A0A077Z117_TRITR Loading...

MRH domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z117, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 995 aa.

						>A0A077Z117_TRITR|A0A077Z117
MAHHVENLLHLLFRVIICIALLKLIEAALRECEEKDFHFEYTECDKQGGRWRVAVPQPDQCVGGHPPPPVRGRDCSFSCRPGTFLDLSSQECKPCLPGTYSLGGGVRYDEFPTGKHLPQGFRVVNEVISLASLQAGIPAGDIEGNIDQSSTNCEGTGWQIRANTLTYIPGTCLSTLMYSVKLVRPGYVKYKYLYPDGGIFFAFQVQNDQCISVNDANLGKHMFPPTTTEAAWREEKATNVMLTSGQLLLSWKAMVLHGQHKPIKIKGIEIRGVAYAQECSPCPNGTYSQGNSGYCQPCPSNTYSGMKASKCLPCDNRTQFSGIQASKCEQRPPCTVSDYYSLHGPCNWNRKSIIEYRWTEPKICRDDIKGAVALPLALPNVDCPPCNPGTYMLNGHCHICPGGHYSSGIGEDAFGAECKRCPANTAPDRGYNFVWWNEMPDKIASSCQTMDEGSCDVHEGWLPLGDRISTSRSRRSDLYLTLSLRVLGYKSTSLASMMTSAGAVGTISFVFDTTCVGDCGFYFIEVDRVSSTGKPTILSEWNGTLPKQAMKYPVMNANGTIYQWVFIRSQITEDVSTDQASIYVINVTNTVDGGAAGCIPCPMNMETLECIPCPSGHYIQNITGNCVQCPKDTFLKGLPSEGMKACAKCGLNTQSNDGTECTASCHLKMNNATFDLRPLKGFIQAKGVEIFSREGSSYFHLFNVSICQSSKAVCNDTMSQRNQGATLPVSSAVCRVTSLPTANETLFVNPLGPRGSMQVAISAFPKSINCFASGQLPQIYFLYESFAISRTCSGGYHTMIIFRCDPAVKVSRATLPSTCPDGTCDGCLYQIVITSRYACPICSQQDYKEIVGECVGGIQKIHRIPARHCILIGKDLTETRMVECSEISVQMQATIGAATAIGAVLFILVLLIWKKNQRLEYKYMKLVENSTGKDDNLSAAESCALNEGEEDTSGPMVDKIVFLKTKPKMRSEKRRREEWDSYENVALAPSNEGNF
					

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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	53.2	Low	70.6	Confident	214 Å²	214	125.5 Å²	125.5	100%	1.054	65%	0.653	S	S	*	*				0	-46.2	0	-85.5	-169.9	-97.8	0	0	113.1	H3 H4	M1-H3 PolarHBondContact O-N 3.17Å; M1-H4 PolarHBondContact O-N 2.83Å; M1-H4 VanDerWaalsContact O-N 3.13Å
2	A	63.2	Low	71.4	Confident	84 Å²	84	123.4 Å²	123.4	69%	0.694	64%	0.643	S	S	*	*	H	α-helix	trans	-54.5	-42.1	179.6	0	0	0	0	0	114.7	H4 V5 E6	A2-H4 VanDerWaalsContact C-N 3.29Å; A2-H4 PolarHBondContact O-N 2.8Å; A2-V5 PolarHBondContact O-N 3.48Å; A2-E6 PolarHBondContact O-N 3.49Å
3	H	62	Low	72.2	Confident	145 Å²	145	124.3 Å²	124.3	67%	0.671	64%	0.639	S	S	*	*	H	α-helix	trans	-65	-25	178.9	-106	-38.7	0	0	0	115.2	M1 E6 N7	M1-H3 PolarHBondContact O-N 3.17Å; H3-E6 IonicContact ND1-OE2 2.67Å; H3-N7 PolarHBondContact O-N 3.28Å
4	H	64.1	Low	72.8	Confident	155 Å²	155	128.4 Å²	128.4	72%	0.718	64%	0.642	S	S	*	*	H	α-helix	trans	-77.3	-27.1	177.3	-92.5	-62.5	0	0	0	112.5	M1 A2 L8	M1-H4 PolarHBondContact O-N 2.83Å; M1-H4 VanDerWaalsContact O-N 3.13Å; A2-H4 VanDerWaalsContact C-N 3.29Å; A2-H4 PolarHBondContact O-N 2.8Å; H4-L8 PolarHBondContact O-N 3.32Å
5	V	73.3	Confident	73.3	Confident	91 Å²	91	124.9 Å²	124.9	55%	0.552	63%	0.63	S	S	*	*	H	α-helix	trans	-75	-39.3	178.6	-177.6	0	0	0	0	110.8	A2 L8 L9	A2-V5 PolarHBondContact O-N 3.48Å; V5-L8 PolarHBondContact O-N 3.32Å; V5-L9 HydrophobicContact CG1-CD1 4.36Å; V5-L9 PolarHBondContact O-N 2.87Å; V5-L9 VanDerWaalsContact O-N 3.08Å
6	E	73.8	Confident	73.8	Confident	116 Å²	116	123.6 Å²	123.6	54%	0.542	62%	0.624	S	S	.	*	H	α-helix	trans	-61.8	-43.3	176.1	-113.5	178.7	170	0	0	112.6	A2 H3 L8 L9 H10	A2-E6 PolarHBondContact O-N 3.49Å; H3-E6 IonicContact ND1-OE2 2.67Å; E6-L8 VanDerWaalsContact C-N 3.33Å; E6-L8 PolarHBondContact O-N 3.31Å; E6-L9 PolarHBondContact O-N 2.99Å; E6-H10 PolarHBondContact O-N 3.49Å
7	N	73.8	Confident	74.2	Confident	108 Å²	108	120.9 Å²	120.9	58%	0.578	61%	0.61	S	S	*	*	H	α-helix	trans	-66.3	-34.6	178.1	-84	-14	0	0	0	112.6	H3 L11	H3-N7 PolarHBondContact O-N 3.28Å; N7-L11 PolarHBondContact O-N 2.95Å
8	L	76.7	Confident	74.2	Confident	115 Å²	115	118.2 Å²	118.2	60%	0.602	60%	0.604	S	S	*	*	H	α-helix	trans	-69.4	-39.4	176.4	-154.9	82.9	0	0	0	111.5	H4 V5 E6 L11 L12	H4-L8 PolarHBondContact O-N 3.32Å; V5-L8 PolarHBondContact O-N 3.32Å; E6-L8 VanDerWaalsContact C-N 3.33Å; E6-L8 PolarHBondContact O-N 3.31Å; L8-L11 PolarHBondContact O-N 2.77Å; L8-L12 PolarHBondContact O-N 2.83Å
9	L	78	Confident	74.1	Confident	117 Å²	117	116.9 Å²	116.9	61%	0.613	60%	0.597	S	S	*	*	H	α-helix	trans	-65.4	-41.8	176.2	-117.4	116.5	0	0	0	111.9	V5 E6 L11 L12 F13	V5-L9 HydrophobicContact CG1-CD1 4.36Å; V5-L9 PolarHBondContact O-N 2.87Å; V5-L9 VanDerWaalsContact O-N 3.08Å; E6-L9 PolarHBondContact O-N 2.99Å; L9-L11 VanDerWaalsContact C-N 3.34Å; L9-L11 PolarHBondContact O-N 3.15Å; L9-L12 PolarHBondContact O-N 3.39Å; L9-F13 WeakPolarHBondContact O-CB 3.36Å; L9-F13 PolarHBondContact O-N 2.7Å
10	H	78.4	Confident	73.8	Confident	119 Å²	119	113.4 Å²	113.4	55%	0.551	59%	0.587	S	S	*	*	H	α-helix	trans	-64.7	-36.6	174.8	-93.1	-51.4	0	0	0	112.8	E6 R14	E6-H10 PolarHBondContact O-N 3.49Å; H10-R14 WeakPolarHBondContact O-CG 3.48Å; H10-R14 PolarHBondContact O-N 3.28Å
11	L	79.9	Confident	73.5	Confident	116 Å²	116	112.6 Å²	112.6	61%	0.607	58%	0.583	S	S	*	*	H	α-helix	trans	-66.6	-45	176.5	-149.3	92.9	0	0	0	111.2	N7 L8 L9 F13 R14 V15	N7-L11 PolarHBondContact O-N 2.95Å; L8-L11 PolarHBondContact O-N 2.77Å; L9-L11 VanDerWaalsContact C-N 3.34Å; L9-L11 PolarHBondContact O-N 3.15Å; L11-F13 PolarHBondContact O-N 2.69Å; L11-R14 PolarHBondContact O-N 3.35Å; L11-V15 WeakPolarHBondContact O-CG2 3.12Å; L11-V15 PolarHBondContact O-N 3.45Å
12	L	80.4	Confident	74	Confident	101 Å²	101	108.9 Å²	108.9	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-61	-42.7	175.8	-84	159.8	0	0	0	112	L8 L9 R14 V15 I16	L8-L12 PolarHBondContact O-N 2.83Å; L9-L12 PolarHBondContact O-N 3.39Å; L12-R14 PolarHBondContact O-N 2.98Å; L12-V15 PolarHBondContact O-N 2.84Å; L12-I16 VanDerWaalsContact O-CG1 3.3Å; L12-I16 WeakPolarHBondContact O-CG1 3.42Å; L12-I16 PolarHBondContact O-N 3.36Å
13	F	82	Confident	73.7	Confident	135 Å²	135	112.9 Å²	112.9	59%	0.592	57%	0.568	S	S	*	*	H	α-helix	trans	-64.8	-39.7	178.2	-154.9	-103.5	0	0	0	112	L9 L11 I16 I17	L9-F13 WeakPolarHBondContact O-CB 3.36Å; L9-F13 PolarHBondContact O-N 2.7Å; L11-F13 PolarHBondContact O-N 2.69Å; F13-I16 PolarHBondContact O-N 2.8Å; F13-I17 HydrophobicContact CD1-CD1 3.48Å; F13-I17 VanDerWaalsContact CD1-CD1 3.48Å; F13-I17 HydrophobicContact CD1-CG1 4.3Å; F13-I17 HydrophobicContact CE1-CD1 3.5Å; F13-I17 VanDerWaalsContact CE1-CD1 3.5Å; F13-I17 HydrophobicContact CE1-CG1 4.31Å; F13-I17 WeakPolarHBondContact O-CG1 3.47Å; F13-I17 PolarHBondContact O-N 3.32Å
14	R	80.2	Confident	73.3	Confident	182 Å²	182	112.4 Å²	112.4	69%	0.687	57%	0.57	S	S	*	*	H	α-helix	trans	-65	-39.6	174	-75.7	-177	179.4	-168.6	1.1	112.4	H10 L11 L12 I17 C18	H10-R14 WeakPolarHBondContact O-CG 3.48Å; H10-R14 PolarHBondContact O-N 3.28Å; L11-R14 PolarHBondContact O-N 3.35Å; L12-R14 PolarHBondContact O-N 2.98Å; R14-I17 PolarHBondContact O-N 3.29Å; R14-C18 WeakPolarHBondContact O-CB 3.36Å; R14-C18 PolarHBondContact O-N 3.48Å
15	V	81.3	Confident	72.8	Confident	75 Å²	75	111.6 Å²	111.6	46%	0.455	57%	0.569	S	S	.	*	H	α-helix	trans	-65.6	-42.1	176.4	172.6	0	0	0	0	110.9	L11 L12 C18 I19	L11-V15 WeakPolarHBondContact O-CG2 3.12Å; L11-V15 PolarHBondContact O-N 3.45Å; L12-V15 PolarHBondContact O-N 2.84Å; V15-C18 PolarHBondContact O-N 3.22Å; V15-I19 HydrophobicContact CG1-CD1 3.8Å; V15-I19 HydrophobicContact CG1-CG1 4.44Å; V15-I19 VanDerWaalsContact O-CG1 3.27Å; V15-I19 WeakPolarHBondContact O-CG1 3.13Å; V15-I19 PolarHBondContact O-N 2.74Å
16	I	80	Confident	71.7	Confident	105 Å²	105	115.6 Å²	115.6	54%	0.538	58%	0.582	S	S	.	*	H	α-helix	trans	-64.5	-42.7	177	-66.2	165.2	0	0	0	111.1	L12 F13 I19 A20	L12-I16 VanDerWaalsContact O-CG1 3.3Å; L12-I16 WeakPolarHBondContact O-CG1 3.42Å; L12-I16 PolarHBondContact O-N 3.36Å; F13-I16 PolarHBondContact O-N 2.8Å; I16-I19 PolarHBondContact O-N 3.3Å; I16-A20 WeakPolarHBondContact O-CB 3.41Å; I16-A20 PolarHBondContact O-N 2.82Å
17	I	80.6	Confident	70.9	Confident	77 Å²	77	114 Å²	114	40%	0.395	59%	0.588	S	S	.	*	H	α-helix	trans	-63.2	-42.5	175.1	-71.6	168.7	0	0	0	111	F13 R14 I19 A20 L21	F13-I17 HydrophobicContact CD1-CD1 3.48Å; F13-I17 VanDerWaalsContact CD1-CD1 3.48Å; F13-I17 HydrophobicContact CD1-CG1 4.3Å; F13-I17 HydrophobicContact CE1-CD1 3.5Å; F13-I17 VanDerWaalsContact CE1-CD1 3.5Å; F13-I17 HydrophobicContact CE1-CG1 4.31Å; F13-I17 WeakPolarHBondContact O-CG1 3.47Å; F13-I17 PolarHBondContact O-N 3.32Å; R14-I17 PolarHBondContact O-N 3.29Å; I17-I19 PolarHBondContact O-N 3.28Å; I17-A20 PolarHBondContact O-N 2.76Å; I17-L21 HydrophobicContact CG2-CD1 3.61Å; I17-L21 HydrophobicContact CG2-CG 4.4Å; I17-L21 WeakPolarHBondContact O-CB 3.42Å; I17-L21 WeakPolarHBondContact O-CG 3.25Å; I17-L21 PolarHBondContact O-N 2.68Å
18	C	74.6	Confident	70.3	Confident	72 Å²	72	113.4 Å²	113.4	49%	0.486	60%	0.599	S	S	.	*	H	α-helix	trans	-62.5	-41.2	175.1	-82.3	0	0	0	0	112	R14 V15 L21 L22	R14-C18 WeakPolarHBondContact O-CB 3.36Å; R14-C18 PolarHBondContact O-N 3.48Å; V15-C18 PolarHBondContact O-N 3.22Å; C18-L21 PolarHBondContact O-N 2.77Å; C18-L22 VanDerWaalsContact O-CB 3.32Å; C18-L22 WeakPolarHBondContact O-CB 3.38Å; C18-L22 WeakPolarHBondContact O-CD1 3.43Å; C18-L22 PolarHBondContact O-N 2.63Å
19	I	72.7	Confident	70.1	Confident	94 Å²	94	111.2 Å²	111.2	48%	0.482	59%	0.588	S	S	.	*	H	α-helix	trans	-66.6	-38.6	176.2	-65.8	165.3	0	0	0	110.8	V15 I16 I17 L22 K23	V15-I19 HydrophobicContact CG1-CD1 3.8Å; V15-I19 HydrophobicContact CG1-CG1 4.44Å; V15-I19 VanDerWaalsContact O-CG1 3.27Å; V15-I19 WeakPolarHBondContact O-CG1 3.13Å; V15-I19 PolarHBondContact O-N 2.74Å; I16-I19 PolarHBondContact O-N 3.3Å; I17-I19 PolarHBondContact O-N 3.28Å; I19-L22 PolarHBondContact O-N 3.35Å; I19-K23 PolarHBondContact O-N 3.27Å
20	A	68.5	Low	70.3	Confident	47 Å²	47	110.9 Å²	110.9	39%	0.388	58%	0.578	S	S	.	*	H	α-helix	trans	-66.5	-42.3	175.7	0	0	0	0	0	111.9	I16 I17 K23 L24	I16-A20 WeakPolarHBondContact O-CB 3.41Å; I16-A20 PolarHBondContact O-N 2.82Å; I17-A20 PolarHBondContact O-N 2.76Å; A20-K23 PolarHBondContact O-N 2.89Å; A20-L24 WeakPolarHBondContact O-CB 3.27Å; A20-L24 WeakPolarHBondContact O-CD1 3.49Å; A20-L24 PolarHBondContact O-N 3.44Å
21	L	66.6	Low	70.3	Confident	97 Å²	97	111.2 Å²	111.2	51%	0.508	58%	0.58	S	S	.	*	H	α-helix	trans	-66.6	-38.8	175.3	-80.4	160.6	0	0	0	112.1	I17 C18 K23 L24 I25	I17-L21 HydrophobicContact CG2-CD1 3.61Å; I17-L21 HydrophobicContact CG2-CG 4.4Å; I17-L21 WeakPolarHBondContact O-CB 3.42Å; I17-L21 WeakPolarHBondContact O-CG 3.25Å; I17-L21 PolarHBondContact O-N 2.68Å; C18-L21 PolarHBondContact O-N 2.77Å; L21-K23 VanDerWaalsContact C-N 3.27Å; L21-K23 PolarHBondContact O-N 3.38Å; L21-L24 PolarHBondContact O-N 3Å; L21-L24 VanDerWaalsContact O-N 3.14Å; L21-I25 WeakPolarHBondContact O-CG1 3.16Å; L21-I25 PolarHBondContact O-N 3.38Å
22	L	64.2	Low	70.4	Confident	136 Å²	136	106.2 Å²	106.2	71%	0.712	56%	0.555	S	S	*	*	H	α-helix	trans	-64	-31.6	172.8	-88.2	151.7	0	0	0	112.2	C18 I19	C18-L22 VanDerWaalsContact O-CB 3.32Å; C18-L22 WeakPolarHBondContact O-CB 3.38Å; C18-L22 WeakPolarHBondContact O-CD1 3.43Å; C18-L22 PolarHBondContact O-N 2.63Å; I19-L22 PolarHBondContact O-N 3.35Å
23	K	56.5	Low	70.4	Confident	167 Å²	167	106.2 Å²	106.2	73%	0.726	55%	0.552	S	S	*	*	H	α-helix	trans	-78.9	-20.9	172.2	-74.8	-167.1	175.1	-168.7	0	114.2	I19 A20 L21	I19-K23 PolarHBondContact O-N 3.27Å; A20-K23 PolarHBondContact O-N 2.89Å; L21-K23 VanDerWaalsContact C-N 3.27Å; L21-K23 PolarHBondContact O-N 3.38Å
24	L	54.8	Low	70.2	Confident	136 Å²	136	107.2 Å²	107.2	71%	0.712	56%	0.558	S	S	*	*	H	α-helix	trans	-90.4	-8.4	-178.8	-102.7	132.3	0	0	0	114.1	A20 L21	A20-L24 WeakPolarHBondContact O-CB 3.27Å; A20-L24 WeakPolarHBondContact O-CD1 3.49Å; A20-L24 PolarHBondContact O-N 3.44Å; L21-L24 PolarHBondContact O-N 3Å; L21-L24 VanDerWaalsContact O-N 3.14Å
25	I	53.6	Low	70.2	Confident	137 Å²	137	105.9 Å²	105.9	70%	0.703	56%	0.557	S	S	*	*			trans	-90.2	1.1	178.7	-65.3	165.5	0	0	0	112.6	L21 A27	L21-I25 WeakPolarHBondContact O-CG1 3.16Å; L21-I25 PolarHBondContact O-N 3.38Å; I25-A27 PolarHBondContact O-N 2.99Å
26	E	48.8	Very low	70.3	Confident	176 Å²	176	102.8 Å²	102.8	82%	0.822	54%	0.539	S	S	*	.			trans	-73.5	77.4	154.9	-82.1	179.9	170.8	0	0	108.8	A28	E26-A28 PolarHBondContact O-N 2.89Å
27	A	57.2	Low	70.4	Confident	81 Å²	81	99 Å²	99	67%	0.669	52%	0.518	S	S	*	.			trans	-61.5	99.3	166	0	0	0	0	0	108	I25 L29	I25-A27 PolarHBondContact O-N 2.99Å; A27-L29 PolarHBondContact O-N 2.9Å; A27-L29 VanDerWaalsContact O-N 3.09Å
28	A	62.5	Low	70.5	Confident	97 Å²	97	98.5 Å²	98.5	80%	0.802	51%	0.514	S	S	*	.			trans	-62.5	109.3	173.6	0	0	0	0	0	108.9	E26	E26-A28 PolarHBondContact O-N 2.89Å
29	L	71.3	Confident	71.1	Confident	69 Å²	69	97.2 Å²	97.2	36%	0.361	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-59.9	157.3	170.3	-74.8	84.1	0	0	0	109.9	A27 D59 V62	A27-L29 PolarHBondContact O-N 2.9Å; A27-L29 VanDerWaalsContact O-N 3.09Å; L29-D59 WeakPolarHBondContact CD2-O 3.33Å; L29-V62 HydrophobicContact CB-CB 4.16Å; L29-V62 HydrophobicContact CB-CG1 3.85Å; L29-V62 HydrophobicContact CB-CG2 3.6Å; L29-V62 HydrophobicContact CD1-CG1 4.02Å; L29-V62 HydrophobicContact CD2-CG1 4.23Å; L29-V62 HydrophobicContact CG-CG1 4.26Å; L29-V62 VanDerWaalsContact O-CG2 3.3Å; L29-V62 WeakPolarHBondContact O-CG2 3.44Å
30	R	82	Confident	71.6	Confident	109 Å²	109	96.9 Å²	96.9	41%	0.411	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-63.6	157.7	174.5	71.1	178.2	178.4	103.4	0.5	111.7	D36 C61 V62	R30-D36 IonicContact CZ-OD1 2.78Å; R30-D36 IonicContact CZ-OD2 3.11Å; R30-D36 VanDerWaalsContact CZ-OD2 3.28Å; R30-D36 IonicContact NH1-OD1 3.47Å; R30-D36 IonicContact NH1-OD2 3.68Å; R30-D36 PolarHBondContact NH1-OD2 2.86Å; R30-D36 IonicContact NH2-OD1 3.67Å; R30-D36 PolarHBondContact NH2-OD1 2.85Å; R30-D36 IonicContact NH2-OD2 2.72Å; R30-D36 PolarHBondContact NH2-OD2 3.28Å; R30-D36 VanDerWaalsContact NH2-OD2 3.11Å; R30-C61 HydrophobicContact CG-CB 4.05Å; R30-C61 CarbonylContact O-C 3.58Å; R30-C61 WeakPolarHBondContact O-CA 3.44Å; R30-C61 WeakPolarHBondContact O-CB 3.37Å; R30-V62 PolarHBondContact O-N 2.89Å
31	E	79.1	Confident	72.4	Confident	127 Å²	127	95.8 Å²	95.8	59%	0.593	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-69.9	140.5	172.2	-161.5	167.2	-169.4	0	0	111.5	V62 G64	E31-V62 WeakPolarHBondContact CA-O 3.27Å; E31-G64 VanDerWaalsContact CG-CA 3.47Å; E31-G64 WeakPolarHBondContact OE1-CA 3.35Å; E31-G64 PolarHBondContact OE1-N 2.87Å
32	C	81.3	Confident	73.3	Confident	11 Å²	11	93.7 Å²	93.7	7%	0.074	47%	0.474	C	S	.	.	B	Isolated β-bridge	trans	-74.6	131.6	-177.9	-61.7	0	0	0	0	112.1	D36 F37 C61 G63	C32-D36 HydrophobicContact CB-CB 4.41Å; C32-F37 HydrophobicContact CB-CE1 4.16Å; C32-F37 HydrophobicContact CB-CE2 3.54Å; C32-F37 HydrophobicContact CB-CZ 3.33Å; C32-C61 WeakPolarHBondContact CA-SG 3.3Å; C32-C61 HydrophobicContact CB-CB 3.82Å; C32-C61 WeakPolarHBondContact CB-SG 3.12Å; C32-C61 VanDerWaalsContact SG-C 3.58Å; C32-C61 WeakPolarHBondContact SG-CB 3.35Å; C32-C61 CovalentContact SG-SG 2.02Å; C32-C61 PolarHBondContact SG-SG 3Å; C32-G63 VanDerWaalsContact CB-O 3.26Å; C32-G63 WeakPolarHBondContact CB-O 3.4Å; C32-G63 PolarHBondContact N-O 3.38Å; C32-G63 PolarHBondContact SG-O 2.9Å
33	E	81.3	Confident	74	Confident	100 Å²	100	94.6 Å²	94.6	47%	0.467	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-91.7	163.7	170.1	-66.8	-179.1	-172.1	0	0	111.3	K35 D36 F37	E33-K35 HydrophobicContact CB-CG 4.3Å; E33-K35 PolarHBondContact O-N 3.34Å; E33-K35 WeakPolarHBondContact OE2-CE 3.11Å; E33-K35 IonicContact OE2-NZ 2.72Å; E33-K35 PolarHBondContact OE2-NZ 2.88Å; E33-D36 PolarHBondContact N-OD2 3.46Å; E33-D36 WeakPolarHBondContact O-CB 3.48Å; E33-D36 PolarHBondContact O-N 3.34Å; E33-F37 WeakPolarHBondContact O-CD2 3.44Å; E33-F37 WeakPolarHBondContact O-CE2 3.41Å
34	E	77.9	Confident	75.1	Confident	156 Å²	156	89.4 Å²	89.4	73%	0.729	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-52.8	-33.6	-178.3	-168.6	174.1	-171	0	0	113.7	D36 F37	E34-D36 VanDerWaalsContact C-N 3.3Å; E34-D36 PolarHBondContact O-N 3.37Å; E34-F37 PolarHBondContact O-N 3.43Å
35	K	79.8	Confident	76.4	Confident	154 Å²	154	85.1 Å²	85.1	67%	0.67	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-73.2	-17.6	177.9	73.2	-166.2	-173.6	-152.7	0	114.6	E33 F37	E33-K35 HydrophobicContact CB-CG 4.3Å; E33-K35 PolarHBondContact O-N 3.34Å; E33-K35 WeakPolarHBondContact OE2-CE 3.11Å; E33-K35 IonicContact OE2-NZ 2.72Å; E33-K35 PolarHBondContact OE2-NZ 2.88Å; K35-F37 VanDerWaalsContact C-N 3.25Å
36	D	82.4	Confident	77.5	Confident	11 Å²	11	88.8 Å²	88.8	6%	0.059	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-84.3	-6.4	179.1	-58.3	-46.5	0	0	0	111.7	R30 C32 E33 E34 Q57	R30-D36 IonicContact CZ-OD1 2.78Å; R30-D36 IonicContact CZ-OD2 3.11Å; R30-D36 VanDerWaalsContact CZ-OD2 3.28Å; R30-D36 IonicContact NH1-OD1 3.47Å; R30-D36 IonicContact NH1-OD2 3.68Å; R30-D36 PolarHBondContact NH1-OD2 2.86Å; R30-D36 IonicContact NH2-OD1 3.67Å; R30-D36 PolarHBondContact NH2-OD1 2.85Å; R30-D36 IonicContact NH2-OD2 2.72Å; R30-D36 PolarHBondContact NH2-OD2 3.28Å; R30-D36 VanDerWaalsContact NH2-OD2 3.11Å; C32-D36 HydrophobicContact CB-CB 4.41Å; E33-D36 PolarHBondContact N-OD2 3.46Å; E33-D36 WeakPolarHBondContact O-CB 3.48Å; E33-D36 PolarHBondContact O-N 3.34Å; E34-D36 VanDerWaalsContact C-N 3.3Å; E34-D36 PolarHBondContact O-N 3.37Å; D36-Q57 PolarHBondContact O-N 3.44Å
37	F	82.9	Confident	79	Confident	26 Å²	26	87.7 Å²	87.7	11%	0.114	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	137.1	176.6	-61.3	-83.6	0	0	0	111.4	C32 E33 E34 K35 A54 V55 P56 P66	C32-F37 HydrophobicContact CB-CE1 4.16Å; C32-F37 HydrophobicContact CB-CE2 3.54Å; C32-F37 HydrophobicContact CB-CZ 3.33Å; E33-F37 WeakPolarHBondContact O-CD2 3.44Å; E33-F37 WeakPolarHBondContact O-CE2 3.41Å; E34-F37 PolarHBondContact O-N 3.43Å; K35-F37 VanDerWaalsContact C-N 3.25Å; F37-A54 HydrophobicContact CB-CB 3.95Å; F37-A54 HydrophobicContact CD1-CB 4.01Å; F37-A54 HydrophobicContact CG-CB 4.13Å; F37-V55 WeakPolarHBondContact CA-O 3.36Å; F37-P56 HydrophobicContact CD1-CB 3.9Å; F37-P56 HydrophobicContact CD1-CG 4.35Å; F37-P56 HydrophobicContact CE1-CB 3.77Å; F37-P56 HydrophobicContact CE1-CG 4.03Å; F37-P66 HydrophobicContact CD1-CB 4.15Å; F37-P66 HydrophobicContact CE1-CB 3.71Å; F37-P66 HydrophobicContact CE1-CG 4.38Å; F37-P66 HydrophobicContact CE2-CB 4.46Å; F37-P66 HydrophobicContact CZ-CB 3.87Å; F37-P66 HydrophobicContact CZ-CG 4.44Å
38	H	82.8	Confident	79.9	Confident	65 Å²	65	84.9 Å²	84.9	30%	0.301	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	154.9	161.6	65.2	-81	0	0	0	110	E40 A54 V55	H38-E40 IonicContact CD2-OE1 3.73Å; H38-E40 PolarHBondContact CD2-OE1 2.84Å; H38-E40 IonicContact CE1-OE1 2.72Å; H38-E40 IonicContact NE2-OE1 3.58Å; H38-E40 PolarHBondContact NE2-OE1 3.49Å; H38-A54 WeakPolarHBondContact O-CA 3.38Å; H38-V55 PolarHBondContact CE1-O 3.34Å; H38-V55 PolarHBondContact N-O 2.91Å; H38-V55 PolarHBondContact ND1-O 3.43Å; H38-V55 VanDerWaalsContact ND1-O 3.13Å; H38-V55 PolarHBondContact O-N 2.94Å
39	F	86	Confident	80.9	Confident	45 Å²	45	80.5 Å²	80.5	20%	0.197	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	133.9	177.4	-69.2	-68.2	0	0	0	110.6	R52 V53 A54 P67 L87	F39-R52 HydrophobicContact CB-CG 4.13Å; F39-R52 HydrophobicContact CD1-CG 3.95Å; F39-R52 VanDerWaalsContact CE1-CZ 3.46Å; F39-R52 VanDerWaalsContact CE2-NH1 3.34Å; F39-R52 HydrophobicContact CG-CG 4.3Å; F39-V53 WeakPolarHBondContact CA-O 3.11Å; F39-A54 HydrophobicContact CD1-CB 4.29Å; F39-A54 HydrophobicContact CE1-CB 4.03Å; F39-P67 HydrophobicContact CE1-CG 3.84Å; F39-P67 HydrophobicContact CZ-CG 3.95Å; F39-L87 HydrophobicContact CB-CB 3.88Å; F39-L87 WeakPolarHBondContact O-CD1 3.33Å
40	E	84.5	Confident	81.6	Confident	87 Å²	87	77.8 Å²	77.8	41%	0.407	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	158.3	168.5	-65.4	-169.2	178	0	0	110.1	H38 R52 V53 V55	H38-E40 IonicContact CD2-OE1 3.73Å; H38-E40 PolarHBondContact CD2-OE1 2.84Å; H38-E40 IonicContact CE1-OE1 2.72Å; H38-E40 IonicContact NE2-OE1 3.58Å; H38-E40 PolarHBondContact NE2-OE1 3.49Å; E40-R52 CarbonylContact O-C 3.56Å; E40-R52 WeakPolarHBondContact O-CA 3.49Å; E40-V53 PolarHBondContact N-O 3.4Å; E40-V53 PolarHBondContact O-N 3.44Å; E40-V55 HydrophobicContact CB-CG2 4.07Å; E40-V55 HydrophobicContact CG-CG2 4.13Å
41	Y	85.4	Confident	81.9	Confident	24 Å²	24	78.1 Å²	78.1	9%	0.094	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	138	166.2	-77.6	-46.5	0	0	0	110.3	R50 W51 R52 G72 R73 L85 L87 Q90 Y275	Y41-R50 HydrophobicContact CD1-CG 4.14Å; Y41-R50 HydrophobicContact CG-CG 4.24Å; Y41-W51 CarbonylContact C-O 3.45Å; Y41-W51 VanDerWaalsContact CA-O 3.31Å; Y41-W51 WeakPolarHBondContact CA-O 3.25Å; Y41-R52 HydrophobicContact CD1-CB 3.91Å; Y41-R52 HydrophobicContact CD1-CG 4.38Å; Y41-R52 HydrophobicContact CE1-CB 3.77Å; Y41-R52 HydrophobicContact CE1-CG 4.22Å; Y41-G72 VanDerWaalsContact CE1-CA 3.41Å; Y41-R73 PolarHBondContact OH-N 2.01Å; Y41-L85 HydrophobicContact CE2-CD2 3.77Å; Y41-L87 HydrophobicContact CD2-CD2 3.61Å; Y41-L87 HydrophobicContact CE1-CD2 4.47Å; Y41-L87 HydrophobicContact CE2-CD2 3.39Å; Y41-L87 HydrophobicContact CG-CD2 4.26Å; Y41-Q90 PolarHBondContact OH-OE1 2.79Å; Y41-Y275 AromaticContact CD2-CE1 3.89Å; Y41-Y275 HydrophobicContact CD2-CE1 3.89Å; Y41-Y275 AromaticContact CD2-CZ 3.8Å; Y41-Y275 WeakPolarHBondContact CD2-OH 3.27Å; Y41-Y275 HydrophobicContact CE2-CE1 4.28Å
42	T	84.1	Confident	82.3	Confident	53 Å²	53	73.4 Å²	73.4	33%	0.325	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-65.8	171.1	168.3	67.2	0	0	0	0	111.2	W51 V53	T42-W51 HydrophobicContact CG2-CB 3.93Å; T42-W51 PolarHBondContact N-O 2.73Å; T42-W51 PolarHBondContact OG1-N 3.47Å; T42-W51 PolarHBondContact OG1-O 3.46Å; T42-V53 HydrophobicContact CG2-CG1 3.71Å; T42-V53 HydrophobicContact CG2-CG2 4.03Å
43	E	78.9	Confident	82.7	Confident	155 Å²	155	74.6 Å²	74.6	72%	0.724	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-59.2	159.6	165.6	-58	-159.6	137.1	0	0	112.3
44	C	80.2	Confident	82.9	Confident	58 Å²	58	70.6 Å²	70.6	39%	0.392	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-73.4	132.1	178.8	-59.8	0	0	0	0	111	G49 C75	C44-G49 CarbonylContact C-O 3.59Å; C44-G49 VanDerWaalsContact CA-O 3.32Å; C44-G49 WeakPolarHBondContact CA-O 3.43Å; C44-C75 VanDerWaalsContact CA-SG 3.53Å; C44-C75 HydrophobicContact CB-CB 4.01Å; C44-C75 WeakPolarHBondContact CB-SG 3.26Å; C44-C75 WeakPolarHBondContact SG-CB 3.47Å; C44-C75 CovalentContact SG-SG 2Å; C44-C75 PolarHBondContact SG-SG 3.11Å
45	D	81.5	Confident	83.3	Confident	47 Å²	47	65.2 Å²	65.2	25%	0.251	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-71.5	170.2	165.2	67.2	31.1	0	0	0	111.2	Q47 G48 G49 R71	D45-Q47 PolarHBondContact O-N 2.99Å; D45-Q47 VanDerWaalsContact O-N 3.14Å; D45-Q47 VanDerWaalsContact OD1-C 3.29Å; D45-Q47 WeakPolarHBondContact OD1-CA 3.34Å; D45-Q47 WeakPolarHBondContact OD1-CB 3.3Å; D45-Q47 PolarHBondContact OD1-N 3.31Å; D45-G48 PolarHBondContact O-N 2.88Å; D45-G48 PolarHBondContact OD1-N 2.6Å; D45-G49 VanDerWaalsContact CG-O 3.24Å; D45-G49 PolarHBondContact N-O 3.1Å; D45-G49 PolarHBondContact OD1-N 2.86Å; D45-R71 IonicContact OD1-NH2 3.06Å; D45-R71 IonicContact OD2-CZ 3.8Å; D45-R71 IonicContact OD2-NH1 2.81Å; D45-R71 PolarHBondContact OD2-NH1 3.36Å; D45-R71 IonicContact OD2-NH2 3.27Å; D45-R71 PolarHBondContact OD2-NH2 3Å
46	K	78	Confident	83.4	Confident	213 Å²	213	60.3 Å²	60.3	93%	0.926	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-17.9	-179.8	-66.6	-174.9	179.3	-179	0	113.2
47	Q	79	Confident	83.2	Confident	154 Å²	154	64 Å²	64	72%	0.72	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	4.1	177.3	-62.7	83	8.3	0	0	112.6	D45 G49	D45-Q47 PolarHBondContact O-N 2.99Å; D45-Q47 VanDerWaalsContact O-N 3.14Å; D45-Q47 VanDerWaalsContact OD1-C 3.29Å; D45-Q47 WeakPolarHBondContact OD1-CA 3.34Å; D45-Q47 WeakPolarHBondContact OD1-CB 3.3Å; D45-Q47 PolarHBondContact OD1-N 3.31Å; Q47-G49 VanDerWaalsContact C-N 3.32Å
48	G	76.8	Confident	83	Confident	21 Å²	21	68 Å²	68	22%	0.216	35%	0.346	C	S	.	.	S	Bend	trans	81	6.8	179.9	0	0	0	0	0	114.4	D45 C75	D45-G48 PolarHBondContact O-N 2.88Å; D45-G48 PolarHBondContact OD1-N 2.6Å; G48-C75 WeakPolarHBondContact O-CB 3.34Å; G48-C75 PolarHBondContact O-N 3.14Å; G48-C75 PolarHBondContact O-SG 3.04Å
49	G	83.6	Confident	82.9	Confident	5 Å²	5	72.2 Å²	72.2	5%	0.052	37%	0.371	C	S	.	.			trans	-93.5	168.5	173	0	0	0	0	0	113.1	C44 D45 Q47	C44-G49 CarbonylContact C-O 3.59Å; C44-G49 VanDerWaalsContact CA-O 3.32Å; C44-G49 WeakPolarHBondContact CA-O 3.43Å; D45-G49 VanDerWaalsContact CG-O 3.24Å; D45-G49 PolarHBondContact N-O 3.1Å; D45-G49 PolarHBondContact OD1-N 2.86Å; Q47-G49 VanDerWaalsContact C-N 3.32Å
50	R	86.5	Confident	82.5	Confident	13 Å²	13	74.5 Å²	74.5	5%	0.049	38%	0.382	C	S	.	.			trans	-151.7	167.5	177.8	61.8	-167.9	176.1	179.6	-6.1	109.8	Y41 G72 R73	Y41-R50 HydrophobicContact CD1-CG 4.14Å; Y41-R50 HydrophobicContact CG-CG 4.24Å; R50-G72 WeakPolarHBondContact O-CA 3.17Å; R50-G72 PolarHBondContact O-N 2.94Å; R50-R73 WeakPolarHBondContact CG-O 3.46Å; R50-R73 PolarHBondContact NE-O 2.83Å
51	W	87.8	Confident	82.3	Confident	115 Å²	115	70.8 Å²	70.8	44%	0.436	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	141.6	-179.7	-62.6	89.4	0	0	0	110.1	Y41 T42 V53 P69 R71	Y41-W51 CarbonylContact C-O 3.45Å; Y41-W51 VanDerWaalsContact CA-O 3.31Å; Y41-W51 WeakPolarHBondContact CA-O 3.25Å; T42-W51 HydrophobicContact CG2-CB 3.93Å; T42-W51 PolarHBondContact N-O 2.73Å; T42-W51 PolarHBondContact OG1-N 3.47Å; T42-W51 PolarHBondContact OG1-O 3.46Å; W51-V53 HydrophobicContact CB-CG1 4.46Å; W51-P69 HydrophobicContact CE3-CB 4.26Å; W51-R71 HydrophobicContact CE3-CB 4.46Å; W51-R71 HydrophobicContact CZ3-CB 4.28Å
52	R	88.2	Confident	82	Confident	28 Å²	28	73.3 Å²	73.3	11%	0.106	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	119.7	166.5	-171.1	-173.6	64.8	126	9.6	107.9	F39 E40 Y41 P69 V70 L87	F39-R52 HydrophobicContact CB-CG 4.13Å; F39-R52 HydrophobicContact CD1-CG 3.95Å; F39-R52 VanDerWaalsContact CE1-CZ 3.46Å; F39-R52 VanDerWaalsContact CE2-NH1 3.34Å; F39-R52 HydrophobicContact CG-CG 4.3Å; E40-R52 CarbonylContact O-C 3.56Å; E40-R52 WeakPolarHBondContact O-CA 3.49Å; Y41-R52 HydrophobicContact CD1-CB 3.91Å; Y41-R52 HydrophobicContact CD1-CG 4.38Å; Y41-R52 HydrophobicContact CE1-CB 3.77Å; Y41-R52 HydrophobicContact CE1-CG 4.22Å; R52-P69 VanDerWaalsContact O-CA 3.3Å; R52-P69 WeakPolarHBondContact O-CA 3.49Å; R52-V70 PolarHBondContact N-O 3Å; R52-V70 PolarHBondContact O-N 2.91Å; R52-L87 WeakPolarHBondContact CD-O 3.47Å; R52-L87 PolarHBondContact NH1-O 3.22Å
53	V	88.8	Confident	81.4	Confident	36 Å²	36	73.5 Å²	73.5	22%	0.218	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	146.4	-179	-67.6	0	0	0	0	109.9	F39 E40 T42 W51 V55 P69	F39-V53 WeakPolarHBondContact CA-O 3.11Å; E40-V53 PolarHBondContact N-O 3.4Å; E40-V53 PolarHBondContact O-N 3.44Å; T42-V53 HydrophobicContact CG2-CG1 3.71Å; T42-V53 HydrophobicContact CG2-CG2 4.03Å; W51-V53 HydrophobicContact CB-CG1 4.46Å; V53-V55 HydrophobicContact CG2-CG2 3.95Å; V53-P69 HydrophobicContact CG1-CB 4.09Å; V53-P69 HydrophobicContact CG1-CG 4.29Å
54	A	86.5	Confident	81.2	Confident	16 Å²	16	67 Å²	67	13%	0.132	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	117.7	169.4	0	0	0	0	0	108.3	F37 H38 F39 P66 P67	F37-A54 HydrophobicContact CB-CB 3.95Å; F37-A54 HydrophobicContact CD1-CB 4.01Å; F37-A54 HydrophobicContact CG-CB 4.13Å; H38-A54 WeakPolarHBondContact O-CA 3.38Å; F39-A54 HydrophobicContact CD1-CB 4.29Å; F39-A54 HydrophobicContact CE1-CB 4.03Å; A54-P66 HydrophobicContact CB-CB 3.99Å; A54-P67 HydrophobicContact CB-CG 3.83Å
55	V	84.9	Confident	81	Confident	43 Å²	43	72.9 Å²	72.9	26%	0.261	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	123.5	-179.4	-176.7	0	0	0	0	107.8	F37 H38 E40 V53	F37-V55 WeakPolarHBondContact CA-O 3.36Å; H38-V55 PolarHBondContact CE1-O 3.34Å; H38-V55 PolarHBondContact N-O 2.91Å; H38-V55 PolarHBondContact ND1-O 3.43Å; H38-V55 VanDerWaalsContact ND1-O 3.13Å; H38-V55 PolarHBondContact O-N 2.94Å; E40-V55 HydrophobicContact CB-CG2 4.07Å; E40-V55 HydrophobicContact CG-CG2 4.13Å; V53-V55 HydrophobicContact CG2-CG2 3.95Å
56	P	83.2	Confident	80.9	Confident	52 Å²	52	73.6 Å²	73.6	34%	0.338	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	150.6	173	30	-31.6	0	0	0	110.2	F37	F37-P56 HydrophobicContact CD1-CB 3.9Å; F37-P56 HydrophobicContact CD1-CG 4.35Å; F37-P56 HydrophobicContact CE1-CB 3.77Å; F37-P56 HydrophobicContact CE1-CG 4.03Å
57	Q	78.6	Confident	81	Confident	87 Å²	87	65.1 Å²	65.1	41%	0.407	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-65.9	133.3	172.4	-75.6	164.1	-5.8	0	0	110.4	D36 Q60	D36-Q57 PolarHBondContact O-N 3.44Å; Q57-Q60 HydrophobicContact CB-CB 4.31Å; Q57-Q60 PolarHBondContact O-N 3.02Å
58	P	78.3	Confident	81.2	Confident	110 Å²	110	62.5 Å²	62.5	71%	0.714	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	143.4	-179.7	-24	32.4	0	0	0	112.1	Q60	P58-Q60 PolarHBondContact O-N 3.43Å
59	D	79.3	Confident	81.6	Confident	155 Å²	155	65.2 Å²	65.2	83%	0.829	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	11.1	174.5	-50.7	-38.8	0	0	0	116.6	L29	L29-D59 WeakPolarHBondContact CD2-O 3.33Å
60	Q	78.8	Confident	81.8	Confident	92 Å²	92	68 Å²	68	43%	0.43	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-28.1	-175.2	-160.9	154.8	-3.4	0	0	114	Q57 P58	Q57-Q60 HydrophobicContact CB-CB 4.31Å; Q57-Q60 PolarHBondContact O-N 3.02Å; P58-Q60 PolarHBondContact O-N 3.43Å
61	C	80.9	Confident	81.8	Confident	10 Å²	10	72.6 Å²	72.6	7%	0.068	41%	0.41	C	S	.	.			trans	-162.4	158.3	177.5	55.4	0	0	0	0	110.1	R30 C32	R30-C61 HydrophobicContact CG-CB 4.05Å; R30-C61 CarbonylContact O-C 3.58Å; R30-C61 WeakPolarHBondContact O-CA 3.44Å; R30-C61 WeakPolarHBondContact O-CB 3.37Å; C32-C61 WeakPolarHBondContact CA-SG 3.3Å; C32-C61 HydrophobicContact CB-CB 3.82Å; C32-C61 WeakPolarHBondContact CB-SG 3.12Å; C32-C61 VanDerWaalsContact SG-C 3.58Å; C32-C61 WeakPolarHBondContact SG-CB 3.35Å; C32-C61 CovalentContact SG-SG 2.02Å; C32-C61 PolarHBondContact SG-SG 3Å
62	V	77.4	Confident	81.6	Confident	76 Å²	76	67.8 Å²	67.8	46%	0.461	40%	0.396	S	S	.	.			trans	-129	136.6	175.1	-69.8	0	0	0	0	109.8	L29 R30 E31	L29-V62 HydrophobicContact CB-CB 4.16Å; L29-V62 HydrophobicContact CB-CG1 3.85Å; L29-V62 HydrophobicContact CB-CG2 3.6Å; L29-V62 HydrophobicContact CD1-CG1 4.02Å; L29-V62 HydrophobicContact CD2-CG1 4.23Å; L29-V62 HydrophobicContact CG-CG1 4.26Å; L29-V62 VanDerWaalsContact O-CG2 3.3Å; L29-V62 WeakPolarHBondContact O-CG2 3.44Å; R30-V62 PolarHBondContact O-N 2.89Å; E31-V62 WeakPolarHBondContact CA-O 3.27Å
63	G	73.1	Confident	81.5	Confident	57 Å²	57	71.1 Å²	71.1	59%	0.588	41%	0.408	S	S	*	.			trans	75.9	-161	-175.3	0	0	0	0	0	113.5	C32	C32-G63 VanDerWaalsContact CB-O 3.26Å; C32-G63 WeakPolarHBondContact CB-O 3.4Å; C32-G63 PolarHBondContact N-O 3.38Å; C32-G63 PolarHBondContact SG-O 2.9Å
64	G	73.9	Confident	81.3	Confident	20 Å²	20	73 Å²	73	21%	0.206	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	109.5	169.7	-174	0	0	0	0	0	113.2	E31 P66	E31-G64 VanDerWaalsContact CG-CA 3.47Å; E31-G64 WeakPolarHBondContact OE1-CA 3.35Å; E31-G64 PolarHBondContact OE1-N 2.87Å; G64-P66 WeakPolarHBondContact O-CD 3.45Å
65	H	76.8	Confident	80.9	Confident	180 Å²	180	72.8 Å²	72.8	83%	0.833	41%	0.414	S	S	*	.			trans	-101.9	78.6	174.1	-78.1	-142.2	0	0	0	109.4
66	P	78	Confident	80.5	Confident	62 Å²	62	74.8 Å²	74.8	40%	0.403	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-59.6	144.5	172.2	24.8	-31.9	0	0	0	109.4	F37 A54 G64	F37-P66 HydrophobicContact CD1-CB 4.15Å; F37-P66 HydrophobicContact CE1-CB 3.71Å; F37-P66 HydrophobicContact CE1-CG 4.38Å; F37-P66 HydrophobicContact CE2-CB 4.46Å; F37-P66 HydrophobicContact CZ-CB 3.87Å; F37-P66 HydrophobicContact CZ-CG 4.44Å; A54-P66 HydrophobicContact CB-CB 3.99Å; G64-P66 WeakPolarHBondContact O-CD 3.45Å
67	P	81.1	Confident	80.5	Confident	35 Å²	35	74.9 Å²	74.9	23%	0.227	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-55.5	141.5	172.5	22.6	-32.2	0	0	0	109.9	F39 A54	F39-P67 HydrophobicContact CE1-CG 3.84Å; F39-P67 HydrophobicContact CZ-CG 3.95Å; A54-P67 HydrophobicContact CB-CG 3.83Å
68	P	82.5	Confident	80.6	Confident	99 Å²	99	72 Å²	72	64%	0.643	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-59.9	147	-175.1	24.1	-33.6	0	0	0	110.9	V70	P68-V70 WeakPolarHBondContact O-CG2 3.48Å; P68-V70 PolarHBondContact O-N 3.41Å
69	P	85.1	Confident	80.9	Confident	79 Å²	79	66.9 Å²	66.9	51%	0.513	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-56.6	126.2	176.2	-23.2	32.6	0	0	0	111	W51 R52 V53	W51-P69 HydrophobicContact CE3-CB 4.26Å; R52-P69 VanDerWaalsContact O-CA 3.3Å; R52-P69 WeakPolarHBondContact O-CA 3.49Å; V53-P69 HydrophobicContact CG1-CB 4.09Å; V53-P69 HydrophobicContact CG1-CG 4.29Å
70	V	88.6	Confident	81.2	Confident	63 Å²	63	69.3 Å²	69.3	38%	0.382	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	141.8	178.2	-177.7	0	0	0	0	108.6	R52 P68 G72	R52-V70 PolarHBondContact N-O 3Å; R52-V70 PolarHBondContact O-N 2.91Å; P68-V70 WeakPolarHBondContact O-CG2 3.48Å; P68-V70 PolarHBondContact O-N 3.41Å; V70-G72 PolarHBondContact O-N 3.33Å; V70-G72 VanDerWaalsContact O-N 3.15Å
71	R	85.9	Confident	81.6	Confident	110 Å²	110	68.4 Å²	68.4	42%	0.415	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	124.6	172.9	-167.2	69.2	168.2	178.3	-2.5	109	D45 W51	D45-R71 IonicContact OD1-NH2 3.06Å; D45-R71 IonicContact OD2-CZ 3.8Å; D45-R71 IonicContact OD2-NH1 2.81Å; D45-R71 PolarHBondContact OD2-NH1 3.36Å; D45-R71 IonicContact OD2-NH2 3.27Å; D45-R71 PolarHBondContact OD2-NH2 3Å; W51-R71 HydrophobicContact CE3-CB 4.46Å; W51-R71 HydrophobicContact CZ3-CB 4.28Å
72	G	84.6	Confident	81.9	Confident	13 Å²	13	68 Å²	68	13%	0.134	38%	0.378	C	S	.	.			trans	-81.4	174.5	-179.1	0	0	0	0	0	112.9	Y41 R50 V70	Y41-G72 VanDerWaalsContact CE1-CA 3.41Å; R50-G72 WeakPolarHBondContact O-CA 3.17Å; R50-G72 PolarHBondContact O-N 2.94Å; V70-G72 PolarHBondContact O-N 3.33Å; V70-G72 VanDerWaalsContact O-N 3.15Å
73	R	85	Confident	82.5	Confident	99 Å²	99	65.2 Å²	65.2	37%	0.374	36%	0.362	S	S	.	.			trans	-57.9	145.1	164.5	-65.7	-70.1	-173.3	180	-1.5	109.9	Y41 R50 F77 Q90	Y41-R73 PolarHBondContact OH-N 2.01Å; R50-R73 WeakPolarHBondContact CG-O 3.46Å; R50-R73 PolarHBondContact NE-O 2.83Å; R73-F77 HydrophobicContact CB-CB 4.05Å; R73-F77 HydrophobicContact CB-CD1 3.86Å; R73-F77 HydrophobicContact CB-CE1 4.45Å; R73-F77 HydrophobicContact CB-CG 3.91Å; R73-F77 HydrophobicContact CG-CD1 4.05Å; R73-F77 HydrophobicContact CG-CE1 4.13Å; R73-F77 HydrophobicContact CG-CG 4.27Å; R73-F77 HydrophobicContact CG-CZ 4.42Å; R73-Q90 HydrophobicContact CG-CB 4.37Å; R73-Q90 PolarHBondContact NE-O 3.07Å; R73-Q90 PolarHBondContact NH2-O 3.21Å
74	D	84	Confident	83.3	Confident	74 Å²	74	64.8 Å²	64.8	40%	0.396	34%	0.344	S	S	.	.			trans	-50.2	150.2	174.8	-167.2	-80.3	0	0	0	111.8	S76 F77	D74-S76 VanDerWaalsContact C-N 3.26Å; D74-S76 PolarHBondContact O-N 3.36Å; D74-S76 WeakPolarHBondContact OD1-CB 3.27Å; D74-S76 PolarHBondContact OD1-N 2.77Å; D74-S76 PolarHBondContact OD1-OG 2.91Å; D74-F77 WeakPolarHBondContact O-CB 3.39Å; D74-F77 PolarHBondContact O-N 2.85Å; D74-F77 VanDerWaalsContact O-N 3.09Å
75	C	77.8	Confident	83.9	Confident	12 Å²	12	63.9 Å²	63.9	8%	0.081	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-33	-179.3	-74	0	0	0	0	112.8	C44 G48 F77 V183	C44-C75 VanDerWaalsContact CA-SG 3.53Å; C44-C75 HydrophobicContact CB-CB 4.01Å; C44-C75 WeakPolarHBondContact CB-SG 3.26Å; C44-C75 WeakPolarHBondContact SG-CB 3.47Å; C44-C75 CovalentContact SG-SG 2Å; C44-C75 PolarHBondContact SG-SG 3.11Å; G48-C75 WeakPolarHBondContact O-CB 3.34Å; G48-C75 PolarHBondContact O-N 3.14Å; G48-C75 PolarHBondContact O-SG 3.04Å; C75-F77 PolarHBondContact O-N 2.83Å; C75-V183 WeakPolarHBondContact O-CG1 3.49Å
76	S	77.1	Confident	84.4	Confident	86 Å²	86	56.7 Å²	56.7	60%	0.601	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.8	175.6	62.4	0	0	0	0	114.4	D74	D74-S76 VanDerWaalsContact C-N 3.26Å; D74-S76 PolarHBondContact O-N 3.36Å; D74-S76 WeakPolarHBondContact OD1-CB 3.27Å; D74-S76 PolarHBondContact OD1-N 2.77Å; D74-S76 PolarHBondContact OD1-OG 2.91Å
