3	169.6	-163	-79.5	0	0	0	109	K583 W584 L585 G632 H659	K583-Y657 PolarHBondContact O-N 3.11Å; W584-Y657 HydrophobicContact CD2-CG 4.47Å; W584-Y657 AromaticContact CE3-CD1 3.53Å; W584-Y657 HydrophobicContact CE3-CD1 3.53Å; W584-Y657 HydrophobicContact CE3-CE1 4.3Å; W584-Y657 AromaticContact CE3-CG 3.79Å; W584-Y657 HydrophobicContact CE3-CG 3.79Å; W584-Y657 HydrophobicContact CH2-CD1 4.19Å; W584-Y657 HydrophobicContact CH2-CD2 4.27Å; W584-Y657 HydrophobicContact CH2-CE1 4.49Å; W584-Y657 HydrophobicContact CH2-CG 4.07Å; W584-Y657 AromaticContact CZ3-CD1 3.3Å; W584-Y657 HydrophobicContact CZ3-CD1 3.3Å; W584-Y657 HydrophobicContact CZ3-CD2 4.16Å; W584-Y657 AromaticContact CZ3-CE1 3.68Å; W584-Y657 HydrophobicContact CZ3-CE1 3.68Å; W584-Y657 HydrophobicContact CZ3-CE2 4.46Å; W584-Y657 AromaticContact CZ3-CG 3.57Å; W584-Y657 HydrophobicContact CZ3-CG 3.57Å; L585-Y657 PolarHBondContact N-O 2.76Å; G632-Y657 CarbonylContact O-C 3.54Å; G632-Y657 WeakPolarHBondContact O-CA 3.34Å; Y657-H659 HydrophobicContact CE1-CB 4.4Å
658	L	88.3	Confident	67.9	Low	0 Å²	0	70.5 Å²	70.5	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.8	175.7	-55.9	-170.6	0	0	0	109.6	L585 V587 I593 L595 V624 L631 G632 Y634	L585-L658 HydrophobicContact CB-CD2 3.82Å; L585-L658 HydrophobicContact CD1-CD2 3.83Å; L585-L658 HydrophobicContact CG-CD2 4.41Å; V587-L658 HydrophobicContact CG1-CD2 4.29Å; V587-L658 HydrophobicContact CG2-CB 4.21Å; I593-L658 HydrophobicContact CD1-CD1 3.62Å; I593-L658 HydrophobicContact CD1-CD2 3.57Å; I593-L658 HydrophobicContact CD1-CG 4.26Å; L595-L658 HydrophobicContact CD2-CD2 4.35Å; V624-L658 HydrophobicContact CG1-CD1 4.32Å; L631-L658 HydrophobicContact CD2-CB 4.48Å; G632-L658 PolarHBondContact N-O 3.16Å; G632-L658 PolarHBondContact O-N 3.01Å; Y634-L658 HydrophobicContact CD2-CD1 3.96Å; Y634-L658 HydrophobicContact CD2-CG 3.75Å; Y634-L658 HydrophobicContact CE2-CB 4.24Å; Y634-L658 HydrophobicContact CE2-CD1 3.3Å; Y634-L658 HydrophobicContact CE2-CG 3.54Å
659	H	87.4	Confident	67.3	Low	63 Å²	63	78.7 Å²	78.7	29%	0.292	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	151	167.8	68.2	-1.9	0	0	0	110	L585 V587 Y657	L585-H659 PolarHBondContact O-N 3.39Å; L585-H659 PolarHBondContact O-ND1 3.06Å; V587-H659 WeakPolarHBondContact CG2-O 3.2Å; V587-H659 PolarHBondContact N-O 3.23Å; V587-H659 VanDerWaalsContact N-O 3.14Å; Y657-H659 HydrophobicContact CE1-CB 4.4Å
660	L	83.6	Confident	66.2	Low	57 Å²	57	77.4 Å²	77.4	30%	0.298	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	144	172.8	-73.9	166	0	0	0	110.3	V587 P589 E628 L631 E662	V587-L660 WeakPolarHBondContact O-CA 3.44Å; P589-L660 HydrophobicContact CG-CD2 3.79Å; E628-L660 HydrophobicContact CG-CD1 4.43Å; L631-L660 HydrophobicContact CD1-CD1 3.66Å; L631-L660 HydrophobicContact CD1-CD2 4.43Å; L631-L660 HydrophobicContact CD1-CG 3.57Å; L631-L660 HydrophobicContact CD2-CD2 4.31Å; L631-L660 HydrophobicContact CD2-CG 3.98Å; L631-L660 HydrophobicContact CG-CG 4.4Å; L660-E662 PolarHBondContact O-N 3.15Å
661	E	78	Confident	64.8	Low	122 Å²	122	82.1 Å²	82.1	57%	0.57	47%	0.465	S	S	*	.			trans	-65.1	114.7	161.6	-170.7	162.8	-144.2	0	0	109	V587	V587-E661 PolarHBondContact O-N 3.25Å
662	E	61.3	Low	63.3	Low	158 Å²	158	86.4 Å²	86.4	74%	0.738	49%	0.488	S	S	*	.			trans	-59.1	134.5	179.6	-69.5	-178.5	167.2	0	0	110.4	L660 N664	L660-E662 PolarHBondContact O-N 3.15Å; E662-N664 PolarHBondContact O-N 3.37Å
663	P	53.3	Low	61.6	Low	123 Å²	123	85.2 Å²	85.2	80%	0.799	50%	0.495	S	S	*	.			trans	-65.9	106.8	171	27.6	-32.2	0	0	0	108.2	A665	P663-A665 VanDerWaalsContact C-N 3.26Å; P663-A665 PolarHBondContact O-N 2.7Å
664	N	40.6	Very low	60.2	Low	136 Å²	136	89.8 Å²	89.8	73%	0.727	52%	0.523	S	S	*	.			trans	-59.2	77.5	-176.5	-89.3	-41.3	0	0	0	113.5	E662 S666 G667	E662-N664 PolarHBondContact O-N 3.37Å; N664-S666 PolarHBondContact O-N 3.38Å; N664-G667 PolarHBondContact O-N 3.15Å
665	A	50.6	Low	58.7	Low	89 Å²	89	99 Å²	99	74%	0.736	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	118.6	161.7	0	0	0	0	0	108	P663	P663-A665 VanDerWaalsContact C-N 3.26Å; P663-A665 PolarHBondContact O-N 2.7Å
666	S	43.8	Very low	57	Low	126 Å²	126	103.9 Å²	103.9	88%	0.881	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.5	29.3	-171.1	78	0	0	0	0	117.8	N664 S668	N664-S666 PolarHBondContact O-N 3.38Å; S666-S668 PolarHBondContact O-N 2.83Å
667	G	35.6	Very low	55.4	Low	52 Å²	52	108.4 Å²	108.4	54%	0.536	60%	0.599	S	S	.	*			trans	-80.8	34.6	155.7	0	0	0	0	0	114.8	N664 F669	N664-G667 PolarHBondContact O-N 3.15Å; G667-F669 PolarHBondContact O-N 2.84Å
668	S	43.7	Very low	53.8	Low	111 Å²	111	110.3 Å²	110.3	78%	0.776	61%	0.614	S	S	*	*			trans	-79.7	53.5	-178.8	-175.8	0	0	0	0	113	S666	S666-S668 PolarHBondContact O-N 2.83Å
669	F	43.6	Very low	52.5	Low	208 Å²	208	112.9 Å²	112.9	91%	0.912	64%	0.636	S	S	*	*	S	Bend	trans	-163.9	106.3	155.5	-115.2	-78.7	0	0	0	107.7	G667	G667-F669 PolarHBondContact O-N 2.84Å
670	G	41	Very low	51.6	Low	66 Å²	66	114.1 Å²	114.1	68%	0.68	64%	0.643	S	S	*	*			trans	175.2	-35.2	-176	0	0	0	0	0	116	N672	G670-N672 PolarHBondContact O-N 3.37Å
671	Q	39	Very low	51	Low	199 Å²	199	119.2 Å²	119.2	93%	0.93	66%	0.66	S	S	*	*			trans	-84.5	63.3	169.8	-91.6	-161.3	6.8	0	0	112.4
672	N	41.9	Very low	50.9	Low	90 Å²	90	116.9 Å²	116.9	48%	0.481	65%	0.654	S	S	.	*			trans	-125.6	24.8	163.6	-126	23.6	0	0	0	113	G670 H676	G670-N672 PolarHBondContact O-N 3.37Å; N672-H676 PolarHBondContact O-CD2 3.5Å
673	G	44	Very low	51.7	Low	39 Å²	39	114.8 Å²	114.8	40%	0.402	65%	0.647	S	S	.	*	S	Bend	trans	-78.9	-60.3	166.9	0	0	0	0	0	112.4	R675 H677	G673-R675 PolarHBondContact O-N 3.24Å; G673-H677 PolarHBondContact O-CD2 2.8Å
674	N	46.7	Very low	52.9	Low	137 Å²	137	113.8 Å²	113.8	73%	0.733	63%	0.634	S	S	*	*	H	α-helix	trans	-80.1	-14.5	-168.8	-72.6	0.2	0	0	0	115.2	L678	N674-L678 WeakPolarHBondContact O-CB 3.46Å; N674-L678 PolarHBondContact O-N 2.7Å; N674-L678 VanDerWaalsContact O-N 3.07Å
675	R	48.1	Very low	54.8	Low	201 Å²	201	113.9 Å²	113.9	76%	0.758	63%	0.628	S	S	*	*	H	α-helix	trans	-74.2	-34	177.2	-143.4	172.3	-174.9	172.3	0.6	112.1	G673 A679	G673-R675 PolarHBondContact O-N 3.24Å; R675-A679 VanDerWaalsContact O-CB 3.24Å; R675-A679 WeakPolarHBondContact O-CB 3.44Å; R675-A679 PolarHBondContact O-N 2.67Å; R675-A679 VanDerWaalsContact O-N 3.07Å
676	H	50.5	Low	56.4	Low	107 Å²	107	115.6 Å²	115.6	50%	0.495	62%	0.62	S	S	.	*	H	α-helix	trans	-72.4	-42.2	172.9	-74.2	-77.2	0	0	0	111.9	N672 A679 I680	N672-H676 PolarHBondContact O-CD2 3.5Å; H676-A679 PolarHBondContact O-N 3.21Å; H676-I680 WeakPolarHBondContact O-CB 3.39Å; H676-I680 WeakPolarHBondContact O-CD1 3.41Å; H676-I680 WeakPolarHBondContact O-CG1 3.44Å; H676-I680 PolarHBondContact O-N 2.99Å
677	H	53.4	Low	58.4	Low	107 Å²	107	113 Å²	113	50%	0.495	60%	0.599	S	S	.	*	H	α-helix	trans	-62.2	-45.3	175.5	-70.7	-62.4	0	0	0	112.4	G673 A679 I680 Y681	G673-H677 PolarHBondContact O-CD2 2.8Å; H677-A679 PolarHBondContact O-N 3.04Å; H677-I680 PolarHBondContact O-N 3.21Å; H677-Y681 HydrophobicContact CB-CE2 4.49Å; H677-Y681 WeakPolarHBondContact O-CD2 3.46Å; H677-Y681 PolarHBondContact O-N 3.26Å
678	L	55.7	Low	60.8	Low	125 Å²	125	112.6 Å²	112.6	65%	0.654	59%	0.594	S	S	*	*	H	α-helix	trans	-63.3	-41.5	176.7	-154	81.9	0	0	0	111.8	N674 Y681 V682	N674-L678 WeakPolarHBondContact O-CB 3.46Å; N674-L678 PolarHBondContact O-N 2.7Å; N674-L678 VanDerWaalsContact O-N 3.07Å; L678-Y681 PolarHBondContact O-N 3.39Å; L678-V682 WeakPolarHBondContact O-CB 3.45Å; L678-V682 VanDerWaalsContact O-CG2 3.26Å; L678-V682 WeakPolarHBondContact O-CG2 3.22Å; L678-V682 PolarHBondContact O-N 2.68Å
679	A	60.1	Low	62.9	Low	55 Å²	55	111.9 Å²	111.9	46%	0.455	58%	0.581	S	S	.	*	H	α-helix	trans	-64	-38.5	174.7	0	0	0	0	0	112.6	R675 H676 H677 L683	R675-A679 VanDerWaalsContact O-CB 3.24Å; R675-A679 WeakPolarHBondContact O-CB 3.44Å; R675-A679 PolarHBondContact O-N 2.67Å; R675-A679 VanDerWaalsContact O-N 3.07Å; H676-A679 PolarHBondContact O-N 3.21Å; H677-A679 PolarHBondContact O-N 3.04Å; A679-L683 WeakPolarHBondContact O-CB 3.34Å; A679-L683 PolarHBondContact O-N 3.16Å
680	I	68.8	Low	65	Low	88 Å²	88	106.2 Å²	106.2	45%	0.451	56%	0.563	S	S	.	*	H	α-helix	trans	-67	-43.8	175.6	-71.9	162.8	0	0	0	110.6	H676 H677 L683 L684	H676-I680 WeakPolarHBondContact O-CB 3.39Å; H676-I680 WeakPolarHBondContact O-CD1 3.41Å; H676-I680 WeakPolarHBondContact O-CG1 3.44Å; H676-I680 PolarHBondContact O-N 2.99Å; H677-I680 PolarHBondContact O-N 3.21Å; I680-L683 PolarHBondContact O-N 3.31Å; I680-L684 HydrophobicContact CG2-CD1 3.74Å; I680-L684 HydrophobicContact CG2-CG 4.24Å; I680-L684 VanDerWaalsContact O-CB 3.27Å; I680-L684 WeakPolarHBondContact O-CB 3.31Å; I680-L684 VanDerWaalsContact O-CG 3.22Å; I680-L684 WeakPolarHBondContact O-CG 3.5Å; I680-L684 PolarHBondContact O-N 3.27Å
681	Y	71	Confident	66.9	Low	165 Å²	165	106.4 Å²	106.4	65%	0.647	55%	0.553	S	S	*	*	H	α-helix	trans	-64.6	-40.6	175.6	-78	-63.8	0	0	0	112.4	H677 L678 F685	H677-Y681 HydrophobicContact CB-CE2 4.49Å; H677-Y681 WeakPolarHBondContact O-CD2 3.46Å; H677-Y681 PolarHBondContact O-N 3.26Å; L678-Y681 PolarHBondContact O-N 3.39Å; Y681-F685 VanDerWaalsContact O-CB 3.28Å; Y681-F685 WeakPolarHBondContact O-CB 3.47Å; Y681-F685 PolarHBondContact O-N 3.11Å
682	V	76.7	Confident	69	Low	72 Å²	72	98.2 Å²	98.2	44%	0.436	52%	0.522	S	S	.	.	H	α-helix	trans	-65.3	-42	174.4	169.9	0	0	0	0	111.2	L678 F685 F686	L678-V682 WeakPolarHBondContact O-CB 3.45Å; L678-V682 VanDerWaalsContact O-CG2 3.26Å; L678-V682 WeakPolarHBondContact O-CG2 3.22Å; L678-V682 PolarHBondContact O-N 2.68Å; V682-F685 WeakPolarHBondContact O-CB 3.48Å; V682-F685 PolarHBondContact O-N 3.45Å; V682-F686 HydrophobicContact CG1-CD2 3.76Å; V682-F686 HydrophobicContact CG1-CE2 3.6Å; V682-F686 WeakPolarHBondContact O-CD2 3.18Å; V682-F686 PolarHBondContact O-N 3.05Å
683	L	78.4	Confident	71	Confident	115 Å²	115	96.7 Å²	96.7	60%	0.602	52%	0.522	S	S	*	.	H	α-helix	trans	-70	-39	178.8	-165.6	147.2	0	0	0	111.6	A679 I680 F685 F686 V687	A679-L683 WeakPolarHBondContact O-CB 3.34Å; A679-L683 PolarHBondContact O-N 3.16Å; I680-L683 PolarHBondContact O-N 3.31Å; L683-F685 VanDerWaalsContact C-N 3.34Å; L683-F686 PolarHBondContact O-N 3.45Å; L683-V687 HydrophobicContact CD2-CG2 4.04Å; L683-V687 WeakPolarHBondContact O-CB 3.36Å; L683-V687 VanDerWaalsContact O-CG2 3.26Å; L683-V687 WeakPolarHBondContact O-CG2 3.34Å; L683-V687 PolarHBondContact O-N 2.92Å
684	L	77.5	Confident	72.7	Confident	102 Å²	102	100.7 Å²	100.7	53%	0.534	53%	0.529	S	S	.	.	H	α-helix	trans	-64.5	-35.4	170.7	-74	171.1	0	0	0	112.2	I680 G688	I680-L684 HydrophobicContact CG2-CD1 3.74Å; I680-L684 HydrophobicContact CG2-CG 4.24Å; I680-L684 VanDerWaalsContact O-CB 3.27Å; I680-L684 WeakPolarHBondContact O-CB 3.31Å; I680-L684 VanDerWaalsContact O-CG 3.22Å; I680-L684 WeakPolarHBondContact O-CG 3.5Å; I680-L684 PolarHBondContact O-N 3.27Å; L684-G688 PolarHBondContact O-N 2.84Å