77	F	83.3	Confident	84.7	Confident	54 Å²	54	54.5 Å²	54.5	24%	0.237	29%	0.287	C	S	.	.			trans	-68.6	132.7	-177.5	178.2	-97.6	0	0	0	112.3	R73 D74 C75 L85 C92	R73-F77 HydrophobicContact CB-CB 4.05Å; R73-F77 HydrophobicContact CB-CD1 3.86Å; R73-F77 HydrophobicContact CB-CE1 4.45Å; R73-F77 HydrophobicContact CB-CG 3.91Å; R73-F77 HydrophobicContact CG-CD1 4.05Å; R73-F77 HydrophobicContact CG-CE1 4.13Å; R73-F77 HydrophobicContact CG-CG 4.27Å; R73-F77 HydrophobicContact CG-CZ 4.42Å; D74-F77 WeakPolarHBondContact O-CB 3.39Å; D74-F77 PolarHBondContact O-N 2.85Å; D74-F77 VanDerWaalsContact O-N 3.09Å; C75-F77 PolarHBondContact O-N 2.83Å; F77-L85 HydrophobicContact CD1-CD2 4.42Å; F77-L85 HydrophobicContact CE1-CD1 3.87Å; F77-L85 HydrophobicContact CE1-CD2 4.09Å; F77-L85 HydrophobicContact CZ-CD1 4.49Å; F77-C92 VanDerWaalsContact CZ-SG 3.54Å
78	S	81.5	Confident	84.7	Confident	25 Å²	25	56.6 Å²	56.6	18%	0.175	30%	0.303	C	S	.	.			trans	-143.1	141.5	175.7	-170.5	0	0	0	0	111.6	G104 R184 A274	S78-G104 WeakPolarHBondContact OG-CA 3.36Å; S78-R184 PolarHBondContact OG-NH2 3.46Å; S78-R184 VanDerWaalsContact OG-NH2 3.1Å; S78-A274 WeakPolarHBondContact CA-O 3.41Å; S78-A274 WeakPolarHBondContact CB-O 3.18Å; S78-A274 PolarHBondContact OG-O 2.78Å
79	C	84.6	Confident	84.8	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.02	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-75.4	152	176.8	-72.4	0	0	0	0	111.6	T83 C92 G103	C79-T83 WeakPolarHBondContact CB-OG1 3.42Å; C79-C92 WeakPolarHBondContact CA-SG 3.41Å; C79-C92 HydrophobicContact CB-CB 3.96Å; C79-C92 WeakPolarHBondContact CB-SG 3.45Å; C79-C92 WeakPolarHBondContact SG-CB 3.05Å; C79-C92 CovalentContact SG-SG 2.05Å; C79-C92 PolarHBondContact SG-SG 2.8Å; C79-G103 CarbonylContact O-C 3.42Å; C79-G103 VanDerWaalsContact O-C 3.23Å; C79-G103 VanDerWaalsContact O-CA 3.29Å; C79-G103 WeakPolarHBondContact O-CA 3.44Å
80	R	84.8	Confident	84.8	Confident	206 Å²	206	51.6 Å²	51.6	78%	0.777	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-74.5	153.5	175.2	-67.5	-176.9	-179.2	174.3	0.5	110.3	G82 T83 G103	R80-G82 PolarHBondContact O-N 2.76Å; R80-T83 PolarHBondContact N-OG1 2.7Å; R80-T83 PolarHBondContact O-N 2.81Å; R80-T83 VanDerWaalsContact O-N 3.13Å; R80-T83 PolarHBondContact O-OG1 3.25Å; R80-G103 WeakPolarHBondContact O-CA 3.39Å
81	P	86.6	Confident	84.8	Confident	74 Å²	74	54.1 Å²	54.1	48%	0.481	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	139.7	171.2	-22.8	32.9	0	0	0	111.1	S101	P81-S101 CarbonylContact C-O 3.57Å; P81-S101 WeakPolarHBondContact CA-O 3.42Å
82	G	88.3	Confident	84.9	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-6.9	-173.5	0	0	0	0	0	115.1	R80 C95 S101 N291 S292	R80-G82 PolarHBondContact O-N 2.76Å; G82-C95 WeakPolarHBondContact O-CB 3.48Å; G82-C95 PolarHBondContact O-N 3.01Å; G82-C95 PolarHBondContact O-SG 3.18Å; G82-C95 VanDerWaalsContact O-SG 3.36Å; G82-S101 PolarHBondContact N-O 2.81Å; G82-N291 PolarHBondContact O-OD1 3.43Å; G82-S292 WeakPolarHBondContact CA-O 3.32Å
83	T	90.7	Very high	85.3	Confident	19 Å²	19	54.7 Å²	54.7	12%	0.117	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	156.7	-179.9	65.8	0	0	0	0	112.1	C79 R80 K93 S101	C79-T83 WeakPolarHBondContact CB-OG1 3.42Å; R80-T83 PolarHBondContact N-OG1 2.7Å; R80-T83 PolarHBondContact O-N 2.81Å; R80-T83 VanDerWaalsContact O-N 3.13Å; R80-T83 PolarHBondContact O-OG1 3.25Å; T83-K93 CarbonylContact C-O 3.5Å; T83-K93 WeakPolarHBondContact CA-O 3.49Å; T83-K93 VanDerWaalsContact CB-O 3.28Å; T83-K93 WeakPolarHBondContact CB-O 2.99Å; T83-S101 WeakPolarHBondContact O-CB 3.04Å; T83-S101 PolarHBondContact O-OG 2.96Å
84	F	88	Confident	85.6	Confident	47 Å²	47	53.8 Å²	53.8	21%	0.206	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	154.5	174	74.4	-83	0	0	0	109.6	D86 C92 K93 A276 Q277 C279	F84-D86 HydrophobicContact CE2-CB 4.19Å; F84-D86 PolarHBondContact O-N 3.25Å; F84-C92 CarbonylContact O-C 3.49Å; F84-C92 VanDerWaalsContact O-CA 3.26Å; F84-C92 WeakPolarHBondContact O-CA 3.21Å; F84-K93 HydrophobicContact CD1-CB 4.23Å; F84-K93 VanDerWaalsContact CD1-O 3.31Å; F84-K93 WeakPolarHBondContact CD1-O 2.91Å; F84-K93 HydrophobicContact CE1-CB 3.67Å; F84-K93 HydrophobicContact CZ-CB 3.87Å; F84-K93 HydrophobicContact CZ-CD 4.42Å; F84-K93 PolarHBondContact N-O 2.82Å; F84-K93 PolarHBondContact O-N 2.67Å; F84-A276 WeakPolarHBondContact CA-O 3.49Å; F84-A276 WeakPolarHBondContact CB-O 3.44Å; F84-Q277 WeakPolarHBondContact CD2-O 3.49Å; F84-C279 WeakPolarHBondContact CD1-SG 3.28Å
85	L	87.6	Confident	85.9	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	112.7	180	-176.6	55.8	0	0	0	110.2	Y41 F77 L87 Y275 A276	Y41-L85 HydrophobicContact CE2-CD2 3.77Å; F77-L85 HydrophobicContact CD1-CD2 4.42Å; F77-L85 HydrophobicContact CE1-CD1 3.87Å; F77-L85 HydrophobicContact CE1-CD2 4.09Å; F77-L85 HydrophobicContact CZ-CD1 4.49Å; L85-L87 HydrophobicContact CD2-CD2 4.22Å; L85-L87 HydrophobicContact CG-CD2 4.38Å; L85-L87 PolarHBondContact O-N 3.46Å; L85-Y275 HydrophobicContact CB-CD2 3.76Å; L85-Y275 HydrophobicContact CB-CG 3.91Å; L85-Y275 HydrophobicContact CD2-CD1 3.67Å; L85-Y275 HydrophobicContact CD2-CD2 3.75Å; L85-Y275 HydrophobicContact CD2-CE1 4.06Å; L85-Y275 HydrophobicContact CD2-CE2 4.1Å; L85-Y275 HydrophobicContact CD2-CG 3.53Å; L85-Y275 HydrophobicContact CG-CD2 4.29Å; L85-Y275 HydrophobicContact CG-CG 4.36Å; L85-A276 PolarHBondContact N-O 2.98Å
86	D	87.1	Confident	86.6	Confident	29 Å²	29	56 Å²	56	16%	0.155	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	110.9	169.2	171.4	21.7	0	0	0	109.4	F84 S88 S89 Q90 E91 K93	F84-D86 HydrophobicContact CE2-CB 4.19Å; F84-D86 PolarHBondContact O-N 3.25Å; D86-S88 PolarHBondContact O-N 3.04Å; D86-S88 WeakPolarHBondContact OD1-CB 3.26Å; D86-S88 PolarHBondContact OD1-N 3.14Å; D86-S89 WeakPolarHBondContact CB-OG 3.14Å; D86-S89 VanDerWaalsContact CG-OG 3.26Å; D86-S89 PolarHBondContact O-N 3.41Å; D86-S89 PolarHBondContact OD2-OG 2.95Å; D86-Q90 VanDerWaalsContact O-CA 3.27Å; D86-Q90 WeakPolarHBondContact O-CA 3.44Å; D86-Q90 PolarHBondContact O-N 3.17Å; D86-E91 PolarHBondContact N-O 3.3Å; D86-K93 HydrophobicContact CB-CD 3.83Å; D86-K93 HydrophobicContact CB-CG 4.2Å; D86-K93 WeakPolarHBondContact OD2-CE 3.21Å; D86-K93 IonicContact OD2-NZ 3.52Å; D86-K93 PolarHBondContact OD2-NZ 2.61Å
87	L	83.6	Confident	87.4	Confident	15 Å²	15	55.2 Å²	55.2	8%	0.079	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.2	-177.3	-68.5	170.8	0	0	0	113.1	F39 Y41 R52 L85 Y275 Q277	F39-L87 HydrophobicContact CB-CB 3.88Å; F39-L87 WeakPolarHBondContact O-CD1 3.33Å; Y41-L87 HydrophobicContact CD2-CD2 3.61Å; Y41-L87 HydrophobicContact CE1-CD2 4.47Å; Y41-L87 HydrophobicContact CE2-CD2 3.39Å; Y41-L87 HydrophobicContact CG-CD2 4.26Å; R52-L87 WeakPolarHBondContact CD-O 3.47Å; R52-L87 PolarHBondContact NH1-O 3.22Å; L85-L87 HydrophobicContact CD2-CD2 4.22Å; L85-L87 HydrophobicContact CG-CD2 4.38Å; L85-L87 PolarHBondContact O-N 3.46Å; L87-Y275 HydrophobicContact CD2-CE2 4.37Å; L87-Q277 HydrophobicContact CD1-CG 4.48Å
88	S	81.9	Confident	87.7	Confident	80 Å²	80	52.7 Å²	52.7	56%	0.559	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-45.8	174.6	-59.5	0	0	0	0	111.3	D86	D86-S88 PolarHBondContact O-N 3.04Å; D86-S88 WeakPolarHBondContact OD1-CB 3.26Å; D86-S88 PolarHBondContact OD1-N 3.14Å
89	S	85.3	Confident	88.2	Confident	47 Å²	47	52 Å²	52	33%	0.329	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-15.7	179	53.9	0	0	0	0	114.1	D86 E91	D86-S89 WeakPolarHBondContact CB-OG 3.14Å; D86-S89 VanDerWaalsContact CG-OG 3.26Å; D86-S89 PolarHBondContact O-N 3.41Å; D86-S89 PolarHBondContact OD2-OG 2.95Å; S89-E91 PolarHBondContact O-N 2.84Å
90	Q	85.4	Confident	88.5	Confident	26 Å²	26	52.4 Å²	52.4	12%	0.121	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.6	30.8	-169.1	-52	-164.3	42.3	0	0	113.5	Y41 R73 D86	Y41-Q90 PolarHBondContact OH-OE1 2.79Å; R73-Q90 HydrophobicContact CG-CB 4.37Å; R73-Q90 PolarHBondContact NE-O 3.07Å; R73-Q90 PolarHBondContact NH2-O 3.21Å; D86-Q90 VanDerWaalsContact O-CA 3.27Å; D86-Q90 WeakPolarHBondContact O-CA 3.44Å; D86-Q90 PolarHBondContact O-N 3.17Å
91	E	88.1	Confident	88.7	Confident	116 Å²	116	42.8 Å²	42.8	54%	0.542	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	150.5	178.4	-67.9	-173.5	167.5	0	0	111.6	D86 S89 K93	D86-E91 PolarHBondContact N-O 3.3Å; S89-E91 PolarHBondContact O-N 2.84Å; E91-K93 PolarHBondContact O-N 2.84Å
92	C	88.7	Confident	88.6	Confident	45 Å²	45	39.6 Å²	39.6	30%	0.304	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	108.6	176	-60.7	0	0	0	0	109.6	F77 C79 F84	F77-C92 VanDerWaalsContact CZ-SG 3.54Å; C79-C92 WeakPolarHBondContact CA-SG 3.41Å; C79-C92 HydrophobicContact CB-CB 3.96Å; C79-C92 WeakPolarHBondContact CB-SG 3.45Å; C79-C92 WeakPolarHBondContact SG-CB 3.05Å; C79-C92 CovalentContact SG-SG 2.05Å; C79-C92 PolarHBondContact SG-SG 2.8Å; F84-C92 CarbonylContact O-C 3.49Å; F84-C92 VanDerWaalsContact O-CA 3.26Å; F84-C92 WeakPolarHBondContact O-CA 3.21Å
93	K	91.2	Very high	88.3	Confident	90 Å²	90	39.6 Å²	39.6	39%	0.391	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	144.5	176.8	-73	-176	175.8	170.6	0	111.1	T83 F84 D86 E91	T83-K93 CarbonylContact C-O 3.5Å; T83-K93 WeakPolarHBondContact CA-O 3.49Å; T83-K93 VanDerWaalsContact CB-O 3.28Å; T83-K93 WeakPolarHBondContact CB-O 2.99Å; F84-K93 HydrophobicContact CD1-CB 4.23Å; F84-K93 VanDerWaalsContact CD1-O 3.31Å; F84-K93 WeakPolarHBondContact CD1-O 2.91Å; F84-K93 HydrophobicContact CE1-CB 3.67Å; F84-K93 HydrophobicContact CZ-CB 3.87Å; F84-K93 HydrophobicContact CZ-CD 4.42Å; F84-K93 PolarHBondContact N-O 2.82Å; F84-K93 PolarHBondContact O-N 2.67Å; D86-K93 HydrophobicContact CB-CD 3.83Å; D86-K93 HydrophobicContact CB-CG 4.2Å; D86-K93 WeakPolarHBondContact OD2-CE 3.21Å; D86-K93 IonicContact OD2-NZ 3.52Å; D86-K93 PolarHBondContact OD2-NZ 2.61Å; E91-K93 PolarHBondContact O-N 2.84Å
94	P	92.2	Very high	88	Confident	79 Å²	79	38.7 Å²	38.7	51%	0.513	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	144.2	177.6	29.2	-34.2	0	0	0	111.5	N291	P94-N291 HydrophobicContact CB-CB 4.15Å
95	C	90.9	Very high	87.8	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.034	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-65.9	137.2	172.2	-69.8	0	0	0	0	111.2	G82 T99 S101 C279 G290 N291	G82-C95 WeakPolarHBondContact O-CB 3.48Å; G82-C95 PolarHBondContact O-N 3.01Å; G82-C95 PolarHBondContact O-SG 3.18Å; G82-C95 VanDerWaalsContact O-SG 3.36Å; C95-T99 WeakPolarHBondContact CB-OG1 3.5Å; C95-S101 WeakPolarHBondContact SG-CB 3.25Å; C95-C279 WeakPolarHBondContact CA-SG 3.42Å; C95-C279 HydrophobicContact CB-CB 3.8Å; C95-C279 WeakPolarHBondContact CB-SG 3.43Å; C95-C279 WeakPolarHBondContact SG-CB 3.36Å; C95-C279 CovalentContact SG-SG 2.03Å; C95-C279 PolarHBondContact SG-SG 3.37Å; C95-G290 WeakPolarHBondContact O-CA 3.44Å; C95-N291 PolarHBondContact O-N 2.8Å
96	L	92.5	Very high	87.7	Confident	128 Å²	128	38.3 Å²	38.3	67%	0.67	22%	0.219	S	C	*	.	P	Polyproline II helix	trans	-65.6	154.3	175.5	-67.3	168.6	0	0	0	110.9	G98 T99	L96-G98 PolarHBondContact O-N 3.06Å; L96-T99 PolarHBondContact N-OG1 2.88Å; L96-T99 PolarHBondContact O-N 3Å; L96-T99 PolarHBondContact O-OG1 2.72Å
97	P	93.1	Very high	87.6	Confident	70 Å²	70	39.4 Å²	39.4	46%	0.455	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	139.2	171.7	-24	33.1	0	0	0	111.8	T99	P97-T99 VanDerWaalsContact C-N 3.28Å
98	G	90.9	Very high	87.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	1.1	-173.3	0	0	0	0	0	115.2	L96 C282 S288 K307 A308	L96-G98 PolarHBondContact O-N 3.06Å; G98-C282 PolarHBondContact O-N 2.74Å; G98-S288 PolarHBondContact N-O 3.07Å; G98-K307 WeakPolarHBondContact O-CA 3.2Å; G98-A308 VanDerWaalsContact CA-O 3.25Å; G98-A308 WeakPolarHBondContact CA-O 3.45Å
99	T	91.3	Very high	87.5	Confident	11 Å²	11	38.9 Å²	38.9	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	161.5	173.8	68.8	0	0	0	0	111.3	C95 L96 P97 C279 S280 S288 K307	C95-T99 WeakPolarHBondContact CB-OG1 3.5Å; L96-T99 PolarHBondContact N-OG1 2.88Å; L96-T99 PolarHBondContact O-N 3Å; L96-T99 PolarHBondContact O-OG1 2.72Å; P97-T99 VanDerWaalsContact C-N 3.28Å; T99-C279 HydrophobicContact CG2-CB 4.48Å; T99-C279 WeakPolarHBondContact OG1-CB 3.15Å; T99-S280 CarbonylContact C-O 3.55Å; T99-S280 WeakPolarHBondContact CA-O 3.02Å; T99-S280 WeakPolarHBondContact CB-O 3.41Å; T99-S288 WeakPolarHBondContact O-CB 3.28Å; T99-S288 PolarHBondContact O-OG 3.13Å; T99-K307 HydrophobicContact CG2-CG 4.22Å
100	Y	90.2	Very high	86.9	Confident	11 Å²	11	40.6 Å²	40.6	4%	0.043	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	159.6	177.7	78.4	-79.7	0	0	0	110.7	L102 R107 D109 C279 S280 S292 C295	Y100-L102 HydrophobicContact CE2-CD2 4.49Å; Y100-R107 PolarHBondContact OH-NE 2.86Å; Y100-R107 VanDerWaalsContact OH-NE 3.16Å; Y100-R107 PolarHBondContact OH-NH2 2.85Å; Y100-D109 PolarHBondContact OH-OD2 2.85Å; Y100-D109 VanDerWaalsContact OH-OD2 3.06Å; Y100-C279 CarbonylContact O-C 3.55Å; Y100-C279 WeakPolarHBondContact O-CA 3.4Å; Y100-S280 WeakPolarHBondContact CD1-O 3.36Å; Y100-S280 PolarHBondContact N-O 3.13Å; Y100-S280 PolarHBondContact O-N 2.77Å; Y100-S292 VanDerWaalsContact CA-O 3.3Å; Y100-S292 WeakPolarHBondContact CA-O 3.41Å; Y100-S292 WeakPolarHBondContact CB-O 3.43Å; Y100-C295 WeakPolarHBondContact CD1-SG 3.48Å
101	S	89.5	Confident	86.7	Confident	4 Å²	4	39.4 Å²	39.4	3%	0.028	21%	0.207	C	C	.	.			trans	-147.3	137.5	173.7	168.4	0	0	0	0	110	P81 G82 T83 C95 G103 S292 G293	P81-S101 CarbonylContact C-O 3.57Å; P81-S101 WeakPolarHBondContact CA-O 3.42Å; G82-S101 PolarHBondContact N-O 2.81Å; T83-S101 WeakPolarHBondContact O-CB 3.04Å; T83-S101 PolarHBondContact O-OG 2.96Å; C95-S101 WeakPolarHBondContact SG-CB 3.25Å; S101-G103 PolarHBondContact O-N 3Å; S101-G103 PolarHBondContact OG-N 3.18Å; S101-S292 PolarHBondContact N-O 2.77Å; S101-G293 WeakPolarHBondContact O-CA 3.23Å
102	L	85.1	Confident	86	Confident	7 Å²	7	36.6 Å²	36.6	4%	0.037	20%	0.199	C	C	.	.			trans	-75.2	-6.5	173.3	-60.6	-173.2	0	0	0	113.3	Y100 G104 R107 E269 R271 G293	Y100-L102 HydrophobicContact CE2-CD2 4.49Å; L102-G104 PolarHBondContact O-N 3.08Å; L102-R107 HydrophobicContact CD1-CB 3.7Å; L102-R107 HydrophobicContact CG-CB 4.49Å; L102-E269 HydrophobicContact CD1-CG 3.97Å; L102-R271 PolarHBondContact O-NH1 2.86Å; L102-G293 VanDerWaalsContact CD2-O 3.24Å; L102-G293 WeakPolarHBondContact CD2-O 3.27Å
103	G	82.2	Confident	84.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.21	C	C	.	.	S	Bend	trans	76.8	-54.2	-179.9	0	0	0	0	0	113.5	C79 R80 S101 Y275 A276	C79-G103 CarbonylContact O-C 3.42Å; C79-G103 VanDerWaalsContact O-C 3.23Å; C79-G103 VanDerWaalsContact O-CA 3.29Å; C79-G103 WeakPolarHBondContact O-CA 3.44Å; R80-G103 WeakPolarHBondContact O-CA 3.39Å; S101-G103 PolarHBondContact O-N 3Å; S101-G103 PolarHBondContact OG-N 3.18Å; G103-Y275 VanDerWaalsContact O-CA 3.28Å; G103-Y275 WeakPolarHBondContact O-CA 3.48Å; G103-A276 PolarHBondContact O-N 1.98Å
104	G	82.8	Confident	83.5	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-139	43	177.2	0	0	0	0	0	111.5	S78 L102 G272 V273	S78-G104 WeakPolarHBondContact OG-CA 3.36Å; L102-G104 PolarHBondContact O-N 3.08Å; G104-G272 PolarHBondContact O-N 2.88Å; G104-V273 CarbonylContact C-O 3.53Å; G104-V273 VanDerWaalsContact CA-O 3.25Å; G104-V273 WeakPolarHBondContact CA-O 2.94Å; G104-V273 WeakPolarHBondContact O-CG2 3.48Å; G104-V273 PolarHBondContact O-N 3.2Å
105	G	85	Confident	82.3	Confident	7 Å²	7	41.9 Å²	41.9	7%	0.072	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	159.5	-179	0	0	0	0	0	111.1	I270 V273	G105-I270 CarbonylContact C-O 3.6Å; G105-I270 WeakPolarHBondContact CA-O 3.43Å; G105-V273 VanDerWaalsContact CA-CG2 3.45Å; G105-V273 VanDerWaalsContact N-CG2 3.32Å
106	V	85.4	Confident	81.6	Confident	34 Å²	34	50.4 Å²	50.4	21%	0.206	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140.3	170.2	59.7	0	0	0	0	108.6	Y108 E269 I270	V106-Y108 HydrophobicContact CG1-CE2 4.28Å; V106-Y108 HydrophobicContact CG2-CD2 4.26Å; V106-Y108 HydrophobicContact CG2-CE1 4.43Å; V106-Y108 HydrophobicContact CG2-CE2 3.5Å; V106-Y108 VanDerWaalsContact CG2-CE2 3.5Å; V106-E269 WeakPolarHBondContact O-CA 3.04Å; V106-I270 HydrophobicContact CG1-CB 3.85Å; V106-I270 HydrophobicContact CG1-CD1 4.22Å; V106-I270 HydrophobicContact CG1-CG1 4.49Å; V106-I270 PolarHBondContact N-O 2.97Å; V106-I270 PolarHBondContact O-N 2.81Å
107	R	84.8	Confident	81	Confident	53 Å²	53	46.9 Å²	46.9	20%	0.2	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	133.4	179.6	-172.7	174.5	75.6	168.2	17.1	111.1	Y100 L102 D109 I268 E269	Y100-R107 PolarHBondContact OH-NE 2.86Å; Y100-R107 VanDerWaalsContact OH-NE 3.16Å; Y100-R107 PolarHBondContact OH-NH2 2.85Å; L102-R107 HydrophobicContact CD1-CB 3.7Å; L102-R107 HydrophobicContact CG-CB 4.49Å; R107-D109 VanDerWaalsContact CD-OD1 3.26Å; R107-D109 WeakPolarHBondContact CD-OD1 3.46Å; R107-D109 WeakPolarHBondContact CG-OD1 3.29Å; R107-D109 IonicContact CZ-OD1 2.78Å; R107-D109 IonicContact CZ-OD2 3.67Å; R107-D109 IonicContact NE-OD1 3.22Å; R107-D109 PolarHBondContact NE-OD1 3.43Å; R107-D109 VanDerWaalsContact NE-OD1 3.15Å; R107-D109 IonicContact NE-OD2 3.41Å; R107-D109 PolarHBondContact NE-OD2 3.07Å; R107-D109 IonicContact NH2-OD1 2.87Å; R107-D109 IonicContact NH2-OD2 2.77Å; R107-D109 PolarHBondContact NH2-OD2 2.04Å; R107-I268 CarbonylContact C-O 3.59Å; R107-I268 VanDerWaalsContact CA-O 3.29Å; R107-I268 WeakPolarHBondContact CA-O 3.38Å; R107-E269 HydrophobicContact CG-CB 4.21Å
108	Y	85.4	Confident	80.4	Confident	38 Å²	38	45.1 Å²	45.1	15%	0.149	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	90.7	177	-58.6	-84.1	0	0	0	108.9	V106 P118 F121 Y178 G267 I268	V106-Y108 HydrophobicContact CG1-CE2 4.28Å; V106-Y108 HydrophobicContact CG2-CD2 4.26Å; V106-Y108 HydrophobicContact CG2-CE1 4.43Å; V106-Y108 HydrophobicContact CG2-CE2 3.5Å; V106-Y108 VanDerWaalsContact CG2-CE2 3.5Å; Y108-P118 HydrophobicContact CD1-CB 4.05Å; Y108-P118 HydrophobicContact CD1-CG 4.03Å; Y108-P118 HydrophobicContact CE1-CB 3.56Å; Y108-P118 HydrophobicContact CE1-CG 4.07Å; Y108-F121 HydrophobicContact CD1-CE2 4.26Å; Y108-F121 AromaticContact CD2-CE2 3.79Å; Y108-F121 HydrophobicContact CD2-CE2 3.79Å; Y108-F121 HydrophobicContact CD2-CZ 4.06Å; Y108-F121 HydrophobicContact CE1-CE2 4.06Å; Y108-F121 AromaticContact CE2-CE2 3.56Å; Y108-F121 HydrophobicContact CE2-CE2 3.56Å; Y108-F121 HydrophobicContact CE2-CZ 4.07Å; Y108-F121 HydrophobicContact CG-CE2 4.13Å; Y108-F121 AromaticContact CZ-CE2 3.7Å; Y108-Y178 AromaticContact CE2-CE2 3.93Å; Y108-Y178 HydrophobicContact CE2-CE2 3.93Å; Y108-Y178 AromaticContact CE2-CZ 3.96Å; Y108-Y178 AromaticContact CZ-CE2 3.99Å; Y108-Y178 WeakPolarHBondContact OH-CE2 3.37Å; Y108-Y178 PolarHBondContact OH-OH 3.09Å; Y108-G267 CarbonylContact O-C 3.15Å; Y108-G267 WeakPolarHBondContact O-CA 3.23Å; Y108-G267 PolarHBondContact O-N 3.42Å; Y108-I268 HydrophobicContact CD2-CB 4.38Å; Y108-I268 PolarHBondContact N-O 3.38Å; Y108-I268 PolarHBondContact O-N 2.79Å
109	D	76.9	Confident	79.8	Confident	46 Å²	46	54 Å²	54	25%	0.246	29%	0.291	C	S	.	.			trans	-77.6	-29.8	179.9	-65.8	-43.5	0	0	0	112.6	Y100 R107	Y100-D109 PolarHBondContact OH-OD2 2.85Å; Y100-D109 VanDerWaalsContact OH-OD2 3.06Å; R107-D109 VanDerWaalsContact CD-OD1 3.26Å; R107-D109 WeakPolarHBondContact CD-OD1 3.46Å; R107-D109 WeakPolarHBondContact CG-OD1 3.29Å; R107-D109 IonicContact CZ-OD1 2.78Å; R107-D109 IonicContact CZ-OD2 3.67Å; R107-D109 IonicContact NE-OD1 3.22Å; R107-D109 PolarHBondContact NE-OD1 3.43Å; R107-D109 VanDerWaalsContact NE-OD1 3.15Å; R107-D109 IonicContact NE-OD2 3.41Å; R107-D109 PolarHBondContact NE-OD2 3.07Å; R107-D109 IonicContact NH2-OD1 2.87Å; R107-D109 IonicContact NH2-OD2 2.77Å; R107-D109 PolarHBondContact NH2-OD2 2.04Å
110	E	73.4	Confident	79.3	Confident	83 Å²	83	55.2 Å²	55.2	39%	0.388	31%	0.305	S	S	.	.			trans	-137.6	140.3	-172.8	-67.4	-168.5	-164.4	0	0	110.6	N163 P283	E110-N163 WeakPolarHBondContact CB-ND2 3.08Å; E110-N163 WeakPolarHBondContact CB-OD1 3.45Å; E110-N163 VanDerWaalsContact CG-ND2 3.3Å; E110-N163 WeakPolarHBondContact CG-ND2 3.45Å; E110-N163 PolarHBondContact OE2-ND2 3.08Å; E110-P283 WeakPolarHBondContact OE1-CB 3.45Å
111	F	80.4	Confident	79.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.305	C	S	.	.			trans	-116.3	88.9	173.9	-65.4	-84.5	0	0	0	109.1	T113 P118 F121 I160 N163 L165 I268	F111-T113 PolarHBondContact O-N 3.42Å; F111-P118 HydrophobicContact CD1-CG 4.11Å; F111-P118 HydrophobicContact CE1-CG 4.18Å; F111-F121 HydrophobicContact CE1-CE2 4.45Å; F111-I160 HydrophobicContact CB-CD1 4.28Å; F111-I160 HydrophobicContact CB-CG1 4.22Å; F111-I160 HydrophobicContact CB-CG2 3.88Å; F111-I160 WeakPolarHBondContact O-CG2 3.32Å; F111-N163 PolarHBondContact N-O 2.6Å; F111-N163 PolarHBondContact N-OD1 2.95Å; F111-N163 VanDerWaalsContact N-OD1 3.12Å; F111-N163 CarbonylContact O-C 3.56Å; F111-N163 WeakPolarHBondContact O-CA 3.47Å; F111-N163 PolarHBondContact O-OD1 2.79Å; F111-L165 HydrophobicContact CD1-CD1 4.1Å; F111-L165 HydrophobicContact CD1-CD2 4.12Å; F111-L165 HydrophobicContact CD1-CG 3.85Å; F111-L165 HydrophobicContact CD2-CD1 4.2Å; F111-L165 HydrophobicContact CD2-CG 3.87Å; F111-L165 HydrophobicContact CE1-CD1 3.52Å; F111-L165 HydrophobicContact CE1-CD2 4.28Å; F111-L165 HydrophobicContact CE1-CG 3.82Å; F111-L165 HydrophobicContact CE2-CD1 3.64Å; F111-L165 HydrophobicContact CE2-CG 3.84Å; F111-L165 HydrophobicContact CG-CD1 4.41Å; F111-L165 HydrophobicContact CG-CD2 4.44Å; F111-L165 HydrophobicContact CG-CG 3.89Å; F111-L165 HydrophobicContact CZ-CD1 3.27Å; F111-L165 HydrophobicContact CZ-CG 3.83Å; F111-I268 HydrophobicContact CZ-CD1 3.93Å; F111-I268 HydrophobicContact CZ-CG1 4.23Å
112	P	73.9	Confident	79.3	Confident	57 Å²	57	64.3 Å²	64.3	37%	0.37	34%	0.339	S	S	.	.			trans	-57.7	124.1	-170.3	-23.8	32.2	0	0	0	112.7	G114 K115	P112-G114 PolarHBondContact O-N 3.18Å; P112-K115 HydrophobicContact CB-CD 4.05Å; P112-K115 HydrophobicContact CB-CG 4.29Å; P112-K115 HydrophobicContact CG-CD 4.45Å; P112-K115 PolarHBondContact O-N 3.17Å
113	T	65.7	Low	79.5	Confident	89 Å²	89	66.1 Å²	66.1	55%	0.546	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	135.2	179.5	-41.1	0	0	0	0	110.8	F111 K115 A162 N163	F111-T113 PolarHBondContact O-N 3.42Å; T113-K115 VanDerWaalsContact C-N 3.35Å; T113-A162 PolarHBondContact OG1-N 2.86Å; T113-N163 PolarHBondContact OG1-N 2.67Å
114	G	62.5	Low	79.7	Confident	83 Å²	83	68.8 Å²	68.8	86%	0.856	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	0.5	179.2	0	0	0	0	0	115.4	P112	P112-G114 PolarHBondContact O-N 3.18Å
115	K	66.8	Low	79.8	Confident	153 Å²	153	71.5 Å²	71.5	67%	0.665	38%	0.381	S	S	*	.	S	Bend	trans	-98.6	157.4	168.9	-66.2	-167	179.4	-177.2	0	111	P112 T113	P112-K115 HydrophobicContact CB-CD 4.05Å; P112-K115 HydrophobicContact CB-CG 4.29Å; P112-K115 HydrophobicContact CG-CD 4.45Å; P112-K115 PolarHBondContact O-N 3.17Å; T113-K115 VanDerWaalsContact C-N 3.35Å
116	H	75	Confident	79.4	Confident	185 Å²	185	76.1 Å²	76.1	86%	0.856	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-60.5	155	169.1	-62.1	-67.5	0	0	0	110.9
117	L	81.1	Confident	78.6	Confident	54 Å²	54	78.2 Å²	78.2	28%	0.283	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-50.7	141.4	171	-79.6	162.1	0	0	0	110.2	F121 V123 I160 L165 L176	L117-F121 HydrophobicContact CB-CB 4.05Å; L117-F121 HydrophobicContact CD2-CB 4.2Å; L117-V123 HydrophobicContact CD1-CB 4.3Å; L117-V123 HydrophobicContact CD1-CG2 3.6Å; L117-I160 HydrophobicContact CD2-CD1 4.14Å; L117-I160 HydrophobicContact CD2-CG1 4.21Å; L117-I160 HydrophobicContact CG-CD1 4.5Å; L117-L165 HydrophobicContact CD2-CD2 3.73Å; L117-L176 HydrophobicContact CD2-CD1 4.38Å
118	P	79.2	Confident	77.3	Confident	33 Å²	33	78.1 Å²	78.1	21%	0.214	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-56.6	152.9	176.9	-19.5	29.4	0	0	0	111.3	Y108 F111 G120 F121	Y108-P118 HydrophobicContact CD1-CB 4.05Å; Y108-P118 HydrophobicContact CD1-CG 4.03Å; Y108-P118 HydrophobicContact CE1-CB 3.56Å; Y108-P118 HydrophobicContact CE1-CG 4.07Å; F111-P118 HydrophobicContact CD1-CG 4.11Å; F111-P118 HydrophobicContact CE1-CG 4.18Å; P118-G120 PolarHBondContact O-N 3.15Å; P118-F121 HydrophobicContact CB-CD2 4Å; P118-F121 HydrophobicContact CB-CE2 4.46Å; P118-F121 HydrophobicContact CG-CD2 4.15Å; P118-F121 HydrophobicContact CG-CE2 4.48Å; P118-F121 PolarHBondContact O-N 3.41Å
119	Q	79.4	Confident	75.4	Confident	187 Å²	187	78.8 Å²	78.8	87%	0.874	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	133.1	178.5	-168.2	178.6	9.8	0	0	110.9
120	G	81.5	Confident	73.9	Confident	36 Å²	36	81.8 Å²	81.8	37%	0.371	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.6	-21.5	-176.7	0	0	0	0	0	114.6	P118 S179	P118-G120 PolarHBondContact O-N 3.15Å; G120-S179 PolarHBondContact O-N 3.4Å
121	F	89.3	Confident	72.3	Confident	11 Å²	11	80.4 Å²	80.4	5%	0.048	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	138.7	172.1	-73.8	-83.9	0	0	0	111.8	Y108 F111 L117 P118 L176 M177 Y178 W251 I268	Y108-F121 HydrophobicContact CD1-CE2 4.26Å; Y108-F121 AromaticContact CD2-CE2 3.79Å; Y108-F121 HydrophobicContact CD2-CE2 3.79Å; Y108-F121 HydrophobicContact CD2-CZ 4.06Å; Y108-F121 HydrophobicContact CE1-CE2 4.06Å; Y108-F121 AromaticContact CE2-CE2 3.56Å; Y108-F121 HydrophobicContact CE2-CE2 3.56Å; Y108-F121 HydrophobicContact CE2-CZ 4.07Å; Y108-F121 HydrophobicContact CG-CE2 4.13Å; Y108-F121 AromaticContact CZ-CE2 3.7Å; F111-F121 HydrophobicContact CE1-CE2 4.45Å; L117-F121 HydrophobicContact CB-CB 4.05Å; L117-F121 HydrophobicContact CD2-CB 4.2Å; P118-F121 HydrophobicContact CB-CD2 4Å; P118-F121 HydrophobicContact CB-CE2 4.46Å; P118-F121 HydrophobicContact CG-CD2 4.15Å; P118-F121 HydrophobicContact CG-CE2 4.48Å; P118-F121 PolarHBondContact O-N 3.41Å; F121-L176 HydrophobicContact CD1-CD1 3.82Å; F121-L176 HydrophobicContact CD1-CD2 4.44Å; F121-L176 HydrophobicContact CD1-CG 4.16Å; F121-L176 HydrophobicContact CE1-CD2 4.45Å; F121-M177 CarbonylContact C-O 3.48Å; F121-M177 VanDerWaalsContact CA-O 3.26Å; F121-M177 WeakPolarHBondContact CA-O 3.34Å; F121-Y178 AromaticContact CD1-CD2 3.84Å; F121-Y178 HydrophobicContact CD1-CD2 3.84Å; F121-Y178 HydrophobicContact CD1-CG 4.33Å; F121-Y178 AromaticContact CD2-CD2 3.55Å; F121-Y178 HydrophobicContact CD2-CD2 3.55Å; F121-Y178 AromaticContact CD2-CE2 3.86Å; F121-Y178 HydrophobicContact CD2-CE2 3.86Å; F121-Y178 AromaticContact CE1-CD2 3.73Å; F121-Y178 HydrophobicContact CE1-CD2 3.73Å; F121-Y178 HydrophobicContact CE1-CG 4.01Å; F121-Y178 AromaticContact CE2-CD2 3.44Å; F121-Y178 HydrophobicContact CE2-CD2 3.44Å; F121-Y178 VanDerWaalsContact CE2-CD2 3.44Å; F121-Y178 AromaticContact CE2-CE2 3.61Å; F121-Y178 HydrophobicContact CE2-CE2 3.61Å; F121-Y178 HydrophobicContact CE2-CG 4.38Å; F121-Y178 AromaticContact CG-CD2 3.76Å; F121-Y178 HydrophobicContact CG-CD2 3.76Å; F121-Y178 HydrophobicContact CG-CE2 4.5Å; F121-Y178 AromaticContact CZ-CD2 3.52Å; F121-Y178 HydrophobicContact CZ-CD2 3.52Å; F121-Y178 HydrophobicContact CZ-CE2 4.04Å; F121-Y178 HydrophobicContact CZ-CG 4.03Å; F121-W251 HydrophobicContact CE1-CZ3 4.08Å; F121-I268 HydrophobicContact CE1-CD1 3.87Å; F121-I268 HydrophobicContact CZ-CD1 3.79Å
122	R	89.5	Confident	70.4	Confident	195 Å²	195	81.4 Å²	81.4	74%	0.736	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.8	147.4	169.3	-71.1	-170	175.9	-160.2	-0.4	109.7	M177	R122-M177 PolarHBondContact N-O 3.28Å; R122-M177 PolarHBondContact O-N 2.59Å
123	V	89.7	Confident	68.9	Low	45 Å²	45	83.8 Å²	83.8	27%	0.273	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.2	172.4	173	0	0	0	0	108	L117 W158 T175 L176	L117-V123 HydrophobicContact CD1-CB 4.3Å; L117-V123 HydrophobicContact CD1-CG2 3.6Å; V123-W158 HydrophobicContact CG1-CB 4Å; V123-W158 HydrophobicContact CG2-CB 3.76Å; V123-T175 WeakPolarHBondContact CA-O 3.42Å; V123-L176 HydrophobicContact CG2-CB 4.46Å; V123-L176 HydrophobicContact CG2-CD1 3.59Å
124	V	87	Confident	67.8	Low	55 Å²	55	87.9 Å²	87.9	33%	0.333	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.8	174.3	-176.8	0	0	0	0	107.6	E126 T175 M177	V124-E126 HydrophobicContact CG1-CG 4.08Å; V124-T175 PolarHBondContact N-O 2.85Å; V124-T175 PolarHBondContact O-N 3.41Å; V124-M177 HydrophobicContact CG2-SD 3.89Å
125	N	83.8	Confident	66.7	Low	57 Å²	57	87 Å²	87	31%	0.305	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	120.9	175.2	-70.5	-19.5	0	0	0	108.5	C153 T156 L173 S174	N125-C153 HydrophobicContact CB-CB 3.97Å; N125-T156 PolarHBondContact ND2-O 3.44Å; N125-T156 VanDerWaalsContact ND2-O 3.11Å; N125-L173 CarbonylContact C-O 3.55Å; N125-L173 WeakPolarHBondContact CA-O 2.94Å; N125-S174 VanDerWaalsContact OD1-CB 3.22Å; N125-S174 WeakPolarHBondContact OD1-CB 3.38Å; N125-S174 PolarHBondContact OD1-OG 3.4Å
126	E	76.5	Confident	65.2	Low	104 Å²	104	83.1 Å²	83.1	49%	0.486	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	134.9	-179.1	-69.8	173.5	-174.9	0	0	110.4	V124 I128 C172 L173	V124-E126 HydrophobicContact CG1-CG 4.08Å; E126-I128 PolarHBondContact O-N 3.32Å; E126-C172 CarbonylContact O-C 3.45Å; E126-C172 VanDerWaalsContact O-CA 3.29Å; E126-C172 WeakPolarHBondContact O-CA 3.47Å; E126-C172 WeakPolarHBondContact O-CB 3.21Å; E126-L173 PolarHBondContact N-O 3.03Å; E126-L173 PolarHBondContact O-N 2.87Å
127	V	69.3	Low	63.3	Low	78 Å²	78	78.4 Å²	78.4	47%	0.473	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	119.2	171.8	-178.1	0	0	0	0	108.1	T151 C153	V127-T151 HydrophobicContact CG1-CG2 4.43Å; V127-C153 WeakPolarHBondContact CG2-SG 3.48Å
128	I	56.3	Low	61.1	Low	52 Å²	52	80.6 Å²	80.6	27%	0.267	46%	0.459	S	S	.	.			trans	-110.3	121.5	173	-60.6	-175.1	0	0	0	108.1	E126 L133 L173	E126-I128 PolarHBondContact O-N 3.32Å; I128-L133 HydrophobicContact CG2-CD1 4.18Å; I128-L133 HydrophobicContact CG2-CG 4.12Å; I128-L173 HydrophobicContact CD1-CB 3.49Å; I128-L173 VanDerWaalsContact CD1-CB 3.49Å; I128-L173 HydrophobicContact CD1-CD2 3.68Å; I128-L173 HydrophobicContact CD1-CG 4.15Å; I128-L173 HydrophobicContact CG1-CB 4.04Å
129	S	47.1	Very low	59.4	Low	51 Å²	51	82.7 Å²	82.7	36%	0.357	48%	0.479	S	S	.	.			trans	-79	137	166.5	-179.7	0	0	0	0	109.1	A131 S132	S129-A131 PolarHBondContact O-N 2.77Å; S129-A131 PolarHBondContact OG-N 3.2Å; S129-S132 VanDerWaalsContact O-CB 3.3Å; S129-S132 WeakPolarHBondContact O-CB 3.34Å; S129-S132 PolarHBondContact O-N 2.91Å; S129-S132 PolarHBondContact O-OG 3.13Å
130	L	44.9	Very low	57.5	Low	109 Å²	109	77 Å²	77	57%	0.571	47%	0.471	S	S	*	.	H	α-helix	trans	-53.8	-26.3	172.4	-136.4	81.4	0	0	0	111.8	S132 L133 Q134	L130-S132 VanDerWaalsContact C-N 3.34Å; L130-S132 PolarHBondContact O-N 3.32Å; L130-L133 HydrophobicContact CD1-CD1 4.24Å; L130-L133 WeakPolarHBondContact O-CB 3.06Å; L130-L133 PolarHBondContact O-N 3.18Å; L130-Q134 PolarHBondContact O-N 2.98Å
131	A	39.4	Very low	55.4	Low	55 Å²	55	81.9 Å²	81.9	46%	0.455	49%	0.488	S	S	.	.	H	α-helix	trans	-64	-34.1	174	0	0	0	0	0	113.3	S129 L133 Q134 A135	S129-A131 PolarHBondContact O-N 2.77Å; S129-A131 PolarHBondContact OG-N 3.2Å; A131-L133 VanDerWaalsContact C-N 3.35Å; A131-Q134 PolarHBondContact O-N 2.84Å; A131-A135 PolarHBondContact O-N 3.43Å
132	S	41.7	Very low	53.1	Low	21 Å²	21	85.4 Å²	85.4	15%	0.147	51%	0.507	C	S	.	.	H	α-helix	trans	-67.4	-36.9	176.3	-44.1	0	0	0	0	111.4	S129 L130 Q134 A135 G136	S129-S132 VanDerWaalsContact O-CB 3.3Å; S129-S132 WeakPolarHBondContact O-CB 3.34Å; S129-S132 PolarHBondContact O-N 2.91Å; S129-S132 PolarHBondContact O-OG 3.13Å; L130-S132 VanDerWaalsContact C-N 3.34Å; L130-S132 PolarHBondContact O-N 3.32Å; S132-Q134 VanDerWaalsContact C-N 3.28Å; S132-Q134 PolarHBondContact O-N 3.42Å; S132-A135 PolarHBondContact O-N 2.87Å; S132-G136 PolarHBondContact O-N 3.45Å
133	L	41.9	Very low	50.6	Low	106 Å²	106	85.8 Å²	85.8	56%	0.555	52%	0.517	S	S	*	.	H	α-helix	trans	-66.7	-28.3	176.7	-76.1	162.6	0	0	0	112.8	I128 L130 A131 M254	I128-L133 HydrophobicContact CG2-CD1 4.18Å; I128-L133 HydrophobicContact CG2-CG 4.12Å; L130-L133 HydrophobicContact CD1-CD1 4.24Å; L130-L133 WeakPolarHBondContact O-CB 3.06Å; L130-L133 PolarHBondContact O-N 3.18Å; A131-L133 VanDerWaalsContact C-N 3.35Å; L133-M254 HydrophobicContact CD1-CE 4.22Å
134	Q	42.2	Very low	48	Very low	175 Å²	175	85.5 Å²	85.5	82%	0.818	52%	0.523	S	S	*	.	H	α-helix	trans	-89.3	-21	-178.6	-139.7	156.1	-18.3	0	0	112.8	L130 A131 S132	L130-Q134 PolarHBondContact O-N 2.98Å; A131-Q134 PolarHBondContact O-N 2.84Å; S132-Q134 VanDerWaalsContact C-N 3.28Å; S132-Q134 PolarHBondContact O-N 3.42Å
135	A	39.4	Very low	45.5	Very low	65 Å²	65	90.7 Å²	90.7	54%	0.537	55%	0.549	S	S	.	.	H	α-helix	trans	-107.7	-15.1	-177	0	0	0	0	0	115.2	A131 S132 I137	A131-A135 PolarHBondContact O-N 3.43Å; S132-A135 PolarHBondContact O-N 2.87Å; A135-I137 VanDerWaalsContact C-N 3.29Å; A135-I137 HydrophobicContact CB-CD1 4.3Å; A135-I137 HydrophobicContact CB-CG1 4.27Å; A135-I137 PolarHBondContact O-N 2.05Å
136	G	34.8	Very low	43.4	Very low	71 Å²	71	93.4 Å²	93.4	73%	0.732	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.3	23.3	177.8	0	0	0	0	0	115	S132	S132-G136 PolarHBondContact O-N 3.45Å
137	I	34.8	Very low	41.6	Very low	87 Å²	87	94.4 Å²	94.4	45%	0.446	57%	0.571	S	S	.	*			trans	-104.2	134.2	-179.5	-52.7	175.6	0	0	0	109.5	A135	A135-I137 VanDerWaalsContact C-N 3.29Å; A135-I137 HydrophobicContact CB-CD1 4.3Å; A135-I137 HydrophobicContact CB-CG1 4.27Å; A135-I137 PolarHBondContact O-N 2.05Å
138	P	35.8	Very low	40.2	Very low	99 Å²	99	100.2 Å²	100.2	64%	0.643	59%	0.593	S	S	*	*			trans	-57.8	139.1	173	-20.2	31.2	0	0	0	111.6	G140 D141	P138-G140 PolarHBondContact O-N 3.25Å; P138-D141 PolarHBondContact O-N 3.43Å
139	A	44.3	Very low	39.4	Very low	77 Å²	77	101.7 Å²	101.7	64%	0.636	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-3.2	-170.5	0	0	0	0	0	116.4
140	G	38.9	Very low	39.5	Very low	68 Å²	68	104.2 Å²	104.2	70%	0.701	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	-23.4	-178	0	0	0	0	0	115.9	P138	P138-G140 PolarHBondContact O-N 3.25Å
141	D	36.1	Very low	39.8	Very low	138 Å²	138	102.8 Å²	102.8	74%	0.738	62%	0.622	S	S	*	*			trans	-104.3	14.2	-167.5	-71.3	-18.6	0	0	0	114.5	P138 E143	P138-D141 PolarHBondContact O-N 3.43Å; D141-E143 PolarHBondContact O-N 2.89Å
142	I	41	Very low	40.8	Very low	85 Å²	85	105.7 Å²	105.7	44%	0.436	63%	0.63	S	S	.	*			trans	-94.5	79.4	172	-51.6	178.7	0	0	0	108.2	G144	I142-G144 PolarHBondContact O-N 2.85Å
143	E	37.2	Very low	42.1	Very low	203 Å²	203	105.6 Å²	105.6	95%	0.949	63%	0.629	S	S	*	*			trans	-70.2	64.4	156.2	-74.4	-171.3	160.5	0	0	108.7	D141	D141-E143 PolarHBondContact O-N 2.89Å
144	G	35.2	Very low	43.4	Very low	39 Å²	39	108.2 Å²	108.2	40%	0.402	64%	0.638	S	S	.	*			trans	-128.8	120.6	177	0	0	0	0	0	107.2	I142 I146	I142-G144 PolarHBondContact O-N 2.85Å; G144-I146 PolarHBondContact O-N 3.48Å
145	N	34.3	Very low	44.8	Very low	164 Å²	164	102 Å²	102	88%	0.877	62%	0.62	S	S	*	*			trans	-57.6	68.5	-176.4	-159.5	26.8	0	0	0	112.4
146	I	40.6	Very low	46.7	Very low	115 Å²	115	100.2 Å²	100.2	59%	0.59	60%	0.603	S	S	*	*			trans	-83.9	109.4	160.1	-59.8	173	0	0	0	102.9	G144 Q148	G144-I146 PolarHBondContact O-N 3.48Å; I146-Q148 PolarHBondContact O-N 3.01Å
147	D	39.1	Very low	49.1	Very low	125 Å²	125	97 Å²	97	67%	0.668	57%	0.569	S	S	*	*			trans	-40.6	108.7	169.8	-74.8	-40.6	0	0	0	108	S149	D147-S149 PolarHBondContact O-N 3.42Å; D147-S149 PolarHBondContact O-OG 3.19Å
148	Q	38.7	Very low	51.7	Low	199 Å²	199	93.1 Å²	93.1	93%	0.93	55%	0.549	S	S	*	.			trans	-67.4	60.4	169.4	-70.1	-179.8	0.1	0	0	107.5	I146 S150	I146-Q148 PolarHBondContact O-N 3.01Å; Q148-S150 PolarHBondContact O-N 2.95Å
149	S	40.6	Very low	54.2	Low	84 Å²	84	91.3 Å²	91.3	59%	0.587	53%	0.532	S	S	*	.			trans	-71.4	79.8	167.4	51	0	0	0	0	106.2	D147 T151	D147-S149 PolarHBondContact O-N 3.42Å; D147-S149 PolarHBondContact O-OG 3.19Å; S149-T151 VanDerWaalsContact C-N 3.28Å; S149-T151 PolarHBondContact O-N 3.29Å
150	S	48	Very low	56.1	Low	104 Å²	104	89 Å²	89	73%	0.727	51%	0.509	S	S	*	.			trans	37.2	49.5	151.9	67.9	0	0	0	0	115.7	Q148 N152	Q148-S150 PolarHBondContact O-N 2.95Å; S150-N152 PolarHBondContact O-N 3.49Å