685	F	80.1	Confident	74.1	Confident	137 Å²	137	99.6 Å²	99.6	60%	0.601	52%	0.522	S	S	*	.	H	α-helix	trans	-66.3	-44.2	174.2	-178.8	-97.7	0	0	0	111.7	Y681 V682 L683 G688 L689	Y681-F685 VanDerWaalsContact O-CB 3.28Å; Y681-F685 WeakPolarHBondContact O-CB 3.47Å; Y681-F685 PolarHBondContact O-N 3.11Å; V682-F685 WeakPolarHBondContact O-CB 3.48Å; V682-F685 PolarHBondContact O-N 3.45Å; L683-F685 VanDerWaalsContact C-N 3.34Å; F685-G688 PolarHBondContact O-N 3.4Å; F685-L689 HydrophobicContact CD1-CD1 4Å; F685-L689 HydrophobicContact CE1-CD1 3.5Å; F685-L689 HydrophobicContact CE1-CG 4.46Å; F685-L689 HydrophobicContact CZ-CD1 4Å; F685-L689 PolarHBondContact O-N 2.99Å
686	F	84.1	Confident	75.4	Confident	126 Å²	126	95.5 Å²	95.5	55%	0.553	52%	0.515	S	S	*	.	H	α-helix	trans	-68	-39.8	174.5	-77.6	-63.3	0	0	0	112.9	V682 L683 G688 L689 V690	V682-F686 HydrophobicContact CG1-CD2 3.76Å; V682-F686 HydrophobicContact CG1-CE2 3.6Å; V682-F686 WeakPolarHBondContact O-CD2 3.18Å; V682-F686 PolarHBondContact O-N 3.05Å; L683-F686 PolarHBondContact O-N 3.45Å; F686-G688 VanDerWaalsContact C-N 3.33Å; F686-L689 HydrophobicContact CD1-CD1 4.46Å; F686-L689 PolarHBondContact O-N 2.92Å; F686-V690 WeakPolarHBondContact O-CG2 3.27Å; F686-V690 PolarHBondContact O-N 3.17Å
687	V	87.6	Confident	76.7	Confident	72 Å²	72	97 Å²	97	44%	0.436	52%	0.517	S	S	.	.	H	α-helix	trans	-62.3	-41.4	172	169.3	0	0	0	0	110.6	L683 L689 V690 C691	L683-V687 HydrophobicContact CD2-CG2 4.04Å; L683-V687 WeakPolarHBondContact O-CB 3.36Å; L683-V687 VanDerWaalsContact O-CG2 3.26Å; L683-V687 WeakPolarHBondContact O-CG2 3.34Å; L683-V687 PolarHBondContact O-N 2.92Å; V687-L689 PolarHBondContact O-N 3.41Å; V687-V690 PolarHBondContact O-N 3.33Å; V687-C691 WeakPolarHBondContact O-CB 3.36Å; V687-C691 PolarHBondContact O-N 2.93Å; V687-C691 PolarHBondContact O-SG 3.22Å; V687-C691 VanDerWaalsContact O-SG 3.38Å
688	G	84.6	Confident	77.5	Confident	42 Å²	42	97.9 Å²	97.9	43%	0.433	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-42.4	174.2	0	0	0	0	0	113.1	L684 F685 F686 G692	L684-G688 PolarHBondContact O-N 2.84Å; F685-G688 PolarHBondContact O-N 3.4Å; F686-G688 VanDerWaalsContact C-N 3.33Å; G688-G692 PolarHBondContact O-N 3.15Å
689	L	87.4	Confident	78	Confident	96 Å²	96	97.3 Å²	97.3	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-63.8	-43.5	173.1	-88.3	167.5	0	0	0	112.4	F685 F686 V687 G692 A693	F685-L689 HydrophobicContact CD1-CD1 4Å; F685-L689 HydrophobicContact CE1-CD1 3.5Å; F685-L689 HydrophobicContact CE1-CG 4.46Å; F685-L689 HydrophobicContact CZ-CD1 4Å; F685-L689 PolarHBondContact O-N 2.99Å; F686-L689 HydrophobicContact CD1-CD1 4.46Å; F686-L689 PolarHBondContact O-N 2.92Å; V687-L689 PolarHBondContact O-N 3.41Å; L689-G692 PolarHBondContact O-N 3.32Å; L689-A693 WeakPolarHBondContact O-CB 3.31Å; L689-A693 PolarHBondContact O-N 3.29Å
690	V	88.3	Confident	78.1	Confident	90 Å²	90	99 Å²	99	55%	0.545	52%	0.521	S	S	.	.	H	α-helix	trans	-66.4	-44.3	177.7	172.1	0	0	0	0	111	F686 V687 A693 F694	F686-V690 WeakPolarHBondContact O-CG2 3.27Å; F686-V690 PolarHBondContact O-N 3.17Å; V687-V690 PolarHBondContact O-N 3.33Å; V690-A693 PolarHBondContact O-N 3.06Å; V690-F694 WeakPolarHBondContact O-CB 3.45Å; V690-F694 PolarHBondContact O-N 3.44Å
691	C	81.4	Confident	77.7	Confident	69 Å²	69	98.9 Å²	98.9	47%	0.466	52%	0.521	S	S	.	.	H	α-helix	trans	-65.1	-38.7	175	-72.3	0	0	0	0	112.3	V687 F694 L695	V687-C691 WeakPolarHBondContact O-CB 3.36Å; V687-C691 PolarHBondContact O-N 2.93Å; V687-C691 PolarHBondContact O-SG 3.22Å; V687-C691 VanDerWaalsContact O-SG 3.38Å; C691-F694 PolarHBondContact O-N 3.16Å; C691-L695 WeakPolarHBondContact O-CB 3.42Å; C691-L695 WeakPolarHBondContact O-CG 3.16Å; C691-L695 PolarHBondContact O-N 3.41Å
692	G	83.6	Confident	76.8	Confident	28 Å²	28	99.4 Å²	99.4	29%	0.289	53%	0.527	S	S	.	.	H	α-helix	trans	-64	-43	173.6	0	0	0	0	0	112.4	G688 L689 L695 L696	G688-G692 PolarHBondContact O-N 3.15Å; L689-G692 PolarHBondContact O-N 3.32Å; G692-L695 PolarHBondContact O-N 3.1Å; G692-L696 WeakPolarHBondContact O-CB 3.49Å; G692-L696 WeakPolarHBondContact O-CG 3.5Å; G692-L696 PolarHBondContact O-N 3.42Å
693	A	82.3	Confident	75.5	Confident	58 Å²	58	104.8 Å²	104.8	48%	0.479	55%	0.545	S	S	.	.	H	α-helix	trans	-64.1	-40.6	172.9	0	0	0	0	0	111.9	L689 V690 L696 Y697	L689-A693 WeakPolarHBondContact O-CB 3.31Å; L689-A693 PolarHBondContact O-N 3.29Å; V690-A693 PolarHBondContact O-N 3.06Å; A693-L696 PolarHBondContact O-N 3.48Å; A693-Y697 VanDerWaalsContact O-CB 3.22Å; A693-Y697 WeakPolarHBondContact O-CB 3.21Å; A693-Y697 PolarHBondContact O-N 3.49Å
694	F	80.9	Confident	74	Confident	122 Å²	122	106.6 Å²	106.6	54%	0.535	56%	0.555	S	S	.	*	H	α-helix	trans	-64.3	-41	174.6	-116.2	-96.8	0	0	0	112.3	V690 C691 Y697 F698	V690-F694 WeakPolarHBondContact O-CB 3.45Å; V690-F694 PolarHBondContact O-N 3.44Å; C691-F694 PolarHBondContact O-N 3.16Å; F694-Y697 PolarHBondContact O-N 3.01Å; F694-F698 AromaticContact CD1-CD2 3.93Å; F694-F698 HydrophobicContact CD1-CD2 3.93Å; F694-F698 AromaticContact CD1-CE2 3.7Å; F694-F698 HydrophobicContact CD1-CE2 3.7Å; F694-F698 AromaticContact CE1-CE2 3.85Å; F694-F698 HydrophobicContact CE1-CE2 3.85Å; F694-F698 WeakPolarHBondContact O-CD2 3.45Å; F694-F698 PolarHBondContact O-N 2.7Å
695	L	76.1	Confident	72.6	Confident	114 Å²	114	106.4 Å²	106.4	60%	0.597	56%	0.562	S	S	*	*	H	α-helix	trans	-65	-43.9	174.8	-81.8	166	0	0	0	111.5	C691 G692 Y697 F698 L699	C691-L695 WeakPolarHBondContact O-CB 3.42Å; C691-L695 WeakPolarHBondContact O-CG 3.16Å; C691-L695 PolarHBondContact O-N 3.41Å; G692-L695 PolarHBondContact O-N 3.1Å; L695-Y697 VanDerWaalsContact C-N 3.34Å; L695-F698 PolarHBondContact O-N 3.42Å; L695-L699 WeakPolarHBondContact O-CB 3.1Å; L695-L699 WeakPolarHBondContact O-CG 3.28Å; L695-L699 PolarHBondContact O-N 2.99Å