151	T	51.8	Low	58.2	Low	78 Å²	78	91.8 Å²	91.8	48%	0.479	50%	0.498	S	S	.	.			trans	-75.1	70.6	166.2	-41.8	0	0	0	0	107.3	V127 S149 C153	V127-T151 HydrophobicContact CG1-CG2 4.43Å; S149-T151 VanDerWaalsContact C-N 3.28Å; S149-T151 PolarHBondContact O-N 3.29Å; T151-C153 PolarHBondContact O-N 3.1Å
152	N	61.2	Low	60.2	Low	117 Å²	117	89.2 Å²	89.2	63%	0.626	50%	0.496	S	S	*	.			trans	-69.2	113.7	174.1	-112.6	17.5	0	0	0	107.1	S150 E154	S150-N152 PolarHBondContact O-N 3.49Å; N152-E154 HydrophobicContact CB-CB 4.2Å; N152-E154 PolarHBondContact ND2-OE2 2.62Å; N152-E154 PolarHBondContact O-N 3.28Å
153	C	68.7	Low	62.1	Low	19 Å²	19	87.4 Å²	87.4	13%	0.128	49%	0.488	C	S	.	.			trans	-69	7	169.4	-56.1	0	0	0	0	112.9	N125 V127 T151 G155 T156 C172	N125-C153 HydrophobicContact CB-CB 3.97Å; V127-C153 WeakPolarHBondContact CG2-SG 3.48Å; T151-C153 PolarHBondContact O-N 3.1Å; C153-G155 PolarHBondContact O-N 3.18Å; C153-T156 PolarHBondContact O-N 2.78Å; C153-T156 VanDerWaalsContact O-N 3.17Å; C153-T156 PolarHBondContact O-OG1 3.13Å; C153-C172 VanDerWaalsContact CA-SG 3.58Å; C153-C172 HydrophobicContact CB-CB 3.81Å; C153-C172 WeakPolarHBondContact CB-SG 3.04Å; C153-C172 WeakPolarHBondContact SG-CB 3.17Å; C153-C172 CovalentContact SG-SG 2.02Å; C153-C172 PolarHBondContact SG-SG 3.41Å
154	E	68.2	Low	64.4	Low	161 Å²	161	78.3 Å²	78.3	75%	0.752	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	119.4	-176.8	-157	170.3	-162.5	0	0	110	N152	N152-E154 HydrophobicContact CB-CB 4.2Å; N152-E154 PolarHBondContact ND2-OE2 2.62Å; N152-E154 PolarHBondContact O-N 3.28Å
155	G	72.5	Confident	67	Low	43 Å²	43	76.5 Å²	76.5	44%	0.443	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	-11.3	-176.5	0	0	0	0	0	115.8	C153 Q159 I168	C153-G155 PolarHBondContact O-N 3.18Å; G155-Q159 PolarHBondContact O-NE2 3.33Å; G155-I168 WeakPolarHBondContact O-CD1 3.39Å
156	T	79.9	Confident	69.6	Low	29 Å²	29	69 Å²	69	18%	0.178	39%	0.387	C	S	.	.			trans	-100.8	166.7	173.6	65.4	0	0	0	0	112.2	N125 C153	N125-T156 PolarHBondContact ND2-O 3.44Å; N125-T156 VanDerWaalsContact ND2-O 3.11Å; C153-T156 PolarHBondContact O-N 2.78Å; C153-T156 VanDerWaalsContact O-N 3.17Å; C153-T156 PolarHBondContact O-OG1 3.13Å
157	G	84.4	Confident	71.9	Confident	2 Å²	2	63.6 Å²	63.6	2%	0.021	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.5	-163.9	177.6	0	0	0	0	0	115.2	Q159 I168 S174	G157-Q159 PolarHBondContact O-N 3.03Å; G157-I168 PolarHBondContact N-O 2.04Å; G157-I168 PolarHBondContact O-N 3.12Å; G157-S174 VanDerWaalsContact CA-CB 3.44Å; G157-S174 VanDerWaalsContact CA-OG 3.22Å; G157-S174 WeakPolarHBondContact CA-OG 3.25Å
158	W	90.2	Very high	74.1	Confident	7 Å²	7	59 Å²	59	3%	0.027	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	121	-177.5	-68.5	108.1	0	0	0	112.3	V123 L165 Y167 S174 L176 F201 W251 A253 I263 I265	V123-W158 HydrophobicContact CG1-CB 4Å; V123-W158 HydrophobicContact CG2-CB 3.76Å; W158-L165 HydrophobicContact CE3-CB 4.43Å; W158-Y167 HydrophobicContact CD2-CD2 4.49Å; W158-S174 PolarHBondContact N-OG 2.75Å; W158-S174 PolarHBondContact NE1-O 3.33Å; W158-L176 HydrophobicContact CB-CB 4.27Å; W158-L176 HydrophobicContact CD2-CB 4.09Å; W158-L176 HydrophobicContact CG-CB 3.74Å; W158-F201 HydrophobicContact CH2-CD2 4.45Å; W158-F201 AromaticContact CH2-CE2 3.77Å; W158-F201 HydrophobicContact CH2-CE2 3.77Å; W158-F201 HydrophobicContact CH2-CZ 4.46Å; W158-F201 HydrophobicContact CZ2-CD2 4.22Å; W158-F201 AromaticContact CZ2-CE2 3.76Å; W158-F201 HydrophobicContact CZ2-CE2 3.76Å; W158-W251 HydrophobicContact CZ2-CB 4.07Å; W158-W251 PolarHBondContact NE1-O 2.79Å; W158-A253 HydrophobicContact CZ2-CB 3.86Å; W158-I263 HydrophobicContact CH2-CB 4.28Å; W158-I263 HydrophobicContact CH2-CG2 3.92Å; W158-I265 HydrophobicContact CH2-CD1 3.42Å; W158-I265 VanDerWaalsContact CH2-CD1 3.42Å; W158-I265 HydrophobicContact CH2-CG1 3.89Å; W158-I265 HydrophobicContact CZ2-CD1 4.18Å; W158-I265 HydrophobicContact CZ3-CD1 3.66Å; W158-I265 HydrophobicContact CZ3-CG1 3.88Å
159	Q	86.8	Confident	75.9	Confident	60 Å²	60	51.3 Å²	51.3	28%	0.28	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	159.7	177.9	-65.3	176.1	12.5	0	0	110.9	G155 G157 R161 L165 T166 I168	G155-Q159 PolarHBondContact O-NE2 3.33Å; G157-Q159 PolarHBondContact O-N 3.03Å; Q159-R161 PolarHBondContact O-N 2.88Å; Q159-L165 CarbonylContact O-C 3.59Å; Q159-T166 PolarHBondContact N-O 2.92Å; Q159-T166 PolarHBondContact O-N 2.79Å; Q159-I168 HydrophobicContact CB-CD1 4.44Å; Q159-I168 HydrophobicContact CG-CD1 4.3Å
160	I	85.6	Confident	77.4	Confident	28 Å²	28	48 Å²	48	14%	0.144	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	115.9	172.5	-60.9	175.8	0	0	0	108.8	F111 L117 T164 L165	F111-I160 HydrophobicContact CB-CD1 4.28Å; F111-I160 HydrophobicContact CB-CG1 4.22Å; F111-I160 HydrophobicContact CB-CG2 3.88Å; F111-I160 WeakPolarHBondContact O-CG2 3.32Å; L117-I160 HydrophobicContact CD2-CD1 4.14Å; L117-I160 HydrophobicContact CD2-CG1 4.21Å; L117-I160 HydrophobicContact CG-CD1 4.5Å; I160-T164 WeakPolarHBondContact CA-O 3.2Å; I160-L165 HydrophobicContact CG1-CD2 4.11Å
161	R	82	Confident	78.3	Confident	127 Å²	127	48.1 Å²	48.1	48%	0.479	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.7	172.2	-69.8	-169.9	175	-167.3	0.5	110.5	Q159 N163 T164 I168	Q159-R161 PolarHBondContact O-N 2.88Å; R161-N163 VanDerWaalsContact C-N 3.32Å; R161-N163 PolarHBondContact O-N 2.89Å; R161-T164 PolarHBondContact N-O 2.83Å; R161-T164 PolarHBondContact O-N 3.03Å; R161-T164 PolarHBondContact O-OG1 3.43Å; R161-I168 VanDerWaalsContact NH2-CD1 3.27Å
162	A	77.9	Confident	79.5	Confident	85 Å²	85	44.5 Å²	44.5	70%	0.702	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	49.7	175.6	0	0	0	0	0	113.5	T113 T164	T113-A162 PolarHBondContact OG1-N 2.86Å; A162-T164 PolarHBondContact O-N 2.94Å
163	N	82.1	Confident	80.4	Confident	47 Å²	47	39.9 Å²	39.9	25%	0.251	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	14.8	-179	-143.9	19.8	0	0	0	116.4	E110 F111 T113 R161	E110-N163 WeakPolarHBondContact CB-ND2 3.08Å; E110-N163 WeakPolarHBondContact CB-OD1 3.45Å; E110-N163 VanDerWaalsContact CG-ND2 3.3Å; E110-N163 WeakPolarHBondContact CG-ND2 3.45Å; E110-N163 PolarHBondContact OE2-ND2 3.08Å; F111-N163 PolarHBondContact N-O 2.6Å; F111-N163 PolarHBondContact N-OD1 2.95Å; F111-N163 VanDerWaalsContact N-OD1 3.12Å; F111-N163 CarbonylContact O-C 3.56Å; F111-N163 WeakPolarHBondContact O-CA 3.47Å; F111-N163 PolarHBondContact O-OD1 2.79Å; T113-N163 PolarHBondContact OG1-N 2.67Å; R161-N163 VanDerWaalsContact C-N 3.32Å; R161-N163 PolarHBondContact O-N 2.89Å
164	T	84.7	Confident	81.3	Confident	12 Å²	12	39 Å²	39	7%	0.074	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	156.8	-177.6	65	0	0	0	0	111.9	I160 R161 A162 T166 W232 K266	I160-T164 WeakPolarHBondContact CA-O 3.2Å; R161-T164 PolarHBondContact N-O 2.83Å; R161-T164 PolarHBondContact O-N 3.03Å; R161-T164 PolarHBondContact O-OG1 3.43Å; A162-T164 PolarHBondContact O-N 2.94Å; T164-T166 PolarHBondContact O-N 2.85Å; T164-T166 PolarHBondContact OG1-OG1 2.99Å; T164-W232 HydrophobicContact CG2-CH2 3.97Å; T164-W232 HydrophobicContact CG2-CZ2 4.44Å; T164-K266 HydrophobicContact CG2-CB 4.2Å; T164-K266 HydrophobicContact CG2-CD 4.3Å; T164-K266 HydrophobicContact CG2-CG 4.37Å
165	L	90	Very high	82.2	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	108.7	169.7	-72.5	164.6	0	0	0	108.6	F111 L117 W158 Q159 I160 L176 K264 I265 I268	F111-L165 HydrophobicContact CD1-CD1 4.1Å; F111-L165 HydrophobicContact CD1-CD2 4.12Å; F111-L165 HydrophobicContact CD1-CG 3.85Å; F111-L165 HydrophobicContact CD2-CD1 4.2Å; F111-L165 HydrophobicContact CD2-CG 3.87Å; F111-L165 HydrophobicContact CE1-CD1 3.52Å; F111-L165 HydrophobicContact CE1-CD2 4.28Å; F111-L165 HydrophobicContact CE1-CG 3.82Å; F111-L165 HydrophobicContact CE2-CD1 3.64Å; F111-L165 HydrophobicContact CE2-CG 3.84Å; F111-L165 HydrophobicContact CG-CD1 4.41Å; F111-L165 HydrophobicContact CG-CD2 4.44Å; F111-L165 HydrophobicContact CG-CG 3.89Å; F111-L165 HydrophobicContact CZ-CD1 3.27Å; F111-L165 HydrophobicContact CZ-CG 3.83Å; L117-L165 HydrophobicContact CD2-CD2 3.73Å; W158-L165 HydrophobicContact CE3-CB 4.43Å; Q159-L165 CarbonylContact O-C 3.59Å; I160-L165 HydrophobicContact CG1-CD2 4.11Å; L165-L176 HydrophobicContact CD1-CD2 3.63Å; L165-L176 HydrophobicContact CD2-CD1 4.47Å; L165-L176 HydrophobicContact CD2-CD2 4.46Å; L165-K264 CarbonylContact O-C 3.19Å; L165-K264 VanDerWaalsContact O-CA 3.29Å; L165-K264 WeakPolarHBondContact O-CA 3.2Å; L165-I265 HydrophobicContact CB-CB 4.13Å; L165-I265 PolarHBondContact N-O 3.06Å; L165-I265 PolarHBondContact O-N 2.89Å; L165-I268 HydrophobicContact CD1-CD1 3.89Å
166	T	88.6	Confident	83.2	Confident	8 Å²	8	29.8 Å²	29.8	5%	0.049	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.7	-178.5	-58.3	0	0	0	0	109.9	Q159 T164 P262 I263 K264	Q159-T166 PolarHBondContact N-O 2.92Å; Q159-T166 PolarHBondContact O-N 2.79Å; T164-T166 PolarHBondContact O-N 2.85Å; T164-T166 PolarHBondContact OG1-OG1 2.99Å; T166-P262 HydrophobicContact CG2-CB 3.8Å; T166-P262 HydrophobicContact CG2-CG 4.38Å; T166-I263 CarbonylContact C-O 3.53Å; T166-I263 VanDerWaalsContact CA-O 3.32Å; T166-I263 WeakPolarHBondContact CA-O 3.31Å; T166-K264 HydrophobicContact CG2-CG 4.29Å
167	Y	88.9	Confident	83.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119	166.6	171.1	-105	0	0	0	109.2	W158 P169 I199 A253 M254 V255 P262 I263	W158-Y167 HydrophobicContact CD2-CD2 4.49Å; Y167-P169 WeakPolarHBondContact O-CD 3.35Å; Y167-I199 HydrophobicContact CD1-CD1 4.5Å; Y167-I199 HydrophobicContact CD1-CG2 4.12Å; Y167-I199 HydrophobicContact CE1-CD1 4.4Å; Y167-I199 HydrophobicContact CE1-CG2 3.68Å; Y167-A253 HydrophobicContact CD1-CB 3.75Å; Y167-A253 HydrophobicContact CD2-CB 3.49Å; Y167-A253 VanDerWaalsContact CD2-CB 3.49Å; Y167-A253 HydrophobicContact CE1-CB 3.87Å; Y167-A253 HydrophobicContact CE2-CB 3.63Å; Y167-A253 WeakPolarHBondContact CE2-O 3.37Å; Y167-A253 HydrophobicContact CG-CB 3.56Å; Y167-A253 PolarHBondContact OH-O 2.73Å; Y167-M254 VanDerWaalsContact OH-CA 3.27Å; Y167-M254 WeakPolarHBondContact OH-CA 3.5Å; Y167-V255 PolarHBondContact OH-N 3.31Å; Y167-P262 WeakPolarHBondContact O-CA 3.46Å; Y167-P262 WeakPolarHBondContact O-CB 3.34Å; Y167-I263 HydrophobicContact CD1-CD1 4.29Å; Y167-I263 HydrophobicContact CD1-CG1 4.31Å; Y167-I263 PolarHBondContact N-O 2.91Å; Y167-I263 PolarHBondContact O-N 3.15Å
168	I	84.5	Confident	84.1	Confident	28 Å²	28	31.3 Å²	31.3	14%	0.144	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.7	174.3	-59.7	164	0	0	0	107.9	G155 G157 Q159 R161 G170	G155-I168 WeakPolarHBondContact O-CD1 3.39Å; G157-I168 PolarHBondContact N-O 2.04Å; G157-I168 PolarHBondContact O-N 3.12Å; Q159-I168 HydrophobicContact CB-CD1 4.44Å; Q159-I168 HydrophobicContact CG-CD1 4.3Å; R161-I168 VanDerWaalsContact NH2-CD1 3.27Å; I168-G170 PolarHBondContact O-N 3.21Å
169	P	78.1	Confident	83.9	Confident	39 Å²	39	33.8 Å²	33.8	25%	0.253	19%	0.194	S	C	.	.	P	Polyproline II helix	trans	-49.2	129.9	175.4	-29.2	36.5	0	0	0	111.8	Y167 I199 V255 H260	Y167-P169 WeakPolarHBondContact O-CD 3.35Å; P169-I199 HydrophobicContact CG-CD1 4.13Å; P169-V255 HydrophobicContact CB-CG2 3.52Å; P169-H260 WeakPolarHBondContact CG-O 3.11Å
170	G	71.7	Confident	84	Confident	14 Å²	14	31.3 Å²	31.3	14%	0.144	18%	0.182	C	C	.	.			trans	-158.8	174.1	179.7	0	0	0	0	0	111.8	I168 C172	I168-G170 PolarHBondContact O-N 3.21Å; G170-C172 PolarHBondContact O-N 2.91Å
171	T	67	Low	83.9	Confident	106 Å²	106	34.8 Å²	34.8	65%	0.65	20%	0.196	S	C	*	.	S	Bend	trans	-72.9	-12.9	177.1	50.5	0	0	0	0	113.1
172	C	76.6	Confident	84.1	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.014	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	143.8	-177	-52.1	0	0	0	0	112	E126 C153 G170 S174	E126-C172 CarbonylContact O-C 3.45Å; E126-C172 VanDerWaalsContact O-CA 3.29Å; E126-C172 WeakPolarHBondContact O-CA 3.47Å; E126-C172 WeakPolarHBondContact O-CB 3.21Å; C153-C172 VanDerWaalsContact CA-SG 3.58Å; C153-C172 HydrophobicContact CB-CB 3.81Å; C153-C172 WeakPolarHBondContact CB-SG 3.04Å; C153-C172 WeakPolarHBondContact SG-CB 3.17Å; C153-C172 CovalentContact SG-SG 2.02Å; C153-C172 PolarHBondContact SG-SG 3.41Å; G170-C172 PolarHBondContact O-N 2.91Å; C172-S174 PolarHBondContact O-N 3.06Å
173	L	80.1	Confident	84.2	Confident	21 Å²	21	27 Å²	27	11%	0.11	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	122.1	165.6	173.4	66.6	0	0	0	108.4	N125 E126 I128 K252 M254	N125-L173 CarbonylContact C-O 3.55Å; N125-L173 WeakPolarHBondContact CA-O 2.94Å; E126-L173 PolarHBondContact N-O 3.03Å; E126-L173 PolarHBondContact O-N 2.87Å; I128-L173 HydrophobicContact CD1-CB 3.49Å; I128-L173 VanDerWaalsContact CD1-CB 3.49Å; I128-L173 HydrophobicContact CD1-CD2 3.68Å; I128-L173 HydrophobicContact CD1-CG 4.15Å; I128-L173 HydrophobicContact CG1-CB 4.04Å; L173-K252 HydrophobicContact CD1-CB 4.32Å; L173-M254 HydrophobicContact CD1-CB 4.04Å; L173-M254 HydrophobicContact CD1-CG 4.25Å; L173-M254 HydrophobicContact CD1-SD 4.31Å
174	S	87.2	Confident	84.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.1	175.5	-164.8	0	0	0	0	110.7	N125 G157 W158 C172 K252 A253	N125-S174 VanDerWaalsContact OD1-CB 3.22Å; N125-S174 WeakPolarHBondContact OD1-CB 3.38Å; N125-S174 PolarHBondContact OD1-OG 3.4Å; G157-S174 VanDerWaalsContact CA-CB 3.44Å; G157-S174 VanDerWaalsContact CA-OG 3.22Å; G157-S174 WeakPolarHBondContact CA-OG 3.25Å; W158-S174 PolarHBondContact N-OG 2.75Å; W158-S174 PolarHBondContact NE1-O 3.33Å; C172-S174 PolarHBondContact O-N 3.06Å; S174-K252 WeakPolarHBondContact O-CA 3.19Å; S174-A253 PolarHBondContact N-O 3.31Å; S174-A253 PolarHBondContact O-N 2.9Å
175	T	87.1	Confident	84.1	Confident	10 Å²	10	34 Å²	34	6%	0.061	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	113	178.9	-54.8	0	0	0	0	109.7	V123 V124 M177 W251 K252	V123-T175 WeakPolarHBondContact CA-O 3.42Å; V124-T175 PolarHBondContact N-O 2.85Å; V124-T175 PolarHBondContact O-N 3.41Å; T175-M177 HydrophobicContact CG2-CG 3.61Å; T175-M177 HydrophobicContact CG2-SD 4.21Å; T175-W251 WeakPolarHBondContact CA-O 3.3Å; T175-K252 HydrophobicContact CG2-CD 4.45Å; T175-K252 HydrophobicContact CG2-CG 3.74Å
176	L	93.2	Very high	83.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	123.6	167.1	174.2	73.4	0	0	0	108.5	L117 F121 V123 W158 L165 S250 W251	L117-L176 HydrophobicContact CD2-CD1 4.38Å; F121-L176 HydrophobicContact CD1-CD1 3.82Å; F121-L176 HydrophobicContact CD1-CD2 4.44Å; F121-L176 HydrophobicContact CD1-CG 4.16Å; F121-L176 HydrophobicContact CE1-CD2 4.45Å; V123-L176 HydrophobicContact CG2-CB 4.46Å; V123-L176 HydrophobicContact CG2-CD1 3.59Å; W158-L176 HydrophobicContact CB-CB 4.27Å; W158-L176 HydrophobicContact CD2-CB 4.09Å; W158-L176 HydrophobicContact CG-CB 3.74Å; L165-L176 HydrophobicContact CD1-CD2 3.63Å; L165-L176 HydrophobicContact CD2-CD1 4.47Å; L165-L176 HydrophobicContact CD2-CD2 4.46Å; L176-S250 CarbonylContact O-C 3.51Å; L176-S250 VanDerWaalsContact O-CA 3.25Å; L176-S250 WeakPolarHBondContact O-CA 3.11Å; L176-W251 HydrophobicContact CB-CB 4.26Å; L176-W251 HydrophobicContact CB-CE3 4.41Å; L176-W251 HydrophobicContact CD2-CD2 4.28Å; L176-W251 HydrophobicContact CD2-CE3 3.78Å; L176-W251 HydrophobicContact CD2-CZ3 4.4Å; L176-W251 HydrophobicContact CG-CE3 3.98Å; L176-W251 PolarHBondContact N-O 2.99Å; L176-W251 PolarHBondContact O-N 2.72Å
177	M	90.7	Very high	83.8	Confident	46 Å²	46	36.5 Å²	36.5	23%	0.227	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.6	-174.6	-56.7	175.6	72.8	0	0	110.3	F121 R122 V124 T175 L248 L249	F121-M177 CarbonylContact C-O 3.48Å; F121-M177 VanDerWaalsContact CA-O 3.26Å; F121-M177 WeakPolarHBondContact CA-O 3.34Å; R122-M177 PolarHBondContact N-O 3.28Å; R122-M177 PolarHBondContact O-N 2.59Å; V124-M177 HydrophobicContact CG2-SD 3.89Å; T175-M177 HydrophobicContact CG2-CG 3.61Å; T175-M177 HydrophobicContact CG2-SD 4.21Å; M177-L248 HydrophobicContact CB-CD1 4.29Å; M177-L248 HydrophobicContact CE-CD1 3.95Å; M177-L248 HydrophobicContact CE-CD2 3.28Å; M177-L248 HydrophobicContact CE-CG 3.87Å; M177-L249 CarbonylContact C-O 3.47Å; M177-L249 VanDerWaalsContact CA-O 3.31Å; M177-L249 WeakPolarHBondContact CA-O 3.27Å
178	Y	92	Very high	83.7	Confident	18 Å²	18	36.5 Å²	36.5	7%	0.071	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	116.4	172.2	-174.7	-102	0	0	0	110.2	Y108 F121 V180 L249 I270	Y108-Y178 AromaticContact CE2-CE2 3.93Å; Y108-Y178 HydrophobicContact CE2-CE2 3.93Å; Y108-Y178 AromaticContact CE2-CZ 3.96Å; Y108-Y178 AromaticContact CZ-CE2 3.99Å; Y108-Y178 WeakPolarHBondContact OH-CE2 3.37Å; Y108-Y178 PolarHBondContact OH-OH 3.09Å; F121-Y178 AromaticContact CD1-CD2 3.84Å; F121-Y178 HydrophobicContact CD1-CD2 3.84Å; F121-Y178 HydrophobicContact CD1-CG 4.33Å; F121-Y178 AromaticContact CD2-CD2 3.55Å; F121-Y178 HydrophobicContact CD2-CD2 3.55Å; F121-Y178 AromaticContact CD2-CE2 3.86Å; F121-Y178 HydrophobicContact CD2-CE2 3.86Å; F121-Y178 AromaticContact CE1-CD2 3.73Å; F121-Y178 HydrophobicContact CE1-CD2 3.73Å; F121-Y178 HydrophobicContact CE1-CG 4.01Å; F121-Y178 AromaticContact CE2-CD2 3.44Å; F121-Y178 HydrophobicContact CE2-CD2 3.44Å; F121-Y178 VanDerWaalsContact CE2-CD2 3.44Å; F121-Y178 AromaticContact CE2-CE2 3.61Å; F121-Y178 HydrophobicContact CE2-CE2 3.61Å; F121-Y178 HydrophobicContact CE2-CG 4.38Å; F121-Y178 AromaticContact CG-CD2 3.76Å; F121-Y178 HydrophobicContact CG-CD2 3.76Å; F121-Y178 HydrophobicContact CG-CE2 4.5Å; F121-Y178 AromaticContact CZ-CD2 3.52Å; F121-Y178 HydrophobicContact CZ-CD2 3.52Å; F121-Y178 HydrophobicContact CZ-CE2 4.04Å; F121-Y178 HydrophobicContact CZ-CG 4.03Å; Y178-V180 HydrophobicContact CD1-CB 3.96Å; Y178-V180 HydrophobicContact CD1-CG1 4.43Å; Y178-V180 HydrophobicContact CE1-CB 3.68Å; Y178-V180 HydrophobicContact CE1-CG2 4.03Å; Y178-L249 HydrophobicContact CD1-CD1 4.16Å; Y178-L249 PolarHBondContact N-O 3.42Å; Y178-L249 PolarHBondContact O-N 3.11Å; Y178-I270 HydrophobicContact CD1-CD1 3.32Å; Y178-I270 HydrophobicContact CE1-CD1 3.17Å; Y178-I270 HydrophobicContact CG-CD1 4.35Å
179	S	87.4	Confident	83.8	Confident	59 Å²	59	37.7 Å²	37.7	41%	0.413	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.5	177.9	-173.8	0	0	0	0	110.2	G120 Q246	G120-S179 PolarHBondContact O-N 3.4Å; S179-Q246 PolarHBondContact OG-NE2 3.42Å
180	V	87.8	Confident	84.2	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.042	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	142.1	-177.1	68.2	0	0	0	0	111.7	Y178 L182 L247 L249 I270 V273	Y178-V180 HydrophobicContact CD1-CB 3.96Å; Y178-V180 HydrophobicContact CD1-CG1 4.43Å; Y178-V180 HydrophobicContact CE1-CB 3.68Å; Y178-V180 HydrophobicContact CE1-CG2 4.03Å; V180-L182 HydrophobicContact CG1-CD2 4.44Å; V180-L182 HydrophobicContact CG2-CD2 3.93Å; V180-L247 HydrophobicContact CG1-CB 4.11Å; V180-L247 PolarHBondContact N-O 3.1Å; V180-L247 PolarHBondContact O-N 3.35Å; V180-L249 HydrophobicContact CG1-CD1 4.17Å; V180-L249 HydrophobicContact CG1-CD2 4.49Å; V180-L249 HydrophobicContact CG1-CG 4.1Å; V180-I270 HydrophobicContact CG2-CG2 4.19Å; V180-V273 HydrophobicContact CG2-CG1 3.43Å; V180-V273 VanDerWaalsContact CG2-CG1 3.43Å
181	K	84.7	Confident	84.9	Confident	101 Å²	101	39 Å²	39	44%	0.439	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	109	173	-166.8	170.6	-177	168.5	0	109.8
182	L	85.1	Confident	85.9	Confident	4 Å²	4	34.1 Å²	34.1	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	120.2	175.1	-59.6	-169.1	0	0	0	110	V180 L242 S244 G245 L247 I270 R271 G272 V273	V180-L182 HydrophobicContact CG1-CD2 4.44Å; V180-L182 HydrophobicContact CG2-CD2 3.93Å; L182-L242 HydrophobicContact CD1-CB 3.32Å; L182-L242 HydrophobicContact CD1-CD1 3.73Å; L182-L242 HydrophobicContact CD1-CG 4.17Å; L182-S244 CarbonylContact O-C 3.44Å; L182-S244 WeakPolarHBondContact O-CA 3.37Å; L182-G245 PolarHBondContact N-O 2.81Å; L182-G245 PolarHBondContact O-N 3.34Å; L182-L247 HydrophobicContact CD1-CD1 3.72Å; L182-L247 HydrophobicContact CG-CD1 4.16Å; L182-I270 HydrophobicContact CD2-CG2 4Å; L182-R271 WeakPolarHBondContact CD2-O 3.31Å; L182-G272 CarbonylContact C-O 3.5Å; L182-G272 WeakPolarHBondContact CA-O 3.17Å; L182-V273 HydrophobicContact CD2-CG1 3.87Å
183	V	80.9	Confident	86.2	Confident	44 Å²	44	34.8 Å²	34.8	27%	0.267	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-31.2	175.7	163.5	0	0	0	0	111.7	C75 G272 A274	C75-V183 WeakPolarHBondContact O-CG1 3.49Å; V183-G272 PolarHBondContact N-O 3.44Å; V183-A274 HydrophobicContact CB-CB 4.41Å; V183-A274 HydrophobicContact CG2-CB 3.45Å; V183-A274 VanDerWaalsContact CG2-CB 3.45Å
184	R	81	Confident	86.3	Confident	109 Å²	109	34.7 Å²	34.7	41%	0.411	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	157.2	-179.6	60.5	179.8	173.1	-173.1	-5.5	109.3	S78 G186 G272	S78-R184 PolarHBondContact OG-NH2 3.46Å; S78-R184 VanDerWaalsContact OG-NH2 3.1Å; R184-G186 PolarHBondContact O-N 3.01Å; R184-G272 PolarHBondContact N-O 3.23Å
185	P	83	Confident	85.4	Confident	99 Å²	99	36 Å²	36	64%	0.643	18%	0.181	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-50.5	133.7	170	-25.4	34.6	0	0	0	110.4	L242	P185-L242 WeakPolarHBondContact CA-O 3.49Å
186	G	85.4	Confident	84.4	Confident	9 Å²	9	37.7 Å²	37.7	9%	0.093	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	-160.9	-171	0	0	0	0	0	111.2	R184 M241 L242 R271	R184-G186 PolarHBondContact O-N 3.01Å; G186-M241 CarbonylContact O-C 3.23Å; G186-M241 WeakPolarHBondContact O-CA 3.43Å; G186-L242 PolarHBondContact N-O 3.37Å; G186-L242 PolarHBondContact O-N 3.25Å; G186-R271 VanDerWaalsContact CA-O 3.31Å; G186-R271 WeakPolarHBondContact CA-O 3.46Å
187	Y	86.9	Confident	83	Confident	51 Å²	51	40.2 Å²	40.2	20%	0.2	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	156	173.9	65.1	-96.2	0	0	0	111.1	K189 N239 V240 E269 I270 R271	Y187-K189 HydrophobicContact CD2-CB 4.17Å; Y187-K189 HydrophobicContact CE2-CB 4.11Å; Y187-N239 HydrophobicContact CD1-CB 4.44Å; Y187-N239 HydrophobicContact CD2-CB 4.14Å; Y187-N239 VanDerWaalsContact CD2-OD1 3.27Å; Y187-N239 WeakPolarHBondContact CD2-OD1 3.31Å; Y187-N239 WeakPolarHBondContact CE2-OD1 3.48Å; Y187-N239 HydrophobicContact CG-CB 3.89Å; Y187-V240 WeakPolarHBondContact CA-O 3.43Å; Y187-V240 WeakPolarHBondContact CB-O 3.39Å; Y187-E269 PolarHBondContact OH-OE1 2.96Å; Y187-I270 WeakPolarHBondContact O-CA 3.44Å; Y187-R271 HydrophobicContact CD1-CB 3.98Å; Y187-R271 HydrophobicContact CD1-CG 4.09Å; Y187-R271 HydrophobicContact CD2-CG 4.46Å; Y187-R271 HydrophobicContact CE1-CB 3.86Å; Y187-R271 HydrophobicContact CE1-CG 3.47Å; Y187-R271 VanDerWaalsContact CE1-CG 3.47Å; Y187-R271 HydrophobicContact CE2-CG 3.87Å; Y187-R271 HydrophobicContact CG-CB 4.4Å; Y187-R271 PolarHBondContact N-O 3.42Å; Y187-R271 PolarHBondContact O-N 2.81Å; Y187-R271 WeakPolarHBondContact OH-CG 3.45Å
188	V	87.7	Confident	81.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	137.2	165.7	56.2	0	0	0	0	109.7	Y190 F203 V240 L242 L249 E269 I270	V188-Y190 HydrophobicContact CG2-CD1 4.31Å; V188-F203 HydrophobicContact CG1-CE1 3.86Å; V188-F203 HydrophobicContact CG1-CZ 3.62Å; V188-V240 HydrophobicContact CG1-CB 3.76Å; V188-V240 HydrophobicContact CG1-CG1 4.38Å; V188-V240 HydrophobicContact CG1-CG2 4.36Å; V188-V240 PolarHBondContact N-O 2.94Å; V188-V240 VanDerWaalsContact N-O 3.09Å; V188-V240 PolarHBondContact O-N 3.26Å; V188-L242 HydrophobicContact CB-CD1 3.91Å; V188-L242 HydrophobicContact CG1-CD1 3.87Å; V188-L242 HydrophobicContact CG1-CD2 4.09Å; V188-L242 HydrophobicContact CG1-CG 4.13Å; V188-L249 HydrophobicContact CB-CD1 4.27Å; V188-L249 HydrophobicContact CG2-CD1 4.08Å; V188-E269 CarbonylContact C-O 3.46Å; V188-E269 WeakPolarHBondContact CA-O 3.05Å; V188-I270 HydrophobicContact CB-CG1 4.22Å; V188-I270 HydrophobicContact CG2-CG1 3.87Å
189	K	85.6	Confident	80.8	Confident	52 Å²	52	38 Å²	38	23%	0.226	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	133.2	177.7	178.9	-179.2	178.4	-170.3	0	108.4	Y187 E234 I268 E269	Y187-K189 HydrophobicContact CD2-CB 4.17Å; Y187-K189 HydrophobicContact CE2-CB 4.11Å; K189-E234 WeakPolarHBondContact CE-OE1 3.33Å; K189-E234 IonicContact NZ-OE1 3.63Å; K189-E234 PolarHBondContact NZ-OE1 3Å; K189-I268 CarbonylContact O-C 3.59Å; K189-E269 HydrophobicContact CB-CB 4.4Å; K189-E269 PolarHBondContact N-O 2.79Å; K189-E269 PolarHBondContact O-N 3.41Å
190	Y	87.4	Confident	80.2	Confident	15 Å²	15	37 Å²	37	6%	0.059	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	145.3	175.9	59.8	-86.1	0	0	0	111.3	V188 Y192 F203 P224 W251 I265 G267	V188-Y190 HydrophobicContact CG2-CD1 4.31Å; Y190-Y192 AromaticContact CD2-CD1 3.98Å; Y190-Y192 HydrophobicContact CD2-CD1 3.98Å; Y190-Y192 AromaticContact CE2-CD1 3.66Å; Y190-Y192 HydrophobicContact CE2-CD1 3.66Å; Y190-Y192 HydrophobicContact CE2-CE1 4.34Å; Y190-Y192 HydrophobicContact CE2-CG 4.24Å; Y190-F203 HydrophobicContact CE1-CD1 4.34Å; Y190-F203 HydrophobicContact CE1-CD2 4.16Å; Y190-F203 HydrophobicContact CE1-CE2 4.43Å; Y190-F203 HydrophobicContact CE1-CG 4.12Å; Y190-F203 WeakPolarHBondContact OH-CB 3.3Å; Y190-P224 WeakPolarHBondContact OH-CG 3.36Å; Y190-W251 HydrophobicContact CD1-CZ2 4.17Å; Y190-W251 AromaticContact CD1-NE1 3.77Å; Y190-W251 AromaticContact CD2-NE1 3.8Å; Y190-W251 AromaticContact CE1-NE1 3.63Å; Y190-W251 AromaticContact CE2-NE1 3.68Å; Y190-W251 HydrophobicContact CG-CZ2 4.46Å; Y190-W251 AromaticContact CG-NE1 3.87Å; Y190-W251 AromaticContact CZ-NE1 3.6Å; Y190-I265 HydrophobicContact CD2-CG2 4.43Å; Y190-G267 VanDerWaalsContact CA-O 3.28Å; Y190-G267 WeakPolarHBondContact CA-O 3.1Å
191	K	86.3	Confident	79.8	Confident	65 Å²	65	36.9 Å²	36.9	28%	0.283	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	140.4	171.3	-44.8	-167.8	-170.1	-155.9	0	109.7	E234 I265 K266 G267	K191-E234 HydrophobicContact CD-CB 4.05Å; K191-E234 HydrophobicContact CD-CG 4.31Å; K191-E234 WeakPolarHBondContact CE-OE2 3.39Å; K191-E234 HydrophobicContact CG-CB 4.04Å; K191-E234 HydrophobicContact CG-CG 4.14Å; K191-E234 IonicContact NZ-OE1 3.93Å; K191-E234 IonicContact NZ-OE2 3.61Å; K191-E234 PolarHBondContact NZ-OE2 3.09Å; K191-I265 WeakPolarHBondContact O-CA 3.44Å; K191-K266 CarbonylContact C-O 3.49Å; K191-K266 WeakPolarHBondContact CA-O 3.09Å; K191-K266 WeakPolarHBondContact CB-O 3.5Å; K191-K266 PolarHBondContact N-O 2.03Å; K191-K266 PolarHBondContact O-N 2.88Å; K191-G267 PolarHBondContact N-O 3.03Å
192	Y	87.1	Confident	79.6	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.016	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	157.8	179.4	69.9	-84.8	0	0	0	112.8	Y190 Y194 F201 P224 P225 T227 R233 K264	Y190-Y192 AromaticContact CD2-CD1 3.98Å; Y190-Y192 HydrophobicContact CD2-CD1 3.98Å; Y190-Y192 AromaticContact CE2-CD1 3.66Å; Y190-Y192 HydrophobicContact CE2-CD1 3.66Å; Y190-Y192 HydrophobicContact CE2-CE1 4.34Å; Y190-Y192 HydrophobicContact CE2-CG 4.24Å; Y192-Y194 HydrophobicContact CE2-CD1 4.46Å; Y192-F201 AromaticContact CD2-CE1 3.9Å; Y192-F201 HydrophobicContact CD2-CE1 3.9Å; Y192-F201 HydrophobicContact CE2-CE1 4.35Å; Y192-F201 HydrophobicContact CG-CE1 4.19Å; Y192-P224 HydrophobicContact CD2-CB 4.48Å; Y192-P224 HydrophobicContact CE1-CB 3.98Å; Y192-P224 HydrophobicContact CE2-CB 3.81Å; Y192-P225 WeakPolarHBondContact CE2-O 3.27Å; Y192-P225 WeakPolarHBondContact OH-CD 3.45Å; Y192-P225 WeakPolarHBondContact OH-CG 3.4Å; Y192-P225 PolarHBondContact OH-O 3.23Å; Y192-T227 HydrophobicContact CD2-CG2 4.01Å; Y192-T227 HydrophobicContact CE2-CG2 3.65Å; Y192-R233 HydrophobicContact CE1-CB 4.38Å; Y192-R233 PolarHBondContact N-O 2.86Å; Y192-R233 PolarHBondContact O-N 2.87Å; Y192-K264 CarbonylContact C-O 3.52Å; Y192-K264 WeakPolarHBondContact CA-O 3.16Å
193	L	84.4	Confident	79.5	Confident	17 Å²	17	32.1 Å²	32.1	9%	0.089	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.1	171	-175.3	76.2	0	0	0	107.1	A231 W232 I263 K264	L193-A231 WeakPolarHBondContact CD1-O 3.45Å; L193-W232 HydrophobicContact CB-CD2 4.39Å; L193-W232 HydrophobicContact CB-CE3 4.12Å; L193-W232 HydrophobicContact CB-CH2 4.49Å; L193-W232 HydrophobicContact CB-CZ3 4.18Å; L193-I263 WeakPolarHBondContact O-CA 3.49Å; L193-I263 WeakPolarHBondContact O-CG2 3.23Å; L193-K264 HydrophobicContact CB-CB 4.19Å; L193-K264 HydrophobicContact CD2-CD 4.12Å; L193-K264 PolarHBondContact N-O 2.7Å; L193-K264 PolarHBondContact O-N 2.87Å
194	Y	80.8	Confident	79.4	Confident	19 Å²	19	32.1 Å²	32.1	8%	0.075	17%	0.174	C	C	.	.			trans	-138.9	78.4	-176	171.2	-139.7	0	0	0	109.1	Y192 D196 G197 I199 F201 P224 T226 T227 I263	Y192-Y194 HydrophobicContact CE2-CD1 4.46Å; Y194-D196 WeakPolarHBondContact CE2-O 3.5Å; Y194-D196 PolarHBondContact O-N 2.91Å; Y194-G197 WeakPolarHBondContact OH-CA 3.26Å; Y194-I199 HydrophobicContact CE2-CB 4.2Å; Y194-I199 VanDerWaalsContact CE2-O 3.23Å; Y194-I199 WeakPolarHBondContact CE2-O 3.41Å; Y194-I199 VanDerWaalsContact CZ-O 3.3Å; Y194-I199 PolarHBondContact OH-O 3.16Å; Y194-F201 HydrophobicContact CD1-CB 4.37Å; Y194-F201 AromaticContact CD1-CD1 3.89Å; Y194-F201 HydrophobicContact CD1-CD1 3.89Å; Y194-F201 HydrophobicContact CD2-CB 4.29Å; Y194-F201 HydrophobicContact CE1-CB 4.15Å; Y194-F201 HydrophobicContact CE1-CD1 4.41Å; Y194-F201 HydrophobicContact CE2-CB 4.03Å; Y194-F201 HydrophobicContact CG-CB 4.46Å; Y194-F201 AromaticContact CG-CD1 3.96Å; Y194-F201 HydrophobicContact CG-CD1 3.96Å; Y194-P224 WeakPolarHBondContact CD1-O 3.39Å; Y194-P224 WeakPolarHBondContact CE1-O 3.33Å; Y194-T226 HydrophobicContact CD1-CG2 4.03Å; Y194-T226 HydrophobicContact CE1-CG2 3.54Å; Y194-T226 CarbonylContact O-C 3.53Å; Y194-T226 WeakPolarHBondContact O-CA 3.5Å; Y194-T227 PolarHBondContact N-OG1 3.29Å; Y194-T227 PolarHBondContact O-N 3.16Å; Y194-T227 PolarHBondContact O-OG1 2.06Å; Y194-I263 HydrophobicContact CD2-CD1 3.82Å; Y194-I263 HydrophobicContact CD2-CG1 3.85Å; Y194-I263 HydrophobicContact CE2-CD1 4.17Å
195	P	69.9	Low	79.5	Confident	26 Å²	26	27.1 Å²	27.1	17%	0.169	16%	0.156	C	C	.	.			trans	-77.1	-18.3	-165.9	31.3	-37.4	0	0	0	114.5	T227 K261	P195-T227 WeakPolarHBondContact CA-O 3.01Å; P195-K261 HydrophobicContact CG-CB 3.69Å; P195-K261 HydrophobicContact CG-CD 4.38Å
196	D	64.8	Low	79.6	Confident	47 Å²	47	24.5 Å²	24.5	25%	0.251	14%	0.135	S	C	.	.			trans	-131.9	116.3	-163.7	-170.8	-23.3	0	0	0	111.4	Y194 G198 I199 H260	Y194-D196 WeakPolarHBondContact CE2-O 3.5Å; Y194-D196 PolarHBondContact O-N 2.91Å; D196-G198 PolarHBondContact O-N 2.05Å; D196-G198 VanDerWaalsContact O-N 3.14Å; D196-G198 PolarHBondContact OD1-N 2.89Å; D196-I199 PolarHBondContact O-N 2.84Å; D196-H260 HydrophobicContact CB-CB 4.46Å; D196-H260 IonicContact OD1-CE1 2.9Å; D196-H260 IonicContact OD1-ND1 3.87Å; D196-H260 PolarHBondContact OD1-ND1 3.36Å; D196-H260 WeakPolarHBondContact OD2-CB 3.45Å; D196-H260 IonicContact OD2-CE1 2.74Å; D196-H260 IonicContact OD2-CG 2.95Å; D196-H260 IonicContact OD2-ND1 3.73Å; D196-H260 PolarHBondContact OD2-ND1 2.95Å
197	G	64.5	Low	79.4	Confident	52 Å²	52	26 Å²	26	54%	0.536	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-9.3	-179.6	0	0	0	0	0	115.5	Y194 I199	Y194-G197 WeakPolarHBondContact OH-CA 3.26Å; G197-I199 VanDerWaalsContact C-N 3.34Å
198	G	66	Low	78.8	Confident	18 Å²	18	29.2 Å²	29.2	19%	0.186	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.6	178.1	0	0	0	0	0	114.9	D196 L256 H260	D196-G198 PolarHBondContact O-N 2.05Å; D196-G198 VanDerWaalsContact O-N 3.14Å; D196-G198 PolarHBondContact OD1-N 2.89Å; G198-L256 WeakPolarHBondContact O-CB 3.4Å; G198-L256 PolarHBondContact O-N 3.03Å; G198-H260 VanDerWaalsContact CA-CE1 3.43Å; G198-H260 WeakPolarHBondContact CA-CE1 3.14Å; G198-H260 PolarHBondContact O-NE2 3.09Å
199	I	70.8	Confident	78.2	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	119.1	166.2	-55.5	176.7	0	0	0	108	Y167 P169 Y194 D196 G197 F201 M254 V255 H260 K261 I263	Y167-I199 HydrophobicContact CD1-CD1 4.5Å; Y167-I199 HydrophobicContact CD1-CG2 4.12Å; Y167-I199 HydrophobicContact CE1-CD1 4.4Å; Y167-I199 HydrophobicContact CE1-CG2 3.68Å; P169-I199 HydrophobicContact CG-CD1 4.13Å; Y194-I199 HydrophobicContact CE2-CB 4.2Å; Y194-I199 VanDerWaalsContact CE2-O 3.23Å; Y194-I199 WeakPolarHBondContact CE2-O 3.41Å; Y194-I199 VanDerWaalsContact CZ-O 3.3Å; Y194-I199 PolarHBondContact OH-O 3.16Å; D196-I199 PolarHBondContact O-N 2.84Å; G197-I199 VanDerWaalsContact C-N 3.34Å; I199-F201 PolarHBondContact O-N 3.29Å; I199-F201 VanDerWaalsContact O-N 3.17Å; I199-M254 CarbonylContact C-O 3.56Å; I199-M254 WeakPolarHBondContact CA-O 3.4Å; I199-M254 WeakPolarHBondContact CG2-O 3.44Å; I199-V255 HydrophobicContact CG1-CG2 4.48Å; I199-H260 HydrophobicContact CD1-CB 3.57Å; I199-H260 HydrophobicContact CG1-CB 3.43Å; I199-H260 VanDerWaalsContact CG1-CB 3.43Å; I199-K261 WeakPolarHBondContact CD1-O 3.18Å; I199-I263 HydrophobicContact CB-CD1 4.22Å; I199-I263 HydrophobicContact CD1-CG1 4.2Å; I199-I263 HydrophobicContact CG2-CD1 3.58Å; I199-I263 HydrophobicContact CG2-CG1 4.29Å
200	F	73.5	Confident	77.5	Confident	38 Å²	38	37.4 Å²	37.4	17%	0.167	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	122	166.1	172.8	-83.1	0	0	0	109.4	A202 K252 A253 M254 L256	F200-A202 HydrophobicContact CE1-CB 4.12Å; F200-K252 HydrophobicContact CE1-CB 4.21Å; F200-A253 WeakPolarHBondContact O-CA 3.18Å; F200-M254 HydrophobicContact CB-CG 3.48Å; F200-M254 VanDerWaalsContact CB-CG 3.48Å; F200-M254 WeakPolarHBondContact CB-O 3.45Å; F200-M254 HydrophobicContact CD1-CG 3.68Å; F200-M254 HydrophobicContact CD1-SD 4.37Å; F200-M254 HydrophobicContact CE1-CG 4.4Å; F200-M254 HydrophobicContact CG-CG 3.73Å; F200-M254 HydrophobicContact CG-SD 4.36Å; F200-M254 PolarHBondContact N-O 2.76Å; F200-M254 PolarHBondContact O-N 3Å; F200-L256 HydrophobicContact CB-CD1 4.4Å; F200-L256 HydrophobicContact CB-CD2 4.39Å; F200-L256 HydrophobicContact CB-CG 4.24Å
201	F	80.6	Confident	76.9	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	125	174.9	-177.2	-137.3	0	0	0	109.5	W158 Y192 Y194 I199 P224 W251 K252 A253 I263 I265	W158-F201 HydrophobicContact CH2-CD2 4.45Å; W158-F201 AromaticContact CH2-CE2 3.77Å; W158-F201 HydrophobicContact CH2-CE2 3.77Å; W158-F201 HydrophobicContact CH2-CZ 4.46Å; W158-F201 HydrophobicContact CZ2-CD2 4.22Å; W158-F201 AromaticContact CZ2-CE2 3.76Å; W158-F201 HydrophobicContact CZ2-CE2 3.76Å; Y192-F201 AromaticContact CD2-CE1 3.9Å; Y192-F201 HydrophobicContact CD2-CE1 3.9Å; Y192-F201 HydrophobicContact CE2-CE1 4.35Å; Y192-F201 HydrophobicContact CG-CE1 4.19Å; Y194-F201 HydrophobicContact CD1-CB 4.37Å; Y194-F201 AromaticContact CD1-CD1 3.89Å; Y194-F201 HydrophobicContact CD1-CD1 3.89Å; Y194-F201 HydrophobicContact CD2-CB 4.29Å; Y194-F201 HydrophobicContact CE1-CB 4.15Å; Y194-F201 HydrophobicContact CE1-CD1 4.41Å; Y194-F201 HydrophobicContact CE2-CB 4.03Å; Y194-F201 HydrophobicContact CG-CB 4.46Å; Y194-F201 AromaticContact CG-CD1 3.96Å; Y194-F201 HydrophobicContact CG-CD1 3.96Å; I199-F201 PolarHBondContact O-N 3.29Å; I199-F201 VanDerWaalsContact O-N 3.17Å; F201-P224 HydrophobicContact CD1-CB 3.78Å; F201-P224 HydrophobicContact CD1-CG 3.74Å; F201-P224 HydrophobicContact CE1-CB 3.67Å; F201-P224 HydrophobicContact CE1-CG 3.56Å; F201-P224 HydrophobicContact CZ-CG 4.26Å; F201-W251 HydrophobicContact CE2-CB 4.32Å; F201-K252 WeakPolarHBondContact CA-O 3.38Å; F201-A253 HydrophobicContact CD2-CB 4.47Å; F201-I263 HydrophobicContact CB-CD1 3.61Å; F201-I263 HydrophobicContact CD1-CD1 4.35Å; F201-I263 HydrophobicContact CD1-CG2 4.44Å; F201-I263 HydrophobicContact CD2-CD1 3.79Å; F201-I263 HydrophobicContact CD2-CG2 4.39Å; F201-I263 HydrophobicContact CE1-CG2 4.23Å; F201-I263 HydrophobicContact CE2-CG2 4.21Å; F201-I263 HydrophobicContact CG-CD1 3.67Å; F201-I263 HydrophobicContact CZ-CG2 4.12Å; F201-I265 HydrophobicContact CE2-CD1 4.22Å; F201-I265 HydrophobicContact CZ-CD1 4.01Å; F201-I265 HydrophobicContact CZ-CG1 4.35Å
202	A	79.2	Confident	76	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	143.1	-177.9	0	0	0	0	0	112.5	F200 M222 W251 K252	F200-A202 HydrophobicContact CE1-CB 4.12Å; A202-M222 CarbonylContact C-O 3.39Å; A202-M222 WeakPolarHBondContact CA-O 3.02Å; A202-M222 WeakPolarHBondContact CB-O 3.19Å; A202-W251 CarbonylContact O-C 3.57Å; A202-W251 WeakPolarHBondContact O-CA 3.31Å; A202-K252 PolarHBondContact N-O 3.23Å; A202-K252 PolarHBondContact O-N 3.26Å
203	F	83.2	Confident	74.9	Confident	5 Å²	5	42.2 Å²	42.2	2%	0.022	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124.9	171	178.5	-110.9	0	0	0	109.3	V188 Y190 V205 M222 P224 V240 L249 S250 W251	V188-F203 HydrophobicContact CG1-CE1 3.86Å; V188-F203 HydrophobicContact CG1-CZ 3.62Å; Y190-F203 HydrophobicContact CE1-CD1 4.34Å; Y190-F203 HydrophobicContact CE1-CD2 4.16Å; Y190-F203 HydrophobicContact CE1-CE2 4.43Å; Y190-F203 HydrophobicContact CE1-CG 4.12Å; Y190-F203 WeakPolarHBondContact OH-CB 3.3Å; F203-V205 HydrophobicContact CE1-CG2 3.68Å; F203-V205 HydrophobicContact CZ-CG2 3.75Å; F203-M222 PolarHBondContact N-O 3.29Å; F203-M222 VanDerWaalsContact O-CA 3.3Å; F203-M222 WeakPolarHBondContact O-CA 3.22Å; F203-P224 HydrophobicContact CB-CG 4.42Å; F203-V240 HydrophobicContact CE1-CB 4.44Å; F203-V240 HydrophobicContact CE1-CG1 4.16Å; F203-V240 HydrophobicContact CE1-CG2 4.29Å; F203-L249 HydrophobicContact CE2-CB 4.09Å; F203-L249 HydrophobicContact CZ-CB 4.31Å; F203-L249 HydrophobicContact CZ-CD2 4.26Å; F203-S250 CarbonylContact C-O 3.46Å; F203-S250 WeakPolarHBondContact CA-O 3.06Å; F203-W251 AromaticContact CD2-CD1 3.68Å; F203-W251 HydrophobicContact CD2-CD2 4.04Å; F203-W251 AromaticContact CD2-CE2 3.61Å; F203-W251 HydrophobicContact CD2-CG 4.09Å; F203-W251 HydrophobicContact CD2-CZ2 4.14Å; F203-W251 AromaticContact CD2-NE1 3.37Å; F203-W251 HydrophobicContact CE2-CD2 4.21Å; F203-W251 AromaticContact CE2-CE2 3.63Å; F203-W251 HydrophobicContact CE2-CH2 4.27Å; F203-W251 AromaticContact CE2-CZ2 3.68Å; F203-W251 HydrophobicContact CE2-CZ2 3.68Å; F203-W251 AromaticContact CE2-NE1 3.84Å
204	Q	79.7	Confident	73.5	Confident	43 Å²	43	49.1 Å²	49.1	20%	0.201	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	144.2	-179.7	-65.8	-174.8	-56.7	0	0	110.8	M222 S250	Q204-M222 HydrophobicContact CG-CG 4.2Å; Q204-M222 HydrophobicContact CG-SD 4.31Å; Q204-S250 WeakPolarHBondContact CB-OG 3.5Å; Q204-S250 PolarHBondContact N-O 3.15Å; Q204-S250 PolarHBondContact O-N 3.31Å; Q204-S250 PolarHBondContact O-OG 3.1Å
205	V	83.7	Confident	72.4	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.03	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	126.2	174.9	-177.3	0	0	0	0	108.6	F203 V213 L218 L242 L247 L248 L249	F203-V205 HydrophobicContact CE1-CG2 3.68Å; F203-V205 HydrophobicContact CZ-CG2 3.75Å; V205-V213 HydrophobicContact CG1-CG2 4.24Å; V205-V213 PolarHBondContact O-N 2.96Å; V205-V213 VanDerWaalsContact O-N 3.08Å; V205-L218 HydrophobicContact CB-CD2 3.45Å; V205-L218 VanDerWaalsContact CB-CD2 3.45Å; V205-L218 HydrophobicContact CG1-CD2 4.35Å; V205-L218 HydrophobicContact CG2-CD2 3.51Å; V205-L242 HydrophobicContact CG1-CD2 4.14Å; V205-L242 HydrophobicContact CG2-CD2 3.82Å; V205-L247 HydrophobicContact CG1-CB 4.22Å; V205-L247 HydrophobicContact CG1-CD1 4.17Å; V205-L247 HydrophobicContact CG1-CD2 4Å; V205-L247 HydrophobicContact CG1-CG 4.38Å; V205-L248 WeakPolarHBondContact CA-O 3.41Å; V205-L249 HydrophobicContact CB-CD2 4.42Å; V205-L249 HydrophobicContact CG1-CD2 3.97Å; V205-L249 HydrophobicContact CG2-CD2 3.82Å
206	Q	83.8	Confident	71.6	Confident	43 Å²	43	53.5 Å²	53.5	20%	0.201	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	150.5	174.6	-61.8	172.3	-70.1	0	0	109.7	C210 I211 L247 L248	Q206-C210 PolarHBondContact NE2-O 3.02Å; Q206-I211 VanDerWaalsContact CA-O 3.31Å; Q206-I211 WeakPolarHBondContact CA-O 3.49Å; Q206-L247 CarbonylContact O-C 3.55Å; Q206-L247 WeakPolarHBondContact O-CA 3.49Å; Q206-L248 HydrophobicContact CB-CB 4.3Å; Q206-L248 PolarHBondContact N-O 3.07Å; Q206-L248 PolarHBondContact O-N 3.3Å
207	N	80.8	Confident	71.3	Confident	41 Å²	41	55.1 Å²	55.1	22%	0.219	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-175	170.1	67.6	1.2	0	0	0	111.6	Q209 C210 I211 V213 Q246	N207-Q209 PolarHBondContact O-N 3.18Å; N207-Q209 WeakPolarHBondContact OD1-CA 3.36Å; N207-Q209 PolarHBondContact OD1-N 3.15Å; N207-Q209 VanDerWaalsContact OD1-N 3.09Å; N207-C210 PolarHBondContact O-N 3.3Å; N207-C210 PolarHBondContact OD1-N 2.85Å; N207-I211 PolarHBondContact N-O 2.61Å; N207-I211 WeakPolarHBondContact OD1-CB 3.21Å; N207-I211 PolarHBondContact OD1-N 2.79Å; N207-I211 PolarHBondContact OD1-O 2.89Å; N207-V213 HydrophobicContact CB-CG2 4.49Å; N207-Q246 WeakPolarHBondContact CA-O 3.09Å
208	D	75.7	Confident	70.9	Confident	119 Å²	119	53.5 Å²	53.5	64%	0.636	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-24.6	173.6	54.1	-13.8	0	0	0	114.9	C210 Q246	D208-C210 VanDerWaalsContact C-N 3.27Å; D208-Q246 HydrophobicContact CB-CB 4.1Å; D208-Q246 HydrophobicContact CB-CG 4.4Å; D208-Q246 PolarHBondContact N-O 2.8Å
209	Q	74.7	Confident	70.4	Confident	139 Å²	139	54.5 Å²	54.5	65%	0.65	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	9.2	174.8	-61.7	-176.8	-25.9	0	0	113.1	N207 I211	N207-Q209 PolarHBondContact O-N 3.18Å; N207-Q209 WeakPolarHBondContact OD1-CA 3.36Å; N207-Q209 PolarHBondContact OD1-N 3.15Å; N207-Q209 VanDerWaalsContact OD1-N 3.09Å; Q209-I211 HydrophobicContact CB-CD1 3.91Å; Q209-I211 HydrophobicContact CB-CG1 3.95Å; Q209-I211 PolarHBondContact O-N 2.96Å; Q209-I211 VanDerWaalsContact O-N 3.11Å
210	C	71.4	Confident	70	Confident	85 Å²	85	62.3 Å²	62.3	57%	0.574	35%	0.348	S	S	*	.	S	Bend	trans	60.1	14.3	-174.4	-62	0	0	0	0	114.4	Q206 N207 D208	Q206-C210 PolarHBondContact NE2-O 3.02Å; N207-C210 PolarHBondContact O-N 3.3Å; N207-C210 PolarHBondContact OD1-N 2.85Å; D208-C210 VanDerWaalsContact C-N 3.27Å
211	I	73.1	Confident	69.5	Low	92 Å²	92	63 Å²	63	47%	0.472	35%	0.351	S	S	.	.			trans	-82.1	130.5	177.9	-57.3	174.1	0	0	0	108.1	Q206 N207 Q209 V213	Q206-I211 VanDerWaalsContact CA-O 3.31Å; Q206-I211 WeakPolarHBondContact CA-O 3.49Å; N207-I211 PolarHBondContact N-O 2.61Å; N207-I211 WeakPolarHBondContact OD1-CB 3.21Å; N207-I211 PolarHBondContact OD1-N 2.79Å; N207-I211 PolarHBondContact OD1-O 2.89Å; Q209-I211 HydrophobicContact CB-CD1 3.91Å; Q209-I211 HydrophobicContact CB-CG1 3.95Å; Q209-I211 PolarHBondContact O-N 2.96Å; Q209-I211 VanDerWaalsContact O-N 3.11Å; I211-V213 PolarHBondContact O-N 3.33Å
212	S	68.4	Low	68.7	Low	59 Å²	59	64.9 Å²	64.9	41%	0.413	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-60.4	126.1	171	53.1	0	0	0	0	109.7	N214	S212-N214 PolarHBondContact O-N 2.76Å
213	V	64.4	Low	68.5	Low	34 Å²	34	68.4 Å²	68.4	21%	0.206	38%	0.376	C	S	.	.			trans	-68	101.7	177.1	-178	0	0	0	0	108.3	V205 N207 I211 D215 L218 L247	V205-V213 HydrophobicContact CG1-CG2 4.24Å; V205-V213 PolarHBondContact O-N 2.96Å; V205-V213 VanDerWaalsContact O-N 3.08Å; N207-V213 HydrophobicContact CB-CG2 4.49Å; I211-V213 PolarHBondContact O-N 3.33Å; V213-D215 HydrophobicContact CG1-CB 4.41Å; V213-D215 PolarHBondContact O-N 3.48Å; V213-L218 HydrophobicContact CB-CD2 4.29Å; V213-L247 HydrophobicContact CG2-CD2 4.36Å
214	N	53.9	Low	67.9	Low	162 Å²	162	68.6 Å²	68.6	87%	0.866	38%	0.378	S	S	*	.			trans	-75.5	75.1	176.8	-105	6.3	0	0	0	109.8	S212	S212-N214 PolarHBondContact O-N 2.76Å
215	D	57.4	Low	67.6	Low	54 Å²	54	69.2 Å²	69.2	29%	0.289	39%	0.385	S	S	.	.			trans	-103.9	129.6	167.5	-170	-24	0	0	0	108.4	V213 N217 L218 G219	V213-D215 HydrophobicContact CG1-CB 4.41Å; V213-D215 PolarHBondContact O-N 3.48Å; D215-N217 PolarHBondContact O-N 2.83Å; D215-N217 VanDerWaalsContact O-N 3.09Å; D215-N217 PolarHBondContact OD1-N 3.2Å; D215-L218 HydrophobicContact CB-CB 4.18Å; D215-L218 HydrophobicContact CB-CD1 3.88Å; D215-L218 PolarHBondContact O-N 2.04Å; D215-G219 PolarHBondContact O-N 3.47Å
216	A	54.7	Low	66.9	Low	82 Å²	82	72.3 Å²	72.3	68%	0.678	40%	0.404	S	S	*	.	H	α-helix	trans	-55.1	-26.6	175.5	0	0	0	0	0	112.3
217	N	56.9	Low	66	Low	81 Å²	81	70.9 Å²	70.9	43%	0.433	40%	0.398	S	S	.	.	H	α-helix	trans	-73	-43.4	171.8	-71.4	-32.8	0	0	0	112.2	D215 G219 K220 H221	D215-N217 PolarHBondContact O-N 2.83Å; D215-N217 VanDerWaalsContact O-N 3.09Å; D215-N217 PolarHBondContact OD1-N 3.2Å; N217-G219 PolarHBondContact O-N 3.4Å; N217-K220 PolarHBondContact O-N 2.93Å; N217-H221 PolarHBondContact O-CD2 3.38Å
218	L	57	Low	65.1	Low	18 Å²	18	73.4 Å²	73.4	9%	0.094	42%	0.415	C	S	.	.	H	α-helix	trans	-64.2	-37.9	177.6	-98.8	87.5	0	0	0	112.8	V205 V213 D215 K220 H221 M222 V240 M241	V205-L218 HydrophobicContact CB-CD2 3.45Å; V205-L218 VanDerWaalsContact CB-CD2 3.45Å; V205-L218 HydrophobicContact CG1-CD2 4.35Å; V205-L218 HydrophobicContact CG2-CD2 3.51Å; V213-L218 HydrophobicContact CB-CD2 4.29Å; D215-L218 HydrophobicContact CB-CB 4.18Å; D215-L218 HydrophobicContact CB-CD1 3.88Å; D215-L218 PolarHBondContact O-N 2.04Å; L218-K220 VanDerWaalsContact C-N 3.26Å; L218-K220 PolarHBondContact O-N 3.32Å; L218-H221 CarbonylContact O-C 3.51Å; L218-H221 WeakPolarHBondContact O-CA 3.3Å; L218-H221 PolarHBondContact O-N 2.81Å; L218-M222 PolarHBondContact O-N 2.81Å; L218-V240 HydrophobicContact CD1-CG1 4.04Å; L218-V240 HydrophobicContact CG-CG1 3.85Å; L218-M241 VanDerWaalsContact CD1-O 3.3Å; L218-M241 WeakPolarHBondContact CD1-O 3.44Å
219	G	56.1	Low	64.2	Low	40 Å²	40	73.4 Å²	73.4	41%	0.412	41%	0.412	S	S	.	.	H	α-helix	trans	-56.2	-40.2	-179.9	0	0	0	0	0	112.9	D215 N217 H221 M222	D215-G219 PolarHBondContact O-N 3.47Å; N217-G219 PolarHBondContact O-N 3.4Å; G219-H221 PolarHBondContact O-N 2.93Å; G219-M222 WeakPolarHBondContact O-CB 3.22Å; G219-M222 PolarHBondContact O-N 3.5Å
220	K	61.2	Low	63.4	Low	165 Å²	165	69.2 Å²	69.2	72%	0.717	40%	0.401	S	S	*	.	H	α-helix	trans	-63	-25.8	175.5	-67.2	178.5	-177.7	174.4	0	113.5	N217 L218	N217-K220 PolarHBondContact O-N 2.93Å; L218-K220 VanDerWaalsContact C-N 3.26Å; L218-K220 PolarHBondContact O-N 3.32Å
221	H	63.2	Low	62.8	Low	51 Å²	51	65.8 Å²	65.8	24%	0.236	38%	0.379	C	S	.	.	H	α-helix	trans	-101.5	-1.4	-177	-57.6	-58.1	0	0	0	113	N217 L218 G219 F223 V240	N217-H221 PolarHBondContact O-CD2 3.38Å; L218-H221 CarbonylContact O-C 3.51Å; L218-H221 WeakPolarHBondContact O-CA 3.3Å; L218-H221 PolarHBondContact O-N 2.81Å; G219-H221 PolarHBondContact O-N 2.93Å; H221-F223 PolarHBondContact O-N 3.03Å; H221-V240 HydrophobicContact CB-CG2 3.79Å
222	M	64.3	Low	62.6	Low	45 Å²	45	65.8 Å²	65.8	22%	0.222	37%	0.373	C	S	.	.	S	Bend	trans	-63.7	-31.3	-177.8	-176.8	166.3	69.6	0	0	112.5	A202 F203 Q204 L218 G219	A202-M222 CarbonylContact C-O 3.39Å; A202-M222 WeakPolarHBondContact CA-O 3.02Å; A202-M222 WeakPolarHBondContact CB-O 3.19Å; F203-M222 PolarHBondContact N-O 3.29Å; F203-M222 VanDerWaalsContact O-CA 3.3Å; F203-M222 WeakPolarHBondContact O-CA 3.22Å; Q204-M222 HydrophobicContact CG-CG 4.2Å; Q204-M222 HydrophobicContact CG-SD 4.31Å; L218-M222 PolarHBondContact O-N 2.81Å; G219-M222 WeakPolarHBondContact O-CB 3.22Å; G219-M222 PolarHBondContact O-N 3.5Å
223	F	74.3	Confident	62.3	Low	74 Å²	74	66.7 Å²	66.7	33%	0.325	37%	0.367	S	S	.	.	S	Bend	trans	-117.2	99.2	176.7	-62.8	-90.9	0	0	0	109.7	H221 R693	H221-F223 PolarHBondContact O-N 3.03Å; F223-R693 HydrophobicContact CE1-CG 4.45Å; F223-R693 HydrophobicContact CZ-CB 4.02Å; F223-R693 VanDerWaalsContact CZ-CD 3.42Å; F223-R693 HydrophobicContact CZ-CG 3.88Å; F223-R693 VanDerWaalsContact CZ-NH1 3.26Å
224	P	72	Confident	61.9	Low	9 Å²	9	68.5 Å²	68.5	6%	0.058	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-59.4	128	174.1	-23.6	36.1	0	0	0	109.3	Y190 Y192 Y194 F201 F203	Y190-P224 WeakPolarHBondContact OH-CG 3.36Å; Y192-P224 HydrophobicContact CD2-CB 4.48Å; Y192-P224 HydrophobicContact CE1-CB 3.98Å; Y192-P224 HydrophobicContact CE2-CB 3.81Å; Y194-P224 WeakPolarHBondContact CD1-O 3.39Å; Y194-P224 WeakPolarHBondContact CE1-O 3.33Å; F201-P224 HydrophobicContact CD1-CB 3.78Å; F201-P224 HydrophobicContact CD1-CG 3.74Å; F201-P224 HydrophobicContact CE1-CB 3.67Å; F201-P224 HydrophobicContact CE1-CG 3.56Å; F201-P224 HydrophobicContact CZ-CG 4.26Å; F203-P224 HydrophobicContact CB-CG 4.42Å
225	P	72.4	Confident	61.7	Low	55 Å²	55	63.8 Å²	63.8	36%	0.357	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-62.7	151.7	178.7	24.9	-35.1	0	0	0	110.9	Y192	Y192-P225 WeakPolarHBondContact CE2-O 3.27Å; Y192-P225 WeakPolarHBondContact OH-CD 3.45Å; Y192-P225 WeakPolarHBondContact OH-CG 3.4Å; Y192-P225 PolarHBondContact OH-O 3.23Å
226	T	68.9	Low	61.2	Low	71 Å²	71	69.7 Å²	69.7	44%	0.436	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-58.2	145.8	174.5	51	0	0	0	0	111	Y194	Y194-T226 HydrophobicContact CD1-CG2 4.03Å; Y194-T226 HydrophobicContact CE1-CG2 3.54Å; Y194-T226 CarbonylContact O-C 3.53Å; Y194-T226 WeakPolarHBondContact O-CA 3.5Å
227	T	66	Low	60.7	Low	12 Å²	12	69.3 Å²	69.3	7%	0.074	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-98	160.1	172.7	67.5	0	0	0	0	109.4	Y192 Y194 P195 A231 R233	Y192-T227 HydrophobicContact CD2-CG2 4.01Å; Y192-T227 HydrophobicContact CE2-CG2 3.65Å; Y194-T227 PolarHBondContact N-OG1 3.29Å; Y194-T227 PolarHBondContact O-N 3.16Å; Y194-T227 PolarHBondContact O-OG1 2.06Å; P195-T227 WeakPolarHBondContact CA-O 3.01Å; T227-A231 WeakPolarHBondContact CB-O 3.12Å; T227-R233 HydrophobicContact CG2-CB 3.67Å
228	T	60.9	Low	60.6	Low	94 Å²	94	66.3 Å²	66.3	58%	0.577	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-72.1	158.9	163	52.7	0	0	0	0	109.3	A230 A231	T228-A230 PolarHBondContact O-N 2.88Å; T228-A231 PolarHBondContact O-N 3.37Å; T228-A231 VanDerWaalsContact OG1-CB 3.23Å; T228-A231 WeakPolarHBondContact OG1-CB 3.41Å
229	E	57.8	Low	60.9	Low	119 Å²	119	68.5 Å²	68.5	56%	0.556	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.8	-165.3	-59.9	-159.4	144.2	0	0	115.6	K261	E229-K261 IonicContact OE1-NZ 3.2Å; E229-K261 PolarHBondContact OE1-NZ 3.46Å; E229-K261 IonicContact OE2-NZ 3.15Å; E229-K261 PolarHBondContact OE2-NZ 3.04Å
230	A	57.1	Low	61.6	Low	52 Å²	52	66.7 Å²	66.7	43%	0.43	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-10.4	-176.4	0	0	0	0	0	114.8	T228 W232	T228-A230 PolarHBondContact O-N 2.88Å; A230-W232 PolarHBondContact O-N 2.9Å
231	A	59.1	Low	62.5	Low	12 Å²	12	63.8 Å²	63.8	10%	0.099	33%	0.334	C	S	.	.			trans	-90.7	112.4	-172	0	0	0	0	0	111.7	L193 T227 T228 R233 M450	L193-A231 WeakPolarHBondContact CD1-O 3.45Å; T227-A231 WeakPolarHBondContact CB-O 3.12Å; T228-A231 PolarHBondContact O-N 3.37Å; T228-A231 VanDerWaalsContact OG1-CB 3.23Å; T228-A231 WeakPolarHBondContact OG1-CB 3.41Å; A231-R233 PolarHBondContact O-N 2.91Å; A231-R233 VanDerWaalsContact O-N 3.16Å; A231-M450 HydrophobicContact CB-CE 3.72Å
232	W	67.9	Low	63.4	Low	92 Å²	92	61.6 Å²	61.6	35%	0.348	32%	0.324	S	S	.	.			trans	-63	114.7	161.6	-68.8	92.3	0	0	0	108.4	T164 L193 A230 E234 K264 K266	T164-W232 HydrophobicContact CG2-CH2 3.97Å; T164-W232 HydrophobicContact CG2-CZ2 4.44Å; L193-W232 HydrophobicContact CB-CD2 4.39Å; L193-W232 HydrophobicContact CB-CE3 4.12Å; L193-W232 HydrophobicContact CB-CH2 4.49Å; L193-W232 HydrophobicContact CB-CZ3 4.18Å; A230-W232 PolarHBondContact O-N 2.9Å; W232-E234 PolarHBondContact O-N 3.33Å; W232-K264 HydrophobicContact CH2-CB 3.55Å; W232-K264 HydrophobicContact CH2-CD 4.23Å; W232-K264 HydrophobicContact CZ2-CB 4.46Å; W232-K264 HydrophobicContact CZ2-CD 4.4Å; W232-K264 HydrophobicContact CZ3-CB 3.97Å; W232-K266 HydrophobicContact CE3-CB 4.19Å; W232-K266 HydrophobicContact CH2-CB 3.92Å; W232-K266 HydrophobicContact CZ3-CB 3.58Å
233	R	62	Low	64.2	Low	79 Å²	79	62.7 Å²	62.7	30%	0.298	33%	0.333	S	S	.	.	B	Isolated β-bridge	trans	-83.5	113.5	175.5	-168.8	169.2	177	151.3	3.1	108.3	Y192 T227 A231 E235	Y192-R233 HydrophobicContact CE1-CB 4.38Å; Y192-R233 PolarHBondContact N-O 2.86Å; Y192-R233 PolarHBondContact O-N 2.87Å; T227-R233 HydrophobicContact CG2-CB 3.67Å; A231-R233 PolarHBondContact O-N 2.91Å; A231-R233 VanDerWaalsContact O-N 3.16Å; R233-E235 HydrophobicContact CG-CB 4.41Å; R233-E235 IonicContact CZ-OE1 2.66Å; R233-E235 IonicContact CZ-OE2 3.95Å; R233-E235 VanDerWaalsContact CZ-OE2 3.27Å; R233-E235 VanDerWaalsContact NE-CD 3.32Å; R233-E235 IonicContact NE-OE1 2.7Å; R233-E235 IonicContact NE-OE2 3.52Å; R233-E235 PolarHBondContact NE-OE2 2.86Å; R233-E235 IonicContact NH2-OE1 3.32Å; R233-E235 PolarHBondContact NH2-OE1 2.89Å; R233-E235 IonicContact NH2-OE2 3.78Å; R233-E235 PolarHBondContact NH2-OE2 3.08Å
234	E	57.6	Low	64.5	Low	71 Å²	71	62.2 Å²	62.2	33%	0.332	34%	0.339	S	S	.	.			trans	-111	90	160.6	-175.5	176.3	-161.9	0	0	106.2	K189 K191 W232 K236	K189-E234 WeakPolarHBondContact CE-OE1 3.33Å; K189-E234 IonicContact NZ-OE1 3.63Å; K189-E234 PolarHBondContact NZ-OE1 3Å; K191-E234 HydrophobicContact CD-CB 4.05Å; K191-E234 HydrophobicContact CD-CG 4.31Å; K191-E234 WeakPolarHBondContact CE-OE2 3.39Å; K191-E234 HydrophobicContact CG-CB 4.04Å; K191-E234 HydrophobicContact CG-CG 4.14Å; K191-E234 IonicContact NZ-OE1 3.93Å; K191-E234 IonicContact NZ-OE2 3.61Å; K191-E234 PolarHBondContact NZ-OE2 3.09Å; W232-E234 PolarHBondContact O-N 3.33Å; E234-K236 PolarHBondContact O-N 2.77Å; E234-K236 VanDerWaalsContact O-N 3.16Å
235	E	49.5	Very low	65	Low	63 Å²	63	63.2 Å²	63.2	29%	0.294	35%	0.35	S	S	.	.			trans	-73.4	117.3	-177.4	-143	165	169.7	0	0	108.2	R233 A237 T238	R233-E235 HydrophobicContact CG-CB 4.41Å; R233-E235 IonicContact CZ-OE1 2.66Å; R233-E235 IonicContact CZ-OE2 3.95Å; R233-E235 VanDerWaalsContact CZ-OE2 3.27Å; R233-E235 VanDerWaalsContact NE-CD 3.32Å; R233-E235 IonicContact NE-OE1 2.7Å; R233-E235 IonicContact NE-OE2 3.52Å; R233-E235 PolarHBondContact NE-OE2 2.86Å; R233-E235 IonicContact NH2-OE1 3.32Å; R233-E235 PolarHBondContact NH2-OE1 2.89Å; R233-E235 IonicContact NH2-OE2 3.78Å; R233-E235 PolarHBondContact NH2-OE2 3.08Å; E235-A237 HydrophobicContact CG-CB 4.44Å; E235-A237 PolarHBondContact O-N 2.91Å; E235-T238 HydrophobicContact CB-CG2 3.4Å; E235-T238 HydrophobicContact CG-CG2 4.45Å; E235-T238 PolarHBondContact O-N 2.6Å; E235-T238 PolarHBondContact O-OG1 3.37Å
236	K	46.9	Very low	65.7	Low	179 Å²	179	63.8 Å²	63.8	78%	0.778	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-13.3	175.4	-70	-179.8	178.5	178.3	0	113	E234 E452	E234-K236 PolarHBondContact O-N 2.77Å; E234-K236 VanDerWaalsContact O-N 3.16Å; K236-E452 IonicContact NZ-OE1 2.74Å; K236-E452 PolarHBondContact NZ-OE1 2.8Å
237	A	43.4	Very low	66.5	Low	74 Å²	74	60.6 Å²	60.6	61%	0.612	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-5.6	173.3	0	0	0	0	0	115.8	E235 N239	E235-A237 HydrophobicContact CG-CB 4.44Å; E235-A237 PolarHBondContact O-N 2.91Å; A237-N239 VanDerWaalsContact C-N 3.34Å; A237-N239 PolarHBondContact O-N 3.3Å; A237-N239 VanDerWaalsContact O-N 3.13Å
238	T	55.6	Low	67.6	Low	18 Å²	18	61.7 Å²	61.7	11%	0.11	33%	0.334	C	S	.	.			trans	-87.2	46.8	-172.9	57.5	0	0	0	0	114.9	E235 V240	E235-T238 HydrophobicContact CB-CG2 3.4Å; E235-T238 HydrophobicContact CG-CG2 4.45Å; E235-T238 PolarHBondContact O-N 2.6Å; E235-T238 PolarHBondContact O-OG1 3.37Å; T238-V240 VanDerWaalsContact C-N 3.33Å; T238-V240 PolarHBondContact O-N 3.48Å
239	N	63.6	Low	69.1	Low	64 Å²	64	57.2 Å²	57.2	34%	0.342	31%	0.306	S	S	.	.			trans	-83.7	89.8	157.7	-72.7	-11.9	0	0	0	106.5	Y187 A237 M241	Y187-N239 HydrophobicContact CD1-CB 4.44Å; Y187-N239 HydrophobicContact CD2-CB 4.14Å; Y187-N239 VanDerWaalsContact CD2-OD1 3.27Å; Y187-N239 WeakPolarHBondContact CD2-OD1 3.31Å; Y187-N239 WeakPolarHBondContact CE2-OD1 3.48Å; Y187-N239 HydrophobicContact CG-CB 3.89Å; A237-N239 VanDerWaalsContact C-N 3.34Å; A237-N239 PolarHBondContact O-N 3.3Å; A237-N239 VanDerWaalsContact O-N 3.13Å; N239-M241 VanDerWaalsContact C-N 3.32Å; N239-M241 HydrophobicContact CB-CE 4.06Å; N239-M241 HydrophobicContact CB-SD 4.48Å; N239-M241 PolarHBondContact O-N 2.66Å
240	V	71.3	Confident	70.5	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	102	170.2	-176.5	0	0	0	0	105.8	Y187 V188 F203 L218 H221 T238 L242	Y187-V240 WeakPolarHBondContact CA-O 3.43Å; Y187-V240 WeakPolarHBondContact CB-O 3.39Å; V188-V240 HydrophobicContact CG1-CB 3.76Å; V188-V240 HydrophobicContact CG1-CG1 4.38Å; V188-V240 HydrophobicContact CG1-CG2 4.36Å; V188-V240 PolarHBondContact N-O 2.94Å; V188-V240 VanDerWaalsContact N-O 3.09Å; V188-V240 PolarHBondContact O-N 3.26Å; F203-V240 HydrophobicContact CE1-CB 4.44Å; F203-V240 HydrophobicContact CE1-CG1 4.16Å; F203-V240 HydrophobicContact CE1-CG2 4.29Å; L218-V240 HydrophobicContact CD1-CG1 4.04Å; L218-V240 HydrophobicContact CG-CG1 3.85Å; H221-V240 HydrophobicContact CB-CG2 3.79Å; T238-V240 VanDerWaalsContact C-N 3.33Å; T238-V240 PolarHBondContact O-N 3.48Å; V240-L242 HydrophobicContact CG1-CD2 4.31Å; V240-L242 WeakPolarHBondContact O-CG 3.19Å; V240-L242 PolarHBondContact O-N 3.43Å
241	M	78.5	Confident	72.2	Confident	103 Å²	103	49 Å²	49	51%	0.507	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	126.2	-178.4	-65.2	-63.2	-179.2	0	0	108.6	G186 L218 N239	G186-M241 CarbonylContact O-C 3.23Å; G186-M241 WeakPolarHBondContact O-CA 3.43Å; L218-M241 VanDerWaalsContact CD1-O 3.3Å; L218-M241 WeakPolarHBondContact CD1-O 3.44Å; N239-M241 VanDerWaalsContact C-N 3.32Å; N239-M241 HydrophobicContact CB-CE 4.06Å; N239-M241 HydrophobicContact CB-SD 4.48Å; N239-M241 PolarHBondContact O-N 2.66Å
242	L	83.4	Confident	73.3	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	136.6	-179	-61.7	-178.8	0	0	0	108.9	L182 P185 G186 V188 V205 V240 L247 L249	L182-L242 HydrophobicContact CD1-CB 3.32Å; L182-L242 HydrophobicContact CD1-CD1 3.73Å; L182-L242 HydrophobicContact CD1-CG 4.17Å; P185-L242 WeakPolarHBondContact CA-O 3.49Å; G186-L242 PolarHBondContact N-O 3.37Å; G186-L242 PolarHBondContact O-N 3.25Å; V188-L242 HydrophobicContact CB-CD1 3.91Å; V188-L242 HydrophobicContact CG1-CD1 3.87Å; V188-L242 HydrophobicContact CG1-CD2 4.09Å; V188-L242 HydrophobicContact CG1-CG 4.13Å; V205-L242 HydrophobicContact CG1-CD2 4.14Å; V205-L242 HydrophobicContact CG2-CD2 3.82Å; V240-L242 HydrophobicContact CG1-CD2 4.31Å; V240-L242 WeakPolarHBondContact O-CG 3.19Å; V240-L242 PolarHBondContact O-N 3.43Å; L242-L247 HydrophobicContact CB-CD1 3.78Å; L242-L247 HydrophobicContact CD1-CD1 4.22Å; L242-L247 HydrophobicContact CD2-CD1 4.27Å; L242-L247 HydrophobicContact CG-CD1 4.31Å; L242-L249 HydrophobicContact CD1-CD2 3.99Å; L242-L249 HydrophobicContact CD2-CD2 4.28Å
243	T	80.6	Confident	74.1	Confident	68 Å²	68	46.3 Å²	46.3	42%	0.417	25%	0.248	S	C	.	.			trans	-69.7	156	171.1	48.9	0	0	0	0	110.7	L247	T243-L247 WeakPolarHBondContact O-CD1 3.46Å
244	S	81.3	Confident	74.7	Confident	65 Å²	65	43.8 Å²	43.8	46%	0.455	24%	0.24	S	C	.	.	S	Bend	trans	-67.9	143	168.9	51	0	0	0	0	110.3	L182	L182-S244 CarbonylContact O-C 3.44Å; L182-S244 WeakPolarHBondContact O-CA 3.37Å
245	G	81.7	Confident	75.1	Confident	29 Å²	29	42 Å²	42	30%	0.299	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	141.7	-176.4	179.7	0	0	0	0	0	112.5	L182	L182-G245 PolarHBondContact N-O 2.81Å; L182-G245 PolarHBondContact O-N 3.34Å
246	Q	85.9	Confident	75.7	Confident	68 Å²	68	42.7 Å²	42.7	32%	0.318	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	120.9	168	-174.4	69.8	32.4	0	0	108.4	S179 N207 D208	S179-Q246 PolarHBondContact OG-NE2 3.42Å; N207-Q246 WeakPolarHBondContact CA-O 3.09Å; D208-Q246 HydrophobicContact CB-CB 4.1Å; D208-Q246 HydrophobicContact CB-CG 4.4Å; D208-Q246 PolarHBondContact N-O 2.8Å
247	L	87.5	Confident	76.2	Confident	4 Å²	4	41 Å²	41	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	145.1	-178.1	-61.9	-179.8	0	0	0	110.8	V180 L182 V205 Q206 V213 L242 T243 L249	V180-L247 HydrophobicContact CG1-CB 4.11Å; V180-L247 PolarHBondContact N-O 3.1Å; V180-L247 PolarHBondContact O-N 3.35Å; L182-L247 HydrophobicContact CD1-CD1 3.72Å; L182-L247 HydrophobicContact CG-CD1 4.16Å; V205-L247 HydrophobicContact CG1-CB 4.22Å; V205-L247 HydrophobicContact CG1-CD1 4.17Å; V205-L247 HydrophobicContact CG1-CD2 4Å; V205-L247 HydrophobicContact CG1-CG 4.38Å; Q206-L247 CarbonylContact O-C 3.55Å; Q206-L247 WeakPolarHBondContact O-CA 3.49Å; V213-L247 HydrophobicContact CG2-CD2 4.36Å; L242-L247 HydrophobicContact CB-CD1 3.78Å; L242-L247 HydrophobicContact CD1-CD1 4.22Å; L242-L247 HydrophobicContact CD2-CD1 4.27Å; L242-L247 HydrophobicContact CG-CD1 4.31Å; T243-L247 WeakPolarHBondContact O-CD1 3.46Å; L247-L249 HydrophobicContact CB-CD2 4.48Å
248	L	88.9	Confident	76.9	Confident	34 Å²	34	40.5 Å²	40.5	18%	0.178	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	108.1	173.7	-173.1	62.9	0	0	0	108.4	M177 V205 Q206	M177-L248 HydrophobicContact CB-CD1 4.29Å; M177-L248 HydrophobicContact CE-CD1 3.95Å; M177-L248 HydrophobicContact CE-CD2 3.28Å; M177-L248 HydrophobicContact CE-CG 3.87Å; V205-L248 WeakPolarHBondContact CA-O 3.41Å; Q206-L248 HydrophobicContact CB-CB 4.3Å; Q206-L248 PolarHBondContact N-O 3.07Å; Q206-L248 PolarHBondContact O-N 3.3Å
249	L	90.8	Very high	77.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.2	177.2	-47.2	-176.8	0	0	0	108.3	M177 Y178 V180 V188 F203 V205 L242 L247 W251 I270	M177-L249 CarbonylContact C-O 3.47Å; M177-L249 VanDerWaalsContact CA-O 3.31Å; M177-L249 WeakPolarHBondContact CA-O 3.27Å; Y178-L249 HydrophobicContact CD1-CD1 4.16Å; Y178-L249 PolarHBondContact N-O 3.42Å; Y178-L249 PolarHBondContact O-N 3.11Å; V180-L249 HydrophobicContact CG1-CD1 4.17Å; V180-L249 HydrophobicContact CG1-CD2 4.49Å; V180-L249 HydrophobicContact CG1-CG 4.1Å; V188-L249 HydrophobicContact CB-CD1 4.27Å; V188-L249 HydrophobicContact CG2-CD1 4.08Å; F203-L249 HydrophobicContact CE2-CB 4.09Å; F203-L249 HydrophobicContact CZ-CB 4.31Å; F203-L249 HydrophobicContact CZ-CD2 4.26Å; V205-L249 HydrophobicContact CB-CD2 4.42Å; V205-L249 HydrophobicContact CG1-CD2 3.97Å; V205-L249 HydrophobicContact CG2-CD2 3.82Å; L242-L249 HydrophobicContact CD1-CD2 3.99Å; L242-L249 HydrophobicContact CD2-CD2 4.28Å; L247-L249 HydrophobicContact CB-CD2 4.48Å; L249-W251 HydrophobicContact CB-CH2 4.11Å; L249-W251 HydrophobicContact CB-CZ3 4.16Å; L249-W251 HydrophobicContact CD1-CH2 4.47Å; L249-I270 HydrophobicContact CD1-CD1 3.55Å; L249-I270 HydrophobicContact CD1-CG1 3.98Å
250	S	88.5	Confident	77.6	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	128.9	-176.2	58.8	0	0	0	0	112.5	L176 F203 Q204	L176-S250 CarbonylContact O-C 3.51Å; L176-S250 VanDerWaalsContact O-CA 3.25Å; L176-S250 WeakPolarHBondContact O-CA 3.11Å; F203-S250 CarbonylContact C-O 3.46Å; F203-S250 WeakPolarHBondContact CA-O 3.06Å; Q204-S250 WeakPolarHBondContact CB-OG 3.5Å; Q204-S250 PolarHBondContact N-O 3.15Å; Q204-S250 PolarHBondContact O-N 3.31Å; Q204-S250 PolarHBondContact O-OG 3.1Å
251	W	91.4	Very high	77.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	111.7	171.4	-62.3	-94.7	0	0	0	108.8	F121 W158 T175 L176 Y190 F201 A202 F203 L249 I265 I268	F121-W251 HydrophobicContact CE1-CZ3 4.08Å; W158-W251 HydrophobicContact CZ2-CB 4.07Å; W158-W251 PolarHBondContact NE1-O 2.79Å; T175-W251 WeakPolarHBondContact CA-O 3.3Å; L176-W251 HydrophobicContact CB-CB 4.26Å; L176-W251 HydrophobicContact CB-CE3 4.41Å; L176-W251 HydrophobicContact CD2-CD2 4.28Å; L176-W251 HydrophobicContact CD2-CE3 3.78Å; L176-W251 HydrophobicContact CD2-CZ3 4.4Å; L176-W251 HydrophobicContact CG-CE3 3.98Å; L176-W251 PolarHBondContact N-O 2.99Å; L176-W251 PolarHBondContact O-N 2.72Å; Y190-W251 HydrophobicContact CD1-CZ2 4.17Å; Y190-W251 AromaticContact CD1-NE1 3.77Å; Y190-W251 AromaticContact CD2-NE1 3.8Å; Y190-W251 AromaticContact CE1-NE1 3.63Å; Y190-W251 AromaticContact CE2-NE1 3.68Å; Y190-W251 HydrophobicContact CG-CZ2 4.46Å; Y190-W251 AromaticContact CG-NE1 3.87Å; Y190-W251 AromaticContact CZ-NE1 3.6Å; F201-W251 HydrophobicContact CE2-CB 4.32Å; A202-W251 CarbonylContact O-C 3.57Å; A202-W251 WeakPolarHBondContact O-CA 3.31Å; F203-W251 AromaticContact CD2-CD1 3.68Å; F203-W251 HydrophobicContact CD2-CD2 4.04Å; F203-W251 AromaticContact CD2-CE2 3.61Å; F203-W251 HydrophobicContact CD2-CG 4.09Å; F203-W251 HydrophobicContact CD2-CZ2 4.14Å; F203-W251 AromaticContact CD2-NE1 3.37Å; F203-W251 HydrophobicContact CE2-CD2 4.21Å; F203-W251 AromaticContact CE2-CE2 3.63Å; F203-W251 HydrophobicContact CE2-CH2 4.27Å; F203-W251 AromaticContact CE2-CZ2 3.68Å; F203-W251 HydrophobicContact CE2-CZ2 3.68Å; F203-W251 AromaticContact CE2-NE1 3.84Å; L249-W251 HydrophobicContact CB-CH2 4.11Å; L249-W251 HydrophobicContact CB-CZ3 4.16Å; L249-W251 HydrophobicContact CD1-CH2 4.47Å; W251-I265 HydrophobicContact CB-CD1 4.15Å; W251-I265 HydrophobicContact CD2-CD1 4.4Å; W251-I265 HydrophobicContact CG-CD1 3.78Å; W251-I268 HydrophobicContact CH2-CD1 4.02Å; W251-I268 HydrophobicContact CH2-CG2 4.21Å; W251-I268 HydrophobicContact CZ2-CD1 4.16Å; W251-I268 HydrophobicContact CZ2-CG2 4.39Å; W251-I268 HydrophobicContact CZ3-CD1 4.5Å
252	K	83.6	Confident	78.1	Confident	46 Å²	46	50 Å²	50	20%	0.2	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.7	-176.2	-68	-176.3	179.8	173.1	0	110.1	L173 S174 T175 F200 F201 A202	L173-K252 HydrophobicContact CD1-CB 4.32Å; S174-K252 WeakPolarHBondContact O-CA 3.19Å; T175-K252 HydrophobicContact CG2-CD 4.45Å; T175-K252 HydrophobicContact CG2-CG 3.74Å; F200-K252 HydrophobicContact CE1-CB 4.21Å; F201-K252 WeakPolarHBondContact CA-O 3.38Å; A202-K252 PolarHBondContact N-O 3.23Å; A202-K252 PolarHBondContact O-N 3.26Å
253	A	83.5	Confident	78.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	135.1	177.4	0	0	0	0	0	112.9	W158 Y167 S174 F200 F201 I263	W158-A253 HydrophobicContact CZ2-CB 3.86Å; Y167-A253 HydrophobicContact CD1-CB 3.75Å; Y167-A253 HydrophobicContact CD2-CB 3.49Å; Y167-A253 VanDerWaalsContact CD2-CB 3.49Å; Y167-A253 HydrophobicContact CE1-CB 3.87Å; Y167-A253 HydrophobicContact CE2-CB 3.63Å; Y167-A253 WeakPolarHBondContact CE2-O 3.37Å; Y167-A253 HydrophobicContact CG-CB 3.56Å; Y167-A253 PolarHBondContact OH-O 2.73Å; S174-A253 PolarHBondContact N-O 3.31Å; S174-A253 PolarHBondContact O-N 2.9Å; F200-A253 WeakPolarHBondContact O-CA 3.18Å; F201-A253 HydrophobicContact CD2-CB 4.47Å; A253-I263 HydrophobicContact CB-CD1 4.18Å
254	M	74.2	Confident	78.6	Confident	27 Å²	27	50 Å²	50	13%	0.133	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	145.9	174	61.2	179.3	-92.3	0	0	111	L133 Y167 L173 I199 F200 L256	L133-M254 HydrophobicContact CD1-CE 4.22Å; Y167-M254 VanDerWaalsContact OH-CA 3.27Å; Y167-M254 WeakPolarHBondContact OH-CA 3.5Å; L173-M254 HydrophobicContact CD1-CB 4.04Å; L173-M254 HydrophobicContact CD1-CG 4.25Å; L173-M254 HydrophobicContact CD1-SD 4.31Å; I199-M254 CarbonylContact C-O 3.56Å; I199-M254 WeakPolarHBondContact CA-O 3.4Å; I199-M254 WeakPolarHBondContact CG2-O 3.44Å; F200-M254 HydrophobicContact CB-CG 3.48Å; F200-M254 VanDerWaalsContact CB-CG 3.48Å; F200-M254 WeakPolarHBondContact CB-O 3.45Å; F200-M254 HydrophobicContact CD1-CG 3.68Å; F200-M254 HydrophobicContact CD1-SD 4.37Å; F200-M254 HydrophobicContact CE1-CG 4.4Å; F200-M254 HydrophobicContact CG-CG 3.73Å; F200-M254 HydrophobicContact CG-SD 4.36Å; F200-M254 PolarHBondContact N-O 2.76Å; F200-M254 PolarHBondContact O-N 3Å; M254-L256 HydrophobicContact CE-CD2 3.9Å
255	V	67.7	Low	78.9	Confident	33 Å²	33	46.9 Å²	46.9	20%	0.2	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	131.4	171.9	170	0	0	0	0	109.5	Y167 P169 I199	Y167-V255 PolarHBondContact OH-N 3.31Å; P169-V255 HydrophobicContact CB-CG2 3.52Å; I199-V255 HydrophobicContact CG1-CG2 4.48Å
256	L	60.8	Low	79.1	Confident	78 Å²	78	49.9 Å²	49.9	41%	0.408	26%	0.255	S	S	.	.			trans	-84.5	-54.7	173.8	-64.8	166.2	0	0	0	110.8	G198 F200 M254	G198-L256 WeakPolarHBondContact O-CB 3.4Å; G198-L256 PolarHBondContact O-N 3.03Å; F200-L256 HydrophobicContact CB-CD1 4.4Å; F200-L256 HydrophobicContact CB-CD2 4.39Å; F200-L256 HydrophobicContact CB-CG 4.24Å; M254-L256 HydrophobicContact CE-CD2 3.9Å
257	H	57	Low	79	Confident	144 Å²	144	47.3 Å²	47.3	67%	0.667	25%	0.246	S	C	*	.	S	Bend	trans	-156.4	130.4	179.9	-64.1	-61.8	0	0	0	113.2	H260	H257-H260 PolarHBondContact O-CE1 3.19Å; H257-H260 VanDerWaalsContact O-CE1 3.23Å; H257-H260 PolarHBondContact O-NE2 2.84Å
258	G	59.3	Low	79	Confident	63 Å²	63	47.1 Å²	47.1	65%	0.649	25%	0.245	S	C	*	.	S	Bend	trans	89.2	-165.4	172	0	0	0	0	0	113.8
259	Q	66.2	Low	79	Confident	199 Å²	199	46.7 Å²	46.7	93%	0.93	24%	0.242	S	C	*	.			trans	-101.5	123.5	-177.8	-66.9	-112.9	-40	0	0	109.2
260	H	68.2	Low	78.8	Confident	37 Å²	37	46.7 Å²	46.7	17%	0.171	24%	0.242	C	C	.	.			trans	-125.6	159	-175.2	-61.2	-65.4	0	0	0	111.9	P169 D196 G198 I199 H257	P169-H260 WeakPolarHBondContact CG-O 3.11Å; D196-H260 HydrophobicContact CB-CB 4.46Å; D196-H260 IonicContact OD1-CE1 2.9Å; D196-H260 IonicContact OD1-ND1 3.87Å; D196-H260 PolarHBondContact OD1-ND1 3.36Å; D196-H260 WeakPolarHBondContact OD2-CB 3.45Å; D196-H260 IonicContact OD2-CE1 2.74Å; D196-H260 IonicContact OD2-CG 2.95Å; D196-H260 IonicContact OD2-ND1 3.73Å; D196-H260 PolarHBondContact OD2-ND1 2.95Å; G198-H260 VanDerWaalsContact CA-CE1 3.43Å; G198-H260 WeakPolarHBondContact CA-CE1 3.14Å; G198-H260 PolarHBondContact O-NE2 3.09Å; I199-H260 HydrophobicContact CD1-CB 3.57Å; I199-H260 HydrophobicContact CG1-CB 3.43Å; I199-H260 VanDerWaalsContact CG1-CB 3.43Å; H257-H260 PolarHBondContact O-CE1 3.19Å; H257-H260 VanDerWaalsContact O-CE1 3.23Å; H257-H260 PolarHBondContact O-NE2 2.84Å
261	K	76.6	Confident	78.8	Confident	101 Å²	101	49.3 Å²	49.3	44%	0.439	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-75.5	143.1	174.3	-70.4	177.1	-178.8	175.3	0	110.9	P195 I199 E229	P195-K261 HydrophobicContact CG-CB 3.69Å; P195-K261 HydrophobicContact CG-CD 4.38Å; I199-K261 WeakPolarHBondContact CD1-O 3.18Å; E229-K261 IonicContact OE1-NZ 3.2Å; E229-K261 PolarHBondContact OE1-NZ 3.46Å; E229-K261 IonicContact OE2-NZ 3.15Å; E229-K261 PolarHBondContact OE2-NZ 3.04Å
262	P	82.7	Confident	78.4	Confident	49 Å²	49	49.4 Å²	49.4	32%	0.318	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-67.8	148	-175.6	28	-35.6	0	0	0	113.2	T166 Y167	T166-P262 HydrophobicContact CG2-CB 3.8Å; T166-P262 HydrophobicContact CG2-CG 4.38Å; Y167-P262 WeakPolarHBondContact O-CA 3.46Å; Y167-P262 WeakPolarHBondContact O-CB 3.34Å
263	I	85.7	Confident	78.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	139.9	172.4	-54.2	175.5	0	0	0	108.6	W158 T166 Y167 L193 Y194 I199 F201 A253	W158-I263 HydrophobicContact CH2-CB 4.28Å; W158-I263 HydrophobicContact CH2-CG2 3.92Å; T166-I263 CarbonylContact C-O 3.53Å; T166-I263 VanDerWaalsContact CA-O 3.32Å; T166-I263 WeakPolarHBondContact CA-O 3.31Å; Y167-I263 HydrophobicContact CD1-CD1 4.29Å; Y167-I263 HydrophobicContact CD1-CG1 4.31Å; Y167-I263 PolarHBondContact N-O 2.91Å; Y167-I263 PolarHBondContact O-N 3.15Å; L193-I263 WeakPolarHBondContact O-CA 3.49Å; L193-I263 WeakPolarHBondContact O-CG2 3.23Å; Y194-I263 HydrophobicContact CD2-CD1 3.82Å; Y194-I263 HydrophobicContact CD2-CG1 3.85Å; Y194-I263 HydrophobicContact CE2-CD1 4.17Å; I199-I263 HydrophobicContact CB-CD1 4.22Å; I199-I263 HydrophobicContact CD1-CG1 4.2Å; I199-I263 HydrophobicContact CG2-CD1 3.58Å; I199-I263 HydrophobicContact CG2-CG1 4.29Å; F201-I263 HydrophobicContact CB-CD1 3.61Å; F201-I263 HydrophobicContact CD1-CD1 4.35Å; F201-I263 HydrophobicContact CD1-CG2 4.44Å; F201-I263 HydrophobicContact CD2-CD1 3.79Å; F201-I263 HydrophobicContact CD2-CG2 4.39Å; F201-I263 HydrophobicContact CE1-CG2 4.23Å; F201-I263 HydrophobicContact CE2-CG2 4.21Å; F201-I263 HydrophobicContact CG-CD1 3.67Å; F201-I263 HydrophobicContact CZ-CG2 4.12Å; A253-I263 HydrophobicContact CB-CD1 4.18Å
264	K	88.1	Confident	78	Confident	73 Å²	73	49.1 Å²	49.1	32%	0.317	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.9	173.8	-53.2	179.4	-176.1	172.8	0	110.7	L165 T166 Y192 L193 W232	L165-K264 CarbonylContact O-C 3.19Å; L165-K264 VanDerWaalsContact O-CA 3.29Å; L165-K264 WeakPolarHBondContact O-CA 3.2Å; T166-K264 HydrophobicContact CG2-CG 4.29Å; Y192-K264 CarbonylContact C-O 3.52Å; Y192-K264 WeakPolarHBondContact CA-O 3.16Å; L193-K264 HydrophobicContact CB-CB 4.19Å; L193-K264 HydrophobicContact CD2-CD 4.12Å; L193-K264 PolarHBondContact N-O 2.7Å; L193-K264 PolarHBondContact O-N 2.87Å; W232-K264 HydrophobicContact CH2-CB 3.55Å; W232-K264 HydrophobicContact CH2-CD 4.23Å; W232-K264 HydrophobicContact CZ2-CB 4.46Å; W232-K264 HydrophobicContact CZ2-CD 4.4Å; W232-K264 HydrophobicContact CZ3-CB 3.97Å