696	L	76	Confident	70.6	Confident	116 Å²	116	105.8 Å²	105.8	61%	0.607	58%	0.575	S	S	*	*	H	α-helix	trans	-65	-37.1	174.4	-73.3	168.7	0	0	0	112.3	G692 A693 L699 T700	G692-L696 WeakPolarHBondContact O-CB 3.49Å; G692-L696 WeakPolarHBondContact O-CG 3.5Å; G692-L696 PolarHBondContact O-N 3.42Å; A693-L696 PolarHBondContact O-N 3.48Å; L696-L699 PolarHBondContact O-N 3.26Å; L696-T700 WeakPolarHBondContact O-CB 3.3Å; L696-T700 WeakPolarHBondContact O-CG2 3.39Å; L696-T700 PolarHBondContact O-N 2.94Å; L696-T700 PolarHBondContact O-OG1 3.13Å
697	Y	76.7	Confident	68.4	Low	139 Å²	139	111.6 Å²	111.6	55%	0.545	59%	0.593	S	S	.	*	H	α-helix	trans	-64.5	-44	173.4	-176.2	-112.6	0	0	0	111.9	A693 F694 L695 T700 L701	A693-Y697 VanDerWaalsContact O-CB 3.22Å; A693-Y697 WeakPolarHBondContact O-CB 3.21Å; A693-Y697 PolarHBondContact O-N 3.49Å; F694-Y697 PolarHBondContact O-N 3.01Å; L695-Y697 VanDerWaalsContact C-N 3.34Å; Y697-T700 WeakPolarHBondContact CA-OG1 3.45Å; Y697-T700 PolarHBondContact O-N 3.14Å; Y697-T700 PolarHBondContact O-OG1 3Å; Y697-L701 HydrophobicContact CD1-CD1 3.74Å; Y697-L701 HydrophobicContact CE1-CD1 3.38Å; Y697-L701 HydrophobicContact CE2-CD1 4.23Å; Y697-L701 HydrophobicContact CG-CD1 4.3Å; Y697-L701 WeakPolarHBondContact O-CB 3.34Å; Y697-L701 WeakPolarHBondContact O-CG 3.12Å; Y697-L701 PolarHBondContact O-N 2.66Å
698	F	70.4	Confident	66.5	Low	125 Å²	125	114.4 Å²	114.4	55%	0.548	61%	0.613	S	S	.	*	H	α-helix	trans	-70.2	-34.9	174.9	-91.1	-70.3	0	0	0	113.2	F694 L695 K702	F694-F698 AromaticContact CD1-CD2 3.93Å; F694-F698 HydrophobicContact CD1-CD2 3.93Å; F694-F698 AromaticContact CD1-CE2 3.7Å; F694-F698 HydrophobicContact CD1-CE2 3.7Å; F694-F698 AromaticContact CE1-CE2 3.85Å; F694-F698 HydrophobicContact CE1-CE2 3.85Å; F694-F698 WeakPolarHBondContact O-CD2 3.45Å; F694-F698 PolarHBondContact O-N 2.7Å; L695-F698 PolarHBondContact O-N 3.42Å; F698-K702 WeakPolarHBondContact O-CB 3.5Å; F698-K702 PolarHBondContact O-N 2.84Å
699	L	65.9	Low	64	Low	112 Å²	112	115.4 Å²	115.4	59%	0.586	62%	0.623	S	S	*	*	H	α-helix	trans	-69	-33.6	174.6	-72.9	168.3	0	0	0	112.1	L695 L696 K703	L695-L699 WeakPolarHBondContact O-CB 3.1Å; L695-L699 WeakPolarHBondContact O-CG 3.28Å; L695-L699 PolarHBondContact O-N 2.99Å; L696-L699 PolarHBondContact O-N 3.26Å; L699-K703 WeakPolarHBondContact O-CB 3.25Å; L699-K703 PolarHBondContact O-N 2.89Å
700	T	63	Low	61.4	Low	90 Å²	90	118.5 Å²	118.5	55%	0.552	64%	0.64	S	S	*	*	H	α-helix	trans	-76.5	-37	174	47.8	0	0	0	0	112.5	L696 Y697 K703	L696-T700 WeakPolarHBondContact O-CB 3.3Å; L696-T700 WeakPolarHBondContact O-CG2 3.39Å; L696-T700 PolarHBondContact O-N 2.94Å; L696-T700 PolarHBondContact O-OG1 3.13Å; Y697-T700 WeakPolarHBondContact CA-OG1 3.45Å; Y697-T700 PolarHBondContact O-N 3.14Å; Y697-T700 PolarHBondContact O-OG1 3Å; T700-K703 PolarHBondContact O-N 2.75Å
701	L	60.3	Low	58.7	Low	86 Å²	86	126 Å²	126	45%	0.45	66%	0.659	S	S	.	*	H	α-helix	trans	-62.5	-45.5	169.3	-83.7	164.9	0	0	0	112.3	Y697 K703 N704	Y697-L701 HydrophobicContact CD1-CD1 3.74Å; Y697-L701 HydrophobicContact CE1-CD1 3.38Å; Y697-L701 HydrophobicContact CE2-CD1 4.23Å; Y697-L701 HydrophobicContact CG-CD1 4.3Å; Y697-L701 WeakPolarHBondContact O-CB 3.34Å; Y697-L701 WeakPolarHBondContact O-CG 3.12Å; Y697-L701 PolarHBondContact O-N 2.66Å; L701-K703 PolarHBondContact O-N 3.24Å; L701-N704 PolarHBondContact O-N 2.91Å; L701-N704 VanDerWaalsContact O-N 3.12Å
702	K	52.3	Low	56.3	Low	177 Å²	177	127.1 Å²	127.1	77%	0.77	67%	0.673	S	S	*	*	H	α-helix	trans	-69.2	-18.7	-179.3	-162.7	170.7	-174.9	177.8	0	113.1	F698 N704	F698-K702 WeakPolarHBondContact O-CB 3.5Å; F698-K702 PolarHBondContact O-N 2.84Å; K702-N704 VanDerWaalsContact C-N 3.32Å
703	K	47.9	Very low	54.9	Low	185 Å²	185	131 Å²	131	80%	0.804	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-11.9	173.5	-163.8	167.6	-177.4	176.5	0	113.7	L699 T700 L701	L699-K703 WeakPolarHBondContact O-CB 3.25Å; L699-K703 PolarHBondContact O-N 2.89Å; T700-K703 PolarHBondContact O-N 2.75Å; L701-K703 PolarHBondContact O-N 3.24Å
704	N	46.7	Very low	52.5	Low	153 Å²	153	134.8 Å²	134.8	82%	0.818	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	7.4	-176.6	-114.8	12.8	0	0	0	115	L701 K702	L701-N704 PolarHBondContact O-N 2.91Å; L701-N704 VanDerWaalsContact O-N 3.12Å; K702-N704 VanDerWaalsContact C-N 3.32Å
705	S	49.1	Very low	50.2	Low	98 Å²	98	135.4 Å²	135.4	69%	0.685	71%	0.714	S	S	*	*	S	Bend	trans	-138.8	80.9	176.2	-162.1	0	0	0	0	112.6
706	S	37.2	Very low	48.1	Very low	124 Å²	124	134.7 Å²	134.7	87%	0.867	72%	0.718	S	S	*	*			trans	174.9	100.7	145.4	-78.8	0	0	0	0	112.4
707	R	38.8	Very low	46.1	Very low	247 Å²	247	136.9 Å²	136.9	93%	0.932	73%	0.73	S	S	*	*			trans	-114.6	166.3	146.1	-88.5	-176.8	171.1	-176.1	-2	106.2
708	P	46.6	Very low	43.9	Very low	131 Å²	131	135.5 Å²	135.5	85%	0.851	74%	0.74	S	S	*	*			cis	-122.3	-170.6	4	34.7	-14.3	0	0	0	111.7
709	G	32.3	Very low	42	Very low	63 Å²	63	135 Å²	135	65%	0.649	75%	0.752	S	S	*	*			cis	174.5	175	-2	0	0	0	0	0	113.5
710	N	33.4	Very low	40.2	Very low	161 Å²	161	132.7 Å²	132.7	86%	0.861	76%	0.755	S	S	*	*			trans	37.8	122.5	160	-56.4	-7.3	0	0	0	119.3
711	R	31.6	Very low	38.7	Very low	249 Å²	249	136.8 Å²	136.8	94%	0.94	77%	0.766	S	S	*	*				-157	150.7	62.8	-82.6	176.9	174.1	161.4	-1	113.5
712	A	31.6	Very low	37.2	Very low	92 Å²	92	139.4 Å²	139.4	76%	0.76	78%	0.776	S	S	*	*			trans	-90.9	-171.5	164.7	0	0	0	0	0	109.3