265	I	89.3	Confident	78.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134	171.5	-60.4	174.3	0	0	0	108.4	W158 L165 Y190 K191 F201 W251 I268	W158-I265 HydrophobicContact CH2-CD1 3.42Å; W158-I265 VanDerWaalsContact CH2-CD1 3.42Å; W158-I265 HydrophobicContact CH2-CG1 3.89Å; W158-I265 HydrophobicContact CZ2-CD1 4.18Å; W158-I265 HydrophobicContact CZ3-CD1 3.66Å; W158-I265 HydrophobicContact CZ3-CG1 3.88Å; L165-I265 HydrophobicContact CB-CB 4.13Å; L165-I265 PolarHBondContact N-O 3.06Å; L165-I265 PolarHBondContact O-N 2.89Å; Y190-I265 HydrophobicContact CD2-CG2 4.43Å; K191-I265 WeakPolarHBondContact O-CA 3.44Å; F201-I265 HydrophobicContact CE2-CD1 4.22Å; F201-I265 HydrophobicContact CZ-CD1 4.01Å; F201-I265 HydrophobicContact CZ-CG1 4.35Å; W251-I265 HydrophobicContact CB-CD1 4.15Å; W251-I265 HydrophobicContact CD2-CD1 4.4Å; W251-I265 HydrophobicContact CG-CD1 3.78Å; I265-I268 HydrophobicContact CG2-CD1 4.03Å; I265-I268 HydrophobicContact CG2-CG1 3.93Å
266	K	84.7	Confident	78.7	Confident	92 Å²	92	49 Å²	49	40%	0.4	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145	177.1	-176.5	179.3	178.8	-177.9	0	109.2	T164 K191 W232	T164-K266 HydrophobicContact CG2-CB 4.2Å; T164-K266 HydrophobicContact CG2-CD 4.3Å; T164-K266 HydrophobicContact CG2-CG 4.37Å; K191-K266 CarbonylContact C-O 3.49Å; K191-K266 WeakPolarHBondContact CA-O 3.09Å; K191-K266 WeakPolarHBondContact CB-O 3.5Å; K191-K266 PolarHBondContact N-O 2.03Å; K191-K266 PolarHBondContact O-N 2.88Å; W232-K266 HydrophobicContact CE3-CB 4.19Å; W232-K266 HydrophobicContact CH2-CB 3.92Å; W232-K266 HydrophobicContact CZ3-CB 3.58Å
267	G	84.4	Confident	79.5	Confident	13 Å²	13	50.9 Å²	50.9	13%	0.134	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	66.8	75	171.8	0	0	0	0	0	113.1	Y108 Y190 K191	Y108-G267 CarbonylContact O-C 3.15Å; Y108-G267 WeakPolarHBondContact O-CA 3.23Å; Y108-G267 PolarHBondContact O-N 3.42Å; Y190-G267 VanDerWaalsContact CA-O 3.28Å; Y190-G267 WeakPolarHBondContact CA-O 3.1Å; K191-G267 PolarHBondContact N-O 3.03Å
268	I	88.3	Confident	80.7	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.4	174.3	-58.6	178.2	0	0	0	108.7	R107 Y108 F111 F121 L165 K189 W251 I265 I270	R107-I268 CarbonylContact C-O 3.59Å; R107-I268 VanDerWaalsContact CA-O 3.29Å; R107-I268 WeakPolarHBondContact CA-O 3.38Å; Y108-I268 HydrophobicContact CD2-CB 4.38Å; Y108-I268 PolarHBondContact N-O 3.38Å; Y108-I268 PolarHBondContact O-N 2.79Å; F111-I268 HydrophobicContact CZ-CD1 3.93Å; F111-I268 HydrophobicContact CZ-CG1 4.23Å; F121-I268 HydrophobicContact CE1-CD1 3.87Å; F121-I268 HydrophobicContact CZ-CD1 3.79Å; L165-I268 HydrophobicContact CD1-CD1 3.89Å; K189-I268 CarbonylContact O-C 3.59Å; W251-I268 HydrophobicContact CH2-CD1 4.02Å; W251-I268 HydrophobicContact CH2-CG2 4.21Å; W251-I268 HydrophobicContact CZ2-CD1 4.16Å; W251-I268 HydrophobicContact CZ2-CG2 4.39Å; W251-I268 HydrophobicContact CZ3-CD1 4.5Å; I265-I268 HydrophobicContact CG2-CD1 4.03Å; I265-I268 HydrophobicContact CG2-CG1 3.93Å; I268-I270 HydrophobicContact CG2-CD1 4.24Å; I268-I270 HydrophobicContact CG2-CG1 4.23Å
269	E	87	Confident	82.1	Confident	25 Å²	25	49.5 Å²	49.5	12%	0.117	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130	173.9	-179.9	177.7	152	0	0	110	L102 V106 R107 Y187 V188 K189 R271	L102-E269 HydrophobicContact CD1-CG 3.97Å; V106-E269 WeakPolarHBondContact O-CA 3.04Å; R107-E269 HydrophobicContact CG-CB 4.21Å; Y187-E269 PolarHBondContact OH-OE1 2.96Å; V188-E269 CarbonylContact C-O 3.46Å; V188-E269 WeakPolarHBondContact CA-O 3.05Å; K189-E269 HydrophobicContact CB-CB 4.4Å; K189-E269 PolarHBondContact N-O 2.79Å; K189-E269 PolarHBondContact O-N 3.41Å; E269-R271 IonicContact OE1-CZ 3.52Å; E269-R271 IonicContact OE1-NE 2.94Å; E269-R271 PolarHBondContact OE1-NE 3.26Å; E269-R271 IonicContact OE1-NH2 2.88Å; E269-R271 PolarHBondContact OE1-NH2 2.76Å; E269-R271 VanDerWaalsContact OE1-NH2 3.1Å
270	I	88.3	Confident	83	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	124.4	176.2	-58.2	160.7	0	0	0	108.2	G105 V106 Y178 V180 L182 Y187 V188 L249 I268	G105-I270 CarbonylContact C-O 3.6Å; G105-I270 WeakPolarHBondContact CA-O 3.43Å; V106-I270 HydrophobicContact CG1-CB 3.85Å; V106-I270 HydrophobicContact CG1-CD1 4.22Å; V106-I270 HydrophobicContact CG1-CG1 4.49Å; V106-I270 PolarHBondContact N-O 2.97Å; V106-I270 PolarHBondContact O-N 2.81Å; Y178-I270 HydrophobicContact CD1-CD1 3.32Å; Y178-I270 HydrophobicContact CE1-CD1 3.17Å; Y178-I270 HydrophobicContact CG-CD1 4.35Å; V180-I270 HydrophobicContact CG2-CG2 4.19Å; L182-I270 HydrophobicContact CD2-CG2 4Å; Y187-I270 WeakPolarHBondContact O-CA 3.44Å; V188-I270 HydrophobicContact CB-CG1 4.22Å; V188-I270 HydrophobicContact CG2-CG1 3.87Å; L249-I270 HydrophobicContact CD1-CD1 3.55Å; L249-I270 HydrophobicContact CD1-CG1 3.98Å; I268-I270 HydrophobicContact CG2-CD1 4.24Å; I268-I270 HydrophobicContact CG2-CG1 4.23Å
271	R	87.3	Confident	84	Confident	55 Å²	55	43.3 Å²	43.3	21%	0.208	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	153.7	173.7	-66.7	-60.9	-174.9	142.6	8.1	110.7	L102 L182 G186 Y187 E269	L102-R271 PolarHBondContact O-NH1 2.86Å; L182-R271 WeakPolarHBondContact CD2-O 3.31Å; G186-R271 VanDerWaalsContact CA-O 3.31Å; G186-R271 WeakPolarHBondContact CA-O 3.46Å; Y187-R271 HydrophobicContact CD1-CB 3.98Å; Y187-R271 HydrophobicContact CD1-CG 4.09Å; Y187-R271 HydrophobicContact CD2-CG 4.46Å; Y187-R271 HydrophobicContact CE1-CB 3.86Å; Y187-R271 HydrophobicContact CE1-CG 3.47Å; Y187-R271 VanDerWaalsContact CE1-CG 3.47Å; Y187-R271 HydrophobicContact CE2-CG 3.87Å; Y187-R271 HydrophobicContact CG-CB 4.4Å; Y187-R271 PolarHBondContact N-O 3.42Å; Y187-R271 PolarHBondContact O-N 2.81Å; Y187-R271 WeakPolarHBondContact OH-CG 3.45Å; E269-R271 IonicContact OE1-CZ 3.52Å; E269-R271 IonicContact OE1-NE 2.94Å; E269-R271 PolarHBondContact OE1-NE 3.26Å; E269-R271 IonicContact OE1-NH2 2.88Å; E269-R271 PolarHBondContact OE1-NH2 2.76Å; E269-R271 VanDerWaalsContact OE1-NH2 3.1Å
272	G	83.7	Confident	84.6	Confident	2 Å²	2	38.5 Å²	38.5	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	107.6	-3.4	176.3	0	0	0	0	0	114	G104 L182 V183 R184	G104-G272 PolarHBondContact O-N 2.88Å; L182-G272 CarbonylContact C-O 3.5Å; L182-G272 WeakPolarHBondContact CA-O 3.17Å; V183-G272 PolarHBondContact N-O 3.44Å; R184-G272 PolarHBondContact N-O 3.23Å
273	V	84.3	Confident	84.8	Confident	23 Å²	23	37.2 Å²	37.2	14%	0.139	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	156.2	170.6	-62.6	0	0	0	0	110.9	G104 G105 V180 L182	G104-V273 CarbonylContact C-O 3.53Å; G104-V273 VanDerWaalsContact CA-O 3.25Å; G104-V273 WeakPolarHBondContact CA-O 2.94Å; G104-V273 WeakPolarHBondContact O-CG2 3.48Å; G104-V273 PolarHBondContact O-N 3.2Å; G105-V273 VanDerWaalsContact CA-CG2 3.45Å; G105-V273 VanDerWaalsContact N-CG2 3.32Å; V180-V273 HydrophobicContact CG2-CG1 3.43Å; V180-V273 VanDerWaalsContact CG2-CG1 3.43Å; L182-V273 HydrophobicContact CD2-CG1 3.87Å
274	A	74.6	Confident	84.8	Confident	17 Å²	17	41 Å²	41	14%	0.14	21%	0.214	C	C	.	.	S	Bend	trans	-56.6	-64.9	-173.3	0	0	0	0	0	112.3	S78 V183	S78-A274 WeakPolarHBondContact CA-O 3.41Å; S78-A274 WeakPolarHBondContact CB-O 3.18Å; S78-A274 PolarHBondContact OG-O 2.78Å; V183-A274 HydrophobicContact CB-CB 4.41Å; V183-A274 HydrophobicContact CG2-CB 3.45Å; V183-A274 VanDerWaalsContact CG2-CB 3.45Å
275	Y	76.3	Confident	84.8	Confident	40 Å²	40	37.5 Å²	37.5	16%	0.157	20%	0.199	C	C	.	.			trans	-157.7	157.2	-176.1	52.3	-88.7	0	0	0	110.8	Y41 L85 L87 G103 Q277	Y41-Y275 AromaticContact CD2-CE1 3.89Å; Y41-Y275 HydrophobicContact CD2-CE1 3.89Å; Y41-Y275 AromaticContact CD2-CZ 3.8Å; Y41-Y275 WeakPolarHBondContact CD2-OH 3.27Å; Y41-Y275 HydrophobicContact CE2-CE1 4.28Å; L85-Y275 HydrophobicContact CB-CD2 3.76Å; L85-Y275 HydrophobicContact CB-CG 3.91Å; L85-Y275 HydrophobicContact CD2-CD1 3.67Å; L85-Y275 HydrophobicContact CD2-CD2 3.75Å; L85-Y275 HydrophobicContact CD2-CE1 4.06Å; L85-Y275 HydrophobicContact CD2-CE2 4.1Å; L85-Y275 HydrophobicContact CD2-CG 3.53Å; L85-Y275 HydrophobicContact CG-CD2 4.29Å; L85-Y275 HydrophobicContact CG-CG 4.36Å; L87-Y275 HydrophobicContact CD2-CE2 4.37Å; G103-Y275 VanDerWaalsContact O-CA 3.28Å; G103-Y275 WeakPolarHBondContact O-CA 3.48Å; Y275-Q277 HydrophobicContact CD2-CG 4.03Å; Y275-Q277 HydrophobicContact CE2-CG 3.66Å
276	A	79.3	Confident	84.8	Confident	18 Å²	18	37.9 Å²	37.9	15%	0.149	20%	0.201	C	C	.	.			trans	-88.6	133.7	163	0	0	0	0	0	109.6	F84 L85 G103	F84-A276 WeakPolarHBondContact CA-O 3.49Å; F84-A276 WeakPolarHBondContact CB-O 3.44Å; L85-A276 PolarHBondContact N-O 2.98Å; G103-A276 PolarHBondContact O-N 1.98Å
277	Q	77.9	Confident	85.2	Confident	118 Å²	118	35.5 Å²	35.5	55%	0.551	19%	0.19	S	C	*	.	S	Bend	trans	-82	-21.1	175.4	-69.8	-174.5	9.2	0	0	112.8	F84 L87 Y275	F84-Q277 WeakPolarHBondContact CD2-O 3.49Å; L87-Q277 HydrophobicContact CD1-CG 4.48Å; Y275-Q277 HydrophobicContact CD2-CG 4.03Å; Y275-Q277 HydrophobicContact CE2-CG 3.66Å
278	E	82.9	Confident	85.6	Confident	153 Å²	153	35 Å²	35	72%	0.715	18%	0.184	S	C	*	.	S	Bend	trans	-146.4	158.1	-179	58.1	175.9	-173.5	0	0	111.1
279	C	88.3	Confident	85.7	Confident	25 Å²	25	41.6 Å²	41.6	17%	0.169	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-89.1	133.6	174.1	-57.8	0	0	0	0	110.4	F84 C95 T99 Y100	F84-C279 WeakPolarHBondContact CD1-SG 3.28Å; C95-C279 WeakPolarHBondContact CA-SG 3.42Å; C95-C279 HydrophobicContact CB-CB 3.8Å; C95-C279 WeakPolarHBondContact CB-SG 3.43Å; C95-C279 WeakPolarHBondContact SG-CB 3.36Å; C95-C279 CovalentContact SG-SG 2.03Å; C95-C279 PolarHBondContact SG-SG 3.37Å; T99-C279 HydrophobicContact CG2-CB 4.48Å; T99-C279 WeakPolarHBondContact OG1-CB 3.15Å; Y100-C279 CarbonylContact O-C 3.55Å; Y100-C279 WeakPolarHBondContact O-CA 3.4Å
280	S	86	Confident	85.7	Confident	51 Å²	51	41.4 Å²	41.4	36%	0.357	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	141.7	176.4	-55.2	0	0	0	0	110.9	T99 Y100	T99-S280 CarbonylContact C-O 3.55Å; T99-S280 WeakPolarHBondContact CA-O 3.02Å; T99-S280 WeakPolarHBondContact CB-O 3.41Å; Y100-S280 WeakPolarHBondContact CD1-O 3.36Å; Y100-S280 PolarHBondContact N-O 3.13Å; Y100-S280 PolarHBondContact O-N 2.77Å
281	P	89.3	Confident	85.7	Confident	55 Å²	55	46 Å²	46	36%	0.357	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	144.1	175	29	-33.9	0	0	0	111	M306 K307	P281-M306 HydrophobicContact CB-CE 3.96Å; P281-M306 HydrophobicContact CG-CE 3.47Å; P281-M306 VanDerWaalsContact CG-CE 3.47Å; P281-K307 HydrophobicContact CB-CB 4.13Å; P281-K307 HydrophobicContact CB-CG 4.22Å
282	C	89.1	Confident	85.7	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-64.4	133.1	172	-73.2	0	0	0	0	110.8	G98 S288 C295 M306 K307	G98-C282 PolarHBondContact O-N 2.74Å; C282-S288 WeakPolarHBondContact SG-CB 3.34Å; C282-C295 WeakPolarHBondContact CA-SG 3.05Å; C282-C295 HydrophobicContact CB-CB 3.86Å; C282-C295 WeakPolarHBondContact CB-SG 3.05Å; C282-C295 WeakPolarHBondContact SG-CB 3.14Å; C282-C295 CovalentContact SG-SG 2.04Å; C282-C295 PolarHBondContact SG-SG 2.04Å; C282-M306 WeakPolarHBondContact O-CA 3.36Å; C282-K307 PolarHBondContact O-N 2.74Å
283	P	85.3	Confident	85.8	Confident	21 Å²	21	45.2 Å²	45.2	14%	0.136	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-66.4	165.6	175	27.7	-34.5	0	0	0	111.6	E110 T286	E110-P283 WeakPolarHBondContact OE1-CB 3.45Å; P283-T286 WeakPolarHBondContact CD-OG1 3.25Å; P283-T286 HydrophobicContact CG-CG2 4.09Å; P283-T286 WeakPolarHBondContact CG-OG1 3.31Å; P283-T286 PolarHBondContact O-N 2.81Å; P283-T286 VanDerWaalsContact O-N 3.16Å; P283-T286 PolarHBondContact O-OG1 2.91Å
284	N	86.7	Confident	85.9	Confident	79 Å²	79	50.2 Å²	50.2	42%	0.422	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	142.2	177.9	-63.3	-51.8	0	0	0	111.3	T286 M306	N284-T286 PolarHBondContact O-N 2.62Å; N284-M306 WeakPolarHBondContact OD1-CA 3.28Å; N284-M306 WeakPolarHBondContact OD1-CB 3.08Å; N284-M306 PolarHBondContact OD1-N 3.15Å
285	G	87.5	Confident	86.5	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	75	3.1	-177.5	0	0	0	0	0	114.9	C298 S304 Q324 A325	G285-C298 WeakPolarHBondContact O-CB 3.44Å; G285-C298 PolarHBondContact O-N 3.06Å; G285-C298 PolarHBondContact O-SG 3.04Å; G285-S304 VanDerWaalsContact CA-OG 3.24Å; G285-S304 WeakPolarHBondContact CA-OG 3.46Å; G285-S304 PolarHBondContact N-O 2.8Å; G285-S304 PolarHBondContact N-OG 2.7Å; G285-Q324 WeakPolarHBondContact O-CA 3.08Å; G285-A325 WeakPolarHBondContact CA-O 3.36Å
286	T	89.6	Confident	87.1	Confident	8 Å²	8	51.5 Å²	51.5	5%	0.049	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	160.9	171.8	71.4	0	0	0	0	111.1	P283 N284 C295 Q296 S304 Q324	P283-T286 WeakPolarHBondContact CD-OG1 3.25Å; P283-T286 HydrophobicContact CG-CG2 4.09Å; P283-T286 WeakPolarHBondContact CG-OG1 3.31Å; P283-T286 PolarHBondContact O-N 2.81Å; P283-T286 VanDerWaalsContact O-N 3.16Å; P283-T286 PolarHBondContact O-OG1 2.91Å; N284-T286 PolarHBondContact O-N 2.62Å; T286-C295 HydrophobicContact CG2-CB 4.46Å; T286-C295 WeakPolarHBondContact OG1-CB 3.34Å; T286-Q296 CarbonylContact C-O 3.59Å; T286-Q296 WeakPolarHBondContact CA-O 3.41Å; T286-Q296 WeakPolarHBondContact CB-O 3.39Å; T286-S304 PolarHBondContact N-OG 3.13Å; T286-S304 PolarHBondContact O-OG 3.44Å; T286-Q324 HydrophobicContact CG2-CG 3.95Å
287	Y	92.7	Very high	87.5	Confident	42 Å²	42	53.8 Å²	53.8	17%	0.165	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	159.2	177.7	75.8	-78.8	0	0	0	112.2	Q289 C295 Q296 A308 S309 C311	Y287-Q289 HydrophobicContact CD2-CG 4.46Å; Y287-Q289 HydrophobicContact CE2-CG 4.21Å; Y287-C295 CarbonylContact O-C 3.48Å; Y287-C295 WeakPolarHBondContact O-CA 3.4Å; Y287-Q296 HydrophobicContact CD1-CB 4.06Å; Y287-Q296 VanDerWaalsContact CD1-O 3.29Å; Y287-Q296 WeakPolarHBondContact CD1-O 3.24Å; Y287-Q296 HydrophobicContact CE1-CB 3.62Å; Y287-Q296 HydrophobicContact CE2-CB 4.45Å; Y287-Q296 PolarHBondContact N-O 3.19Å; Y287-Q296 PolarHBondContact O-N 3.11Å; Y287-Q296 PolarHBondContact OH-OE1 3.06Å; Y287-A308 VanDerWaalsContact CA-O 3.23Å; Y287-A308 WeakPolarHBondContact CA-O 3.48Å; Y287-A308 WeakPolarHBondContact CB-O 3.37Å; Y287-S309 WeakPolarHBondContact CD2-O 3.16Å; Y287-C311 WeakPolarHBondContact CD1-SG 3.36Å; Y287-C311 VanDerWaalsContact CE1-SG 3.55Å
288	S	92.7	Very high	88	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.021	26%	0.26	C	S	.	.			trans	-140.9	127.3	173.5	169	0	0	0	0	109.2	G98 T99 C282 G290 S292 A308 S309	G98-S288 PolarHBondContact N-O 3.07Å; T99-S288 WeakPolarHBondContact O-CB 3.28Å; T99-S288 PolarHBondContact O-OG 3.13Å; C282-S288 WeakPolarHBondContact SG-CB 3.34Å; S288-G290 PolarHBondContact O-N 2.83Å; S288-G290 VanDerWaalsContact O-N 3.15Å; S288-G290 PolarHBondContact OG-N 3.01Å; S288-S292 WeakPolarHBondContact OG-CB 3.37Å; S288-A308 PolarHBondContact N-O 2.9Å; S288-S309 WeakPolarHBondContact O-CA 3.01Å
289	Q	90.6	Very high	88.2	Confident	138 Å²	138	44.3 Å²	44.3	65%	0.645	25%	0.248	S	C	*	.			trans	-72	-1.2	175.8	-63.7	-177	-1.9	0	0	113	Y287	Y287-Q289 HydrophobicContact CD2-CG 4.46Å; Y287-Q289 HydrophobicContact CE2-CG 4.21Å
290	G	87.5	Confident	87.9	Confident	21 Å²	21	46.4 Å²	46.4	22%	0.216	26%	0.263	C	S	.	.	S	Bend	trans	101.2	163.4	-173.2	0	0	0	0	0	111.5	C95 S288 S292	C95-G290 WeakPolarHBondContact O-CA 3.44Å; S288-G290 PolarHBondContact O-N 2.83Å; S288-G290 VanDerWaalsContact O-N 3.15Å; S288-G290 PolarHBondContact OG-N 3.01Å; G290-S292 PolarHBondContact O-N 2.84Å
291	N	88.6	Confident	87.8	Confident	98 Å²	98	46.3 Å²	46.3	52%	0.524	26%	0.259	S	S	.	.	S	Bend	trans	48.5	34.9	-177.9	-165.2	38.9	0	0	0	114.2	G82 P94 C95	G82-N291 PolarHBondContact O-OD1 3.43Å; P94-N291 HydrophobicContact CB-CB 4.15Å; C95-N291 PolarHBondContact O-N 2.8Å
292	S	87.3	Confident	87.9	Confident	24 Å²	24	44.9 Å²	44.9	17%	0.168	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-112.1	140.7	-175.2	-171.6	0	0	0	0	112.5	G82 Y100 S101 S288 G290 Y294	G82-S292 WeakPolarHBondContact CA-O 3.32Å; Y100-S292 VanDerWaalsContact CA-O 3.3Å; Y100-S292 WeakPolarHBondContact CA-O 3.41Å; Y100-S292 WeakPolarHBondContact CB-O 3.43Å; S101-S292 PolarHBondContact N-O 2.77Å; S288-S292 WeakPolarHBondContact OG-CB 3.37Å; G290-S292 PolarHBondContact O-N 2.84Å; S292-Y294 WeakPolarHBondContact CB-O 3.42Å; S292-Y294 PolarHBondContact O-N 2.83Å; S292-Y294 PolarHBondContact OG-N 3.46Å; S292-Y294 PolarHBondContact OG-O 2.9Å
293	G	85.5	Confident	88	Confident	16 Å²	16	48.4 Å²	48.4	17%	0.165	26%	0.263	C	S	.	.	S	Bend	trans	-73.5	-13.5	170.7	0	0	0	0	0	114.2	S101 L102	S101-G293 WeakPolarHBondContact O-CA 3.23Å; L102-G293 VanDerWaalsContact CD2-O 3.24Å; L102-G293 WeakPolarHBondContact CD2-O 3.27Å
294	Y	85.5	Confident	88.4	Confident	127 Å²	127	47.5 Å²	47.5	50%	0.498	26%	0.257	S	S	.	.	S	Bend	trans	-154.2	157.2	-175.5	68	-80.9	0	0	0	111.3	S292 Q296	S292-Y294 WeakPolarHBondContact CB-O 3.42Å; S292-Y294 PolarHBondContact O-N 2.83Å; S292-Y294 PolarHBondContact OG-N 3.46Å; S292-Y294 PolarHBondContact OG-O 2.9Å; Y294-Q296 HydrophobicContact CD2-CG 4.43Å; Y294-Q296 HydrophobicContact CE2-CG 3.73Å
295	C	88.4	Confident	88.5	Confident	14 Å²	14	45.4 Å²	45.4	10%	0.095	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-90	135.2	170.9	-53.6	0	0	0	0	109.9	Y100 C282 T286 Y287	Y100-C295 WeakPolarHBondContact CD1-SG 3.48Å; C282-C295 WeakPolarHBondContact CA-SG 3.05Å; C282-C295 HydrophobicContact CB-CB 3.86Å; C282-C295 WeakPolarHBondContact CB-SG 3.05Å; C282-C295 WeakPolarHBondContact SG-CB 3.14Å; C282-C295 CovalentContact SG-SG 2.04Å; C282-C295 PolarHBondContact SG-SG 2.04Å; T286-C295 HydrophobicContact CG2-CB 4.46Å; T286-C295 WeakPolarHBondContact OG1-CB 3.34Å; Y287-C295 CarbonylContact O-C 3.48Å; Y287-C295 WeakPolarHBondContact O-CA 3.4Å
296	Q	88.9	Confident	88.5	Confident	70 Å²	70	51.3 Å²	51.3	33%	0.327	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	136.7	174.3	-70.4	177.4	-14.1	0	0	109.5	T286 Y287 Y294	T286-Q296 CarbonylContact C-O 3.59Å; T286-Q296 WeakPolarHBondContact CA-O 3.41Å; T286-Q296 WeakPolarHBondContact CB-O 3.39Å; Y287-Q296 HydrophobicContact CD1-CB 4.06Å; Y287-Q296 VanDerWaalsContact CD1-O 3.29Å; Y287-Q296 WeakPolarHBondContact CD1-O 3.24Å; Y287-Q296 HydrophobicContact CE1-CB 3.62Å; Y287-Q296 HydrophobicContact CE2-CB 4.45Å; Y287-Q296 PolarHBondContact N-O 3.19Å; Y287-Q296 PolarHBondContact O-N 3.11Å; Y287-Q296 PolarHBondContact OH-OE1 3.06Å; Y294-Q296 HydrophobicContact CD2-CG 4.43Å; Y294-Q296 HydrophobicContact CE2-CG 3.73Å
297	P	87.2	Confident	88.4	Confident	67 Å²	67	57 Å²	57	44%	0.435	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	145.3	174.1	29.8	-33.7	0	0	0	110.5	I323 Q324	P297-I323 HydrophobicContact CB-CG2 4.3Å; P297-Q324 HydrophobicContact CB-CB 4.26Å; P297-Q324 HydrophobicContact CB-CG 4.42Å
298	C	88.8	Confident	88.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-68.2	132.1	172.8	-73.6	0	0	0	0	110.8	G285 T302 S304 C311 I323 Q324	G285-C298 WeakPolarHBondContact O-CB 3.44Å; G285-C298 PolarHBondContact O-N 3.06Å; G285-C298 PolarHBondContact O-SG 3.04Å; C298-T302 WeakPolarHBondContact CB-OG1 3.19Å; C298-S304 WeakPolarHBondContact SG-CB 3.36Å; C298-S304 PolarHBondContact SG-OG 3.06Å; C298-C311 WeakPolarHBondContact CA-SG 3.4Å; C298-C311 HydrophobicContact CB-CB 3.92Å; C298-C311 WeakPolarHBondContact CB-SG 3.24Å; C298-C311 WeakPolarHBondContact SG-CB 3.44Å; C298-C311 CovalentContact SG-SG 2.04Å; C298-C311 PolarHBondContact SG-SG 3.06Å; C298-I323 CarbonylContact O-C 3.53Å; C298-I323 WeakPolarHBondContact O-CA 3.41Å; C298-I323 WeakPolarHBondContact O-CG2 3.4Å; C298-Q324 PolarHBondContact O-N 3.08Å
299	P	86.2	Confident	88.4	Confident	71 Å²	71	58.3 Å²	58.3	46%	0.461	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-65.9	165	174	27.6	-34.7	0	0	0	111.7	T302	P299-T302 WeakPolarHBondContact CD-OG1 3.38Å; P299-T302 HydrophobicContact CG-CG2 3.99Å; P299-T302 WeakPolarHBondContact CG-OG1 3.22Å; P299-T302 PolarHBondContact O-N 3.09Å; P299-T302 VanDerWaalsContact O-N 3.11Å; P299-T302 PolarHBondContact O-OG1 2.97Å
300	S	81.9	Confident	88.5	Confident	70 Å²	70	58.7 Å²	58.7	49%	0.49	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	146.3	173.8	56.4	0	0	0	0	112	T302	S300-T302 PolarHBondContact O-N 3.41Å
301	N	85	Confident	88.8	Confident	49 Å²	49	59 Å²	59	26%	0.262	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	18	-173.4	-59.2	-51.3	0	0	0	114.6	C314 S321	N301-C314 PolarHBondContact O-N 3.22Å; N301-S321 VanDerWaalsContact C-OG 3.25Å; N301-S321 WeakPolarHBondContact CA-OG 3.44Å; N301-S321 PolarHBondContact N-O 2.81Å; N301-S321 PolarHBondContact N-OG 3.42Å
302	T	90.6	Very high	89	Confident	24 Å²	24	58.9 Å²	58.9	15%	0.147	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	159	166.5	73.2	0	0	0	0	111	C298 P299 S300 C311 L312 S321	C298-T302 WeakPolarHBondContact CB-OG1 3.19Å; P299-T302 WeakPolarHBondContact CD-OG1 3.38Å; P299-T302 HydrophobicContact CG-CG2 3.99Å; P299-T302 WeakPolarHBondContact CG-OG1 3.22Å; P299-T302 PolarHBondContact O-N 3.09Å; P299-T302 VanDerWaalsContact O-N 3.11Å; P299-T302 PolarHBondContact O-OG1 2.97Å; S300-T302 PolarHBondContact O-N 3.41Å; T302-C311 WeakPolarHBondContact OG1-CB 3.46Å; T302-L312 CarbonylContact C-O 3.46Å; T302-L312 WeakPolarHBondContact CA-O 3.17Å; T302-L312 WeakPolarHBondContact CB-O 3.5Å; T302-S321 PolarHBondContact N-OG 3.44Å; T302-S321 PolarHBondContact O-OG 3.03Å
303	Y	92	Very high	89.3	Confident	74 Å²	74	62.6 Å²	62.6	29%	0.29	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	160.3	179.3	76.3	-76.9	0	0	0	111.7	C311 L312 A325 S326 C328	Y303-C311 WeakPolarHBondContact O-CA 3.08Å; Y303-L312 HydrophobicContact CD1-CB 4.01Å; Y303-L312 VanDerWaalsContact CD1-O 3.25Å; Y303-L312 WeakPolarHBondContact CD1-O 3.28Å; Y303-L312 HydrophobicContact CE1-CB 3.58Å; Y303-L312 HydrophobicContact CE1-CD1 4.41Å; Y303-L312 HydrophobicContact CE2-CD1 4.31Å; Y303-L312 PolarHBondContact N-O 3.42Å; Y303-L312 PolarHBondContact O-N 3.47Å; Y303-A325 WeakPolarHBondContact CA-O 3.43Å; Y303-A325 WeakPolarHBondContact CB-O 3.37Å; Y303-S326 WeakPolarHBondContact CD2-O 3.32Å; Y303-C328 WeakPolarHBondContact CD1-SG 3.4Å; Y303-C328 VanDerWaalsContact CE1-SG 3.53Å
304	S	92.7	Very high	89.5	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.014	34%	0.34	C	S	.	.			trans	-148.1	145.5	171.3	70.9	0	0	0	0	112.9	G285 T286 C298 A325 S326	G285-S304 VanDerWaalsContact CA-OG 3.24Å; G285-S304 WeakPolarHBondContact CA-OG 3.46Å; G285-S304 PolarHBondContact N-O 2.8Å; G285-S304 PolarHBondContact N-OG 2.7Å; T286-S304 PolarHBondContact N-OG 3.13Å; T286-S304 PolarHBondContact O-OG 3.44Å; C298-S304 WeakPolarHBondContact SG-CB 3.36Å; C298-S304 PolarHBondContact SG-OG 3.06Å; S304-A325 PolarHBondContact N-O 2.95Å; S304-A325 VanDerWaalsContact N-O 3.12Å; S304-S326 WeakPolarHBondContact O-CA 3.45Å
305	G	89	Confident	89.8	Confident	36 Å²	36	59.8 Å²	59.8	37%	0.371	34%	0.335	S	S	.	.			trans	-81.1	177.5	167.9	0	0	0	0	0	112.4	A308	G305-A308 VanDerWaalsContact O-CB 3.24Å; G305-A308 WeakPolarHBondContact O-CB 3.47Å; G305-A308 PolarHBondContact O-N 3.28Å
306	M	87.8	Confident	89.6	Confident	123 Å²	123	64.9 Å²	64.9	61%	0.606	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	141.3	173.9	-170.6	176.8	180	0	0	110.6	P281 C282 N284 A308	P281-M306 HydrophobicContact CB-CE 3.96Å; P281-M306 HydrophobicContact CG-CE 3.47Å; P281-M306 VanDerWaalsContact CG-CE 3.47Å; C282-M306 WeakPolarHBondContact O-CA 3.36Å; N284-M306 WeakPolarHBondContact OD1-CA 3.28Å; N284-M306 WeakPolarHBondContact OD1-CB 3.08Å; N284-M306 PolarHBondContact OD1-N 3.15Å; M306-A308 VanDerWaalsContact C-N 3.3Å; M306-A308 PolarHBondContact O-N 2.97Å
307	K	88.2	Confident	89.3	Confident	128 Å²	128	69.6 Å²	69.6	56%	0.557	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	34.6	-179.7	-157.8	-178.6	177.8	175.8	0	113.7	G98 T99 P281 C282	G98-K307 WeakPolarHBondContact O-CA 3.2Å; T99-K307 HydrophobicContact CG2-CG 4.22Å; P281-K307 HydrophobicContact CB-CB 4.13Å; P281-K307 HydrophobicContact CB-CG 4.22Å; C282-K307 PolarHBondContact O-N 2.74Å
308	A	91.5	Very high	89.3	Confident	17 Å²	17	67.6 Å²	67.6	14%	0.14	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-81	140.2	178.3	0	0	0	0	0	113.5	G98 Y287 S288 G305 M306	G98-A308 VanDerWaalsContact CA-O 3.25Å; G98-A308 WeakPolarHBondContact CA-O 3.45Å; Y287-A308 VanDerWaalsContact CA-O 3.23Å; Y287-A308 WeakPolarHBondContact CA-O 3.48Å; Y287-A308 WeakPolarHBondContact CB-O 3.37Å; S288-A308 PolarHBondContact N-O 2.9Å; G305-A308 VanDerWaalsContact O-CB 3.24Å; G305-A308 WeakPolarHBondContact O-CB 3.47Å; G305-A308 PolarHBondContact O-N 3.28Å; M306-A308 VanDerWaalsContact C-N 3.3Å; M306-A308 PolarHBondContact O-N 2.97Å
309	S	92.8	Very high	89.2	Confident	56 Å²	56	70.2 Å²	70.2	39%	0.392	38%	0.375	S	S	.	.	S	Bend	trans	-90.4	-20.8	176.1	58.1	0	0	0	0	114	Y287 S288	Y287-S309 WeakPolarHBondContact CD2-O 3.16Å; S288-S309 WeakPolarHBondContact O-CA 3.01Å
310	K	93.1	Very high	89.2	Confident	146 Å²	146	68.4 Å²	68.4	64%	0.635	36%	0.36	S	S	*	.	S	Bend	trans	-151	157.7	177.9	-64.7	-173.9	179.9	-179.9	0	109.6
311	C	93.7	Very high	89.2	Confident	28 Å²	28	65.3 Å²	65.3	19%	0.189	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-84.5	144.8	170.4	-53.6	0	0	0	0	111	Y287 C298 T302 Y303	Y287-C311 WeakPolarHBondContact CD1-SG 3.36Å; Y287-C311 VanDerWaalsContact CE1-SG 3.55Å; C298-C311 WeakPolarHBondContact CA-SG 3.4Å; C298-C311 HydrophobicContact CB-CB 3.92Å; C298-C311 WeakPolarHBondContact CB-SG 3.24Å; C298-C311 WeakPolarHBondContact SG-CB 3.44Å; C298-C311 CovalentContact SG-SG 2.04Å; C298-C311 PolarHBondContact SG-SG 3.06Å; T302-C311 WeakPolarHBondContact OG1-CB 3.46Å; Y303-C311 WeakPolarHBondContact O-CA 3.08Å
312	L	94	Very high	88.8	Confident	94 Å²	94	65 Å²	65	49%	0.492	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	135.7	175.4	-63.9	173.1	0	0	0	109.5	T302 Y303	T302-L312 CarbonylContact C-O 3.46Å; T302-L312 WeakPolarHBondContact CA-O 3.17Å; T302-L312 WeakPolarHBondContact CB-O 3.5Å; Y303-L312 HydrophobicContact CD1-CB 4.01Å; Y303-L312 VanDerWaalsContact CD1-O 3.25Å; Y303-L312 WeakPolarHBondContact CD1-O 3.28Å; Y303-L312 HydrophobicContact CE1-CB 3.58Å; Y303-L312 HydrophobicContact CE1-CD1 4.41Å; Y303-L312 HydrophobicContact CE2-CD1 4.31Å; Y303-L312 PolarHBondContact N-O 3.42Å; Y303-L312 PolarHBondContact O-N 3.47Å
313	P	93.1	Very high	88.2	Confident	102 Å²	102	68.6 Å²	68.6	66%	0.662	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	142.8	177.1	30.3	-33.8	0	0	0	111.5
314	C	89.9	Confident	87.7	Confident	12 Å²	12	70.1 Å²	70.1	8%	0.081	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-76.2	155.1	168.4	-61.3	0	0	0	0	110.8	N301 N316 Q319 S321 C328	N301-C314 PolarHBondContact O-N 3.22Å; C314-N316 PolarHBondContact O-N 3.26Å; C314-Q319 HydrophobicContact CB-CB 4.15Å; C314-S321 VanDerWaalsContact SG-CB 3.58Å; C314-S321 PolarHBondContact SG-OG 3.45Å; C314-S321 VanDerWaalsContact SG-OG 3.35Å; C314-C328 WeakPolarHBondContact CA-SG 3.48Å; C314-C328 HydrophobicContact CB-CB 3.85Å; C314-C328 WeakPolarHBondContact CB-SG 3.26Å; C314-C328 WeakPolarHBondContact SG-CB 3.32Å; C314-C328 CovalentContact SG-SG 2.03Å; C314-C328 PolarHBondContact SG-SG 2.98Å
315	D	90.6	Very high	87.2	Confident	72 Å²	72	70.9 Å²	70.9	39%	0.385	38%	0.38	S	S	.	.			trans	-63.2	109.5	170	173.5	10.7	0	0	0	109.6	R317 T318 Q319	D315-R317 PolarHBondContact O-N 3.36Å; D315-R317 PolarHBondContact OD1-N 2.89Å; D315-T318 PolarHBondContact O-N 2.91Å; D315-T318 WeakPolarHBondContact OD2-CB 3.38Å; D315-T318 WeakPolarHBondContact OD2-CG2 3.44Å; D315-T318 PolarHBondContact OD2-OG1 3.14Å; D315-Q319 HydrophobicContact CB-CB 4.37Å; D315-Q319 CarbonylContact O-C 3.48Å; D315-Q319 WeakPolarHBondContact O-CA 3.39Å; D315-Q319 PolarHBondContact O-N 3.12Å
316	N	85	Confident	87.1	Confident	121 Å²	121	72 Å²	72	65%	0.647	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-27	-174.4	-161.8	23.1	0	0	0	113.3	C314 R331	C314-N316 PolarHBondContact O-N 3.26Å; N316-R331 PolarHBondContact O-NE 2.93Å; N316-R331 PolarHBondContact O-NH2 2.91Å
317	R	83.3	Confident	87.1	Confident	170 Å²	170	72.5 Å²	72.5	64%	0.642	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-45	-179.2	-169.9	-174	66.9	-176.4	-0.4	113	D315 R331 R365	D315-R317 PolarHBondContact O-N 3.36Å; D315-R317 PolarHBondContact OD1-N 2.89Å; R317-R331 WeakPolarHBondContact O-CD 3.39Å; R317-R365 WeakPolarHBondContact O-CD 3.23Å
318	T	85.8	Confident	87.2	Confident	24 Å²	24	67.6 Å²	67.6	15%	0.147	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-23.8	-170.1	65.1	0	0	0	0	113.6	D315 Q330 R331	D315-T318 PolarHBondContact O-N 2.91Å; D315-T318 WeakPolarHBondContact OD2-CB 3.38Å; D315-T318 WeakPolarHBondContact OD2-CG2 3.44Å; D315-T318 PolarHBondContact OD2-OG1 3.14Å; T318-Q330 PolarHBondContact O-OE1 3.5Å; T318-Q330 VanDerWaalsContact O-OE1 3.12Å; T318-R331 WeakPolarHBondContact O-CB 3.41Å; T318-R331 WeakPolarHBondContact O-CG 3.29Å; T318-R331 PolarHBondContact O-N 3.36Å
319	Q	88.2	Confident	86.9	Confident	55 Å²	55	71.9 Å²	71.9	26%	0.257	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	159.3	-171.6	-68.9	176.3	-16.4	0	0	111.8	C314 D315 C328 E329 Q330 R331	C314-Q319 HydrophobicContact CB-CB 4.15Å; D315-Q319 HydrophobicContact CB-CB 4.37Å; D315-Q319 CarbonylContact O-C 3.48Å; D315-Q319 WeakPolarHBondContact O-CA 3.39Å; D315-Q319 PolarHBondContact O-N 3.12Å; Q319-C328 HydrophobicContact CB-CB 4Å; Q319-C328 HydrophobicContact CG-CB 4.39Å; Q319-E329 CarbonylContact C-O 3.46Å; Q319-E329 WeakPolarHBondContact CA-O 3.26Å; Q319-E329 WeakPolarHBondContact CB-O 3.4Å; Q319-Q330 VanDerWaalsContact NE2-NE2 3.18Å; Q319-R331 PolarHBondContact O-NE 3.2Å
320	F	84.9	Confident	86.6	Confident	33 Å²	33	74.9 Å²	74.9	15%	0.145	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	164.4	172.9	77.7	-75	0	0	0	109.7	E329 Q330 R331 I363	F320-E329 HydrophobicContact CD1-CB 4.31Å; F320-E329 HydrophobicContact CE1-CB 3.82Å; F320-E329 HydrophobicContact CZ-CB 4.12Å; F320-E329 PolarHBondContact N-O 3.38Å; F320-E329 PolarHBondContact O-N 2.84Å; F320-Q330 WeakPolarHBondContact CE1-O 3.36Å; F320-R331 HydrophobicContact CB-CG 4.13Å; F320-R331 HydrophobicContact CD1-CG 3.83Å; F320-R331 HydrophobicContact CG-CG 4.39Å; F320-I363 HydrophobicContact CD1-CG2 3.83Å; F320-I363 HydrophobicContact CD2-CD1 4.44Å; F320-I363 HydrophobicContact CD2-CG1 4.22Å; F320-I363 HydrophobicContact CD2-CG2 3.82Å; F320-I363 HydrophobicContact CE1-CG2 3.73Å; F320-I363 HydrophobicContact CE2-CD1 4.3Å; F320-I363 HydrophobicContact CE2-CG1 4.47Å; F320-I363 HydrophobicContact CE2-CG2 3.73Å; F320-I363 HydrophobicContact CG-CG2 3.88Å; F320-I363 HydrophobicContact CZ-CG2 3.69Å
321	S	82.5	Confident	86.3	Confident	6 Å²	6	69.2 Å²	69.2	4%	0.042	36%	0.362	C	S	.	.			trans	-149.8	147.6	169.2	66.9	0	0	0	0	110.6	N301 T302 C314	N301-S321 VanDerWaalsContact C-OG 3.25Å; N301-S321 WeakPolarHBondContact CA-OG 3.44Å; N301-S321 PolarHBondContact N-O 2.81Å; N301-S321 PolarHBondContact N-OG 3.42Å; T302-S321 PolarHBondContact N-OG 3.44Å; T302-S321 PolarHBondContact O-OG 3.03Å; C314-S321 VanDerWaalsContact SG-CB 3.58Å; C314-S321 PolarHBondContact SG-OG 3.45Å; C314-S321 VanDerWaalsContact SG-OG 3.35Å
322	G	75.5	Confident	85.9	Confident	43 Å²	43	69.6 Å²	69.6	44%	0.443	36%	0.364	S	S	.	.			trans	-71.4	179.3	168.7	0	0	0	0	0	112.3	A325	G322-A325 WeakPolarHBondContact O-CB 3.4Å
323	I	79.5	Confident	85.6	Confident	99 Å²	99	67.8 Å²	67.8	51%	0.508	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	145.3	168.1	-62.9	170	0	0	0	108.6	P297 C298 A325	P297-I323 HydrophobicContact CB-CG2 4.3Å; C298-I323 CarbonylContact O-C 3.53Å; C298-I323 WeakPolarHBondContact O-CA 3.41Å; C298-I323 WeakPolarHBondContact O-CG2 3.4Å; I323-A325 PolarHBondContact O-N 3.02Å
324	Q	81.2	Confident	85.2	Confident	106 Å²	106	63 Å²	63	50%	0.495	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	33.8	178.8	-158.4	178.7	-29.9	0	0	113.7	G285 T286 P297 C298	G285-Q324 WeakPolarHBondContact O-CA 3.08Å; T286-Q324 HydrophobicContact CG2-CG 3.95Å; P297-Q324 HydrophobicContact CB-CB 4.26Å; P297-Q324 HydrophobicContact CB-CG 4.42Å; C298-Q324 PolarHBondContact O-N 3.08Å
325	A	82.9	Confident	84.9	Confident	17 Å²	17	64.9 Å²	64.9	14%	0.14	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-79.7	140	179.6	0	0	0	0	0	113	G285 Y303 S304 G322 I323	G285-A325 WeakPolarHBondContact CA-O 3.36Å; Y303-A325 WeakPolarHBondContact CA-O 3.43Å; Y303-A325 WeakPolarHBondContact CB-O 3.37Å; S304-A325 PolarHBondContact N-O 2.95Å; S304-A325 VanDerWaalsContact N-O 3.12Å; G322-A325 WeakPolarHBondContact O-CB 3.4Å; I323-A325 PolarHBondContact O-N 3.02Å
326	S	86.7	Confident	84.3	Confident	60 Å²	60	65.6 Å²	65.6	42%	0.42	35%	0.345	S	S	.	.	S	Bend	trans	-85.9	-19.2	175.3	62.1	0	0	0	0	113.8	Y303 S304	Y303-S326 WeakPolarHBondContact CD2-O 3.32Å; S304-S326 WeakPolarHBondContact O-CA 3.45Å
327	K	87.8	Confident	83.6	Confident	134 Å²	134	60.7 Å²	60.7	58%	0.583	32%	0.32	S	S	*	.	S	Bend	trans	-153.6	157.7	-178.4	60.1	180	-179.3	176.4	0	109.9
328	C	89.7	Confident	83.3	Confident	24 Å²	24	53 Å²	53	16%	0.162	29%	0.292	C	S	.	.			trans	-81.3	145.1	168.3	-54.3	0	0	0	0	110.9	Y303 C314 Q319	Y303-C328 WeakPolarHBondContact CD1-SG 3.4Å; Y303-C328 VanDerWaalsContact CE1-SG 3.53Å; C314-C328 WeakPolarHBondContact CA-SG 3.48Å; C314-C328 HydrophobicContact CB-CB 3.85Å; C314-C328 WeakPolarHBondContact CB-SG 3.26Å; C314-C328 WeakPolarHBondContact SG-CB 3.32Å; C314-C328 CovalentContact SG-SG 2.03Å; C314-C328 PolarHBondContact SG-SG 2.98Å; Q319-C328 HydrophobicContact CB-CB 4Å; Q319-C328 HydrophobicContact CG-CB 4.39Å
329	E	85.3	Confident	83.1	Confident	107 Å²	107	54 Å²	54	50%	0.5	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	154.2	174.1	-62.1	-171.3	165.8	0	0	110.2	Q319 F320	Q319-E329 CarbonylContact C-O 3.46Å; Q319-E329 WeakPolarHBondContact CA-O 3.26Å; Q319-E329 WeakPolarHBondContact CB-O 3.4Å; F320-E329 HydrophobicContact CD1-CB 4.31Å; F320-E329 HydrophobicContact CE1-CB 3.82Å; F320-E329 HydrophobicContact CZ-CB 4.12Å; F320-E329 PolarHBondContact N-O 3.38Å; F320-E329 PolarHBondContact O-N 2.84Å
330	Q	86	Confident	82.5	Confident	120 Å²	120	54 Å²	54	56%	0.561	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	136.8	179	-68.2	-67.6	-22.2	0	0	110.2	T318 Q319 F320 P332	T318-Q330 PolarHBondContact O-OE1 3.5Å; T318-Q330 VanDerWaalsContact O-OE1 3.12Å; Q319-Q330 VanDerWaalsContact NE2-NE2 3.18Å; F320-Q330 WeakPolarHBondContact CE1-O 3.36Å; Q330-P332 WeakPolarHBondContact O-CD 3.44Å
331	R	86.3	Confident	82.1	Confident	27 Å²	27	53.9 Å²	53.9	10%	0.102	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-68.1	120.6	175.4	-67.9	-179.3	177.9	-91	8	109.8	N316 R317 T318 Q319 F320 K362 I363 R365	N316-R331 PolarHBondContact O-NE 2.93Å; N316-R331 PolarHBondContact O-NH2 2.91Å; R317-R331 WeakPolarHBondContact O-CD 3.39Å; T318-R331 WeakPolarHBondContact O-CB 3.41Å; T318-R331 WeakPolarHBondContact O-CG 3.29Å; T318-R331 PolarHBondContact O-N 3.36Å; Q319-R331 PolarHBondContact O-NE 3.2Å; F320-R331 HydrophobicContact CB-CG 4.13Å; F320-R331 HydrophobicContact CD1-CG 3.83Å; F320-R331 HydrophobicContact CG-CG 4.39Å; R331-K362 PolarHBondContact NH1-O 2.93Å; R331-I363 WeakPolarHBondContact CB-O 3.47Å; R331-I363 WeakPolarHBondContact CD-O 3.46Å; R331-I363 WeakPolarHBondContact CG-O 3.47Å; R331-I363 VanDerWaalsContact NH1-CA 3.29Å; R331-I363 PolarHBondContact NH1-O 2.76Å; R331-R365 HydrophobicContact CB-CG 3.93Å
332	P	85.4	Confident	81.7	Confident	35 Å²	35	55.6 Å²	55.6	23%	0.227	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-72.6	164.2	179	28.7	-32.3	0	0	0	112	Q330 C364 R365	Q330-P332 WeakPolarHBondContact O-CD 3.44Å; P332-C364 CarbonylContact O-C 3.47Å; P332-C364 VanDerWaalsContact O-CA 3.27Å; P332-C364 WeakPolarHBondContact O-CA 3.48Å; P332-R365 PolarHBondContact O-N 2.97Å