713	P	54.3	Low	36	Very low	108 Å²	108	138.1 Å²	138.1	70%	0.701	77%	0.772	S	S	*	*			cis	-128.6	-171.2	7.7	40.3	-18	0	0	0	112.7
714	D	31.6	Very low	35	Very low	138 Å²	138	137.9 Å²	137.9	74%	0.738	77%	0.771	S	S	*	*			cis	-161.5	171	38.4	-117.5	-35.3	0	0	0	115.5
715	N	32.5	Very low	34.1	Very low	136 Å²	136	138.3 Å²	138.3	73%	0.727	77%	0.773	S	S	*	*			trans	82.8	87.4	162.3	-64	-27.4	0	0	0	122.3
716	S	32.1	Very low	33.1	Very low	99 Å²	99	141.8 Å²	141.8	69%	0.692	78%	0.783	S	S	*	*				43.9	143.5	108.8	58.1	0	0	0	0	122.3
717	L	34.4	Very low	32.6	Very low	161 Å²	161	141.5 Å²	141.5	84%	0.843	78%	0.779	S	S	*	*			cis	-169.5	161.8	-19.9	-147.8	97.1	0	0	0	110.1
718	S	30	Very low	32.1	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	77%	0.769	S	S	*	*			trans	77.8	140.7	152	-151	0	0	0	0	119.5
719	S	30.2	Very low	31.5	Very low	115 Å²	115	133.3 Å²	133.3	80%	0.804	76%	0.763	S	S	*	*			cis	-173.9	160.1	-18.8	178.1	0	0	0	0	111.1
720	G	29.2	Very low	31.4	Very low	63 Å²	63	134.6 Å²	134.6	65%	0.649	77%	0.767	S	S	*	*			trans	111.5	117.5	165	0	0	0	0	0	114.4
721	K	30.4	Very low	31.3	Very low	177 Å²	177	133.1 Å²	133.1	77%	0.77	76%	0.764	S	S	*	*			cis	63.6	140.5	49	-66.6	-178.7	139.3	-130.6	0	113.1
722	E	28.6	Very low	31.8	Very low	140 Å²	140	127.4 Å²	127.4	65%	0.654	76%	0.76	S	S	*	*			cis	-160	169	2.9	-129.2	166.7	122.4	0	0	112.7
723	Q	27.6	Very low	31.8	Very low	150 Å²	150	131.6 Å²	131.6	70%	0.701	76%	0.764	S	S	*	*			trans	-0.4	150.3	157	-110.6	82.9	-8.4	0	0	125.1
724	K	27.1	Very low	30.7	Very low	180 Å²	180	131.1 Å²	131.1	78%	0.783	76%	0.763	S	S	*	*			trans	86.6	107.2	135.3	-81.7	168.4	-179.6	179.4	0	122.7
725	L	28.5	Very low	30.6	Very low	162 Å²	162	133 Å²	133	85%	0.848	77%	0.767	S	S	*	*				32.8	121.8	114.1	-79.6	149.2	0	0	0	120.4
726	L	28.1	Very low	30.6	Very low	171 Å²	171	131.1 Å²	131.1	90%	0.895	77%	0.765	S	S	*	*			trans	-163.6	165.1	134.9	-103.3	164.1	0	0	0	111.2
727	C	26.3	Very low	30.6	Very low	118 Å²	118	131.4 Å²	131.4	80%	0.797	77%	0.767	S	S	*	*			trans	-71.8	176	-165.9	-50.1	0	0	0	0	115
728	S	28.2	Very low	30.4	Very low	103 Å²	103	128.7 Å²	128.7	72%	0.72	76%	0.761	S	S	*	*			cis	-165.2	168	22.4	-160.3	0	0	0	0	113.9
729	S	32.9	Very low	30.5	Very low	104 Å²	104	128.2 Å²	128.2	73%	0.727	76%	0.758	S	S	*	*			trans	3.8	148.5	150.4	55.9	0	0	0	0	121.7
730	A	31.5	Very low	30.6	Very low	89 Å²	89	130.1 Å²	130.1	74%	0.736	76%	0.758	S	S	*	*			cis	-170.8	174.4	-2.2	0	0	0	0	0	111.9
731	T	31	Very low	30.7	Very low	130 Å²	130	133.1 Å²	133.1	80%	0.798	76%	0.764	S	S	*	*			trans	0.1	151.3	161.3	26.5	0	0	0	0	122.4
732	P	41.1	Very low	30.8	Very low	130 Å²	130	128.9 Å²	128.9	84%	0.844	76%	0.756	S	S	*	*				-151.9	-170.5	63.7	41.5	-19.7	0	0	0	118.7
733	Q	31.2	Very low	30.9	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	77%	0.768	S	S	*	*			trans	-105.5	152.7	-178.6	-63.6	176	-72.7	0	0	114.6
734	S	32	Very low	30.8	Very low	99 Å²	99	126.3 Å²	126.3	69%	0.692	77%	0.768	S	S	*	*			trans	36.6	132.9	144.4	66	0	0	0	0	123.8
735	Q	30.3	Very low	30.8	Very low	177 Å²	177	127 Å²	127	83%	0.827	77%	0.771	S	S	*	*				176.7	149.8	107.7	-97.5	-171.9	2	0	0	116.1
736	S	31.1	Very low	30.6	Very low	96 Å²	96	131.1 Å²	131.1	67%	0.671	78%	0.775	S	S	*	*			trans	50.6	116.9	142.8	68.8	0	0	0	0	125.7
737	S	32.3	Very low	30.5	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	77%	0.765	S	S	*	*				45.3	136.8	127.5	65.5	0	0	0	0	124.7
738	S	30.5	Very low	30.6	Very low	104 Å²	104	127.7 Å²	127.7	73%	0.727	77%	0.767	S	S	*	*				160.2	147.6	106.1	58.9	0	0	0	0	115.2
739	S	32.2	Very low	30.7	Very low	101 Å²	101	132.2 Å²	132.2	71%	0.706	78%	0.777	S	S	*	*			trans	38.9	159.2	144.2	47.9	0	0	0	0	123.2
740	L	32.8	Very low	30.6	Very low	154 Å²	154	135.6 Å²	135.6	81%	0.806	78%	0.779	S	S	*	*			cis	-173	166.2	-6.3	-110.1	164.8	0	0	0	108.5
741	V	32	Very low	30.7	Very low	127 Å²	127	138 Å²	138	77%	0.77	78%	0.775	S	S	*	*			trans	68	146.7	154	164.7	0	0	0	0	118
742	S	31.7	Very low	30.6	Very low	87 Å²	87	139 Å²	139	61%	0.608	78%	0.775	S	S	*	*			cis	-168.3	171.8	-23.4	-84.9	0	0	0	0	109.9
743	D	29.6	Very low	30.1	Very low	170 Å²	170	136.5 Å²	136.5	91%	0.909	77%	0.772	S	S	*	*			trans	66.3	145.3	160.8	-55.1	-33.8	0	0	0	119.6
744	G	27.3	Very low	30	Very low	67 Å²	67	137.3 Å²	137.3	69%	0.691	77%	0.773	S	S	*	*			cis	178.9	164.9	-5.8	0	0	0	0	0	114
745	F	25.6	Very low	30	Very low	194 Å²	194	138.1 Å²	138.1	85%	0.851	77%	0.774	S	S	*	*			trans	42.1	124.1	161.2	-84	-89.1	0	0	0	122.8
746	R	26.1	Very low	30	Very low	248 Å²	248	136.4 Å²	136.4	94%	0.936	78%	0.776	S	S	*	*				-164.5	142.2	106.3	-116.5	-179.7	178.1	-178.9	0.2	114.8
747	S	26.1	Very low	30	Very low	97 Å²	97	136.4 Å²	136.4	68%	0.678	78%	0.776	S	S	*	*			trans	-82.4	157.4	176.9	-34.8	0	0	0	0	113.2
748	S	27.7	Very low	29.8	Very low	121 Å²	121	137.2 Å²	137.2	85%	0.846	78%	0.777	S	S	*	*				179	116.2	120.4	-77.2	0	0	0	0	112.1
749	E	30.6	Very low	29.8	Very low	197 Å²	197	138.1 Å²	138.1	92%	0.921	78%	0.778	S	S	*	*			trans	-132.9	140.8	156.8	-165.2	73.2	-122.6	0	0	107
750	K	30.1	Very low	29.8	Very low	175 Å²	175	137.4 Å²	137.4	76%	0.761	78%	0.778	S	S	*	*			trans	-124.3	129.7	-161.2	-138.8	-174.2	-176.3	-176.4	0	112.4
751	Q	32.7	Very low	29.7	Very low	141 Å²	141	136.4 Å²	136.4	66%	0.659	78%	0.779	S	S	*	*			trans	68.6	112.3	153.5	-76.5	172.6	-69.2	0	0	121.1
752	N	29.3	Very low	29.5	Very low	151 Å²	151	135.7 Å²	135.7	81%	0.807	78%	0.775	S	S	*	*				59	129.5	121	-55.8	-3	0	0	0	120.4
753	G	31.5	Very low	29.4	Very low	76 Å²	76	140.2 Å²	140.2	78%	0.784	79%	0.791	S	S	*	*			cis	152.7	-171.1	-6.4	0	0	0	0	0	114.6
754	K	29.3	Very low	29.3	Very low	197 Å²	197	138.8 Å²	138.8	86%	0.857	78%	0.783	S	S	*	*			trans	95.9	73.7	161.6	-149.3	171	-172.8	179	0	120.3
755	T	31.6	Very low	29.3	Very low	116 Å²	116	140.4 Å²	140.4	71%	0.712	78%	0.784	S	S	*	*				40.3	129.5	120.5	62.2	0	0	0	0	121.9
756	T	30.7	Very low	29.5	Very low	141 Å²	141	137.3 Å²	137.3	87%	0.865	79%	0.786	S	S	*	*				-147.9	134.8	119.9	11.3	0	0	0	0	112.1
757	S	29.9	Very low	29.7	Very low	96 Å²	96	135 Å²	135	67%	0.671	79%	0.786	S	S	*	*			trans	-50.7	162.4	168.7	49.6	0	0	0	0	114.1
758	T	29.7	Very low	29.7	Very low	122 Å²	122	134 Å²	134	75%	0.748	79%	0.791	S	S	*	*				-175.3	111.6	70.2	-53.7	0	0	0	0	107
759	T	30.5	Very low	29.9	Very low	122 Å²	122	136.8 Å²	136.8	75%	0.748	80%	0.797	S	S	*	*				105.3	124.8	77.2	-62	0	0	0	0	112.9
760	A	30.5	Very low	29.8	Very low	87 Å²	87	131.2 Å²	131.2	72%	0.719	79%	0.792	S	S	*	*			trans	66.5	152	163.3	0	0	0	0	0	118.1
761	T	30.5	Very low	29.7	Very low	132 Å²	132	126.4 Å²	126.4	81%	0.81	79%	0.792	S	S	*	*			cis	-140.8	145.3	12.2	-36.9	0	0	0	0	112.4
762	T	28.5	Very low	30.7	Very low	112 Å²	112	125 Å²	125	69%	0.687	80%	0.795	S	S	*	*			trans	-67.6	145.8	168.9	44	0	0	0	0	113.3
763	L	30.1	Very low	30.7	Very low	182 Å²	182	126.6 Å²	126.6	95%	0.953	80%	0.797	S	S	*	*			trans	-137.2	144	138.3	-102.7	173.9	0	0	0	110.3
764	L	27.4	Very low	30.5	Very low	141 Å²	141	127.8 Å²	127.8	74%	0.738	80%	0.8	S	S	*	*			trans	-101.5	141.6	-165.9	-91.6	102.5	0	0	0	113.3
765	S	27.4	Very low	30.7	Very low	101 Å²	101	125.9 Å²	125.9	71%	0.706	80%	0.799	S	S	*	*			trans	30.6	133.2	141.2	67.6	0	0	0	0	121.4
766	S	29	Very low	30.5	Very low	128 Å²	128	126.1 Å²	126.1	90%	0.895	81%	0.805	S	S	*	*				-140.2	153.5	117.5	61	0	0	0	0	110.7
767	Q	30.4	Very low	30.4	Very low	199 Å²	199	130.1 Å²	130.1	93%	0.93	81%	0.806	S	S	*	*			trans	-99.4	157.2	-172.5	-64.1	164.6	-43.8	0	0	111.2
768	G	27.4	Very low	30.6	Very low	78 Å²	78	131.2 Å²	131.2	80%	0.804	81%	0.814	S	S	*	*			trans	-171.9	73.9	173.6	0	0	0	0	0	114
769	N	30	Very low	30.4	Very low	179 Å²	179	129.3 Å²	129.3	96%	0.957	82%	0.819	S	S	*	*			trans	-73.4	148.9	171.1	-86.4	-18.3	0	0	0	111.7
770	G	28.6	Very low	30.3	Very low	79 Å²	79	127 Å²	127	81%	0.814	82%	0.819	S	S	*	*			trans	152.2	110	157	0	0	0	0	0	115.1
771	G	28.4	Very low	30.2	Very low	74 Å²	74	129.2 Å²	129.2	76%	0.763	83%	0.829	S	S	*	*			trans	-91	-142.6	171.8	0	0	0	0	0	113.7
772	P	55.1	Low	30.1	Very low	112 Å²	112	134.6 Å²	134.6	73%	0.727	84%	0.835	S	S	*	*				-129.5	-178.6	-106.6	32.3	-14.1	0	0	0	116
773	H	29.3	Very low	30	Very low	184 Å²	184	136.5 Å²	136.5	85%	0.852	85%	0.846	S	S	*	*			trans	76.6	127.4	171	-59.4	-78.7	0	0	0	119.2
774	A	26.5	Very low	30	Very low	101 Å²	101	132.9 Å²	132.9	84%	0.835	84%	0.836	S	S	*	*				-178	149.8	105.8	0	0	0	0	0	113
775	N	33.1	Very low	29.9	Very low	158 Å²	158	131.7 Å²	131.7	85%	0.845	84%	0.839	S	S	*	*			trans	-79.6	152.3	167.4	-74.3	-34.5	0	0	0	111.2
776	S	28.6	Very low	29.9	Very low	121 Å²	121	134.2 Å²	134.2	85%	0.846	85%	0.845	S	S	*	*			trans	-168.5	143.6	131.3	34.2	0	0	0	0	115.3
777	Y	28.6	Very low	31.2	Very low	225 Å²	225	133.2 Å²	133.2	88%	0.882	84%	0.835	S	S	*	*			trans	-52.7	155.7	168.5	-67.6	-109.1	0	0	0	112.9
778	S	32.5	Very low	31.1	Very low	118 Å²	118	128.4 Å²	128.4	83%	0.825	82%	0.824	S	S	*	*				164.5	159.8	71.8	45.3	0	0	0	0	112
779	G	26.6	Very low	31.1	Very low	83 Å²	83	132.4 Å²	132.4	86%	0.856	83%	0.827	S	S	*	*			trans	89.7	130.7	160	0	0	0	0	0	116.2
780	G	27.9	Very low	31	Very low	74 Å²	74	127 Å²	127	76%	0.763	81%	0.813	S	S	*	*			cis	137.6	109.9	-6.6	0	0	0	0	0	113
781	S	28.4	Very low	31	Very low	132 Å²	132	132.8 Å²	132.8	92%	0.923	82%	0.818	S	S	*	*			trans	-159.4	130.4	158.2	-86.4	0	0	0	0	111.3
782	R	28.3	Very low	31.1	Very low	246 Å²	246	134.1 Å²	134.1	93%	0.928	82%	0.816	S	S	*	*			trans	-111.4	138.9	172.4	-68.9	172.4	167.9	175.5	-5.2	108.4
783	V	27.6	Very low	29.7	Very low	151 Å²	151	136.5 Å²	136.5	92%	0.915	82%	0.822	S	S	*	*			trans	-140.3	144.1	144.2	-177.8	0	0	0	0	108.4
784	S	28.2	Very low	29.6	Very low	107 Å²	107	138.7 Å²	138.7	75%	0.748	82%	0.824	S	S	*	*			trans	-105.7	147.2	-178.5	171.8	0	0	0	0	110.7
785	S	26.9	Very low	29.8	Very low	116 Å²	116	136.9 Å²	136.9	81%	0.811	82%	0.815	S	S	*	*			trans	-174	146.5	135.8	34.3	0	0	0	0	113.6
786	N	26.8	Very low	29.6	Very low	154 Å²	154	136 Å²	136	82%	0.824	81%	0.811	S	S	*	*			trans	-143.6	164.2	166.8	-127.2	2.2	0	0	0	104.1
787	P	55.4	Low	29.4	Very low	106 Å²	106	136.6 Å²	136.6	69%	0.688	81%	0.814	S	S	*	*			cis	-134.5	-159.8	-22.3	39.9	-21.2	0	0	0	112
788	S	28.7	Very low	29.3	Very low	99 Å²	99	132.1 Å²	132.1	69%	0.692	81%	0.805	S	S	*	*			trans	99	138.2	153.3	79.6	0	0	0	0	121.2
789	N	28.8	Very low	29.2	Very low	162 Å²	162	133.4 Å²	133.4	87%	0.866	81%	0.808	S	S	*	*			trans	51.1	132.5	160.2	-55.2	-10.9	0	0	0	119.1
790	G	26.8	Very low	29.3	Very low	65 Å²	65	133.5 Å²	133.5	67%	0.67	81%	0.809	S	S	*	*			cis	123.3	120.1	6	0	0	0	0	0	111.1
791	H	28.1	Very low	29.2	Very low	200 Å²	200	133 Å²	133	93%	0.926	80%	0.804	S	S	*	*			trans	-164.2	139.3	161	-112.2	-72.4	0	0	0	112.6
792	S	30.3	Very low	29.2	Very low	103 Å²	103	133.2 Å²	133.2	72%	0.72	81%	0.806	S	S	*	*			trans	-107.1	155.5	177.5	52.8	0	0	0	0	111.9
793	L	27.2	Very low	29.1	Very low	161 Å²	161	124.7 Å²	124.7	84%	0.843	79%	0.794	S	S	*	*			trans	-149.4	126.1	154.2	-88.7	178.6	0	0	0	111.4
794	Y	27.1	Very low	29	Very low	230 Å²	230	125 Å²	125	90%	0.902	79%	0.79	S	S	*	*			trans	-6.3	155.2	160.5	-68.3	-100.6	0	0	0	121.4
795	G	29.5	Very low	28.9	Very low	63 Å²	63	128.4 Å²	128.4	65%	0.649	79%	0.791	S	S	*	*			cis	160.8	145.6	-4.2	0	0	0	0	0	115.2