333	P	87.4	Confident	81.7	Confident	57 Å²	57	56.1 Å²	56.1	37%	0.37	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-62.2	141.4	172.8	27.2	-34.3	0	0	0	111	R365 A371	P333-R365 CarbonylContact C-O 3.58Å; P333-R365 WeakPolarHBondContact CA-O 3.27Å; P333-A371 HydrophobicContact CB-CB 3.94Å
334	C	86.5	Confident	81.4	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.007	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-64.7	142.1	176.2	-68.9	0	0	0	0	111.4	W358 C364 R365 A371 V372	C334-W358 HydrophobicContact CB-CH2 3.77Å; C334-W358 HydrophobicContact CB-CZ3 3.82Å; C334-C364 WeakPolarHBondContact CA-SG 3.32Å; C334-C364 HydrophobicContact CB-CB 3.81Å; C334-C364 WeakPolarHBondContact CB-SG 3.2Å; C334-C364 WeakPolarHBondContact SG-CB 3.37Å; C334-C364 CovalentContact SG-SG 2.04Å; C334-C364 PolarHBondContact SG-SG 3.23Å; C334-R365 PolarHBondContact N-O 3.04Å; C334-R365 PolarHBondContact SG-N 3.01Å; C334-R365 VanDerWaalsContact SG-N 3.44Å; C334-A371 HydrophobicContact CB-CB 4.44Å; C334-A371 WeakPolarHBondContact O-CA 3.41Å; C334-V372 PolarHBondContact O-N 3.17Å
335	T	83.5	Confident	81.1	Confident	51 Å²	51	51.7 Å²	51.7	31%	0.313	28%	0.284	S	S	.	.			trans	-124.7	174.1	-179.3	67.3	0	0	0	0	110.1	S337 D338	T335-S337 PolarHBondContact O-N 2.76Å; T335-S337 PolarHBondContact OG1-N 2.84Å; T335-S337 PolarHBondContact OG1-OG 3.15Å; T335-D338 PolarHBondContact N-OD2 2.94Å; T335-D338 PolarHBondContact O-N 3.08Å; T335-D338 VanDerWaalsContact O-N 3.16Å; T335-D338 PolarHBondContact OG1-OD2 3.23Å
336	V	77.3	Confident	80.8	Confident	87 Å²	87	52 Å²	52	53%	0.527	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-10	174.3	-61.8	0	0	0	0	113.7	Y339 V372	V336-Y339 HydrophobicContact CB-CE1 4.29Å; V336-Y339 HydrophobicContact CG1-CE1 4.26Å; V336-V372 HydrophobicContact CG1-CG1 4.29Å; V336-V372 HydrophobicContact CG1-CG2 4.25Å
337	S	70.3	Confident	80.2	Confident	19 Å²	19	53.7 Å²	53.7	13%	0.133	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-14.3	173.3	56.4	0	0	0	0	113.8	T335 R472	T335-S337 PolarHBondContact O-N 2.76Å; T335-S337 PolarHBondContact OG1-N 2.84Å; T335-S337 PolarHBondContact OG1-OG 3.15Å; S337-R472 WeakPolarHBondContact O-CD 3.45Å
338	D	76.8	Confident	79.2	Confident	9 Å²	9	58.4 Å²	58.4	5%	0.048	30%	0.304	C	S	.	.	S	Bend	trans	-86.9	-5.9	-178.1	-59.2	-73.7	0	0	0	112.8	T335 W358 T359 C364 R474	T335-D338 PolarHBondContact N-OD2 2.94Å; T335-D338 PolarHBondContact O-N 3.08Å; T335-D338 VanDerWaalsContact O-N 3.16Å; T335-D338 PolarHBondContact OG1-OD2 3.23Å; D338-W358 HydrophobicContact CB-CE3 4.09Å; D338-W358 HydrophobicContact CB-CZ3 4Å; D338-W358 VanDerWaalsContact O-CE3 3.31Å; D338-T359 PolarHBondContact O-N 3.07Å; D338-T359 PolarHBondContact O-OG1 3.24Å; D338-C364 HydrophobicContact CB-CB 4.47Å; D338-C364 VanDerWaalsContact CB-SG 3.55Å; D338-R474 IonicContact OD1-CZ 3.3Å; D338-R474 IonicContact OD1-NE 3.08Å; D338-R474 IonicContact OD1-NH2 3.9Å; D338-R474 PolarHBondContact OD1-NH2 3.42Å; D338-R474 VanDerWaalsContact OD1-NH2 3.13Å; D338-R474 IonicContact OD2-NH2 2.76Å
339	Y	81.2	Confident	78.2	Confident	45 Å²	45	63.8 Å²	63.8	18%	0.176	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	157.1	172.1	71.4	-97	0	0	0	112	V336 Y356 R357 W358 V372 L374 P375	V336-Y339 HydrophobicContact CB-CE1 4.29Å; V336-Y339 HydrophobicContact CG1-CE1 4.26Å; Y339-Y356 AromaticContact CD2-CD1 3.69Å; Y339-Y356 HydrophobicContact CD2-CD1 3.69Å; Y339-Y356 HydrophobicContact CD2-CE1 4.47Å; Y339-Y356 HydrophobicContact CD2-CG 4.42Å; Y339-Y356 AromaticContact CE2-CD1 3.61Å; Y339-Y356 HydrophobicContact CE2-CD1 3.61Å; Y339-Y356 AromaticContact CE2-CE1 3.98Å; Y339-Y356 HydrophobicContact CE2-CE1 3.98Å; Y339-Y356 HydrophobicContact CE2-CG 4.48Å; Y339-R357 CarbonylContact C-O 3.53Å; Y339-R357 VanDerWaalsContact CA-O 3.26Å; Y339-R357 WeakPolarHBondContact CA-O 3.37Å; Y339-R357 WeakPolarHBondContact CB-O 3.33Å; Y339-W358 HydrophobicContact CD1-CH2 4.28Å; Y339-W358 AromaticContact CD1-CZ3 3.92Å; Y339-W358 HydrophobicContact CD1-CZ3 3.92Å; Y339-W358 HydrophobicContact CG-CZ3 4.44Å; Y339-V372 HydrophobicContact CE1-CG1 3.81Å; Y339-L374 HydrophobicContact CG-CD1 4.12Å; Y339-P375 HydrophobicContact CD2-CG 4.5Å; Y339-P375 HydrophobicContact CE1-CG 4.28Å; Y339-P375 HydrophobicContact CE2-CG 3.75Å
340	Y	75.2	Confident	77.4	Confident	55 Å²	55	62.7 Å²	62.7	22%	0.216	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	160.2	175.6	61.8	-80.5	0	0	0	109.9	L342 Y356 R357 W358 T359 L462	Y340-L342 HydrophobicContact CD2-CD2 4.08Å; Y340-L342 HydrophobicContact CD2-CG 3.89Å; Y340-L342 HydrophobicContact CE2-CD1 3.71Å; Y340-L342 HydrophobicContact CE2-CD2 3.69Å; Y340-L342 HydrophobicContact CE2-CG 3.5Å; Y340-L342 VanDerWaalsContact CE2-CG 3.5Å; Y340-Y356 WeakPolarHBondContact O-CA 3.38Å; Y340-R357 VanDerWaalsContact CD1-O 3.29Å; Y340-R357 WeakPolarHBondContact CD1-O 3.39Å; Y340-R357 HydrophobicContact CE1-CB 4.09Å; Y340-R357 HydrophobicContact CE2-CB 4.34Å; Y340-R357 PolarHBondContact N-O 2.84Å; Y340-R357 PolarHBondContact O-N 2.81Å; Y340-W358 WeakPolarHBondContact CE1-O 3.43Å; Y340-T359 HydrophobicContact CD1-CG2 3.88Å; Y340-T359 HydrophobicContact CE1-CG2 4.34Å; Y340-L462 HydrophobicContact CD1-CD1 4.47Å; Y340-L462 HydrophobicContact CD2-CD1 3.81Å; Y340-L462 HydrophobicContact CD2-CD2 4.27Å; Y340-L462 HydrophobicContact CE2-CD1 4.49Å; Y340-L462 HydrophobicContact CE2-CD2 4.29Å; Y340-L462 HydrophobicContact CG-CD1 3.8Å
341	S	77.4	Confident	77.1	Confident	30 Å²	30	59.7 Å²	59.7	21%	0.21	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.4	177.2	54.1	0	0	0	0	110.3	E355	S341-E355 CarbonylContact C-O 3.15Å; S341-E355 WeakPolarHBondContact CA-O 3.43Å
342	L	74	Confident	76.7	Confident	42 Å²	42	58.7 Å²	58.7	22%	0.22	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	128	173.7	-73.5	172.3	0	0	0	108.7	Y340 I354 E355 R357	Y340-L342 HydrophobicContact CD2-CD2 4.08Å; Y340-L342 HydrophobicContact CD2-CG 3.89Å; Y340-L342 HydrophobicContact CE2-CD1 3.71Å; Y340-L342 HydrophobicContact CE2-CD2 3.69Å; Y340-L342 HydrophobicContact CE2-CG 3.5Å; Y340-L342 VanDerWaalsContact CE2-CG 3.5Å; L342-I354 WeakPolarHBondContact O-CA 3.14Å; L342-E355 PolarHBondContact N-O 3.06Å; L342-E355 PolarHBondContact O-N 2.81Å; L342-R357 HydrophobicContact CD1-CG 4.03Å
343	H	74.9	Confident	76.5	Confident	54 Å²	54	60.6 Å²	60.6	25%	0.25	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121.7	169.1	-67.8	80.9	0	0	0	108.2	I354	H343-I354 WeakPolarHBondContact NE2-CD1 3.47Å
344	G	74.9	Confident	76.2	Confident	23 Å²	23	58.8 Å²	58.8	24%	0.237	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-65.4	165.8	168.6	0	0	0	0	0	111.6	S352 I353	G344-S352 PolarHBondContact N-OG 2.05Å; G344-S352 PolarHBondContact O-OG 2.95Å; G344-I353 PolarHBondContact N-O 3.23Å
345	P	74.3	Confident	76.1	Confident	88 Å²	88	62.7 Å²	62.7	57%	0.571	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-58	146.4	175.6	26.5	-34.5	0	0	0	110.8	N347	P345-N347 PolarHBondContact O-N 3.26Å
346	C	75.4	Confident	76.1	Confident	23 Å²	23	62.9 Å²	62.9	16%	0.155	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-72.6	121.6	177.1	-76.3	0	0	0	0	110.4	C383 M392 G395	C346-C383 VanDerWaalsContact CA-SG 3.59Å; C346-C383 HydrophobicContact CB-CB 4.12Å; C346-C383 WeakPolarHBondContact CB-SG 3.21Å; C346-C383 WeakPolarHBondContact SG-CB 3.5Å; C346-C383 CovalentContact SG-SG 2.03Å; C346-C383 PolarHBondContact SG-SG 2.84Å; C346-M392 HydrophobicContact CB-CE 4.38Å; C346-G395 WeakPolarHBondContact O-CA 3.23Å
347	N	74.6	Confident	76.4	Confident	97 Å²	97	64.6 Å²	64.6	52%	0.519	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-70.1	166.6	171.5	-70.4	-25.7	0	0	0	110.9	P345 N349 R350 K351	P345-N347 PolarHBondContact O-N 3.26Å; N347-N349 PolarHBondContact O-N 2.93Å; N347-R350 PolarHBondContact O-N 2.94Å; N347-K351 WeakPolarHBondContact CB-O 3.13Å; N347-K351 PolarHBondContact N-O 3.49Å
348	W	66.9	Low	77	Confident	233 Å²	233	65.7 Å²	65.7	88%	0.883	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-22.5	177.1	-67.6	-56	0	0	0	114.7
349	N	69.2	Low	76.9	Confident	137 Å²	137	66 Å²	66	73%	0.733	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	13.7	177.5	-65.5	-8.7	0	0	0	114.2	N347 K351	N347-N349 PolarHBondContact O-N 2.93Å; N349-K351 HydrophobicContact CB-CG 4.37Å; N349-K351 PolarHBondContact O-N 3.09Å
350	R	68.7	Low	76.2	Confident	83 Å²	83	70.3 Å²	70.3	31%	0.313	34%	0.335	S	S	.	.	S	Bend	trans	52.4	35.9	-170.2	-68.5	-168.8	-173.2	155.8	4.6	113.3	N347 C383 D412 A413	N347-R350 PolarHBondContact O-N 2.94Å; R350-C383 VanDerWaalsContact C-SG 3.52Å; R350-C383 HydrophobicContact CB-CB 4.05Å; R350-C383 WeakPolarHBondContact O-CB 3.29Å; R350-C383 PolarHBondContact O-N 3.09Å; R350-D412 PolarHBondContact NH2-O 2.79Å; R350-A413 PolarHBondContact NE-O 3.38Å
351	K	78.5	Confident	76	Confident	58 Å²	58	70.7 Å²	70.7	25%	0.252	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.4	173.9	-65.8	-54.6	-163.5	169.3	0	108.9	N347 N349 N380 V381 D382	N347-K351 WeakPolarHBondContact CB-O 3.13Å; N347-K351 PolarHBondContact N-O 3.49Å; N349-K351 HydrophobicContact CB-CG 4.37Å; N349-K351 PolarHBondContact O-N 3.09Å; K351-N380 HydrophobicContact CD-CB 4.43Å; K351-N380 WeakPolarHBondContact CD-O 3.18Å; K351-N380 PolarHBondContact NZ-O 3.15Å; K351-N380 VanDerWaalsContact NZ-O 3.12Å; K351-V381 WeakPolarHBondContact CA-O 3.35Å; K351-D382 VanDerWaalsContact CE-OD1 3.3Å; K351-D382 WeakPolarHBondContact CE-OD1 3.36Å; K351-D382 IonicContact NZ-OD1 2.66Å; K351-D382 PolarHBondContact NZ-OD1 3.31Å; K351-D382 IonicContact NZ-OD2 3.87Å; K351-D382 PolarHBondContact NZ-OD2 2.95Å
352	S	78.5	Confident	76.1	Confident	6 Å²	6	72.8 Å²	72.8	4%	0.042	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	161.2	171.9	177.8	0	0	0	0	110	G344 N380 V381	G344-S352 PolarHBondContact N-OG 2.05Å; G344-S352 PolarHBondContact O-OG 2.95Å; S352-N380 PolarHBondContact O-N 3.1Å; S352-V381 PolarHBondContact N-O 2.87Å; S352-V381 PolarHBondContact O-N 2.97Å
353	I	81.6	Confident	76.3	Confident	74 Å²	74	71.9 Å²	71.9	38%	0.379	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.7	170.8	-59.4	172.4	0	0	0	106.2	G344 E355 A377	G344-I353 PolarHBondContact N-O 3.23Å; I353-E355 HydrophobicContact CG2-CG 4.25Å; I353-A377 HydrophobicContact CG2-CB 4.13Å
354	I	81.1	Confident	76.8	Confident	20 Å²	20	69.5 Å²	69.5	10%	0.103	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	112.5	171.1	-59.3	-179	0	0	0	107.6	L342 H343 Y356 A377 L378 V381	L342-I354 WeakPolarHBondContact O-CA 3.14Å; H343-I354 WeakPolarHBondContact NE2-CD1 3.47Å; I354-Y356 HydrophobicContact CG2-CE2 4.36Å; I354-A377 CarbonylContact O-C 3.36Å; I354-A377 VanDerWaalsContact O-CA 3.23Å; I354-A377 WeakPolarHBondContact O-CA 3.26Å; I354-A377 WeakPolarHBondContact O-CB 3.04Å; I354-L378 HydrophobicContact CB-CB 4.26Å; I354-L378 PolarHBondContact N-O 3.29Å; I354-L378 PolarHBondContact O-N 3.04Å; I354-V381 HydrophobicContact CD1-CB 4.26Å; I354-V381 HydrophobicContact CD1-CG1 4.09Å; I354-V381 HydrophobicContact CD1-CG2 3.84Å; I354-V381 HydrophobicContact CG1-CB 4.36Å; I354-V381 HydrophobicContact CG1-CG2 3.99Å
355	E	84.3	Confident	77.4	Confident	82 Å²	82	70.9 Å²	70.9	38%	0.383	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	142.6	172.6	-65.4	-174.2	169.4	0	0	109.9	S341 L342 I353 R357	S341-E355 CarbonylContact C-O 3.15Å; S341-E355 WeakPolarHBondContact CA-O 3.43Å; L342-E355 PolarHBondContact N-O 3.06Å; L342-E355 PolarHBondContact O-N 2.81Å; I353-E355 HydrophobicContact CG2-CG 4.25Å; E355-R357 IonicContact OE2-CZ 2.97Å; E355-R357 IonicContact OE2-NE 3.62Å; E355-R357 IonicContact OE2-NH2 2.84Å; E355-R357 PolarHBondContact OE2-NH2 2.85Å
356	Y	84	Confident	78	Confident	55 Å²	55	70 Å²	70	22%	0.216	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133	170.9	-65.1	-84.9	0	0	0	109.1	Y339 Y340 I354 L374 P375 L378	Y339-Y356 AromaticContact CD2-CD1 3.69Å; Y339-Y356 HydrophobicContact CD2-CD1 3.69Å; Y339-Y356 HydrophobicContact CD2-CE1 4.47Å; Y339-Y356 HydrophobicContact CD2-CG 4.42Å; Y339-Y356 AromaticContact CE2-CD1 3.61Å; Y339-Y356 HydrophobicContact CE2-CD1 3.61Å; Y339-Y356 AromaticContact CE2-CE1 3.98Å; Y339-Y356 HydrophobicContact CE2-CE1 3.98Å; Y339-Y356 HydrophobicContact CE2-CG 4.48Å; Y340-Y356 WeakPolarHBondContact O-CA 3.38Å; I354-Y356 HydrophobicContact CG2-CE2 4.36Å; Y356-L374 WeakPolarHBondContact O-CD2 3.08Å; Y356-P375 HydrophobicContact CD1-CG 4.22Å; Y356-P375 HydrophobicContact CD2-CB 3.67Å; Y356-P375 HydrophobicContact CD2-CG 4.25Å; Y356-P375 HydrophobicContact CE1-CG 4.42Å; Y356-P375 HydrophobicContact CE2-CB 3.81Å; Y356-P375 HydrophobicContact CE2-CG 4.46Å; Y356-P375 HydrophobicContact CG-CB 4.03Å; Y356-P375 HydrophobicContact CG-CG 4.1Å; Y356-L378 HydrophobicContact CE2-CD1 3.75Å; Y356-L378 HydrophobicContact CE2-CG 4.42Å; Y356-L378 WeakPolarHBondContact OH-CD1 3.48Å
357	R	83.6	Confident	78.5	Confident	124 Å²	124	73.6 Å²	73.6	47%	0.468	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.7	176.4	-63.9	-165.7	-172.5	173.5	1.8	110.7	Y339 Y340 L342 E355	Y339-R357 CarbonylContact C-O 3.53Å; Y339-R357 VanDerWaalsContact CA-O 3.26Å; Y339-R357 WeakPolarHBondContact CA-O 3.37Å; Y339-R357 WeakPolarHBondContact CB-O 3.33Å; Y340-R357 VanDerWaalsContact CD1-O 3.29Å; Y340-R357 WeakPolarHBondContact CD1-O 3.39Å; Y340-R357 HydrophobicContact CE1-CB 4.09Å; Y340-R357 HydrophobicContact CE2-CB 4.34Å; Y340-R357 PolarHBondContact N-O 2.84Å; Y340-R357 PolarHBondContact O-N 2.81Å; L342-R357 HydrophobicContact CD1-CG 4.03Å; E355-R357 IonicContact OE2-CZ 2.97Å; E355-R357 IonicContact OE2-NE 3.62Å; E355-R357 IonicContact OE2-NH2 2.84Å; E355-R357 PolarHBondContact OE2-NH2 2.85Å
358	W	82.6	Confident	79.1	Confident	41 Å²	41	71.6 Å²	71.6	16%	0.155	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	146.2	171.7	-65.8	111.4	0	0	0	110.5	C334 D338 Y339 Y340 K362 D366 V372 L374	C334-W358 HydrophobicContact CB-CH2 3.77Å; C334-W358 HydrophobicContact CB-CZ3 3.82Å; D338-W358 HydrophobicContact CB-CE3 4.09Å; D338-W358 HydrophobicContact CB-CZ3 4Å; D338-W358 VanDerWaalsContact O-CE3 3.31Å; Y339-W358 HydrophobicContact CD1-CH2 4.28Å; Y339-W358 AromaticContact CD1-CZ3 3.92Å; Y339-W358 HydrophobicContact CD1-CZ3 3.92Å; Y339-W358 HydrophobicContact CG-CZ3 4.44Å; Y340-W358 WeakPolarHBondContact CE1-O 3.43Å; W358-K362 HydrophobicContact CD2-CD 4.47Å; W358-K362 HydrophobicContact CG-CD 4.17Å; W358-D366 HydrophobicContact CZ2-CB 4.31Å; W358-V372 WeakPolarHBondContact CH2-O 3.25Å; W358-L374 HydrophobicContact CD2-CD1 4.08Å; W358-L374 HydrophobicContact CG-CD1 4.37Å; W358-L374 HydrophobicContact CH2-CB 4.49Å; W358-L374 HydrophobicContact CZ2-CB 3.62Å; W358-L374 HydrophobicContact CZ2-CD1 4.16Å; W358-L374 HydrophobicContact CZ2-CG 4.45Å
359	T	73.2	Confident	79.9	Confident	17 Å²	17	70.7 Å²	70.7	10%	0.104	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-68.4	130.6	168.2	55.2	0	0	0	0	109.7	D338 Y340 P361 K362	D338-T359 PolarHBondContact O-N 3.07Å; D338-T359 PolarHBondContact O-OG1 3.24Å; Y340-T359 HydrophobicContact CD1-CG2 3.88Å; Y340-T359 HydrophobicContact CE1-CG2 4.34Å; T359-P361 CarbonylContact O-C 3.54Å; T359-K362 PolarHBondContact O-N 3.44Å
360	E	68	Low	80.6	Confident	135 Å²	135	67.7 Å²	67.7	63%	0.631	33%	0.333	S	S	*	.	S	Bend	trans	-87.9	148.5	175.7	-67	-172.6	165.1	0	0	111.5	D456	E360-D456 CarbonylContact C-O 3.53Å; E360-D456 CarbonylContact O-C 3.5Å
361	P	70.7	Confident	81.4	Confident	62 Å²	62	64.7 Å²	64.7	40%	0.403	33%	0.326	S	S	.	.	S	Bend	cis	-67.8	142.8	-17.7	32.1	-31.5	0	0	0	109.8	T359 I363 D456	T359-P361 CarbonylContact O-C 3.54Å; P361-I363 PolarHBondContact O-N 2.83Å; P361-D456 WeakPolarHBondContact CD-OD2 3.12Å; P361-D456 HydrophobicContact CG-CB 4.45Å
362	K	79.3	Confident	81.8	Confident	74 Å²	74	64.2 Å²	64.2	32%	0.322	33%	0.328	S	S	.	.			trans	-65.2	101.6	176.9	-176.3	-177.9	172.4	-170.6	0	108.9	R331 W358 T359 C364 D366	R331-K362 PolarHBondContact NH1-O 2.93Å; W358-K362 HydrophobicContact CD2-CD 4.47Å; W358-K362 HydrophobicContact CG-CD 4.17Å; T359-K362 PolarHBondContact O-N 3.44Å; K362-C364 WeakPolarHBondContact CE-O 3.29Å; K362-D366 IonicContact NZ-OD1 3.22Å; K362-D366 PolarHBondContact NZ-OD1 2.93Å; K362-D366 IonicContact NZ-OD2 3.79Å; K362-D366 PolarHBondContact NZ-OD2 2.79Å
363	I	78.8	Confident	82.2	Confident	23 Å²	23	67.2 Å²	67.2	12%	0.118	35%	0.353	C	S	.	.			trans	-82.7	-36.8	178	-69.6	167	0	0	0	110.6	F320 R331 P361 R474	F320-I363 HydrophobicContact CD1-CG2 3.83Å; F320-I363 HydrophobicContact CD2-CD1 4.44Å; F320-I363 HydrophobicContact CD2-CG1 4.22Å; F320-I363 HydrophobicContact CD2-CG2 3.82Å; F320-I363 HydrophobicContact CE1-CG2 3.73Å; F320-I363 HydrophobicContact CE2-CD1 4.3Å; F320-I363 HydrophobicContact CE2-CG1 4.47Å; F320-I363 HydrophobicContact CE2-CG2 3.73Å; F320-I363 HydrophobicContact CG-CG2 3.88Å; F320-I363 HydrophobicContact CZ-CG2 3.69Å; R331-I363 WeakPolarHBondContact CB-O 3.47Å; R331-I363 WeakPolarHBondContact CD-O 3.46Å; R331-I363 WeakPolarHBondContact CG-O 3.47Å; R331-I363 VanDerWaalsContact NH1-CA 3.29Å; R331-I363 PolarHBondContact NH1-O 2.76Å; P361-I363 PolarHBondContact O-N 2.83Å; I363-R474 HydrophobicContact CD1-CB 4.24Å
364	C	84.2	Confident	82.4	Confident	5 Å²	5	66.8 Å²	66.8	3%	0.034	35%	0.351	C	S	.	.	S	Bend	trans	-80.9	163.5	-172.5	72.6	0	0	0	0	114.6	P332 C334 D338 K362	P332-C364 CarbonylContact O-C 3.47Å; P332-C364 VanDerWaalsContact O-CA 3.27Å; P332-C364 WeakPolarHBondContact O-CA 3.48Å; C334-C364 WeakPolarHBondContact CA-SG 3.32Å; C334-C364 HydrophobicContact CB-CB 3.81Å; C334-C364 WeakPolarHBondContact CB-SG 3.2Å; C334-C364 WeakPolarHBondContact SG-CB 3.37Å; C334-C364 CovalentContact SG-SG 2.04Å; C334-C364 PolarHBondContact SG-SG 3.23Å; D338-C364 HydrophobicContact CB-CB 4.47Å; D338-C364 VanDerWaalsContact CB-SG 3.55Å; K362-C364 WeakPolarHBondContact CE-O 3.29Å
365	R	87.3	Confident	82.7	Confident	52 Å²	52	67.9 Å²	67.9	20%	0.196	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-111.4	131.8	173.4	-83	-175.6	58.8	-162.8	-4.5	112.3	R317 R331 P332 P333 C334 D367 I368 A371	R317-R365 WeakPolarHBondContact O-CD 3.23Å; R331-R365 HydrophobicContact CB-CG 3.93Å; P332-R365 PolarHBondContact O-N 2.97Å; P333-R365 CarbonylContact C-O 3.58Å; P333-R365 WeakPolarHBondContact CA-O 3.27Å; C334-R365 PolarHBondContact N-O 3.04Å; C334-R365 PolarHBondContact SG-N 3.01Å; C334-R365 VanDerWaalsContact SG-N 3.44Å; R365-D367 WeakPolarHBondContact CB-OD1 3.42Å; R365-D367 IonicContact CZ-OD1 2.65Å; R365-D367 VanDerWaalsContact CZ-OD1 3.3Å; R365-D367 IonicContact CZ-OD2 2.66Å; R365-D367 IonicContact NE-OD1 3.54Å; R365-D367 PolarHBondContact NE-OD1 3.33Å; R365-D367 IonicContact NE-OD2 2.97Å; R365-D367 IonicContact NH2-OD1 3.28Å; R365-D367 PolarHBondContact NH2-OD1 2.98Å; R365-D367 VanDerWaalsContact NH2-OD1 3.08Å; R365-D367 IonicContact NH2-OD2 3.72Å; R365-D367 PolarHBondContact NH2-OD2 3.15Å; R365-I368 HydrophobicContact CB-CD1 3.66Å; R365-I368 HydrophobicContact CB-CG1 3.88Å; R365-I368 HydrophobicContact CG-CD1 4.36Å; R365-A371 WeakPolarHBondContact O-CB 3.41Å
366	D	87	Confident	82.9	Confident	70 Å²	70	71.6 Å²	71.6	37%	0.374	38%	0.381	S	S	.	.	S	Bend	trans	-97.2	-9.2	-179.7	49.1	-19	0	0	0	113.9	W358 K362	W358-D366 HydrophobicContact CZ2-CB 4.31Å; K362-D366 IonicContact NZ-OD1 3.22Å; K362-D366 PolarHBondContact NZ-OD1 2.93Å; K362-D366 IonicContact NZ-OD2 3.79Å; K362-D366 PolarHBondContact NZ-OD2 2.79Å
367	D	86.3	Confident	82.9	Confident	97 Å²	97	71.4 Å²	71.4	52%	0.519	39%	0.391	S	S	.	.	S	Bend	trans	-93.5	-3.4	-179.9	66.2	-37.7	0	0	0	113.9	R365	R365-D367 WeakPolarHBondContact CB-OD1 3.42Å; R365-D367 IonicContact CZ-OD1 2.65Å; R365-D367 VanDerWaalsContact CZ-OD1 3.3Å; R365-D367 IonicContact CZ-OD2 2.66Å; R365-D367 IonicContact NE-OD1 3.54Å; R365-D367 PolarHBondContact NE-OD1 3.33Å; R365-D367 IonicContact NE-OD2 2.97Å; R365-D367 IonicContact NH2-OD1 3.28Å; R365-D367 PolarHBondContact NH2-OD1 2.98Å; R365-D367 VanDerWaalsContact NH2-OD1 3.08Å; R365-D367 IonicContact NH2-OD2 3.72Å; R365-D367 PolarHBondContact NH2-OD2 3.15Å
368	I	86.6	Confident	82.7	Confident	56 Å²	56	69.3 Å²	69.3	29%	0.287	39%	0.389	S	S	.	.	S	Bend	trans	-84.2	143.3	177.1	-55	175.3	0	0	0	109.9	R365 G370 A371	R365-I368 HydrophobicContact CB-CD1 3.66Å; R365-I368 HydrophobicContact CB-CG1 3.88Å; R365-I368 HydrophobicContact CG-CD1 4.36Å; I368-G370 PolarHBondContact O-N 3.14Å; I368-A371 WeakPolarHBondContact O-CB 3.24Å; I368-A371 PolarHBondContact O-N 3.34Å
369	K	84.9	Confident	82.6	Confident	213 Å²	213	71.4 Å²	71.4	93%	0.926	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	122.1	172.7	-172.1	-179.8	-179.3	-178.5	0	110.9
370	G	83	Confident	82.8	Confident	74 Å²	74	75.9 Å²	75.9	76%	0.763	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.1	-4.5	-177.1	0	0	0	0	0	114.4	I368	I368-G370 PolarHBondContact O-N 3.14Å
371	A	85.6	Confident	83.3	Confident	21 Å²	21	71.8 Å²	71.8	17%	0.174	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-74.2	140.8	171.2	0	0	0	0	0	111.4	P333 C334 R365 I368	P333-A371 HydrophobicContact CB-CB 3.94Å; C334-A371 HydrophobicContact CB-CB 4.44Å; C334-A371 WeakPolarHBondContact O-CA 3.41Å; R365-A371 WeakPolarHBondContact O-CB 3.41Å; I368-A371 WeakPolarHBondContact O-CB 3.24Å; I368-A371 PolarHBondContact O-N 3.34Å
372	V	86.4	Confident	83.5	Confident	48 Å²	48	74.2 Å²	74.2	29%	0.291	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-77.9	129.4	174.2	-178.8	0	0	0	0	108.7	C334 V336 Y339 W358	C334-V372 PolarHBondContact O-N 3.17Å; V336-V372 HydrophobicContact CG1-CG1 4.29Å; V336-V372 HydrophobicContact CG1-CG2 4.25Å; Y339-V372 HydrophobicContact CE1-CG1 3.81Å; W358-V372 WeakPolarHBondContact CH2-O 3.25Å
373	A	86.8	Confident	83.2	Confident	69 Å²	69	71.3 Å²	71.3	57%	0.57	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-80.3	151.4	171	0	0	0	0	0	110.4	P375	A373-P375 WeakPolarHBondContact O-CD 3.43Å
374	L	87.5	Confident	83	Confident	65 Å²	65	72.1 Å²	72.1	34%	0.34	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-61	123.6	174.3	-167.4	66	0	0	0	108.8	Y339 Y356 W358	Y339-L374 HydrophobicContact CG-CD1 4.12Å; Y356-L374 WeakPolarHBondContact O-CD2 3.08Å; W358-L374 HydrophobicContact CD2-CD1 4.08Å; W358-L374 HydrophobicContact CG-CD1 4.37Å; W358-L374 HydrophobicContact CH2-CB 4.49Å; W358-L374 HydrophobicContact CZ2-CB 3.62Å; W358-L374 HydrophobicContact CZ2-CD1 4.16Å; W358-L374 HydrophobicContact CZ2-CG 4.45Å
375	P	86.8	Confident	82.9	Confident	43 Å²	43	74 Å²	74	28%	0.279	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-61.7	149.5	178.6	-19.9	31.1	0	0	0	111.2	Y339 Y356 A373	Y339-P375 HydrophobicContact CD2-CG 4.5Å; Y339-P375 HydrophobicContact CE1-CG 4.28Å; Y339-P375 HydrophobicContact CE2-CG 3.75Å; Y356-P375 HydrophobicContact CD1-CG 4.22Å; Y356-P375 HydrophobicContact CD2-CB 3.67Å; Y356-P375 HydrophobicContact CD2-CG 4.25Å; Y356-P375 HydrophobicContact CE1-CG 4.42Å; Y356-P375 HydrophobicContact CE2-CB 3.81Å; Y356-P375 HydrophobicContact CE2-CG 4.46Å; Y356-P375 HydrophobicContact CG-CB 4.03Å; Y356-P375 HydrophobicContact CG-CG 4.1Å; A373-P375 WeakPolarHBondContact O-CD 3.43Å
376	L	87.6	Confident	82.8	Confident	160 Å²	160	71.8 Å²	71.8	84%	0.838	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-64.9	145.5	171.4	-68.6	169.1	0	0	0	109.6	L378	L376-L378 PolarHBondContact O-N 2.85Å
377	A	83.9	Confident	83	Confident	51 Å²	51	69 Å²	69	42%	0.421	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-57	137.7	175.3	0	0	0	0	0	110.4	I353 I354 P379	I353-A377 HydrophobicContact CG2-CB 4.13Å; I354-A377 CarbonylContact O-C 3.36Å; I354-A377 VanDerWaalsContact O-CA 3.23Å; I354-A377 WeakPolarHBondContact O-CA 3.26Å; I354-A377 WeakPolarHBondContact O-CB 3.04Å; A377-P379 WeakPolarHBondContact O-CD 3.39Å
378	L	81	Confident	83.3	Confident	80 Å²	80	65.8 Å²	65.8	42%	0.419	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	108.8	176.9	-73.9	143.9	0	0	0	109	I354 Y356 L376 V381	I354-L378 HydrophobicContact CB-CB 4.26Å; I354-L378 PolarHBondContact N-O 3.29Å; I354-L378 PolarHBondContact O-N 3.04Å; Y356-L378 HydrophobicContact CE2-CD1 3.75Å; Y356-L378 HydrophobicContact CE2-CG 4.42Å; Y356-L378 WeakPolarHBondContact OH-CD1 3.48Å; L376-L378 PolarHBondContact O-N 2.85Å; L378-V381 HydrophobicContact CB-CG2 4.17Å
379	P	80.6	Confident	83.5	Confident	85 Å²	85	63.1 Å²	63.1	55%	0.552	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	153.6	176.3	33.3	-35	0	0	0	111.6	A377	A377-P379 WeakPolarHBondContact O-CD 3.39Å
380	N	76.6	Confident	83.7	Confident	111 Å²	111	53.6 Å²	53.6	59%	0.594	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	65.5	35.2	169	-54.8	-50.2	0	0	0	116.3	K351 S352	K351-N380 HydrophobicContact CD-CB 4.43Å; K351-N380 WeakPolarHBondContact CD-O 3.18Å; K351-N380 PolarHBondContact NZ-O 3.15Å; K351-N380 VanDerWaalsContact NZ-O 3.12Å; S352-N380 PolarHBondContact O-N 3.1Å
381	V	77.7	Confident	83.9	Confident	49 Å²	49	52.9 Å²	52.9	30%	0.297	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	134.1	171.2	-177	0	0	0	0	109.6	K351 S352 I354 L378 C383	K351-V381 WeakPolarHBondContact CA-O 3.35Å; S352-V381 PolarHBondContact N-O 2.87Å; S352-V381 PolarHBondContact O-N 2.97Å; I354-V381 HydrophobicContact CD1-CB 4.26Å; I354-V381 HydrophobicContact CD1-CG1 4.09Å; I354-V381 HydrophobicContact CD1-CG2 3.84Å; I354-V381 HydrophobicContact CG1-CB 4.36Å; I354-V381 HydrophobicContact CG1-CG2 3.99Å; L378-V381 HydrophobicContact CB-CG2 4.17Å; V381-C383 PolarHBondContact O-N 3.07Å
382	D	75	Confident	83.7	Confident	112 Å²	112	54.2 Å²	54.2	60%	0.599	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	127.8	176.8	-72.1	-57.6	0	0	0	111.2	K351	K351-D382 VanDerWaalsContact CE-OD1 3.3Å; K351-D382 WeakPolarHBondContact CE-OD1 3.36Å; K351-D382 IonicContact NZ-OD1 2.66Å; K351-D382 PolarHBondContact NZ-OD1 3.31Å; K351-D382 IonicContact NZ-OD2 3.87Å; K351-D382 PolarHBondContact NZ-OD2 2.95Å
383	C	73.6	Confident	83.4	Confident	14 Å²	14	55.2 Å²	55.2	10%	0.095	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-68.4	129.9	175	-73.4	0	0	0	0	110.3	C346 R350 V381	C346-C383 VanDerWaalsContact CA-SG 3.59Å; C346-C383 HydrophobicContact CB-CB 4.12Å; C346-C383 WeakPolarHBondContact CB-SG 3.21Å; C346-C383 WeakPolarHBondContact SG-CB 3.5Å; C346-C383 CovalentContact SG-SG 2.03Å; C346-C383 PolarHBondContact SG-SG 2.84Å; R350-C383 VanDerWaalsContact C-SG 3.52Å; R350-C383 HydrophobicContact CB-CB 4.05Å; R350-C383 WeakPolarHBondContact O-CB 3.29Å; R350-C383 PolarHBondContact O-N 3.09Å; V381-C383 PolarHBondContact O-N 3.07Å
384	P	74.5	Confident	83	Confident	40 Å²	40	58.3 Å²	58.3	26%	0.26	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-66.1	159.5	171.5	-16.2	31.4	0	0	0	110.5	W435 N437	P384-W435 HydrophobicContact CB-CD2 4.41Å; P384-W435 HydrophobicContact CB-CE3 4.23Å; P384-N437 WeakPolarHBondContact CB-ND2 3.46Å; P384-N437 VanDerWaalsContact CG-OD1 3.28Å; P384-N437 WeakPolarHBondContact CG-OD1 3.45Å
385	P	81.2	Confident	82.5	Confident	44 Å²	44	55.9 Å²	55.9	29%	0.286	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-64.6	161.9	176.3	27.2	-32.2	0	0	0	111.5	I409 W435	P385-I409 HydrophobicContact CB-CB 4.33Å; P385-I409 HydrophobicContact CB-CG1 3.79Å; P385-I409 HydrophobicContact CG-CG1 4.01Å; P385-W435 HydrophobicContact CG-CZ2 4.17Å; P385-W435 VanDerWaalsContact O-CD1 3.28Å
386	C	86.5	Confident	82.2	Confident	5 Å²	5	58 Å²	58	3%	0.034	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-69.6	158.9	174	-76.7	0	0	0	0	110.9	T390 C397 G408	C386-T390 WeakPolarHBondContact CB-OG1 3.41Å; C386-C397 WeakPolarHBondContact CA-SG 3.38Å; C386-C397 HydrophobicContact CB-CB 3.91Å; C386-C397 WeakPolarHBondContact CB-SG 3.47Å; C386-C397 WeakPolarHBondContact SG-CB 3.17Å; C386-C397 CovalentContact SG-SG 2.05Å; C386-C397 PolarHBondContact SG-SG 3.46Å; C386-G408 PolarHBondContact N-O 3.31Å; C386-G408 VanDerWaalsContact N-O 3.1Å; C386-G408 CarbonylContact O-C 3.49Å; C386-G408 WeakPolarHBondContact O-CA 3.39Å
387	N	91.2	Very high	82.1	Confident	13 Å²	13	51.6 Å²	51.6	7%	0.07	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-61.5	146	174.5	-79.8	-47.7	0	0	0	111.2	G389 T390 N432 V434 W435	N387-G389 PolarHBondContact O-N 3.4Å; N387-T390 HydrophobicContact CB-CG2 4.5Å; N387-T390 PolarHBondContact N-OG1 2.87Å; N387-T390 WeakPolarHBondContact O-CB 3.44Å; N387-T390 PolarHBondContact O-N 3.44Å; N387-T390 PolarHBondContact O-OG1 3.46Å; N387-N432 WeakPolarHBondContact CB-O 3.49Å; N387-V434 WeakPolarHBondContact OD1-CG2 3.42Å; N387-V434 PolarHBondContact OD1-N 2.96Å; N387-W435 PolarHBondContact ND2-O 2.84Å; N387-W435 PolarHBondContact OD1-N 3.2Å; N387-W435 PolarHBondContact OD1-O 2.03Å
388	P	91.5	Very high	82.3	Confident	29 Å²	29	52.1 Å²	52.1	19%	0.188	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	134.5	176.1	-25.9	34.2	0	0	0	112.3	T390 N432 V434 A596	P388-T390 VanDerWaalsContact C-N 3.34Å; P388-N432 HydrophobicContact CB-CB 4.35Å; P388-V434 HydrophobicContact CG-CG2 4.41Å; P388-A596 HydrophobicContact CB-CB 3.64Å
389	G	90.8	Very high	82.8	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	2.7	-173.3	0	0	0	0	0	115.4	N387 C400 S406 G594 A595	N387-G389 PolarHBondContact O-N 3.4Å; G389-C400 PolarHBondContact O-N 2.93Å; G389-S406 WeakPolarHBondContact CA-O 3.3Å; G389-S406 PolarHBondContact N-O 3.2Å; G389-G594 WeakPolarHBondContact O-CA 3.38Å; G389-A595 VanDerWaalsContact CA-C 3.42Å; G389-A595 VanDerWaalsContact CA-O 3.3Å; G389-A595 WeakPolarHBondContact CA-O 3.49Å
390	T	89.8	Confident	83.3	Confident	13 Å²	13	46.7 Å²	46.7	8%	0.08	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	161.9	174.7	69.1	0	0	0	0	111.1	C386 N387 P388 H398 I399 S406 G408	C386-T390 WeakPolarHBondContact CB-OG1 3.41Å; N387-T390 HydrophobicContact CB-CG2 4.5Å; N387-T390 PolarHBondContact N-OG1 2.87Å; N387-T390 WeakPolarHBondContact O-CB 3.44Å; N387-T390 PolarHBondContact O-N 3.44Å; N387-T390 PolarHBondContact O-OG1 3.46Å; P388-T390 VanDerWaalsContact C-N 3.34Å; T390-H398 CarbonylContact C-O 3.53Å; T390-H398 WeakPolarHBondContact CA-O 3.13Å; T390-H398 WeakPolarHBondContact CB-O 3.47Å; T390-I399 HydrophobicContact CG2-CG1 4.26Å; T390-S406 PolarHBondContact O-OG 2.83Å; T390-G408 WeakPolarHBondContact O-CA 3.41Å
391	Y	87.1	Confident	83.9	Confident	58 Å²	58	44.6 Å²	44.6	23%	0.227	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	153.6	177.6	74	-68.8	0	0	0	110	L393 C397 H398 A416 C418	Y391-L393 HydrophobicContact CD2-CB 4.31Å; Y391-L393 HydrophobicContact CE2-CB 3.74Å; Y391-L393 HydrophobicContact CE2-CD1 4.31Å; Y391-L393 HydrophobicContact CE2-CD2 4.43Å; Y391-L393 HydrophobicContact CE2-CG 4.38Å; Y391-L393 PolarHBondContact O-N 2.95Å; Y391-C397 WeakPolarHBondContact O-CA 3.31Å; Y391-H398 HydrophobicContact CD1-CB 4.41Å; Y391-H398 WeakPolarHBondContact CD1-O 3.05Å; Y391-H398 HydrophobicContact CE1-CB 3.9Å; Y391-H398 PolarHBondContact N-O 3.13Å; Y391-H398 PolarHBondContact O-N 3.25Å; Y391-A416 WeakPolarHBondContact CB-O 3.03Å; Y391-C418 WeakPolarHBondContact CD1-SG 3.19Å; Y391-C418 VanDerWaalsContact CG-SG 3.51Å
392	M	81.8	Confident	84.3	Confident	49 Å²	49	44.4 Å²	44.4	24%	0.241	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	119.3	179.7	-171.5	67.4	76.3	0	0	109.6	C346	C346-M392 HydrophobicContact CB-CE 4.38Å
393	L	79.3	Confident	84.8	Confident	70 Å²	70	40.4 Å²	40.4	37%	0.366	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	124.4	172.9	178.7	74.3	0	0	0	108.6	Y391 G395 H396	Y391-L393 HydrophobicContact CD2-CB 4.31Å; Y391-L393 HydrophobicContact CE2-CB 3.74Å; Y391-L393 HydrophobicContact CE2-CD1 4.31Å; Y391-L393 HydrophobicContact CE2-CD2 4.43Å; Y391-L393 HydrophobicContact CE2-CG 4.38Å; Y391-L393 PolarHBondContact O-N 2.95Å; L393-G395 PolarHBondContact O-N 3.36Å; L393-G395 VanDerWaalsContact O-N 3.16Å; L393-H396 PolarHBondContact N-O 2.03Å; L393-H396 PolarHBondContact O-N 2.94Å; L393-H396 VanDerWaalsContact O-N 3.08Å
394	N	78.3	Confident	85.6	Confident	134 Å²	134	42.5 Å²	42.5	72%	0.717	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	32.3	-180	-59.4	-27.1	0	0	0	114.9	H396	N394-H396 VanDerWaalsContact C-N 3.33Å
395	G	76.7	Confident	86.4	Confident	14 Å²	14	43.9 Å²	43.9	14%	0.144	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	0.1	179.5	0	0	0	0	0	115.4	C346 L393	C346-G395 WeakPolarHBondContact O-CA 3.23Å; L393-G395 PolarHBondContact O-N 3.36Å; L393-G395 VanDerWaalsContact O-N 3.16Å
396	H	81.6	Confident	86.8	Confident	86 Å²	86	42 Å²	42	40%	0.398	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	149.8	176	-66.4	-75.6	0	0	0	111.4	L393 N394 E438	L393-H396 PolarHBondContact N-O 2.03Å; L393-H396 PolarHBondContact O-N 2.94Å; L393-H396 VanDerWaalsContact O-N 3.08Å; N394-H396 VanDerWaalsContact C-N 3.33Å; H396-E438 IonicContact CE1-OE2 3.66Å; H396-E438 IonicContact CG-OE2 3.12Å; H396-E438 IonicContact ND1-OE2 3.79Å; H396-E438 PolarHBondContact ND1-OE2 2.79Å
397	C	85.8	Confident	86.8	Confident	26 Å²	26	44.5 Å²	44.5	18%	0.176	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	113.7	178.7	-65.8	0	0	0	0	110.9	C386 Y391 E438	C386-C397 WeakPolarHBondContact CA-SG 3.38Å; C386-C397 HydrophobicContact CB-CB 3.91Å; C386-C397 WeakPolarHBondContact CB-SG 3.47Å; C386-C397 WeakPolarHBondContact SG-CB 3.17Å; C386-C397 CovalentContact SG-SG 2.05Å; C386-C397 PolarHBondContact SG-SG 3.46Å; Y391-C397 WeakPolarHBondContact O-CA 3.31Å; C397-E438 PolarHBondContact N-OE1 3.46Å
398	H	88.5	Confident	86.3	Confident	62 Å²	62	44.2 Å²	44.2	29%	0.287	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	149.5	179	-72.8	-78.8	0	0	0	112.5	T390 Y391 D441	T390-H398 CarbonylContact C-O 3.53Å; T390-H398 WeakPolarHBondContact CA-O 3.13Å; T390-H398 WeakPolarHBondContact CB-O 3.47Å; Y391-H398 HydrophobicContact CD1-CB 4.41Å; Y391-H398 WeakPolarHBondContact CD1-O 3.05Å; Y391-H398 HydrophobicContact CE1-CB 3.9Å; Y391-H398 PolarHBondContact N-O 3.13Å; Y391-H398 PolarHBondContact O-N 3.25Å; H398-D441 IonicContact ND1-OD2 3.1Å
399	I	91.1	Very high	85.7	Confident	48 Å²	48	47.9 Å²	47.9	25%	0.246	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	134.6	176.9	-65.3	170.6	0	0	0	110.4	T390 Y431 K442	T390-I399 HydrophobicContact CG2-CG1 4.26Å; I399-Y431 HydrophobicContact CD1-CE1 3.86Å; I399-K442 HydrophobicContact CD1-CG 4.29Å
400	C	90.7	Very high	84.5	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.02	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-59.5	140.5	176	-77.5	0	0	0	0	112.1	G389 H404 S406 C418	G389-C400 PolarHBondContact O-N 2.93Å; C400-H404 HydrophobicContact CB-CB 4.49Å; C400-S406 VanDerWaalsContact SG-CB 3.53Å; C400-C418 WeakPolarHBondContact CA-SG 3.33Å; C400-C418 HydrophobicContact CB-CB 3.9Å; C400-C418 WeakPolarHBondContact CB-SG 3.39Å; C400-C418 WeakPolarHBondContact SG-CB 3.46Å; C400-C418 CovalentContact SG-SG 2.05Å; C400-C418 PolarHBondContact SG-SG 2.9Å
401	P	89.3	Confident	83.1	Confident	68 Å²	68	57.9 Å²	57.9	44%	0.442	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-65.2	164.6	176.8	28.6	-34.5	0	0	0	111.5	G403 H404	P401-G403 PolarHBondContact O-N 2.91Å; P401-H404 HydrophobicContact CG-CB 4.27Å; P401-H404 PolarHBondContact O-N 3.03Å
402	G	85.5	Confident	81.4	Confident	44 Å²	44	59.7 Å²	59.7	45%	0.454	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	140.1	-179.7	0	0	0	0	0	113.6	H404	G402-H404 VanDerWaalsContact C-N 3.26Å; G402-H404 PolarHBondContact O-N 3.29Å; G402-H404 PolarHBondContact O-ND1 3.26Å
403	G	85.3	Confident	79.9	Confident	29 Å²	29	61 Å²	61	30%	0.299	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	2.9	-177.7	0	0	0	0	0	115	P401 C421	P401-G403 PolarHBondContact O-N 2.91Å; G403-C421 PolarHBondContact O-N 2.87Å
404	H	91	Very high	78.5	Confident	57 Å²	57	65.4 Å²	65.4	26%	0.264	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	158	-179.7	-58.5	69.9	0	0	0	111.8	C400 P401 G402 C418 K419	C400-H404 HydrophobicContact CB-CB 4.49Å; P401-H404 HydrophobicContact CG-CB 4.27Å; P401-H404 PolarHBondContact O-N 3.03Å; G402-H404 VanDerWaalsContact C-N 3.26Å; G402-H404 PolarHBondContact O-N 3.29Å; G402-H404 PolarHBondContact O-ND1 3.26Å; H404-C418 HydrophobicContact CB-CB 3.83Å; H404-K419 CarbonylContact C-O 3.52Å; H404-K419 WeakPolarHBondContact CA-O 3.48Å; H404-K419 WeakPolarHBondContact CB-O 3.47Å