796	N	29.4	Very low	28.8	Very low	140 Å²	140	130.6 Å²	130.6	75%	0.749	79%	0.793	S	S	*	*			trans	40.8	136.4	158.2	-74.7	30.8	0	0	0	124.6
797	C	24.6	Very low	28.7	Very low	134 Å²	134	129.6 Å²	129.6	91%	0.905	79%	0.788	S	S	*	*				-153.5	144.9	105.7	-91.4	0	0	0	0	112.1
798	D	27.3	Very low	27.3	Very low	131 Å²	131	128.8 Å²	128.8	70%	0.701	78%	0.784	S	S	*	*			trans	-99.6	161.7	-172.2	-80.3	-68.7	0	0	0	114.7
799	T	29.9	Very low	27.2	Very low	144 Å²	144	132.1 Å²	132.1	88%	0.883	79%	0.789	S	S	*	*			trans	154.2	128	136.4	41.2	0	0	0	0	107.8
800	G	27.3	Very low	27.1	Very low	85 Å²	85	130.6 Å²	130.6	88%	0.876	78%	0.78	S	S	*	*			cis	101.1	122.6	35.8	0	0	0	0	0	108.5
801	G	27.2	Very low	27	Very low	65 Å²	65	134.4 Å²	134.4	67%	0.67	78%	0.784	S	S	*	*			cis	177.6	-175.9	-1.2	0	0	0	0	0	110.3
802	S	28	Very low	26.9	Very low	136 Å²	136	131 Å²	131	95%	0.951	78%	0.777	S	S	*	*			trans	67.4	151	177.7	77	0	0	0	0	117.7
803	G	25.9	Very low	26.8	Very low	67 Å²	67	130 Å²	130	69%	0.691	78%	0.775	S	S	*	*			cis	168.6	130.3	-11.6	0	0	0	0	0	115.2
804	L	26.2	Very low	26.9	Very low	157 Å²	157	130 Å²	130	82%	0.822	78%	0.776	S	S	*	*			trans	65.7	125	149	-65.4	164.7	0	0	0	123.8
805	K	26	Very low	27.2	Very low	178 Å²	178	123 Å²	123	77%	0.774	77%	0.766	S	S	*	*			trans	55	128.4	133.4	-68.1	-178.7	174.8	-178.1	0	122.6
806	L	25.4	Very low	27.4	Very low	163 Å²	163	128.7 Å²	128.7	85%	0.853	78%	0.78	S	S	*	*				-168.1	130	108.9	-115.2	83.3	0	0	0	106.5
807	N	23.7	Very low	27.2	Very low	132 Å²	132	125.7 Å²	125.7	71%	0.706	78%	0.782	S	S	*	*				58.5	87.3	61.7	-85.4	41.7	0	0	0	116.2
808	S	26.5	Very low	27.4	Very low	89 Å²	89	123 Å²	123	62%	0.622	78%	0.778	S	S	*	*				64.3	148.9	112.1	66.8	0	0	0	0	122.6
809	E	26.5	Very low	27.6	Very low	169 Å²	169	128.1 Å²	128.1	79%	0.79	79%	0.787	S	S	*	*			trans	80.5	148.3	154.1	-74.4	-174.7	-168	0	0	119.2
810	I	25.9	Very low	27.6	Very low	131 Å²	131	128.1 Å²	128.1	67%	0.672	79%	0.787	S	S	*	*			cis	-168.4	155.2	-20.5	-125.9	176.8	0	0	0	111.5
811	L	26.2	Very low	27.7	Very low	144 Å²	144	127.5 Å²	127.5	75%	0.754	78%	0.781	S	S	*	*			trans	48.9	129.6	152.4	-63.2	174.7	0	0	0	126
812	V	25.6	Very low	27.7	Very low	129 Å²	129	130.3 Å²	130.3	78%	0.782	78%	0.78	S	S	*	*				96.9	132.6	118.7	165.2	0	0	0	0	125.3
813	A	27.8	Very low	27.6	Very low	82 Å²	82	135 Å²	135	68%	0.678	78%	0.777	S	S	*	*			trans	73.9	108.4	148.2	0	0	0	0	0	125.6
814	N	29.9	Very low	27.6	Very low	160 Å²	160	142.4 Å²	142.4	86%	0.856	78%	0.784	S	S	*	*				50.3	120.3	111.7	-73.8	-5.1	0	0	0	124.9
815	A	32.6	Very low	27.8	Very low	84 Å²	84	144.9 Å²	144.9	69%	0.694	78%	0.783	S	S	*	*				83.2	124.6	120.8	0	0	0	0	0	123
816	L	33	Very low	28.4	Very low	183 Å²	183	142.3 Å²	142.3	96%	0.958	78%	0.784	S	S	*	*				162.8	151.3	113.6	-87.1	165.9	0	0	0	111.5
817	G	26.6	Very low	28.5	Very low	77 Å²	77	139.7 Å²	139.7	79%	0.794	77%	0.771	S	S	*	*			trans	158.2	25.7	165.2	0	0	0	0	0	125.1
818	G	28.6	Very low	28.8	Very low	78 Å²	78	142 Å²	142	80%	0.804	78%	0.783	S	S	*	*			trans	36.7	132.8	149.8	0	0	0	0	0	126.6
819	R	31.1	Very low	28.8	Very low	238 Å²	238	141.5 Å²	141.5	90%	0.898	79%	0.792	S	S	*	*				104.2	140.3	121.2	-109.4	-178.8	-169.8	179.2	3.7	122.7
820	T	29.7	Very low	28.9	Very low	143 Å²	143	142.4 Å²	142.4	88%	0.877	80%	0.796	S	S	*	*			trans	70.7	141.3	167.6	66.5	0	0	0	0	117.7
821	G	28.6	Very low	29.1	Very low	73 Å²	73	146 Å²	146	75%	0.753	81%	0.807	S	S	*	*			cis	170.9	127.8	-10.7	0	0	0	0	0	113.6
822	D	27.4	Very low	29.2	Very low	123 Å²	123	147.7 Å²	147.7	66%	0.658	81%	0.811	S	S	*	*			trans	47.5	131.6	159.4	-142.1	0.4	0	0	0	122.1
823	W	26.8	Very low	30.3	Very low	234 Å²	234	147.4 Å²	147.4	89%	0.886	81%	0.812	S	S	*	*				174.2	151.7	115.7	-92.8	103.2	0	0	0	111.6
824	R	24.8	Very low	30.4	Very low	223 Å²	223	147.2 Å²	147.2	84%	0.842	82%	0.817	S	S	*	*			trans	-103.2	165.7	-167.9	-62.7	177.5	-179.1	168.6	-0.5	114.6
825	R	30.1	Very low	30.3	Very low	209 Å²	209	149.3 Å²	149.3	79%	0.789	82%	0.822	S	S	*	*			trans	-26.5	151	147.7	-64.5	-175.8	-172.9	174.7	1.5	114.4
826	P	39.3	Very low	30.1	Very low	124 Å²	124	149 Å²	149	81%	0.805	83%	0.827	S	S	*	*				-147	-177.9	73.3	34.2	-13.6	0	0	0	116.6
827	D	28.5	Very low	29.9	Very low	108 Å²	108	148.7 Å²	148.7	58%	0.578	83%	0.826	S	S	*	*			cis	-177	158.2	-49.6	-91.7	-44.8	0	0	0	108.3
828	L	29.1	Very low	29.9	Very low	181 Å²	181	148.9 Å²	148.9	95%	0.948	83%	0.828	S	S	*	*			trans	60.5	139	162.8	-67.3	161.6	0	0	0	122.5
829	G	27.5	Very low	30	Very low	79 Å²	79	149.3 Å²	149.3	81%	0.814	82%	0.824	S	S	*	*			trans	173.2	108	160.2	0	0	0	0	0	115.5
830	E	28.6	Very low	30	Very low	188 Å²	188	144.6 Å²	144.6	88%	0.879	82%	0.817	S	S	*	*			trans	-87.2	147.4	-178.1	-53.6	166.2	127.9	0	0	113.7
831	K	28.6	Very low	30.1	Very low	206 Å²	206	145.3 Å²	145.3	90%	0.896	81%	0.81	S	S	*	*				173.1	141.3	125.8	-99.2	172.8	178.5	177.3	0	114.7
832	E	28.8	Very low	30.2	Very low	180 Å²	180	147.8 Å²	147.8	84%	0.841	81%	0.806	S	S	*	*			trans	-84.8	-169.9	164.2	-62.3	-164.7	146.7	0	0	111.9
833	P	48.9	Very low	30.3	Very low	123 Å²	123	149.7 Å²	149.7	80%	0.799	82%	0.815	S	S	*	*				-124.2	-179	-58.4	32.1	-16.3	0	0	0	111.1
834	G	29.2	Very low	30.3	Very low	77 Å²	77	141.8 Å²	141.8	79%	0.794	81%	0.806	S	S	*	*			trans	-161.2	124.4	170.9	0	0	0	0	0	114
835	E	29.2	Very low	30.5	Very low	205 Å²	205	135.8 Å²	135.8	96%	0.958	80%	0.804	S	S	*	*			trans	-68.8	159.7	172.6	-61	166	101.6	0	0	112.1
836	G	28.3	Very low	30.4	Very low	77 Å²	77	137.8 Å²	137.8	79%	0.794	81%	0.811	S	S	*	*			trans	165.6	91.6	165.8	0	0	0	0	0	116.5