405	Y	90.8	Very high	77.5	Confident	69 Å²	69	59.4 Å²	59.4	27%	0.271	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.8	178.8	77.9	-77.3	0	0	0	111.1	C418 K419 A595 C598	Y405-C418 WeakPolarHBondContact O-CA 3.45Å; Y405-K419 HydrophobicContact CD1-CB 4.26Å; Y405-K419 VanDerWaalsContact CD1-O 3.23Å; Y405-K419 WeakPolarHBondContact CD1-O 3.15Å; Y405-K419 HydrophobicContact CE1-CB 3.8Å; Y405-K419 PolarHBondContact N-O 3.23Å; Y405-K419 PolarHBondContact O-N 3.48Å; Y405-A595 CarbonylContact C-O 3.57Å; Y405-A595 WeakPolarHBondContact CA-O 3.32Å; Y405-A595 VanDerWaalsContact CB-O 3.26Å; Y405-A595 WeakPolarHBondContact CB-O 3.2Å; Y405-C598 WeakPolarHBondContact CD1-SG 3.12Å; Y405-C598 VanDerWaalsContact CG-SG 3.58Å
406	S	90.6	Very high	77.2	Confident	4 Å²	4	59.4 Å²	59.4	3%	0.028	34%	0.336	C	S	.	.			trans	-151.7	139.4	171.7	-179.9	0	0	0	0	109.9	G389 T390 C400 G408 A416 A595 A596	G389-S406 WeakPolarHBondContact CA-O 3.3Å; G389-S406 PolarHBondContact N-O 3.2Å; T390-S406 PolarHBondContact O-OG 2.83Å; C400-S406 VanDerWaalsContact SG-CB 3.53Å; S406-G408 PolarHBondContact O-N 3.45Å; S406-G408 PolarHBondContact OG-N 3.08Å; S406-G408 VanDerWaalsContact OG-N 3.17Å; S406-A416 WeakPolarHBondContact OG-CB 3.44Å; S406-A416 PolarHBondContact OG-O 2.84Å; S406-A595 PolarHBondContact N-O 3.01Å; S406-A596 WeakPolarHBondContact O-CA 3.4Å
407	S	86	Confident	77.2	Confident	59 Å²	59	62 Å²	62	41%	0.413	35%	0.349	S	S	.	.			trans	-67	-13	171.9	54.5	0	0	0	0	112.8	I409	S407-I409 PolarHBondContact O-N 2.92Å; S407-I409 PolarHBondContact OG-N 2.93Å; S407-I409 PolarHBondContact OG-O 3.34Å
408	G	81.2	Confident	77.3	Confident	6 Å²	6	62 Å²	62	6%	0.062	35%	0.349	C	S	.	.	S	Bend	trans	76.8	-13.5	-170.2	0	0	0	0	0	113.9	C386 T390 S406	C386-G408 PolarHBondContact N-O 3.31Å; C386-G408 VanDerWaalsContact N-O 3.1Å; C386-G408 CarbonylContact O-C 3.49Å; C386-G408 WeakPolarHBondContact O-CA 3.39Å; T390-G408 WeakPolarHBondContact O-CA 3.41Å; S406-G408 PolarHBondContact O-N 3.45Å; S406-G408 PolarHBondContact OG-N 3.08Å; S406-G408 VanDerWaalsContact OG-N 3.17Å
409	I	78.2	Confident	77.4	Confident	106 Å²	106	65.3 Å²	65.3	54%	0.544	36%	0.362	S	S	.	.			trans	-110	107.6	-179.7	-52.3	173	0	0	0	108.2	P385 S407 A416	P385-I409 HydrophobicContact CB-CB 4.33Å; P385-I409 HydrophobicContact CB-CG1 3.79Å; P385-I409 HydrophobicContact CG-CG1 4.01Å; S407-I409 PolarHBondContact O-N 2.92Å; S407-I409 PolarHBondContact OG-N 2.93Å; S407-I409 PolarHBondContact OG-O 3.34Å; I409-A416 WeakPolarHBondContact O-CB 3.35Å
410	G	65.7	Low	77.3	Confident	13 Å²	13	72.6 Å²	72.6	13%	0.134	39%	0.387	C	S	.	.			trans	-90.8	140.1	173.2	0	0	0	0	0	112.5	D412	G410-D412 VanDerWaalsContact C-N 3.34Å
411	E	60.3	Low	77.1	Confident	210 Å²	210	73.2 Å²	73.2	98%	0.981	39%	0.391	S	S	*	.	S	Bend	trans	-74.4	-25.9	172.4	-66.9	-177	166.4	0	0	112.2
412	D	51	Low	76.9	Confident	96 Å²	96	73.5 Å²	73.5	51%	0.513	39%	0.393	S	S	.	.	S	Bend	trans	-102.3	161.4	-179.4	57.6	-13.6	0	0	0	112.5	R350 G410 F414 G415	R350-D412 PolarHBondContact NH2-O 2.79Å; G410-D412 VanDerWaalsContact C-N 3.34Å; D412-F414 PolarHBondContact O-N 2.77Å; D412-G415 PolarHBondContact O-N 3.01Å
413	A	51.7	Low	76.7	Confident	76 Å²	76	75.2 Å²	75.2	63%	0.628	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.6	-174.6	0	0	0	0	0	114.1	R350	R350-A413 PolarHBondContact NE-O 3.38Å
414	F	49.5	Very low	76.3	Confident	164 Å²	164	78 Å²	78	72%	0.719	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-5.5	-176.9	-87.9	-89.4	0	0	0	115.4	D412	D412-F414 PolarHBondContact O-N 2.77Å
415	G	57.3	Low	76	Confident	7 Å²	7	77 Å²	77	7%	0.072	41%	0.408	C	S	.	.			trans	84.8	156.8	178.7	0	0	0	0	0	111.8	D412 E417	D412-G415 PolarHBondContact O-N 3.01Å; G415-E417 VanDerWaalsContact C-N 3.32Å; G415-E417 PolarHBondContact O-N 3.49Å
416	A	69.6	Low	75.6	Confident	14 Å²	14	74.1 Å²	74.1	12%	0.116	40%	0.399	C	S	.	.			trans	-66.7	94.2	-179.3	0	0	0	0	0	109.4	Y391 S406 I409	Y391-A416 WeakPolarHBondContact CB-O 3.03Å; S406-A416 WeakPolarHBondContact OG-CB 3.44Å; S406-A416 PolarHBondContact OG-O 2.84Å; I409-A416 WeakPolarHBondContact O-CB 3.35Å
417	E	81.4	Confident	75.4	Confident	141 Å²	141	75.3 Å²	75.3	66%	0.659	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-50.2	145.3	167.3	-70.3	-175.5	166.3	0	0	109.7	G415 K419	G415-E417 VanDerWaalsContact C-N 3.32Å; G415-E417 PolarHBondContact O-N 3.49Å; E417-K419 PolarHBondContact O-N 3.17Å; E417-K419 VanDerWaalsContact O-N 3.15Å
418	C	89.2	Confident	75.6	Confident	25 Å²	25	76.2 Å²	76.2	17%	0.169	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-66.5	116.6	178.7	-62.2	0	0	0	0	110.1	Y391 C400 H404 Y405	Y391-C418 WeakPolarHBondContact CD1-SG 3.19Å; Y391-C418 VanDerWaalsContact CG-SG 3.51Å; C400-C418 WeakPolarHBondContact CA-SG 3.33Å; C400-C418 HydrophobicContact CB-CB 3.9Å; C400-C418 WeakPolarHBondContact CB-SG 3.39Å; C400-C418 WeakPolarHBondContact SG-CB 3.46Å; C400-C418 CovalentContact SG-SG 2.05Å; C400-C418 PolarHBondContact SG-SG 2.9Å; H404-C418 HydrophobicContact CB-CB 3.83Å; Y405-C418 WeakPolarHBondContact O-CA 3.45Å
419	K	89.4	Confident	76	Confident	133 Å²	133	79.4 Å²	79.4	58%	0.578	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	142.5	177.7	-64.2	177.2	-175.4	176.9	0	109.5	H404 Y405 E417	H404-K419 CarbonylContact C-O 3.52Å; H404-K419 WeakPolarHBondContact CA-O 3.48Å; H404-K419 WeakPolarHBondContact CB-O 3.47Å; Y405-K419 HydrophobicContact CD1-CB 4.26Å; Y405-K419 VanDerWaalsContact CD1-O 3.23Å; Y405-K419 WeakPolarHBondContact CD1-O 3.15Å; Y405-K419 HydrophobicContact CE1-CB 3.8Å; Y405-K419 PolarHBondContact N-O 3.23Å; Y405-K419 PolarHBondContact O-N 3.48Å; E417-K419 PolarHBondContact O-N 3.17Å; E417-K419 VanDerWaalsContact O-N 3.15Å
420	R	89.7	Confident	76.7	Confident	200 Å²	200	75 Å²	75	76%	0.755	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	138.2	173.9	-168.8	174.4	179.4	149.7	0.2	109.6
421	C	87.1	Confident	78.1	Confident	17 Å²	17	74.6 Å²	74.6	12%	0.115	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-59.7	138.8	173.8	-78.4	0	0	0	0	110.8	G403 C598	G403-C421 PolarHBondContact O-N 2.87Å; C421-C598 WeakPolarHBondContact CA-SG 3.46Å; C421-C598 HydrophobicContact CB-CB 3.92Å; C421-C598 WeakPolarHBondContact CB-SG 3.22Å; C421-C598 WeakPolarHBondContact SG-CB 3.5Å; C421-C598 CovalentContact SG-SG 2.04Å; C421-C598 PolarHBondContact SG-SG 2.6Å
422	P	85.2	Confident	79.7	Confident	74 Å²	74	67 Å²	67	48%	0.481	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-62.5	160.5	175.4	24.8	-31.3	0	0	0	111.6	T425	P422-T425 VanDerWaalsContact CD-OG1 3.24Å; P422-T425 WeakPolarHBondContact CD-OG1 3.42Å; P422-T425 HydrophobicContact CG-CG2 3.95Å; P422-T425 WeakPolarHBondContact CG-OG1 3.31Å; P422-T425 PolarHBondContact O-N 3.36Å; P422-T425 PolarHBondContact O-OG1 3.34Å
423	A	80.6	Confident	81.7	Confident	80 Å²	80	62.9 Å²	62.9	66%	0.661	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	148.2	176.6	0	0	0	0	0	111.5	T425	A423-T425 PolarHBondContact O-N 3.24Å
424	N	76.7	Confident	83.7	Confident	87 Å²	87	61.3 Å²	61.3	47%	0.465	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	21.4	-173.5	-55.8	-35.2	0	0	0	115.4	C601 M603	N424-C601 PolarHBondContact O-N 3Å; N424-M603 PolarHBondContact N-SD 2.91Å; N424-M603 PolarHBondContact OD1-SD 3.43Å; N424-M603 VanDerWaalsContact OD1-SD 3.42Å
425	T	83.9	Confident	85.5	Confident	35 Å²	35	58 Å²	58	22%	0.215	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	154	174.7	72	0	0	0	0	112.1	P422 A423 C598 I599	P422-T425 VanDerWaalsContact CD-OG1 3.24Å; P422-T425 WeakPolarHBondContact CD-OG1 3.42Å; P422-T425 HydrophobicContact CG-CG2 3.95Å; P422-T425 WeakPolarHBondContact CG-OG1 3.31Å; P422-T425 PolarHBondContact O-N 3.36Å; P422-T425 PolarHBondContact O-OG1 3.34Å; A423-T425 PolarHBondContact O-N 3.24Å; T425-C598 WeakPolarHBondContact OG1-CB 3.39Å; T425-I599 CarbonylContact C-O 3.57Å; T425-I599 WeakPolarHBondContact CA-O 3.01Å; T425-I599 WeakPolarHBondContact CB-O 3Å
426	A	83.3	Confident	87	Confident	9 Å²	9	57.6 Å²	57.6	7%	0.074	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	149.5	175.4	0	0	0	0	0	110.5	D428 C598 I599 C601 C610	A426-D428 PolarHBondContact O-N 2.82Å; A426-C598 CarbonylContact O-C 3.56Å; A426-C598 WeakPolarHBondContact O-CA 3.13Å; A426-C598 WeakPolarHBondContact O-CB 3.14Å; A426-I599 PolarHBondContact N-O 3.29Å; A426-I599 WeakPolarHBondContact O-CG1 3.45Å; A426-I599 PolarHBondContact O-N 3.29Å; A426-C601 HydrophobicContact CB-CB 4.11Å; A426-C610 HydrophobicContact CB-CB 4.36Å; A426-C610 WeakPolarHBondContact CB-SG 3.41Å
427	P	87.6	Confident	87.5	Confident	29 Å²	29	58.3 Å²	58.3	19%	0.188	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	126.4	171.3	26.2	-33.7	0	0	0	110.8	R429 A595	P427-R429 HydrophobicContact CB-CG 4.35Å; P427-R429 HydrophobicContact CG-CG 4.46Å; P427-R429 PolarHBondContact O-N 2.77Å; P427-R429 VanDerWaalsContact O-N 3.08Å; P427-A595 HydrophobicContact CB-CB 3.46Å; P427-A595 VanDerWaalsContact CB-CB 3.46Å
428	D	88.2	Confident	87.6	Confident	78 Å²	78	54.2 Å²	54.2	42%	0.417	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	88.3	172.1	-177.6	26.6	0	0	0	109.6	A426 A595 G597 I599	A426-D428 PolarHBondContact O-N 2.82Å; D428-A595 WeakPolarHBondContact O-CA 3.3Å; D428-A595 WeakPolarHBondContact O-CB 3.49Å; D428-G597 PolarHBondContact N-O 2.8Å; D428-I599 HydrophobicContact CB-CD1 4.44Å; D428-I599 HydrophobicContact CB-CG1 4.22Å; D428-I599 HydrophobicContact CB-CG2 3.87Å
429	R	90.6	Very high	87.6	Confident	73 Å²	73	55.4 Å²	55.4	28%	0.275	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	129.8	-171.7	-70.8	-179.3	174.4	-104.7	17.5	111.8	P427 N589 T590 V591 G593 G594	P427-R429 HydrophobicContact CB-CG 4.35Å; P427-R429 HydrophobicContact CG-CG 4.46Å; P427-R429 PolarHBondContact O-N 2.77Å; P427-R429 VanDerWaalsContact O-N 3.08Å; R429-N589 VanDerWaalsContact O-CA 3.27Å; R429-N589 WeakPolarHBondContact O-CA 3.16Å; R429-N589 PolarHBondContact O-N 3.38Å; R429-T590 WeakPolarHBondContact CB-O 3.37Å; R429-T590 PolarHBondContact O-N 3.06Å; R429-T590 VanDerWaalsContact O-N 3.09Å; R429-V591 PolarHBondContact NH1-O 3.04Å; R429-G593 PolarHBondContact NH1-O 3.41Å; R429-G594 CarbonylContact C-O 3.55Å; R429-G594 WeakPolarHBondContact CA-O 3.45Å
430	G	93	Very high	87.6	Confident	15 Å²	15	49.9 Å²	49.9	16%	0.155	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	-178.9	176.7	0	0	0	0	0	112.2	V587 T590 G593 G594	G430-V587 CarbonylContact C-O 3.15Å; G430-V587 WeakPolarHBondContact CA-O 3.48Å; G430-T590 WeakPolarHBondContact CA-OG1 3.45Å; G430-G593 CarbonylContact O-C 3.58Å; G430-G593 WeakPolarHBondContact O-CA 3.23Å; G430-G594 PolarHBondContact N-O 3.3Å; G430-G594 PolarHBondContact O-N 2.97Å; G430-G594 VanDerWaalsContact O-N 3.07Å
431	Y	94.8	Very high	87.4	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.016	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	125.6	166.7	-66.1	-63	0	0	0	108.2	I399 F433 K442 L484 V486 N586 V587 T590 D592	I399-Y431 HydrophobicContact CD1-CE1 3.86Å; Y431-F433 HydrophobicContact CD1-CE1 4.43Å; Y431-F433 HydrophobicContact CD1-CE2 4.13Å; Y431-F433 AromaticContact CD1-CZ 3.62Å; Y431-F433 HydrophobicContact CD1-CZ 3.62Å; Y431-F433 HydrophobicContact CE1-CZ 4.44Å; Y431-F433 AromaticContact CG-CE2 3.97Å; Y431-F433 HydrophobicContact CG-CE2 3.97Å; Y431-F433 AromaticContact CG-CZ 3.95Å; Y431-F433 HydrophobicContact CG-CZ 3.95Å; Y431-K442 HydrophobicContact CE1-CB 4.37Å; Y431-K442 HydrophobicContact CE1-CG 3.98Å; Y431-K442 WeakPolarHBondContact OH-CG 3.29Å; Y431-L484 HydrophobicContact CD2-CD1 4.48Å; Y431-V486 HydrophobicContact CD2-CG2 4.38Å; Y431-V486 HydrophobicContact CE2-CG2 4.13Å; Y431-N586 CarbonylContact O-C 3.57Å; Y431-N586 VanDerWaalsContact O-CA 3.23Å; Y431-N586 WeakPolarHBondContact O-CA 3.44Å; Y431-N586 PolarHBondContact O-OD1 2.84Å; Y431-V587 HydrophobicContact CD2-CB 4.17Å; Y431-V587 HydrophobicContact CD2-CG2 4.48Å; Y431-V587 PolarHBondContact N-O 2.94Å; Y431-V587 PolarHBondContact O-N 2.78Å; Y431-T590 HydrophobicContact CD2-CG2 3.97Å; Y431-T590 HydrophobicContact CE2-CG2 4.08Å; Y431-D592 PolarHBondContact OH-O 3.2Å; Y431-D592 PolarHBondContact OH-OD1 2.86Å; Y431-D592 PolarHBondContact OH-OD2 2.88Å
432	N	93.4	Very high	87.5	Confident	49 Å²	49	48 Å²	48	26%	0.262	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	90	175.3	-170.4	-2.2	0	0	0	109.1	N387 P388 V434	N387-N432 WeakPolarHBondContact CB-O 3.49Å; P388-N432 HydrophobicContact CB-CB 4.35Å; N432-V434 WeakPolarHBondContact OD1-CG1 3.21Å
433	F	94.3	Very high	87.8	Confident	11 Å²	11	44.9 Å²	44.9	5%	0.048	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	109.1	-179.7	-55.2	-60.4	0	0	0	109.3	Y431 W436 P440 I443 L484 V584 I585	Y431-F433 HydrophobicContact CD1-CE1 4.43Å; Y431-F433 HydrophobicContact CD1-CE2 4.13Å; Y431-F433 AromaticContact CD1-CZ 3.62Å; Y431-F433 HydrophobicContact CD1-CZ 3.62Å; Y431-F433 HydrophobicContact CE1-CZ 4.44Å; Y431-F433 AromaticContact CG-CE2 3.97Å; Y431-F433 HydrophobicContact CG-CE2 3.97Å; Y431-F433 AromaticContact CG-CZ 3.95Å; Y431-F433 HydrophobicContact CG-CZ 3.95Å; F433-W436 HydrophobicContact CB-CH2 3.89Å; F433-W436 HydrophobicContact CB-CZ2 3.73Å; F433-W436 HydrophobicContact CG-CH2 4.34Å; F433-P440 HydrophobicContact CD1-CB 4.18Å; F433-P440 HydrophobicContact CD1-CG 3.73Å; F433-P440 HydrophobicContact CE1-CB 3.54Å; F433-P440 HydrophobicContact CE1-CG 3.64Å; F433-P440 HydrophobicContact CZ-CB 4.05Å; F433-P440 HydrophobicContact CZ-CG 4.36Å; F433-I443 HydrophobicContact CD2-CD1 3.66Å; F433-I443 HydrophobicContact CE2-CD1 3.56Å; F433-I443 HydrophobicContact CE2-CG1 4.1Å; F433-I443 HydrophobicContact CG-CD1 4.19Å; F433-I443 HydrophobicContact CZ-CD1 4.04Å; F433-I443 HydrophobicContact CZ-CG1 4.33Å; F433-L484 HydrophobicContact CE2-CD1 3.92Å; F433-L484 HydrophobicContact CZ-CD1 4.46Å; F433-V584 CarbonylContact O-C 3.6Å; F433-V584 VanDerWaalsContact O-CA 3.27Å; F433-V584 WeakPolarHBondContact O-CA 3.42Å; F433-I585 HydrophobicContact CB-CB 4.33Å; F433-I585 HydrophobicContact CD2-CB 4.04Å; F433-I585 HydrophobicContact CD2-CG2 4.04Å; F433-I585 PolarHBondContact N-O 2.91Å; F433-I585 PolarHBondContact O-N 3.32Å
434	V	92.1	Very high	88.3	Confident	42 Å²	42	43.7 Å²	43.7	26%	0.255	23%	0.232	S	C	.	.			trans	-124	-23.2	177.9	-68.7	0	0	0	0	112	N387 P388 N432 V584	N387-V434 WeakPolarHBondContact OD1-CG2 3.42Å; N387-V434 PolarHBondContact OD1-N 2.96Å; P388-V434 HydrophobicContact CG-CG2 4.41Å; N432-V434 WeakPolarHBondContact OD1-CG1 3.21Å; V434-V584 HydrophobicContact CG1-CG1 4.04Å; V434-V584 HydrophobicContact CG1-CG2 4.21Å
435	W	88.5	Confident	88.9	Confident	94 Å²	94	40.9 Å²	40.9	36%	0.356	22%	0.219	S	C	.	.			trans	-113.2	125.7	174.9	-54.8	116.3	0	0	0	109.5	P384 P385 N387	P384-W435 HydrophobicContact CB-CD2 4.41Å; P384-W435 HydrophobicContact CB-CE3 4.23Å; P385-W435 HydrophobicContact CG-CZ2 4.17Å; P385-W435 VanDerWaalsContact O-CD1 3.28Å; N387-W435 PolarHBondContact ND2-O 2.84Å; N387-W435 PolarHBondContact OD1-N 3.2Å; N387-W435 PolarHBondContact OD1-O 2.03Å
436	W	88.7	Confident	88.9	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-115.5	60.3	-175.7	-64.3	97.7	0	0	0	110.2	F433 I443 P463 L464 G465 R467 I468 Y583 I585	F433-W436 HydrophobicContact CB-CH2 3.89Å; F433-W436 HydrophobicContact CB-CZ2 3.73Å; F433-W436 HydrophobicContact CG-CH2 4.34Å; W436-I443 HydrophobicContact CH2-CD1 3.58Å; W436-I443 HydrophobicContact CZ3-CD1 3.65Å; W436-P463 HydrophobicContact CB-CB 4.18Å; W436-P463 CarbonylContact O-C 3.52Å; W436-P463 VanDerWaalsContact O-C 3.23Å; W436-P463 WeakPolarHBondContact O-CA 3.16Å; W436-P463 WeakPolarHBondContact O-CB 3.1Å; W436-L464 PolarHBondContact O-N 2.77Å; W436-G465 PolarHBondContact N-O 2.9Å; W436-G465 VanDerWaalsContact O-CA 3.27Å; W436-G465 WeakPolarHBondContact O-CA 3.43Å; W436-G465 PolarHBondContact O-N 2.96Å; W436-R467 WeakPolarHBondContact CB-O 3.44Å; W436-R467 VanDerWaalsContact CD1-C 3.43Å; W436-R467 VanDerWaalsContact CG-C 3.48Å; W436-I468 HydrophobicContact CB-CB 4.45Å; W436-I468 HydrophobicContact CD2-CB 3.57Å; W436-I468 HydrophobicContact CD2-CG2 3.74Å; W436-I468 HydrophobicContact CE3-CB 3.57Å; W436-I468 HydrophobicContact CE3-CD1 3.81Å; W436-I468 HydrophobicContact CE3-CG1 4.2Å; W436-I468 HydrophobicContact CE3-CG2 3.82Å; W436-I468 HydrophobicContact CG-CB 3.98Å; W436-I468 HydrophobicContact CG-CG2 4.46Å; W436-I468 HydrophobicContact CH2-CB 4.47Å; W436-I468 HydrophobicContact CH2-CG2 3.79Å; W436-I468 HydrophobicContact CZ2-CB 4.47Å; W436-I468 HydrophobicContact CZ2-CG2 3.71Å; W436-I468 HydrophobicContact CZ3-CB 4.04Å; W436-I468 HydrophobicContact CZ3-CD1 3.76Å; W436-I468 HydrophobicContact CZ3-CG1 4.5Å; W436-I468 HydrophobicContact CZ3-CG2 3.84Å; W436-Y583 PolarHBondContact NE1-O 3.36Å; W436-I585 HydrophobicContact CH2-CD1 3.74Å; W436-I585 HydrophobicContact CH2-CG1 4.45Å; W436-I585 HydrophobicContact CZ2-CB 4.44Å; W436-I585 HydrophobicContact CZ2-CD1 3.91Å; W436-I585 HydrophobicContact CZ2-CG1 4.19Å
437	N	80.6	Confident	88.7	Confident	28 Å²	28	41.6 Å²	41.6	15%	0.15	23%	0.225	C	C	.	.	S	Bend	trans	-86.6	-34.7	-178.6	-52.3	-32.8	0	0	0	111.9	P384	P384-N437 WeakPolarHBondContact CB-ND2 3.46Å; P384-N437 VanDerWaalsContact CG-OD1 3.28Å; P384-N437 WeakPolarHBondContact CG-OD1 3.45Å
438	E	83.4	Confident	87.8	Confident	56 Å²	56	45.8 Å²	45.8	26%	0.262	24%	0.242	S	C	.	.	S	Bend	trans	-138.2	164.4	176.2	63.1	-177.1	177.5	0	0	108.5	H396 C397 P440	H396-E438 IonicContact CE1-OE2 3.66Å; H396-E438 IonicContact CG-OE2 3.12Å; H396-E438 IonicContact ND1-OE2 3.79Å; H396-E438 PolarHBondContact ND1-OE2 2.79Å; C397-E438 PolarHBondContact N-OE1 3.46Å; E438-P440 VanDerWaalsContact O-CD 3.25Å; E438-P440 WeakPolarHBondContact O-CD 3.38Å
439	M	88.4	Confident	86.5	Confident	49 Å²	49	42.9 Å²	42.9	24%	0.241	23%	0.227	C	C	.	.			trans	-74.3	117.8	173.7	-163.8	68.3	63.5	0	0	109.3	I443 I468 L482	M439-I443 HydrophobicContact CG-CB 4.48Å; M439-I443 HydrophobicContact CG-CG2 4.4Å; M439-I443 VanDerWaalsContact CG-O 3.29Å; M439-I443 WeakPolarHBondContact CG-O 3.23Å; M439-I443 HydrophobicContact SD-CB 4.15Å; M439-I443 HydrophobicContact SD-CG2 3.52Å; M439-I443 VanDerWaalsContact SD-CG2 3.52Å; M439-I468 HydrophobicContact CE-CD1 3.95Å; M439-I468 HydrophobicContact SD-CD1 3.9Å; M439-L482 HydrophobicContact SD-CD1 4.3Å
440	P	89	Confident	84.9	Confident	18 Å²	18	44 Å²	44	12%	0.117	24%	0.237	C	C	.	.			trans	-63.2	146.7	178	-22.4	34.2	0	0	0	111.9	F433 E438 K442 I443	F433-P440 HydrophobicContact CD1-CB 4.18Å; F433-P440 HydrophobicContact CD1-CG 3.73Å; F433-P440 HydrophobicContact CE1-CB 3.54Å; F433-P440 HydrophobicContact CE1-CG 3.64Å; F433-P440 HydrophobicContact CZ-CB 4.05Å; F433-P440 HydrophobicContact CZ-CG 4.36Å; E438-P440 VanDerWaalsContact O-CD 3.25Å; E438-P440 WeakPolarHBondContact O-CD 3.38Å; P440-K442 PolarHBondContact O-N 2.88Å; P440-I443 HydrophobicContact CB-CG1 4.49Å; P440-I443 HydrophobicContact CG-CD1 4.17Å; P440-I443 PolarHBondContact O-N 2.91Å; P440-I443 VanDerWaalsContact O-O 3.11Å
441	D	86.4	Confident	82.9	Confident	114 Å²	114	49.3 Å²	49.3	61%	0.61	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-26.3	-176.9	-70.7	-18.3	0	0	0	116	H398	H398-D441 IonicContact ND1-OD2 3.1Å
442	K	88.8	Confident	80.7	Confident	62 Å²	62	56.7 Å²	56.7	27%	0.27	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-4.6	-176.4	-60.4	-67.1	-174.5	-118.8	0	113.6	I399 Y431 P440 L484 R485	I399-K442 HydrophobicContact CD1-CG 4.29Å; Y431-K442 HydrophobicContact CE1-CB 4.37Å; Y431-K442 HydrophobicContact CE1-CG 3.98Å; Y431-K442 WeakPolarHBondContact OH-CG 3.29Å; P440-K442 PolarHBondContact O-N 2.88Å; K442-L484 HydrophobicContact CB-CD1 4.13Å; K442-R485 PolarHBondContact O-N 2.92Å
443	I	92.6	Very high	78.8	Confident	9 Å²	9	55.4 Å²	55.4	5%	0.046	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	133.9	178	-62.8	-174.8	0	0	0	108.5	F433 W436 M439 P440 L482 S483 L484	F433-I443 HydrophobicContact CD2-CD1 3.66Å; F433-I443 HydrophobicContact CE2-CD1 3.56Å; F433-I443 HydrophobicContact CE2-CG1 4.1Å; F433-I443 HydrophobicContact CG-CD1 4.19Å; F433-I443 HydrophobicContact CZ-CD1 4.04Å; F433-I443 HydrophobicContact CZ-CG1 4.33Å; W436-I443 HydrophobicContact CH2-CD1 3.58Å; W436-I443 HydrophobicContact CZ3-CD1 3.65Å; M439-I443 HydrophobicContact CG-CB 4.48Å; M439-I443 HydrophobicContact CG-CG2 4.4Å; M439-I443 VanDerWaalsContact CG-O 3.29Å; M439-I443 WeakPolarHBondContact CG-O 3.23Å; M439-I443 HydrophobicContact SD-CB 4.15Å; M439-I443 HydrophobicContact SD-CG2 3.52Å; M439-I443 VanDerWaalsContact SD-CG2 3.52Å; P440-I443 HydrophobicContact CB-CG1 4.49Å; P440-I443 HydrophobicContact CG-CD1 4.17Å; P440-I443 PolarHBondContact O-N 2.91Å; P440-I443 VanDerWaalsContact O-O 3.11Å; I443-L482 HydrophobicContact CG2-CD1 3.4Å; I443-L482 HydrophobicContact CG2-CD2 4.45Å; I443-L482 HydrophobicContact CG2-CG 3.89Å; I443-S483 CarbonylContact C-O 3.49Å; I443-S483 VanDerWaalsContact CA-O 3.29Å; I443-S483 WeakPolarHBondContact CA-O 3.12Å; I443-L484 HydrophobicContact CD1-CD1 4.39Å; I443-L484 HydrophobicContact CG1-CB 4.4Å; I443-L484 HydrophobicContact CG1-CD1 3.72Å
444	A	90.4	Very high	77.1	Confident	55 Å²	55	59.7 Å²	59.7	46%	0.455	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	145.8	173.8	0	0	0	0	0	110.2	L482 S483	A444-L482 CarbonylContact O-C 3.54Å; A444-S483 PolarHBondContact N-O 3.05Å; A444-S483 PolarHBondContact O-N 3.27Å
445	S	89.3	Confident	75.9	Confident	28 Å²	28	58.8 Å²	58.8	20%	0.196	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.8	178.8	174.2	0	0	0	0	108.3	G460 W461	S445-G460 PolarHBondContact OG-N 2.79Å; S445-W461 WeakPolarHBondContact OG-CA 3.35Å; S445-W461 WeakPolarHBondContact OG-CB 3.48Å; S445-W461 PolarHBondContact OG-N 2.87Å; S445-W461 PolarHBondContact OG-O 2.81Å
446	S	83.7	Confident	74.7	Confident	36 Å²	36	56.2 Å²	56.2	25%	0.252	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145.7	178.2	63	0	0	0	0	111.2	T481	S446-T481 PolarHBondContact N-O 2.96Å; S446-T481 PolarHBondContact O-N 2.95Å
447	C	78.5	Confident	73.6	Confident	23 Å²	23	56.9 Å²	56.9	16%	0.155	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.5	170.1	175.2	0	0	0	0	108.8	C455 Y479 L480	C447-C455 HydrophobicContact CB-CB 3.62Å; C447-C455 WeakPolarHBondContact CB-SG 3.25Å; C447-C455 PolarHBondContact O-SG 3.43Å; C447-C455 WeakPolarHBondContact SG-CB 3.2Å; C447-C455 CovalentContact SG-SG 2.04Å; C447-C455 PolarHBondContact SG-SG 3.4Å; C447-Y479 WeakPolarHBondContact CA-O 3.38Å; C447-L480 HydrophobicContact CB-CD2 4.16Å
448	Q	69	Low	73	Confident	117 Å²	117	63.9 Å²	63.9	55%	0.547	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	154.6	176.8	-60.8	180	2.2	0	0	110.4	C455 Y479	Q448-C455 PolarHBondContact N-SG 3.02Å; Q448-C455 VanDerWaalsContact N-SG 3.41Å; Q448-Y479 PolarHBondContact N-O 2.83Å; Q448-Y479 PolarHBondContact O-N 3.37Å
449	T	61.4	Low	72.6	Confident	18 Å²	18	65 Å²	65	11%	0.11	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	159	171.3	64.3	0	0	0	0	108.8	D451 G453 L478	T449-D451 VanDerWaalsContact C-N 3.29Å; T449-D451 PolarHBondContact O-N 2.81Å; T449-G453 WeakPolarHBondContact OG1-CA 3.4Å; T449-G453 PolarHBondContact OG1-N 2.85Å; T449-G453 PolarHBondContact OG1-O 3.11Å; T449-L478 HydrophobicContact CG2-CD2 3.61Å
450	M	56.5	Low	72.4	Confident	96 Å²	96	62.7 Å²	62.7	47%	0.473	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-33.6	176.9	-69.4	-65.1	-72.4	0	0	113.1	A231 Y479	A231-M450 HydrophobicContact CB-CE 3.72Å; M450-Y479 HydrophobicContact CG-CE2 3.55Å; M450-Y479 HydrophobicContact SD-CE2 3.55Å; M450-Y479 VanDerWaalsContact SD-CE2 3.55Å; M450-Y479 VanDerWaalsContact SD-CZ 3.52Å; M450-Y479 PolarHBondContact SD-OH 3.04Å
451	D	50.5	Low	72.5	Confident	126 Å²	126	61.9 Å²	61.9	67%	0.674	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	27.5	-165.6	-74.2	-23.3	0	0	0	113.9	T449 G453	T449-D451 VanDerWaalsContact C-N 3.29Å; T449-D451 PolarHBondContact O-N 2.81Å; D451-G453 PolarHBondContact O-N 3.21Å
452	E	50.1	Low	72.6	Confident	159 Å²	159	57.1 Å²	57.1	74%	0.743	31%	0.313	S	S	*	.	S	Bend	trans	55.7	14.9	-173.7	-64.4	175.4	-178.4	0	0	113.5	K236	K236-E452 IonicContact NZ-OE1 2.74Å; K236-E452 PolarHBondContact NZ-OE1 2.8Å
453	G	52	Low	72.6	Confident	23 Å²	23	55 Å²	55	24%	0.237	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-68.5	142.3	177.3	0	0	0	0	0	111.1	T449 D451 C455	T449-G453 WeakPolarHBondContact OG1-CA 3.4Å; T449-G453 PolarHBondContact OG1-N 2.85Å; T449-G453 PolarHBondContact OG1-O 3.11Å; D451-G453 PolarHBondContact O-N 3.21Å; G453-C455 PolarHBondContact O-N 3.33Å
454	S	59.2	Low	72.2	Confident	100 Å²	100	56.6 Å²	56.6	70%	0.699	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-55	133.3	169.7	-172.4	0	0	0	0	109.3	R475	S454-R475 PolarHBondContact O-NH1 3.31Å
455	C	67.1	Low	71.9	Confident	24 Å²	24	54.4 Å²	54.4	16%	0.162	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-68.1	141.4	163.2	-83.3	0	0	0	0	109.5	C447 Q448 G453 V457	C447-C455 HydrophobicContact CB-CB 3.62Å; C447-C455 WeakPolarHBondContact CB-SG 3.25Å; C447-C455 PolarHBondContact O-SG 3.43Å; C447-C455 WeakPolarHBondContact SG-CB 3.2Å; C447-C455 CovalentContact SG-SG 2.04Å; C447-C455 PolarHBondContact SG-SG 3.4Å; Q448-C455 PolarHBondContact N-SG 3.02Å; Q448-C455 VanDerWaalsContact N-SG 3.41Å; G453-C455 PolarHBondContact O-N 3.33Å; C455-V457 VanDerWaalsContact C-N 3.28Å
456	D	63.1	Low	71.7	Confident	40 Å²	40	57.5 Å²	57.5	21%	0.214	31%	0.311	C	S	.	.	S	Bend	trans	-69.4	-34.9	173	-75.4	27	0	0	0	110	E360 P361 R475	E360-D456 CarbonylContact C-O 3.53Å; E360-D456 CarbonylContact O-C 3.5Å; P361-D456 WeakPolarHBondContact CD-OD2 3.12Å; P361-D456 HydrophobicContact CG-CB 4.45Å; D456-R475 VanDerWaalsContact OD1-CD 3.32Å; D456-R475 WeakPolarHBondContact OD1-CD 3.39Å; D456-R475 IonicContact OD1-CZ 3.13Å; D456-R475 IonicContact OD1-NH1 3.78Å; D456-R475 PolarHBondContact OD1-NH1 3.27Å; D456-R475 WeakPolarHBondContact OD2-CD 3.41Å
457	V	66.6	Low	72.1	Confident	14 Å²	14	59.1 Å²	59.1	9%	0.085	31%	0.312	C	S	.	.	S	Bend	trans	-97.9	135.2	-178.4	-162.3	0	0	0	0	111.2	C455 E459	C455-V457 VanDerWaalsContact C-N 3.28Å; V457-E459 WeakPolarHBondContact CG1-O 3.38Å
458	H	66.4	Low	72.8	Confident	175 Å²	175	58 Å²	58	81%	0.81	30%	0.304	S	S	*	.	S	Bend	trans	-66.3	-40.3	176.9	-130.7	78.3	0	0	0	112.9
459	E	76.6	Confident	74	Confident	80 Å²	80	52.5 Å²	52.5	37%	0.374	28%	0.279	S	S	.	.			trans	-124.9	126.7	-178.3	-64.2	-177.6	177.9	0	0	109.9	V457 W461 L462 S471	V457-E459 WeakPolarHBondContact CG1-O 3.38Å; E459-W461 VanDerWaalsContact C-N 3.29Å; E459-W461 PolarHBondContact O-N 3.06Å; E459-L462 HydrophobicContact CB-CD2 4.11Å; E459-S471 VanDerWaalsContact O-CB 3.25Å; E459-S471 WeakPolarHBondContact O-CB 3.43Å; E459-S471 PolarHBondContact O-OG 2.74Å
460	G	83.1	Confident	75.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-74.9	-18.8	-178	0	0	0	0	0	114.5	S445 T470 S471	S445-G460 PolarHBondContact OG-N 2.79Å; G460-T470 CarbonylContact O-C 3.59Å; G460-T470 WeakPolarHBondContact O-CA 3.16Å; G460-S471 PolarHBondContact O-N 2.85Å; G460-S471 PolarHBondContact O-OG 2.8Å
461	W	91.2	Very high	76.8	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	134.1	-178	-71.9	78.8	0	0	0	109.4	S445 E459 I468 S469 T470 L480 T481 L482 F521 W564 F566 A580 I582	S445-W461 WeakPolarHBondContact OG-CA 3.35Å; S445-W461 WeakPolarHBondContact OG-CB 3.48Å; S445-W461 PolarHBondContact OG-N 2.87Å; S445-W461 PolarHBondContact OG-O 2.81Å; E459-W461 VanDerWaalsContact C-N 3.29Å; E459-W461 PolarHBondContact O-N 3.06Å; W461-I468 HydrophobicContact CB-CD1 4.1Å; W461-I468 HydrophobicContact CB-CG1 4.12Å; W461-I468 HydrophobicContact CE3-CG1 4.14Å; W461-I468 HydrophobicContact CE3-CG2 4.36Å; W461-S469 CarbonylContact C-O 3.59Å; W461-S469 VanDerWaalsContact CA-O 3.32Å; W461-S469 WeakPolarHBondContact CA-O 3.19Å; W461-T470 HydrophobicContact CD2-CG2 3.85Å; W461-T470 VanDerWaalsContact CE2-CG2 3.49Å; W461-T470 HydrophobicContact CE3-CG2 4.09Å; W461-T470 HydrophobicContact CH2-CG2 3.72Å; W461-T470 HydrophobicContact CZ2-CG2 3.44Å; W461-T470 VanDerWaalsContact CZ2-CG2 3.44Å; W461-T470 HydrophobicContact CZ3-CG2 4.03Å; W461-L480 VanDerWaalsContact NE1-C 3.31Å; W461-L480 PolarHBondContact NE1-O 2.87Å; W461-T481 VanDerWaalsContact CD1-C 3.41Å; W461-L482 HydrophobicContact CB-CD1 3.96Å; W461-L482 HydrophobicContact CD2-CB 3.91Å; W461-L482 HydrophobicContact CE3-CD2 4.43Å; W461-L482 HydrophobicContact CG-CB 3.93Å; W461-L482 HydrophobicContact CG-CD1 4.08Å; W461-L482 HydrophobicContact CZ2-CB 4.42Å; W461-F521 AromaticContact CH2-CE2 3.73Å; W461-F521 HydrophobicContact CH2-CE2 3.73Å; W461-F521 HydrophobicContact CH2-CZ 4.4Å; W461-F521 AromaticContact CZ2-CE2 3.98Å; W461-F521 HydrophobicContact CZ2-CE2 3.98Å; W461-W564 HydrophobicContact CZ2-CB 4.34Å; W461-F566 HydrophobicContact CZ2-CB 4.3Å; W461-A580 HydrophobicContact CH2-CB 3.91Å; W461-I582 HydrophobicContact CH2-CD1 3.82Å; W461-I582 HydrophobicContact CH2-CG1 4.05Å; W461-I582 HydrophobicContact CZ3-CD1 3.88Å; W461-I582 HydrophobicContact CZ3-CG1 3.92Å
462	L	88.6	Confident	78.1	Confident	15 Å²	15	45.1 Å²	45.1	8%	0.079	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	128.6	-174.1	-62.9	173.1	0	0	0	110.7	Y340 E459 L464 I468 S469	Y340-L462 HydrophobicContact CD1-CD1 4.47Å; Y340-L462 HydrophobicContact CD2-CD1 3.81Å; Y340-L462 HydrophobicContact CD2-CD2 4.27Å; Y340-L462 HydrophobicContact CE2-CD1 4.49Å; Y340-L462 HydrophobicContact CE2-CD2 4.29Å; Y340-L462 HydrophobicContact CG-CD1 3.8Å; E459-L462 HydrophobicContact CB-CD2 4.11Å; L462-L464 HydrophobicContact CB-CD2 4.42Å; L462-L464 PolarHBondContact O-N 2.86Å; L462-I468 WeakPolarHBondContact O-CA 3.43Å; L462-I468 WeakPolarHBondContact O-CG1 3.42Å; L462-S469 PolarHBondContact N-O 3.3Å; L462-S469 PolarHBondContact O-N 3.13Å
463	P	88.7	Confident	79.2	Confident	16 Å²	16	38.1 Å²	38.1	10%	0.104	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	117.9	173.1	30	-31.9	0	0	0	110.1	W436	W436-P463 HydrophobicContact CB-CB 4.18Å; W436-P463 CarbonylContact O-C 3.52Å; W436-P463 VanDerWaalsContact O-C 3.23Å; W436-P463 WeakPolarHBondContact O-CA 3.16Å; W436-P463 WeakPolarHBondContact O-CB 3.1Å
464	L	84.4	Confident	80	Confident	44 Å²	44	40.4 Å²	40.4	23%	0.23	21%	0.205	C	C	.	.			trans	-111.6	19.6	-174.1	-61.2	178.9	0	0	0	113.7	W436 L462 D466 R467	W436-L464 PolarHBondContact O-N 2.77Å; L462-L464 HydrophobicContact CB-CD2 4.42Å; L462-L464 PolarHBondContact O-N 2.86Å; L464-D466 PolarHBondContact O-N 3.22Å; L464-R467 WeakPolarHBondContact CA-O 3.39Å; L464-R467 HydrophobicContact CB-CG 4.29Å; L464-R467 WeakPolarHBondContact CB-O 3.47Å; L464-R467 PolarHBondContact N-O 3.24Å
465	G	83.6	Confident	80.3	Confident	9 Å²	9	37.9 Å²	37.9	9%	0.093	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	87.7	-69.1	180	0	0	0	0	0	112.8	W436	W436-G465 PolarHBondContact N-O 2.9Å; W436-G465 VanDerWaalsContact O-CA 3.27Å; W436-G465 WeakPolarHBondContact O-CA 3.43Å; W436-G465 PolarHBondContact O-N 2.96Å
466	D	86.3	Confident	80.3	Confident	92 Å²	92	38.7 Å²	38.7	49%	0.492	19%	0.186	S	C	.	.	S	Bend	trans	-89.1	-12.1	-178.7	72.4	-35.2	0	0	0	113.8	L464	L464-D466 PolarHBondContact O-N 3.22Å
467	R	91.7	Very high	80.4	Confident	70 Å²	70	39.3 Å²	39.3	26%	0.264	19%	0.189	S	C	.	.			trans	-156.9	161.5	-179.9	66.4	-164.8	176.7	177.7	-3.1	111.1	W436 L464 I582 Y583	W436-R467 WeakPolarHBondContact CB-O 3.44Å; W436-R467 VanDerWaalsContact CD1-C 3.43Å; W436-R467 VanDerWaalsContact CG-C 3.48Å; L464-R467 WeakPolarHBondContact CA-O 3.39Å; L464-R467 HydrophobicContact CB-CG 4.29Å; L464-R467 WeakPolarHBondContact CB-O 3.47Å; L464-R467 PolarHBondContact N-O 3.24Å; R467-I582 WeakPolarHBondContact CA-O 3.5Å; R467-I582 WeakPolarHBondContact CB-O 3.3Å; R467-Y583 HydrophobicContact CB-CD1 3.73Å; R467-Y583 HydrophobicContact CB-CE1 3.89Å; R467-Y583 HydrophobicContact CB-CG 4.26Å; R467-Y583 HydrophobicContact CG-CE1 4.38Å; R467-Y583 PolarHBondContact NH1-OH 2.03Å; R467-Y583 VanDerWaalsContact NH1-OH 3.16Å
468	I	93.9	Very high	80.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	130.6	163.2	-169.6	170.4	0	0	0	108.5	W436 M439 W461 L462 L482 S581 I582	W436-I468 HydrophobicContact CB-CB 4.45Å; W436-I468 HydrophobicContact CD2-CB 3.57Å; W436-I468 HydrophobicContact CD2-CG2 3.74Å; W436-I468 HydrophobicContact CE3-CB 3.57Å; W436-I468 HydrophobicContact CE3-CD1 3.81Å; W436-I468 HydrophobicContact CE3-CG1 4.2Å; W436-I468 HydrophobicContact CE3-CG2 3.82Å; W436-I468 HydrophobicContact CG-CB 3.98Å; W436-I468 HydrophobicContact CG-CG2 4.46Å; W436-I468 HydrophobicContact CH2-CB 4.47Å; W436-I468 HydrophobicContact CH2-CG2 3.79Å; W436-I468 HydrophobicContact CZ2-CB 4.47Å; W436-I468 HydrophobicContact CZ2-CG2 3.71Å; W436-I468 HydrophobicContact CZ3-CB 4.04Å; W436-I468 HydrophobicContact CZ3-CD1 3.76Å; W436-I468 HydrophobicContact CZ3-CG1 4.5Å; W436-I468 HydrophobicContact CZ3-CG2 3.84Å; M439-I468 HydrophobicContact CE-CD1 3.95Å; M439-I468 HydrophobicContact SD-CD1 3.9Å; W461-I468 HydrophobicContact CB-CD1 4.1Å; W461-I468 HydrophobicContact CB-CG1 4.12Å; W461-I468 HydrophobicContact CE3-CG1 4.14Å; W461-I468 HydrophobicContact CE3-CG2 4.36Å; L462-I468 WeakPolarHBondContact O-CA 3.43Å; L462-I468 WeakPolarHBondContact O-CG1 3.42Å; I468-L482 HydrophobicContact CD1-CD1 3.52Å; I468-L482 HydrophobicContact CD1-CD2 4.09Å; I468-L482 HydrophobicContact CD1-CG 4.47Å; I468-L482 HydrophobicContact CG2-CD2 4.12Å; I468-S581 CarbonylContact O-C 3.46Å; I468-S581 WeakPolarHBondContact O-CA 3.15Å; I468-I582 HydrophobicContact CG2-CB 3.84Å; I468-I582 PolarHBondContact N-O 2.91Å; I468-I582 PolarHBondContact O-N 2.93Å
469	S	92.9	Very high	81.3	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.2	-178	-60.1	0	0	0	0	112.1	W461 L462 S471 Q579 A580 S581	W461-S469 CarbonylContact C-O 3.59Å; W461-S469 VanDerWaalsContact CA-O 3.32Å; W461-S469 WeakPolarHBondContact CA-O 3.19Å; L462-S469 PolarHBondContact N-O 3.3Å; L462-S469 PolarHBondContact O-N 3.13Å; S469-S471 PolarHBondContact O-N 3.09Å; S469-Q579 PolarHBondContact OG-NE2 3.06Å; S469-A580 CarbonylContact C-O 3.52Å; S469-A580 VanDerWaalsContact CA-O 3.25Å; S469-A580 WeakPolarHBondContact CA-O 3.2Å; S469-S581 VanDerWaalsContact OG-CB 3.22Å; S469-S581 WeakPolarHBondContact OG-CB 3.46Å; S469-S581 PolarHBondContact OG-OG 2.77Å
470	T	91.1	Very high	81.7	Confident	4 Å²	4	28.8 Å²	28.8	3%	0.025	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	138.6	173.2	53.6	0	0	0	0	111.3	G460 W461 L480 F566 Q579 A580	G460-T470 CarbonylContact O-C 3.59Å; G460-T470 WeakPolarHBondContact O-CA 3.16Å; W461-T470 HydrophobicContact CD2-CG2 3.85Å; W461-T470 VanDerWaalsContact CE2-CG2 3.49Å; W461-T470 HydrophobicContact CE3-CG2 4.09Å; W461-T470 HydrophobicContact CH2-CG2 3.72Å; W461-T470 HydrophobicContact CZ2-CG2 3.44Å; W461-T470 VanDerWaalsContact CZ2-CG2 3.44Å; W461-T470 HydrophobicContact CZ3-CG2 4.03Å; T470-L480 HydrophobicContact CG2-CB 4.17Å; T470-L480 HydrophobicContact CG2-CD1 4.13Å; T470-F566 HydrophobicContact CG2-CB 3.64Å; T470-F566 HydrophobicContact CG2-CD1 3.72Å; T470-F566 HydrophobicContact CG2-CG 3.88Å; T470-Q579 WeakPolarHBondContact OG1-CA 3.49Å; T470-A580 HydrophobicContact CG2-CB 3.95Å; T470-A580 PolarHBondContact N-O 2.78Å; T470-A580 PolarHBondContact OG1-N 2.77Å; T470-A580 PolarHBondContact OG1-O 3.29Å
471	S	85	Confident	81.8	Confident	2 Å²	2	29.2 Å²	29.2	1%	0.014	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-60.2	149.8	174.8	62.5	0	0	0	0	111.9	E459 G460 S469 R568	E459-S471 VanDerWaalsContact O-CB 3.25Å; E459-S471 WeakPolarHBondContact O-CB 3.43Å; E459-S471 PolarHBondContact O-OG 2.74Å; G460-S471 PolarHBondContact O-N 2.85Å; G460-S471 PolarHBondContact O-OG 2.8Å; S469-S471 PolarHBondContact O-N 3.09Å; S471-R568 PolarHBondContact O-NH2 3.31Å