837	N	27.1	Very low	29.9	Very low	176 Å²	176	141.6 Å²	141.6	94%	0.941	82%	0.815	S	S	*	*			trans	-44.9	149.3	168.1	-54.9	-41.1	0	0	0	114.7
838	G	28.4	Very low	30	Very low	82 Å²	82	146.6 Å²	146.6	85%	0.845	83%	0.832	S	S	*	*			trans	-178.7	114.9	164.7	0	0	0	0	0	111.8
839	A	30.4	Very low	29.8	Very low	86 Å²	86	141 Å²	141	71%	0.711	82%	0.817	S	S	*	*			trans	-101.7	177.4	-174	0	0	0	0	0	113
840	D	31.6	Very low	30	Very low	140 Å²	140	144.4 Å²	144.4	75%	0.749	82%	0.816	S	S	*	*			trans	83.7	111.9	147.3	-63.3	-18.6	0	0	0	121.8
841	E	30.9	Very low	30.2	Very low	157 Å²	157	142.4 Å²	142.4	73%	0.734	81%	0.807	S	S	*	*				85.5	115.4	116.8	-70.1	-153.5	134.1	0	0	122.7
842	L	30.8	Very low	30.4	Very low	126 Å²	126	139 Å²	139	66%	0.66	80%	0.798	S	S	*	*				95.5	133.8	121.6	-100.7	65.9	0	0	0	123.9
843	L	29.2	Very low	30.4	Very low	163 Å²	163	138.1 Å²	138.1	85%	0.853	80%	0.795	S	S	*	*			trans	82.9	136.9	141.1	-70.6	170.8	0	0	0	122.1
844	G	26.9	Very low	29.5	Very low	68 Å²	68	140.5 Å²	140.5	70%	0.701	79%	0.792	S	S	*	*			trans	134.5	48	165.8	0	0	0	0	0	114.9
845	A	29.8	Very low	29.4	Very low	96 Å²	96	142.8 Å²	142.8	79%	0.793	79%	0.791	S	S	*	*				42.9	111.2	89.7	0	0	0	0	0	116.4
846	R	27.6	Very low	29.3	Very low	251 Å²	251	137.6 Å²	137.6	95%	0.947	78%	0.777	S	S	*	*				-164.7	122.7	126.2	-154.2	158.2	-173.2	158.5	2.1	114.1
847	K	28.9	Very low	29.2	Very low	204 Å²	204	141.9 Å²	141.9	89%	0.887	78%	0.781	S	S	*	*			trans	-73	148.5	163.5	-80.2	178.3	170	-179.6	0	111.4
848	K	29.7	Very low	29.3	Very low	214 Å²	214	138 Å²	138	93%	0.93	77%	0.768	S	S	*	*			trans	-142.8	138.2	136.5	-106.9	-168.9	175.1	-170	0	108.5
849	G	26.4	Very low	29.2	Very low	62 Å²	62	142.4 Å²	142.4	64%	0.639	77%	0.766	S	S	*	*			trans	-146.9	-159.7	172.3	0	0	0	0	0	109
850	L	31.5	Very low	28.9	Very low	152 Å²	152	148.4 Å²	148.4	80%	0.796	78%	0.777	S	S	*	*			trans	78.3	136.3	-179.6	-76.7	80.6	0	0	0	116
851	E	32.7	Very low	28.8	Very low	146 Å²	146	150.7 Å²	150.7	68%	0.682	78%	0.783	S	S	*	*			cis	-167.3	-176.5	-17.7	-138.4	151.2	-139.6	0	0	111.5
852	D	31.3	Very low	28.6	Very low	133 Å²	133	147.7 Å²	147.7	71%	0.711	79%	0.785	S	S	*	*			trans	74	139	159	-54.7	-26	0	0	0	119.9
853	E	29.7	Very low	28.8	Very low	163 Å²	163	147.6 Å²	147.6	76%	0.762	79%	0.792	S	S	*	*			cis	-162.2	167.5	-3.7	-113.7	-135.5	100.5	0	0	107.8
854	F	28.9	Very low	28.9	Very low	172 Å²	172	148.1 Å²	148.1	75%	0.754	80%	0.795	S	S	*	*			cis	-169.4	-174.5	-43.2	-145.6	-98.5	0	0	0	109.2
855	V	28.5	Very low	28.9	Very low	126 Å²	126	149 Å²	149	76%	0.764	80%	0.796	S	S	*	*			trans	70.3	129.9	165.6	-171.8	0	0	0	0	117.4
856	S	27.1	Very low	28.9	Very low	96 Å²	96	150.5 Å²	150.5	67%	0.671	80%	0.797	S	S	*	*			cis	-172.9	141.4	-10.2	165.9	0	0	0	0	110.2
857	L	26.1	Very low	28.9	Very low	166 Å²	166	144.7 Å²	144.7	87%	0.869	79%	0.794	S	S	*	*				179.9	165.6	114.6	-111.7	126.3	0	0	0	113.1
858	S	28	Very low	28.8	Very low	96 Å²	96	144.1 Å²	144.1	67%	0.671	79%	0.794	S	S	*	*			trans	-101	166.1	-152	54.6	0	0	0	0	117.3
859	E	27	Very low	28.9	Very low	173 Å²	173	142.6 Å²	142.6	81%	0.808	79%	0.79	S	S	*	*			trans	-23.8	143.8	161.5	-56.3	165.5	129.3	0	0	117.1
860	F	24.9	Very low	29	Very low	213 Å²	213	145.4 Å²	145.4	93%	0.934	80%	0.8	S	S	*	*				-164.6	150.8	116.5	-114.1	-77	0	0	0	112.1
861	Q	28.9	Very low	28.8	Very low	187 Å²	187	143 Å²	143	87%	0.874	80%	0.796	S	S	*	*			trans	-119.4	121.1	-171.6	176.3	-179.6	0	0	0	110.6
862	A	27	Very low	28.8	Very low	95 Å²	95	147.5 Å²	147.5	79%	0.785	82%	0.823	S	S	*	*			trans	-165.7	163.4	170.2	0	0	0	0	0	110.3
863	P	34.4	Very low	28.7	Very low	124 Å²	124	148.3 Å²	148.3	81%	0.805	83%	0.828	S	S	*	*				-121.2	165.8	-84.2	34.4	-20.1	0	0	0	113.5
864	L	31.1	Very low	28.6	Very low	173 Å²	173	147.5 Å²	147.5	91%	0.906	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-63.7	131.3	168.1	-70.9	161.4	0	0	0	110.1
865	A	27.7	Very low	28.6	Very low	87 Å²	87	146.1 Å²	146.1	72%	0.719	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-73.1	137.9	168	0	0	0	0	0	109.7
866	P	29.6	Very low	28.6	Very low	127 Å²	127	147.3 Å²	147.3	83%	0.825	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-70	133.9	175.3	29.4	-33.3	0	0	0	110.3	E868	P866-E868 PolarHBondContact O-N 3.27Å
867	C	28.3	Very low	28.7	Very low	130 Å²	130	150.5 Å²	150.5	88%	0.878	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-69.7	122.5	168.3	-63.7	0	0	0	0	109.1
868	E	26.3	Very low	28.9	Very low	191 Å²	191	149.5 Å²	149.5	89%	0.893	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-79.4	127.1	-179.8	-145.3	168.9	-166.8	0	0	109.9	P866 S870	P866-E868 PolarHBondContact O-N 3.27Å; E868-S870 PolarHBondContact O-N 2.63Å
869	E	31.2	Very low	29	Very low	182 Å²	182	153.3 Å²	153.3	85%	0.85	86%	0.862	S	S	*	*			trans	-71.7	96.1	177.7	-74.1	-176.6	125.1	0	0	111.1	S871	E869-S871 VanDerWaalsContact C-N 3.31Å; E869-S871 PolarHBondContact O-N 3.12Å
870	S	28.4	Very low	29.1	Very low	121 Å²	121	151.8 Å²	151.8	85%	0.846	87%	0.867	S	S	*	*			trans	-77	81.9	167.1	64.3	0	0	0	0	110.9	E868 I872	E868-S870 PolarHBondContact O-N 2.63Å; S870-I872 PolarHBondContact O-N 3.18Å
871	S	28.4	Very low	29.5	Very low	102 Å²	102	146.7 Å²	146.7	71%	0.713	86%	0.861	S	S	*	*			trans	-82.1	98.7	168.9	-65.5	0	0	0	0	111.3	E869	E869-S871 VanDerWaalsContact C-N 3.31Å; E869-S871 PolarHBondContact O-N 3.12Å
872	I	32.4	Very low	29.5	Very low	241 Å²	241	143 Å²	143	100%	1.236	86%	0.86	S	S	*	*			trans	-141.4	0	158.6	-57.6	-175.5	0	0	0	108.7	S870	S870-I872 PolarHBondContact O-N 3.18Å

Retrieved 872 of 872 residues in 390 ms (Link to these results)

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