472	R	78.5	Confident	81.9	Confident	80 Å²	80	29.2 Å²	29.2	30%	0.302	14%	0.14	S	C	.	.	P	Polyproline II helix	trans	-88.6	139.1	174.9	-65.2	-178.8	174.4	178.7	-6.2	110.4	S337 Q579	S337-R472 WeakPolarHBondContact O-CD 3.45Å; R472-Q579 VanDerWaalsContact NH2-OE1 3.1Å
473	S	72.8	Confident	82	Confident	11 Å²	11	29.3 Å²	29.3	8%	0.077	14%	0.142	C	C	.	.			trans	-159.6	158	179.1	170.5	0	0	0	0	108.7	R475 R568 S576	S473-R475 PolarHBondContact OG-N 3.34Å; S473-R568 VanDerWaalsContact C-NH1 3.29Å; S473-R568 PolarHBondContact O-NH1 3.06Å; S473-S576 VanDerWaalsContact O-CA 3.29Å; S473-S576 WeakPolarHBondContact O-CA 3.45Å; S473-S576 VanDerWaalsContact O-CB 3.31Å; S473-S576 WeakPolarHBondContact O-CB 3.36Å
474	R	68.4	Low	82.2	Confident	72 Å²	72	28.6 Å²	28.6	27%	0.272	14%	0.137	S	C	.	.	S	Bend	trans	-87.6	-6.2	175.1	-66.6	176.4	-177.3	-103	-2.7	113.4	D338 I363 D574	D338-R474 IonicContact OD1-CZ 3.3Å; D338-R474 IonicContact OD1-NE 3.08Å; D338-R474 IonicContact OD1-NH2 3.9Å; D338-R474 PolarHBondContact OD1-NH2 3.42Å; D338-R474 VanDerWaalsContact OD1-NH2 3.13Å; D338-R474 IonicContact OD2-NH2 2.76Å; I363-R474 HydrophobicContact CD1-CB 4.24Å; R474-D574 IonicContact NH1-OD2 2.77Å
475	R	66.9	Low	82.6	Confident	47 Å²	47	33 Å²	33	18%	0.177	15%	0.151	C	C	.	.			trans	-80	137.8	177.4	-73.2	-176	66.7	171.9	0.8	111.9	S454 D456 S473 D477 L478 R568	S454-R475 PolarHBondContact O-NH1 3.31Å; D456-R475 VanDerWaalsContact OD1-CD 3.32Å; D456-R475 WeakPolarHBondContact OD1-CD 3.39Å; D456-R475 IonicContact OD1-CZ 3.13Å; D456-R475 IonicContact OD1-NH1 3.78Å; D456-R475 PolarHBondContact OD1-NH1 3.27Å; D456-R475 WeakPolarHBondContact OD2-CD 3.41Å; S473-R475 PolarHBondContact OG-N 3.34Å; R475-D477 IonicContact CZ-OD1 2.62Å; R475-D477 IonicContact CZ-OD2 3.49Å; R475-D477 IonicContact NE-OD1 3.22Å; R475-D477 PolarHBondContact NE-OD1 3.35Å; R475-D477 IonicContact NE-OD2 2.74Å; R475-D477 IonicContact NH2-OD1 2.71Å; R475-D477 PolarHBondContact NH2-OD1 3.03Å; R475-D477 IonicContact NH2-OD2 3.68Å; R475-D477 PolarHBondContact NH2-OD2 3.48Å; R475-L478 HydrophobicContact CB-CD1 3.94Å; R475-L478 HydrophobicContact CB-CD2 4.12Å; R475-L478 HydrophobicContact CB-CG 3.77Å; R475-R568 PolarHBondContact O-NH1 2.82Å
476	S	66.9	Low	83	Confident	40 Å²	40	32.5 Å²	32.5	28%	0.28	15%	0.146	S	C	.	.	S	Bend	trans	-96.3	-14.6	177.6	67.6	0	0	0	0	113.4	L478 Q570	S476-L478 VanDerWaalsContact C-N 3.32Å; S476-L478 PolarHBondContact O-N 2.88Å; S476-Q570 PolarHBondContact O-NE2 3.29Å; S476-Q570 PolarHBondContact OG-OE1 3.1Å; S476-Q570 VanDerWaalsContact OG-OE1 3.13Å
477	D	65.9	Low	83.1	Confident	54 Å²	54	32.5 Å²	32.5	29%	0.289	15%	0.146	S	C	.	.	S	Bend	trans	-92.1	18.6	-174.5	68.4	-43.8	0	0	0	114.2	R475	R475-D477 IonicContact CZ-OD1 2.62Å; R475-D477 IonicContact CZ-OD2 3.49Å; R475-D477 IonicContact NE-OD1 3.22Å; R475-D477 PolarHBondContact NE-OD1 3.35Å; R475-D477 IonicContact NE-OD2 2.74Å; R475-D477 IonicContact NH2-OD1 2.71Å; R475-D477 PolarHBondContact NH2-OD1 3.03Å; R475-D477 IonicContact NH2-OD2 3.68Å; R475-D477 PolarHBondContact NH2-OD2 3.48Å
478	L	71.7	Confident	83	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.6	-175.9	-55.8	-174.9	0	0	0	112.1	T449 R475 S476 L480	T449-L478 HydrophobicContact CG2-CD2 3.61Å; R475-L478 HydrophobicContact CB-CD1 3.94Å; R475-L478 HydrophobicContact CB-CD2 4.12Å; R475-L478 HydrophobicContact CB-CG 3.77Å; S476-L478 VanDerWaalsContact C-N 3.32Å; S476-L478 PolarHBondContact O-N 2.88Å; L478-L480 HydrophobicContact CB-CD2 4.11Å; L478-L480 HydrophobicContact CB-CG 4.45Å; L478-L480 HydrophobicContact CD1-CD2 4.44Å
479	Y	78.8	Confident	82.7	Confident	47 Å²	47	29.8 Å²	29.8	18%	0.184	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	110	167.3	-67.5	-103.8	0	0	0	107.6	C447 Q448 M450 V565 I567	C447-Y479 WeakPolarHBondContact CA-O 3.38Å; Q448-Y479 PolarHBondContact N-O 2.83Å; Q448-Y479 PolarHBondContact O-N 3.37Å; M450-Y479 HydrophobicContact CG-CE2 3.55Å; M450-Y479 HydrophobicContact SD-CE2 3.55Å; M450-Y479 VanDerWaalsContact SD-CE2 3.55Å; M450-Y479 VanDerWaalsContact SD-CZ 3.52Å; M450-Y479 PolarHBondContact SD-OH 3.04Å; Y479-V565 HydrophobicContact CD1-CG1 4.16Å; Y479-I567 HydrophobicContact CD1-CD1 3.9Å; Y479-I567 HydrophobicContact CD1-CG1 3.93Å; Y479-I567 HydrophobicContact CE1-CD1 3.45Å; Y479-I567 VanDerWaalsContact CE1-CD1 3.45Å; Y479-I567 HydrophobicContact CE1-CG1 3.96Å
480	L	85	Confident	82	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	107.2	-178.6	-55.8	179.5	0	0	0	108.3	C447 W461 T470 L478 V565 F566	C447-L480 HydrophobicContact CB-CD2 4.16Å; W461-L480 VanDerWaalsContact NE1-C 3.31Å; W461-L480 PolarHBondContact NE1-O 2.87Å; T470-L480 HydrophobicContact CG2-CB 4.17Å; T470-L480 HydrophobicContact CG2-CD1 4.13Å; L478-L480 HydrophobicContact CB-CD2 4.11Å; L478-L480 HydrophobicContact CB-CG 4.45Å; L478-L480 HydrophobicContact CD1-CD2 4.44Å; L480-V565 WeakPolarHBondContact O-CA 3.41Å; L480-F566 HydrophobicContact CB-CB 4.43Å; L480-F566 HydrophobicContact CD1-CD1 4.33Å; L480-F566 PolarHBondContact N-O 3.31Å; L480-F566 PolarHBondContact O-N 2.81Å
481	T	86	Confident	80.9	Confident	8 Å²	8	37.5 Å²	37.5	5%	0.049	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.4	-171.4	-54.1	0	0	0	0	111.7	S446 W461 Q563 W564 V565	S446-T481 PolarHBondContact N-O 2.96Å; S446-T481 PolarHBondContact O-N 2.95Å; W461-T481 VanDerWaalsContact CD1-C 3.41Å; T481-Q563 HydrophobicContact CG2-CB 4.13Å; T481-Q563 HydrophobicContact CG2-CG 4.36Å; T481-W564 CarbonylContact C-O 3.58Å; T481-W564 WeakPolarHBondContact CA-O 3.47Å; T481-V565 HydrophobicContact CG2-CG2 3.97Å
482	L	92.7	Very high	79.6	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.5	166.8	-170.8	70.5	0	0	0	108.2	M439 I443 A444 W461 I468 Q563 W564 I582 I585	M439-L482 HydrophobicContact SD-CD1 4.3Å; I443-L482 HydrophobicContact CG2-CD1 3.4Å; I443-L482 HydrophobicContact CG2-CD2 4.45Å; I443-L482 HydrophobicContact CG2-CG 3.89Å; A444-L482 CarbonylContact O-C 3.54Å; W461-L482 HydrophobicContact CB-CD1 3.96Å; W461-L482 HydrophobicContact CD2-CB 3.91Å; W461-L482 HydrophobicContact CE3-CD2 4.43Å; W461-L482 HydrophobicContact CG-CB 3.93Å; W461-L482 HydrophobicContact CG-CD1 4.08Å; W461-L482 HydrophobicContact CZ2-CB 4.42Å; I468-L482 HydrophobicContact CD1-CD1 3.52Å; I468-L482 HydrophobicContact CD1-CD2 4.09Å; I468-L482 HydrophobicContact CD1-CG 4.47Å; I468-L482 HydrophobicContact CG2-CD2 4.12Å; L482-Q563 CarbonylContact O-C 3.58Å; L482-Q563 WeakPolarHBondContact O-CA 3.23Å; L482-W564 HydrophobicContact CB-CB 4.3Å; L482-W564 HydrophobicContact CB-CE3 4.12Å; L482-W564 HydrophobicContact CD2-CE3 3.89Å; L482-W564 HydrophobicContact CD2-CZ3 4.33Å; L482-W564 HydrophobicContact CG-CE3 4.09Å; L482-W564 PolarHBondContact N-O 2.77Å; L482-W564 PolarHBondContact O-N 3.3Å; L482-I582 HydrophobicContact CD2-CD1 3.99Å; L482-I585 HydrophobicContact CD2-CD1 4.24Å
483	S	90.9	Very high	78.1	Confident	18 Å²	18	40.1 Å²	40.1	13%	0.126	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.6	-176.2	-61	0	0	0	0	110.8	I443 A444 Y562 Q563	I443-S483 CarbonylContact C-O 3.49Å; I443-S483 VanDerWaalsContact CA-O 3.29Å; I443-S483 WeakPolarHBondContact CA-O 3.12Å; A444-S483 PolarHBondContact N-O 3.05Å; A444-S483 PolarHBondContact O-N 3.27Å; S483-Y562 CarbonylContact C-O 3.6Å; S483-Y562 WeakPolarHBondContact CA-O 3.31Å; S483-Q563 PolarHBondContact OG-NE2 3.05Å
484	L	93.8	Very high	76.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.5	170.1	172.7	62.9	0	0	0	110.1	Y431 F433 K442 I443 V486 I507 I561 Y562 W564 I585 V587	Y431-L484 HydrophobicContact CD2-CD1 4.48Å; F433-L484 HydrophobicContact CE2-CD1 3.92Å; F433-L484 HydrophobicContact CZ-CD1 4.46Å; K442-L484 HydrophobicContact CB-CD1 4.13Å; I443-L484 HydrophobicContact CD1-CD1 4.39Å; I443-L484 HydrophobicContact CG1-CB 4.4Å; I443-L484 HydrophobicContact CG1-CD1 3.72Å; L484-V486 HydrophobicContact CD2-CG2 4.34Å; L484-V486 HydrophobicContact CG-CG2 4.16Å; L484-I507 HydrophobicContact CD2-CD1 4.4Å; L484-I561 WeakPolarHBondContact O-CA 3.32Å; L484-Y562 PolarHBondContact N-O 3.09Å; L484-Y562 PolarHBondContact O-N 3.32Å; L484-W564 HydrophobicContact CB-CH2 3.91Å; L484-W564 HydrophobicContact CB-CZ3 3.67Å; L484-W564 HydrophobicContact CD2-CH2 4.15Å; L484-I585 HydrophobicContact CD2-CG2 4.04Å; L484-V587 HydrophobicContact CD2-CG2 3.63Å
485	R	91.8	Very high	74.8	Confident	136 Å²	136	48.5 Å²	48.5	51%	0.513	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	115.1	177.8	-175.2	-177.6	-70.6	-171.6	0.7	110.7	K442	K442-R485 PolarHBondContact O-N 2.92Å
486	V	92.1	Very high	73.1	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.9	171.6	-174.7	0	0	0	0	108.9	Y431 L484 Y489 R528 G559 T560 Y562 V587 T590	Y431-V486 HydrophobicContact CD2-CG2 4.38Å; Y431-V486 HydrophobicContact CE2-CG2 4.13Å; L484-V486 HydrophobicContact CD2-CG2 4.34Å; L484-V486 HydrophobicContact CG-CG2 4.16Å; V486-Y489 HydrophobicContact CG1-CD2 4.5Å; V486-Y489 HydrophobicContact CG1-CE2 3.94Å; V486-R528 PolarHBondContact O-NH2 2.86Å; V486-G559 WeakPolarHBondContact O-CA 3.47Å; V486-T560 PolarHBondContact N-O 3.23Å; V486-T560 PolarHBondContact O-N 3.28Å; V486-T560 VanDerWaalsContact O-O 3.05Å; V486-Y562 HydrophobicContact CB-CE2 4.44Å; V486-Y562 HydrophobicContact CG2-CD2 3.99Å; V486-Y562 HydrophobicContact CG2-CE2 3.92Å; V486-V587 HydrophobicContact CG2-CG1 4.5Å; V486-T590 HydrophobicContact CG1-CG2 3.84Å
487	L	89.3	Confident	71.4	Confident	92 Å²	92	55.2 Å²	55.2	48%	0.482	31%	0.305	S	S	.	.			trans	-79.7	-22.8	-179.5	-68.9	174.4	0	0	0	113.2	G559 V591 D592	L487-G559 VanDerWaalsContact C-CA 3.47Å; L487-G559 WeakPolarHBondContact O-CA 2.91Å; L487-G559 PolarHBondContact O-N 3.38Å; L487-V591 HydrophobicContact CB-CG2 4.18Å; L487-D592 HydrophobicContact CB-CB 4.01Å; L487-D592 WeakPolarHBondContact CB-OD2 3.09Å; L487-D592 HydrophobicContact CD1-CB 3.75Å; L487-D592 HydrophobicContact CG-CB 4.16Å; L487-D592 VanDerWaalsContact CG-OD2 3.23Å; L487-D592 WeakPolarHBondContact CG-OD2 3.4Å; L487-D592 PolarHBondContact N-OD1 3.04Å; L487-D592 PolarHBondContact N-OD2 2.84Å; L487-D592 VanDerWaalsContact N-OD2 3.13Å
488	G	88.3	Confident	70	Confident	5 Å²	5	57.2 Å²	57.2	5%	0.052	31%	0.313	C	S	.	.			trans	162.3	179.4	173.6	0	0	0	0	0	112.2	A557 T590 V591	G488-A557 WeakPolarHBondContact CA-O 3.36Å; G488-T590 WeakPolarHBondContact O-CA 3.46Å; G488-V591 PolarHBondContact O-N 3.43Å
489	Y	87.3	Confident	68.4	Low	7 Å²	7	61.5 Å²	61.5	3%	0.027	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-119.7	146.3	177.8	-61.9	-96.9	0	0	0	110.6	V486 S491 V554 A557 Y562 V587 T588 N589 T590	V486-Y489 HydrophobicContact CG1-CD2 4.5Å; V486-Y489 HydrophobicContact CG1-CE2 3.94Å; Y489-S491 PolarHBondContact O-N 2.8Å; Y489-V554 HydrophobicContact CD2-CG1 3.92Å; Y489-V554 HydrophobicContact CE1-CB 4.43Å; Y489-V554 HydrophobicContact CE1-CG1 4.34Å; Y489-V554 HydrophobicContact CE1-CG2 4.18Å; Y489-V554 HydrophobicContact CE2-CB 4.48Å; Y489-V554 HydrophobicContact CE2-CG1 3.59Å; Y489-V554 HydrophobicContact CE2-CG2 4.48Å; Y489-V554 HydrophobicContact CG-CG1 4.44Å; Y489-A557 PolarHBondContact N-O 3.26Å; Y489-Y562 WeakPolarHBondContact OH-CE2 3.49Å; Y489-Y562 PolarHBondContact OH-OH 3.01Å; Y489-V587 HydrophobicContact CE1-CG1 3.73Å; Y489-V587 WeakPolarHBondContact OH-CG1 3.27Å; Y489-T588 WeakPolarHBondContact CD1-O 3.43Å; Y489-T588 WeakPolarHBondContact CE1-O 3.48Å; Y489-N589 VanDerWaalsContact CA-O 3.29Å; Y489-N589 WeakPolarHBondContact CA-O 3.48Å; Y489-N589 WeakPolarHBondContact CB-O 3.38Å; Y489-N589 WeakPolarHBondContact CD1-O 3.4Å; Y489-T590 HydrophobicContact CD1-CG2 4.29Å; Y489-T590 HydrophobicContact CE1-CG2 3.99Å
490	K	78.8	Confident	66.7	Low	115 Å²	115	62.4 Å²	62.4	50%	0.5	35%	0.353	S	S	.	.			trans	-71.5	116.1	177.6	-177.9	-175	179.2	-176.9	0	109.2	N589	K490-N589 WeakPolarHBondContact CB-OD1 3.31Å; K490-N589 PolarHBondContact N-O 3.2Å; K490-N589 PolarHBondContact O-ND2 2.85Å
491	S	69.2	Low	65	Low	52 Å²	52	64.1 Å²	64.1	36%	0.364	37%	0.368	S	S	.	.			trans	-115.6	132.4	173.7	-176.6	0	0	0	0	110.4	Y489 S493	Y489-S491 PolarHBondContact O-N 2.8Å; S491-S493 VanDerWaalsContact C-N 3.34Å; S491-S493 PolarHBondContact OG-N 3.11Å
492	T	55.6	Low	63.7	Low	98 Å²	98	64.6 Å²	64.6	60%	0.601	37%	0.374	S	S	*	.			trans	-86.3	-9	172.3	53.1	0	0	0	0	112.6	L494 P612	T492-L494 PolarHBondContact O-N 2.83Å; T492-P612 HydrophobicContact CG2-CB 3.37Å
493	S	48.9	Very low	62.5	Low	39 Å²	39	65.7 Å²	65.7	27%	0.273	38%	0.383	S	S	.	.	S	Bend	trans	-73.4	99.4	171.4	-174.3	0	0	0	0	108.2	S491 A495	S491-S493 VanDerWaalsContact C-N 3.34Å; S491-S493 PolarHBondContact OG-N 3.11Å; S493-A495 PolarHBondContact O-N 3.01Å
494	L	35.1	Very low	61.9	Low	163 Å²	163	65.3 Å²	65.3	85%	0.853	38%	0.38	S	S	*	.			trans	-59.3	81.1	174.2	-174.1	86.9	0	0	0	109.8	T492 S496	T492-L494 PolarHBondContact O-N 2.83Å; L494-S496 PolarHBondContact O-N 3.33Å
495	A	35.8	Very low	61.5	Low	97 Å²	97	65.4 Å²	65.4	80%	0.802	38%	0.381	S	S	*	.	S	Bend	trans	41.9	18.4	166.4	0	0	0	0	0	117.6	S493 M497	S493-A495 PolarHBondContact O-N 3.01Å; A495-M497 VanDerWaalsContact C-N 3.29Å; A495-M497 PolarHBondContact O-N 3.47Å; A495-M497 VanDerWaalsContact O-N 3.08Å
496	S	30.3	Very low	61.3	Low	78 Å²	78	60.3 Å²	60.3	55%	0.545	37%	0.365	S	S	.	.			trans	-89.7	78.7	176.7	173.7	0	0	0	0	107.1	L494 M498	L494-S496 PolarHBondContact O-N 3.33Å; S496-M498 PolarHBondContact O-N 2.65Å
497	M	32.5	Very low	61.4	Low	150 Å²	150	60.3 Å²	60.3	74%	0.739	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	4.3	-4.2	163.3	-83.8	-172.2	-159.6	0	0	124	A495 L727	A495-M497 VanDerWaalsContact C-N 3.29Å; A495-M497 PolarHBondContact O-N 3.47Å; A495-M497 VanDerWaalsContact O-N 3.08Å; M497-L727 HydrophobicContact CG-CD2 4.44Å; M497-L727 HydrophobicContact SD-CD2 4.34Å
498	M	36	Very low	61.6	Low	95 Å²	95	57.2 Å²	57.2	47%	0.468	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.2	-7.9	-168.5	-68.3	-172.1	-165.8	0	0	119.2	S496 P728	S496-M498 PolarHBondContact O-N 2.65Å; M498-P728 HydrophobicContact CE-CG 4.44Å
499	T	38.7	Very low	62	Low	91 Å²	91	57.1 Å²	57.1	56%	0.558	35%	0.349	S	S	*	.			trans	-125.9	-5.6	-154.6	55.2	0	0	0	0	121	A501	T499-A501 PolarHBondContact O-N 3.02Å; T499-A501 VanDerWaalsContact O-N 3.15Å
500	S	42.8	Very low	62.5	Low	67 Å²	67	58.7 Å²	58.7	47%	0.469	36%	0.359	S	S	.	.			trans	-81.5	102.5	174.6	59.4	0	0	0	0	111.1	G502	S500-G502 PolarHBondContact O-N 3.02Å
501	A	49.1	Very low	63.4	Low	36 Å²	36	53.2 Å²	53.2	30%	0.298	34%	0.335	S	S	.	.			trans	-72.3	-6.8	-179.9	0	0	0	0	0	114.6	T499 G755	T499-A501 PolarHBondContact O-N 3.02Å; T499-A501 VanDerWaalsContact O-N 3.15Å; A501-G755 VanDerWaalsContact O-CA 3.24Å; A501-G755 WeakPolarHBondContact O-CA 3.29Å
502	G	58.5	Low	64.7	Low	17 Å²	17	51.7 Å²	51.7	18%	0.175	32%	0.323	C	S	.	.	S	Bend	trans	-108.2	161.3	-177	0	0	0	0	0	113.9	S500	S500-G502 PolarHBondContact O-N 3.02Å
503	A	68.3	Low	66.5	Low	24 Å²	24	47.1 Å²	47.1	20%	0.198	30%	0.295	C	S	.	.			trans	-62.1	133.9	172	0	0	0	0	0	111	G505 P553 V554 M555	A503-G505 VanDerWaalsContact C-N 3.3Å; A503-P553 HydrophobicContact CB-CB 3.69Å; A503-V554 CarbonylContact C-O 3.47Å; A503-V554 VanDerWaalsContact CA-O 3.24Å; A503-V554 WeakPolarHBondContact CA-O 3.47Å; A503-M555 HydrophobicContact CB-SD 4.27Å
504	V	77.9	Confident	68.6	Low	10 Å²	10	49 Å²	49	6%	0.061	31%	0.305	C	S	.	.	S	Bend	trans	-75	-24.1	175.2	-148.8	0	0	0	0	111.2	V554 M555 A557 N589	V504-V554 PolarHBondContact N-O 3.14Å; V504-M555 WeakPolarHBondContact CG2-O 3.44Å; V504-A557 HydrophobicContact CG1-CB 4.08Å; V504-N589 PolarHBondContact O-ND2 3.02Å
505	G	84.4	Confident	71.1	Confident	2 Å²	2	42 Å²	42	2%	0.021	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	-176.6	178.9	0	0	0	0	0	110.7	A503 V554	A503-G505 VanDerWaalsContact C-N 3.3Å; G505-V554 PolarHBondContact O-N 2.96Å
506	T	88.5	Confident	73.4	Confident	28 Å²	28	40.6 Å²	40.6	17%	0.172	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	131.6	175.7	-58.3	0	0	0	0	109.9	K551 V587 T588	T506-K551 HydrophobicContact CG2-CD 4.02Å; T506-K551 HydrophobicContact CG2-CG 3.44Å; T506-K551 VanDerWaalsContact CG2-CG 3.44Å; T506-V587 CarbonylContact O-C 3.58Å; T506-V587 WeakPolarHBondContact O-CA 3.28Å; T506-T588 PolarHBondContact N-OG1 2.95Å; T506-T588 PolarHBondContact O-N 2.91Å; T506-T588 PolarHBondContact O-OG1 3.14Å
507	I	93.5	Very high	75.7	Confident	0 Å²	0	38 Å²	38	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132	166.9	-178.7	157.4	0	0	0	108.7	L484 F523 Y552 V554 Y562 W564 N586 V587	L484-I507 HydrophobicContact CD2-CD1 4.4Å; I507-F523 HydrophobicContact CD1-CE2 4.15Å; I507-F523 HydrophobicContact CD1-CZ 3.89Å; I507-F523 HydrophobicContact CG1-CZ 4.22Å; I507-F523 HydrophobicContact CG2-CE1 4.27Å; I507-F523 HydrophobicContact CG2-CZ 3.88Å; I507-Y552 HydrophobicContact CG2-CD1 3.81Å; I507-Y552 HydrophobicContact CG2-CG 4.27Å; I507-Y552 PolarHBondContact N-O 3.19Å; I507-Y552 PolarHBondContact O-N 2.67Å; I507-V554 HydrophobicContact CG2-CG2 4.28Å; I507-Y562 HydrophobicContact CD1-CD1 4.12Å; I507-Y562 HydrophobicContact CD1-CD2 3.75Å; I507-Y562 HydrophobicContact CD1-CE2 4.25Å; I507-Y562 HydrophobicContact CD1-CG 3.68Å; I507-Y562 HydrophobicContact CG2-CE1 4.37Å; I507-W564 HydrophobicContact CD1-CH2 4.26Å; I507-W564 HydrophobicContact CD1-CZ2 4.18Å; I507-N586 CarbonylContact C-O 3.46Å; I507-N586 WeakPolarHBondContact CA-O 3.32Å; I507-V587 HydrophobicContact CB-CG2 4.27Å; I507-V587 HydrophobicContact CD1-CG2 3.85Å; I507-V587 HydrophobicContact CG1-CG2 3.9Å
508	S	94	Very high	78	Confident	28 Å²	28	37.5 Å²	37.5	20%	0.196	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	146.5	177.6	54.5	0	0	0	0	110.2	M550 N586	S508-M550 CarbonylContact C-O 3.47Å; S508-M550 WeakPolarHBondContact CA-O 3.38Å; S508-M550 WeakPolarHBondContact CB-O 3.23Å; S508-N586 PolarHBondContact N-O 2.8Å; S508-N586 PolarHBondContact O-N 2.86Å; S508-N586 PolarHBondContact OG-O 3.04Å
509	F	96.9	Very high	80.2	Confident	3 Å²	3	33 Å²	33	1%	0.013	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	152.6	179.3	59	-88.2	0	0	0	111.8	F511 F521 F523 W541 A549 M550 W564 I582 V584 I585	F509-F511 HydrophobicContact CD2-CB 4.31Å; F509-F511 AromaticContact CD2-CD1 3.69Å; F509-F511 HydrophobicContact CD2-CD1 3.69Å; F509-F511 HydrophobicContact CD2-CE1 4.46Å; F509-F511 HydrophobicContact CD2-CG 4.29Å; F509-F511 AromaticContact CE2-CD1 3.48Å; F509-F511 HydrophobicContact CE2-CD1 3.48Å; F509-F511 VanDerWaalsContact CE2-CD1 3.48Å; F509-F511 AromaticContact CE2-CE1 3.87Å; F509-F511 HydrophobicContact CE2-CE1 3.87Å; F509-F511 HydrophobicContact CE2-CG 4.16Å; F509-F521 HydrophobicContact CE2-CE1 4.17Å; F509-F523 AromaticContact CE1-CD1 3.94Å; F509-F523 HydrophobicContact CE1-CD1 3.94Å; F509-F523 AromaticContact CE1-CD2 3.88Å; F509-F523 HydrophobicContact CE1-CD2 3.88Å; F509-F523 HydrophobicContact CE1-CE1 4.07Å; F509-F523 AromaticContact CE1-CE2 3.99Å; F509-F523 HydrophobicContact CE1-CE2 3.99Å; F509-F523 AromaticContact CE1-CG 3.86Å; F509-F523 HydrophobicContact CE1-CG 3.86Å; F509-F523 HydrophobicContact CE1-CZ 4.11Å; F509-F523 HydrophobicContact CZ-CB 4.09Å; F509-F523 HydrophobicContact CZ-CD1 4.29Å; F509-F523 HydrophobicContact CZ-CD2 4.18Å; F509-F523 AromaticContact CZ-CG 3.95Å; F509-F523 HydrophobicContact CZ-CG 3.95Å; F509-W541 HydrophobicContact CE2-CH2 4.23Å; F509-W541 HydrophobicContact CE2-CZ3 4.48Å; F509-W541 AromaticContact CZ-CH2 3.74Å; F509-W541 HydrophobicContact CZ-CH2 3.74Å; F509-W541 HydrophobicContact CZ-CZ3 4.12Å; F509-A549 WeakPolarHBondContact O-CA 3.25Å; F509-M550 HydrophobicContact CD1-CB 4.48Å; F509-M550 HydrophobicContact CE1-CB 4.02Å; F509-M550 HydrophobicContact CE1-CG 4.02Å; F509-M550 HydrophobicContact CE2-CB 4.07Å; F509-M550 HydrophobicContact CZ-CB 3.8Å; F509-M550 HydrophobicContact CZ-CG 3.97Å; F509-M550 PolarHBondContact N-O 3.47Å; F509-M550 PolarHBondContact O-N 3.22Å; F509-W564 HydrophobicContact CD1-CZ2 4.06Å; F509-W564 AromaticContact CD1-NE1 3.51Å; F509-W564 AromaticContact CD2-NE1 3.62Å; F509-W564 AromaticContact CE1-NE1 3.38Å; F509-W564 AromaticContact CE2-CD1 3.88Å; F509-W564 AromaticContact CE2-NE1 3.49Å; F509-W564 HydrophobicContact CG-CZ2 4.37Å; F509-W564 AromaticContact CG-NE1 3.62Å; F509-W564 AromaticContact CZ-CD1 3.9Å; F509-W564 AromaticContact CZ-NE1 3.36Å; F509-I582 HydrophobicContact CB-CG2 4.3Å; F509-V584 CarbonylContact C-O 3.6Å; F509-V584 WeakPolarHBondContact CA-O 3.45Å; F509-V584 WeakPolarHBondContact CB-O 2.97Å; F509-I585 HydrophobicContact CB-CG1 3.85Å
510	V	97.5	Very high	82.3	Confident	39 Å²	39	29 Å²	29	24%	0.236	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.5	179.1	179.9	0	0	0	0	108.4	K547 Q548 A549 I582 Y583 V584	V510-K547 HydrophobicContact CG1-CD 4.18Å; V510-K547 HydrophobicContact CG1-CG 3.8Å; V510-Q548 CarbonylContact C-O 3.59Å; V510-Q548 VanDerWaalsContact CA-O 3.3Å; V510-Q548 WeakPolarHBondContact CA-O 3.45Å; V510-A549 HydrophobicContact CG2-CB 4.06Å; V510-I582 CarbonylContact O-C 3.48Å; V510-I582 WeakPolarHBondContact O-CA 3.37Å; V510-Y583 HydrophobicContact CG1-CD2 4.36Å; V510-Y583 PolarHBondContact O-N 3Å; V510-V584 HydrophobicContact CB-CB 4.19Å; V510-V584 HydrophobicContact CB-CG2 4.48Å; V510-V584 HydrophobicContact CG2-CB 4.1Å; V510-V584 HydrophobicContact CG2-CG2 4.42Å; V510-V584 PolarHBondContact N-O 2.74Å
511	F	97.4	Very high	84.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	162.7	-174.2	76.2	-79.1	0	0	0	112.8	F509 T513 F521 W541 L545 K547 Q548 M550 S581 I582	F509-F511 HydrophobicContact CD2-CB 4.31Å; F509-F511 AromaticContact CD2-CD1 3.69Å; F509-F511 HydrophobicContact CD2-CD1 3.69Å; F509-F511 HydrophobicContact CD2-CE1 4.46Å; F509-F511 HydrophobicContact CD2-CG 4.29Å; F509-F511 AromaticContact CE2-CD1 3.48Å; F509-F511 HydrophobicContact CE2-CD1 3.48Å; F509-F511 VanDerWaalsContact CE2-CD1 3.48Å; F509-F511 AromaticContact CE2-CE1 3.87Å; F509-F511 HydrophobicContact CE2-CE1 3.87Å; F509-F511 HydrophobicContact CE2-CG 4.16Å; F511-T513 HydrophobicContact CD2-CG2 4.38Å; F511-T513 HydrophobicContact CE2-CG2 4.45Å; F511-F521 HydrophobicContact CB-CE1 4.31Å; F511-F521 HydrophobicContact CD1-CE1 4.31Å; F511-F521 AromaticContact CD2-CD1 3.64Å; F511-F521 HydrophobicContact CD2-CD1 3.64Å; F511-F521 AromaticContact CD2-CE1 3.4Å; F511-F521 HydrophobicContact CD2-CE1 3.4Å; F511-F521 VanDerWaalsContact CD2-CE1 3.4Å; F511-F521 HydrophobicContact CD2-CZ 4.32Å; F511-F521 AromaticContact CE2-CD1 3.54Å; F511-F521 HydrophobicContact CE2-CD1 3.54Å; F511-F521 AromaticContact CE2-CE1 3.71Å; F511-F521 HydrophobicContact CE2-CE1 3.71Å; F511-F521 HydrophobicContact CG-CD1 4.41Å; F511-F521 AromaticContact CG-CE1 3.75Å; F511-F521 HydrophobicContact CG-CE1 3.75Å; F511-F521 HydrophobicContact CG-CZ 4.49Å; F511-F521 HydrophobicContact CZ-CD1 4.24Å; F511-F521 HydrophobicContact CZ-CE1 4.28Å; F511-W541 HydrophobicContact CE1-CD2 4.38Å; F511-W541 HydrophobicContact CE1-CH2 4.34Å; F511-W541 AromaticContact CE1-CZ2 3.99Å; F511-W541 HydrophobicContact CE1-CZ2 3.99Å; F511-W541 HydrophobicContact CE2-CD2 4.12Å; F511-W541 HydrophobicContact CE2-CE3 4.45Å; F511-W541 HydrophobicContact CE2-CG 4.16Å; F511-W541 AromaticContact CZ-CD1 3.88Å; F511-W541 AromaticContact CZ-CD2 3.54Å; F511-W541 HydrophobicContact CZ-CD2 3.54Å; F511-W541 AromaticContact CZ-CE2 3.47Å; F511-W541 VanDerWaalsContact CZ-CE2 3.47Å; F511-W541 HydrophobicContact CZ-CE3 4.06Å; F511-W541 AromaticContact CZ-CG 3.82Å; F511-W541 HydrophobicContact CZ-CG 3.82Å; F511-W541 HydrophobicContact CZ-CH2 4.4Å; F511-W541 AromaticContact CZ-CZ2 3.94Å; F511-W541 HydrophobicContact CZ-CZ2 3.94Å; F511-W541 HydrophobicContact CZ-CZ3 4.46Å; F511-W541 AromaticContact CZ-NE1 3.67Å; F511-L545 HydrophobicContact CE2-CD1 4.16Å; F511-K547 WeakPolarHBondContact O-CA 3.33Å; F511-Q548 HydrophobicContact CD1-CG 4.29Å; F511-Q548 HydrophobicContact CE1-CG 3.72Å; F511-Q548 HydrophobicContact CE2-CG 4.48Å; F511-Q548 HydrophobicContact CZ-CG 3.82Å; F511-Q548 PolarHBondContact N-O 3.1Å; F511-Q548 PolarHBondContact O-N 2.92Å; F511-M550 HydrophobicContact CE1-CB 4.41Å; F511-S581 CarbonylContact C-O 3.47Å; F511-S581 WeakPolarHBondContact CA-O 2.96Å; F511-S581 VanDerWaalsContact CB-O 3.23Å; F511-S581 WeakPolarHBondContact CB-O 3.32Å; F511-I582 HydrophobicContact CB-CG1 4.11Å
512	D	96.6	Very high	86.1	Confident	21 Å²	21	26.4 Å²	26.4	11%	0.112	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	162.5	165	62.8	22.4	0	0	0	110.8	K547 A580 S581 Y583	D512-K547 HydrophobicContact CB-CB 4.49Å; D512-A580 WeakPolarHBondContact O-CA 2.83Å; D512-S581 PolarHBondContact N-O 2.76Å; D512-S581 PolarHBondContact O-N 2Å; D512-S581 WeakPolarHBondContact OD1-CB 2.93Å; D512-S581 PolarHBondContact OD1-OG 2.77Å; D512-Y583 HydrophobicContact CB-CE2 4.36Å; D512-Y583 VanDerWaalsContact OD2-CE2 3.27Å; D512-Y583 WeakPolarHBondContact OD2-CE2 3.01Å; D512-Y583 PolarHBondContact OD2-OH 2.78Å
513	T	94.2	Very high	87.5	Confident	1 Å²	1	25.6 Å²	25.6	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.4	170.6	56	0	0	0	0	108.9	F511 F521 G543 T544 L545 F566 Q579 A580	F511-T513 HydrophobicContact CD2-CG2 4.38Å; F511-T513 HydrophobicContact CE2-CG2 4.45Å; T513-F521 HydrophobicContact CG2-CB 3.97Å; T513-F521 HydrophobicContact CG2-CD1 4.46Å; T513-F521 HydrophobicContact CG2-CG 4.2Å; T513-G543 WeakPolarHBondContact CB-O 3.08Å; T513-G543 PolarHBondContact OG1-O 3.37Å; T513-T544 CarbonylContact O-C 3.53Å; T513-T544 WeakPolarHBondContact O-CA 3.38Å; T513-T544 WeakPolarHBondContact O-CG2 3.46Å; T513-L545 PolarHBondContact N-O 3.26Å; T513-L545 PolarHBondContact O-N 2.81Å; T513-L545 VanDerWaalsContact OG1-CB 3.27Å; T513-L545 WeakPolarHBondContact OG1-CB 3.48Å; T513-L545 WeakPolarHBondContact OG1-CG 3.28Å; T513-L545 PolarHBondContact OG1-N 3.43Å; T513-F566 HydrophobicContact CG2-CE2 4.48Å; T513-Q579 WeakPolarHBondContact CA-O 3.07Å; T513-A580 HydrophobicContact CG2-CB 4.06Å
514	T	92.6	Very high	88.2	Confident	79 Å²	79	25.4 Å²	25.4	49%	0.485	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	119.3	174	-59	0	0	0	0	107.6	D578 Q579	T514-D578 CarbonylContact O-C 3.52Å; T514-D578 VanDerWaalsContact O-CA 3.31Å; T514-D578 WeakPolarHBondContact O-CA 3.3Å; T514-Q579 PolarHBondContact N-O 2.87Å; T514-Q579 PolarHBondContact O-N 3.09Å
515	C	88.6	Confident	88.3	Confident	16 Å²	16	26 Å²	26	11%	0.108	15%	0.153	C	C	.	.			trans	-141.4	143.9	-171.8	-54.5	0	0	0	0	111.5	G517 C519 T544 D578	C515-G517 VanDerWaalsContact CB-O 3.31Å; C515-G517 WeakPolarHBondContact CB-O 3.13Å; C515-C519 HydrophobicContact CB-CB 3.68Å; C515-C519 WeakPolarHBondContact CB-SG 3.25Å; C515-C519 WeakPolarHBondContact SG-CB 3.48Å; C515-C519 CovalentContact SG-SG 2Å; C515-C519 PolarHBondContact SG-SG 2.05Å; C515-T544 PolarHBondContact N-OG1 3.16Å; C515-T544 PolarHBondContact O-OG1 2.77Å; C515-D578 VanDerWaalsContact CA-OD1 3.22Å; C515-D578 WeakPolarHBondContact CA-OD1 3.19Å
516	V	83.4	Confident	87.9	Confident	68 Å²	68	27.4 Å²	27.4	41%	0.412	16%	0.161	S	C	.	.	S	Bend	trans	-75.3	-33.9	174.4	-176.3	0	0	0	0	110.6	I571 T577 D578	V516-I571 HydrophobicContact CB-CD1 3.81Å; V516-I571 HydrophobicContact CG1-CD1 3.5Å; V516-T577 WeakPolarHBondContact CG2-OG1 3.44Å; V516-D578 PolarHBondContact N-OD1 2.8Å
517	G	78.8	Confident	86.9	Confident	22 Å²	22	28.1 Å²	28.1	23%	0.227	16%	0.164	C	C	.	.	S	Bend	trans	-133.8	-148.3	174.9	0	0	0	0	0	112.7	C515 C519 S569	C515-G517 VanDerWaalsContact CB-O 3.31Å; C515-G517 WeakPolarHBondContact CB-O 3.13Å; G517-C519 PolarHBondContact O-N 2.8Å; G517-C519 VanDerWaalsContact O-N 3.11Å; G517-S569 WeakPolarHBondContact CA-OG 3.39Å; G517-S569 PolarHBondContact N-OG 3.33Å; G517-S569 PolarHBondContact O-OG 2.84Å
518	D	80.1	Confident	85.5	Confident	140 Å²	140	33.3 Å²	33.3	75%	0.749	18%	0.183	S	C	*	.			trans	-82.3	82.8	179.5	-68.8	-26.7	0	0	0	111.6	S569	D518-S569 PolarHBondContact N-OG 2.79Å
519	C	82.6	Confident	83.6	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.014	20%	0.203	C	C	.	.			trans	-78.4	159.3	165.5	67.1	0	0	0	0	111	C515 G517 N542 G543 F566 I567 S569	C515-C519 HydrophobicContact CB-CB 3.68Å; C515-C519 WeakPolarHBondContact CB-SG 3.25Å; C515-C519 WeakPolarHBondContact SG-CB 3.48Å; C515-C519 CovalentContact SG-SG 2Å; C515-C519 PolarHBondContact SG-SG 2.05Å; G517-C519 PolarHBondContact O-N 2.8Å; G517-C519 VanDerWaalsContact O-N 3.11Å; C519-N542 CarbonylContact O-C 3.55Å; C519-N542 VanDerWaalsContact O-CA 3.24Å; C519-N542 WeakPolarHBondContact O-CA 3.34Å; C519-G543 PolarHBondContact O-N 3.16Å; C519-G543 PolarHBondContact SG-O 3.4Å; C519-G543 VanDerWaalsContact SG-O 3.36Å; C519-F566 HydrophobicContact CB-CE2 3.8Å; C519-F566 HydrophobicContact CB-CZ 3.84Å; C519-I567 CarbonylContact C-O 3.55Å; C519-I567 WeakPolarHBondContact CA-O 3.44Å; C519-I567 WeakPolarHBondContact CB-O 3.4Å; C519-S569 PolarHBondContact N-OG 3.08Å
520	G	81.7	Confident	81.4	Confident	5 Å²	5	38.5 Å²	38.5	5%	0.052	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.1	177.6	0	0	0	0	0	112.2	F566 I567	G520-F566 CarbonylContact O-C 3.51Å; G520-F566 WeakPolarHBondContact O-CA 3.39Å; G520-F566 WeakPolarHBondContact O-CD2 3.36Å; G520-I567 PolarHBondContact N-O 2.81Å; G520-I567 PolarHBondContact O-N 2.89Å
521	F	87.9	Confident	78.7	Confident	1 Å²	1	41.9 Å²	41.9	0%	0.004	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	123.7	174.8	-176	-117.3	0	0	0	109.6	W461 F509 F511 T513 E540 W541 W564 V565 F566 A580 I582	W461-F521 AromaticContact CH2-CE2 3.73Å; W461-F521 HydrophobicContact CH2-CE2 3.73Å; W461-F521 HydrophobicContact CH2-CZ 4.4Å; W461-F521 AromaticContact CZ2-CE2 3.98Å; W461-F521 HydrophobicContact CZ2-CE2 3.98Å; F509-F521 HydrophobicContact CE2-CE1 4.17Å; F511-F521 HydrophobicContact CB-CE1 4.31Å; F511-F521 HydrophobicContact CD1-CE1 4.31Å; F511-F521 AromaticContact CD2-CD1 3.64Å; F511-F521 HydrophobicContact CD2-CD1 3.64Å; F511-F521 AromaticContact CD2-CE1 3.4Å; F511-F521 HydrophobicContact CD2-CE1 3.4Å; F511-F521 VanDerWaalsContact CD2-CE1 3.4Å; F511-F521 HydrophobicContact CD2-CZ 4.32Å; F511-F521 AromaticContact CE2-CD1 3.54Å; F511-F521 HydrophobicContact CE2-CD1 3.54Å; F511-F521 AromaticContact CE2-CE1 3.71Å; F511-F521 HydrophobicContact CE2-CE1 3.71Å; F511-F521 HydrophobicContact CG-CD1 4.41Å; F511-F521 AromaticContact CG-CE1 3.75Å; F511-F521 HydrophobicContact CG-CE1 3.75Å; F511-F521 HydrophobicContact CG-CZ 4.49Å; F511-F521 HydrophobicContact CZ-CD1 4.24Å; F511-F521 HydrophobicContact CZ-CE1 4.28Å; T513-F521 HydrophobicContact CG2-CB 3.97Å; T513-F521 HydrophobicContact CG2-CD1 4.46Å; T513-F521 HydrophobicContact CG2-CG 4.2Å; F521-E540 CarbonylContact O-C 3.57Å; F521-E540 WeakPolarHBondContact O-CA 3.27Å; F521-W541 HydrophobicContact CB-CB 4.25Å; F521-W541 HydrophobicContact CD1-CD2 4.3Å; F521-W541 AromaticContact CD1-CE3 3.56Å; F521-W541 HydrophobicContact CD1-CE3 3.56Å; F521-W541 HydrophobicContact CD1-CZ3 4.09Å; F521-W541 HydrophobicContact CE1-CE3 4.14Å; F521-W541 HydrophobicContact CE1-CZ3 4.23Å; F521-W541 HydrophobicContact CG-CE3 4.47Å; F521-W541 PolarHBondContact N-O 2.87Å; F521-W541 PolarHBondContact O-N 2.81Å; F521-W564 HydrophobicContact CE2-CB 3.91Å; F521-W564 HydrophobicContact CZ-CB 4Å; F521-W564 AromaticContact CZ-CD1 3.63Å; F521-W564 HydrophobicContact CZ-CG 4.15Å; F521-V565 CarbonylContact C-O 3.13Å; F521-V565 WeakPolarHBondContact CA-O 3.27Å; F521-F566 HydrophobicContact CB-CD2 4.22Å; F521-F566 HydrophobicContact CD2-CB 4.23Å; F521-F566 HydrophobicContact CD2-CD2 4.2Å; F521-A580 HydrophobicContact CD2-CB 3.9Å; F521-A580 HydrophobicContact CE2-CB 4.06Å; F521-I582 HydrophobicContact CZ-CD1 4.06Å; F521-I582 HydrophobicContact CZ-CG1 4.17Å
522	Y	85	Confident	76.3	Confident	48 Å²	48	47 Å²	47	19%	0.188	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.8	-170	-56.2	-102.4	0	0	0	110.4	E540 W564 V565 I567	Y522-E540 HydrophobicContact CD1-CB 3.9Å; Y522-E540 HydrophobicContact CD1-CG 3.43Å; Y522-E540 VanDerWaalsContact CD1-CG 3.43Å; Y522-E540 HydrophobicContact CE1-CB 4.2Å; Y522-E540 HydrophobicContact CE1-CG 3.28Å; Y522-E540 VanDerWaalsContact CE1-OE2 3.25Å; Y522-E540 WeakPolarHBondContact CE1-OE2 3.29Å; Y522-E540 HydrophobicContact CG-CG 4.19Å; Y522-W564 CarbonylContact O-C 3.58Å; Y522-W564 VanDerWaalsContact O-CA 3.28Å; Y522-W564 WeakPolarHBondContact O-CA 3.34Å; Y522-V565 PolarHBondContact N-O 2.71Å; Y522-V565 PolarHBondContact O-N 2.99Å; Y522-I567 HydrophobicContact CD2-CD1 4.23Å; Y522-I567 HydrophobicContact CD2-CG1 4.4Å; Y522-I567 HydrophobicContact CE2-CB 4.49Å; Y522-I567 HydrophobicContact CE2-CD1 3.56Å; Y522-I567 HydrophobicContact CE2-CG1 3.96Å
523	F	87.8	Confident	73.9	Confident	0 Å²	0	48 Å²	48	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	121.7	169.6	178.6	-125.8	0	0	0	109.6	I507 F509 L538 S539 W541 Y552 Y562 Q563 W564	I507-F523 HydrophobicContact CD1-CE2 4.15Å; I507-F523 HydrophobicContact CD1-CZ 3.89Å; I507-F523 HydrophobicContact CG1-CZ 4.22Å; I507-F523 HydrophobicContact CG2-CE1 4.27Å; I507-F523 HydrophobicContact CG2-CZ 3.88Å; F509-F523 AromaticContact CE1-CD1 3.94Å; F509-F523 HydrophobicContact CE1-CD1 3.94Å; F509-F523 AromaticContact CE1-CD2 3.88Å; F509-F523 HydrophobicContact CE1-CD2 3.88Å; F509-F523 HydrophobicContact CE1-CE1 4.07Å; F509-F523 AromaticContact CE1-CE2 3.99Å; F509-F523 HydrophobicContact CE1-CE2 3.99Å; F509-F523 AromaticContact CE1-CG 3.86Å; F509-F523 HydrophobicContact CE1-CG 3.86Å; F509-F523 HydrophobicContact CE1-CZ 4.11Å; F509-F523 HydrophobicContact CZ-CB 4.09Å; F509-F523 HydrophobicContact CZ-CD1 4.29Å; F509-F523 HydrophobicContact CZ-CD2 4.18Å; F509-F523 AromaticContact CZ-CG 3.95Å; F509-F523 HydrophobicContact CZ-CG 3.95Å; F523-L538 HydrophobicContact CD1-CB 3.67Å; F523-L538 HydrophobicContact CD1-CD1 3.83Å; F523-L538 HydrophobicContact CD1-CG 4.33Å; F523-L538 HydrophobicContact CE1-CB 4.08Å; F523-L538 HydrophobicContact CE1-CD1 3.38Å; F523-L538 HydrophobicContact CE1-CG 4.34Å; F523-L538 HydrophobicContact CZ-CD1 3.99Å; F523-L538 PolarHBondContact O-N 2.97Å; F523-S539 PolarHBondContact N-O 2.86Å; F523-S539 PolarHBondContact O-N 3.39Å; F523-W541 HydrophobicContact CB-CH2 4.17Å; F523-W541 HydrophobicContact CB-CZ3 3.79Å; F523-Y552 HydrophobicContact CE1-CG 4.39Å; F523-Y562 HydrophobicContact CE2-CD1 4.11Å; F523-Y562 HydrophobicContact CE2-CG 4.36Å; F523-Y562 AromaticContact CZ-CD1 3.74Å; F523-Y562 HydrophobicContact CZ-CD1 3.74Å; F523-Y562 HydrophobicContact CZ-CE1 4.46Å; F523-Y562 HydrophobicContact CZ-CG 4.32Å; F523-Q563 CarbonylContact C-O 3.54Å; F523-Q563 WeakPolarHBondContact CA-O 3.5Å; F523-W564 AromaticContact CD2-CD1 3.82Å; F523-W564 HydrophobicContact CD2-CD2 4.34Å; F523-W564 AromaticContact CD2-CE2 3.82Å; F523-W564 HydrophobicContact CD2-CG 4.35Å; F523-W564 HydrophobicContact CD2-CZ2 4.33Å; F523-W564 AromaticContact CD2-NE1 3.47Å; F523-W564 AromaticContact CE2-CE2 3.82Å; F523-W564 AromaticContact CE2-CZ2 3.86Å; F523-W564 HydrophobicContact CE2-CZ2 3.86Å; F523-W564 AromaticContact CE2-NE1 3.86Å
524	I	81.9	Confident	71.9	Confident	21 Å²	21	55.2 Å²	55.2	11%	0.108	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	141	-166.7	-55.4	179.1	0	0	0	109.7	V526 P535 T536 I537 Y562 Q563 V565	I524-V526 HydrophobicContact CG2-CG2 4.27Å; I524-P535 HydrophobicContact CG2-CB 3.59Å; I524-T536 WeakPolarHBondContact CA-O 3.15Å; I524-I537 HydrophobicContact CG1-CG1 4.3Å; I524-Y562 CarbonylContact O-C 3.57Å; I524-Y562 WeakPolarHBondContact O-CA 2.96Å; I524-Q563 HydrophobicContact CB-CB 4.3Å; I524-Q563 PolarHBondContact N-O 3.17Å; I524-Q563 PolarHBondContact O-N 2.79Å; I524-V565 HydrophobicContact CD1-CB 4.49Å; I524-V565 HydrophobicContact CD1-CG2 3.79Å
525	E	80.9	Confident	70.6	Confident	23 Å²	23	55 Å²	55	11%	0.107	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.7	168.6	167.7	170.5	-133.9	0	0	110.2	T536 L538 T560 Y562	E525-T536 PolarHBondContact N-O 2.94Å; E525-T536 PolarHBondContact O-N 2.88Å; E525-T536 PolarHBondContact O-OG1 2.78Å; E525-T536 VanDerWaalsContact O-OG1 3.07Å; E525-L538 HydrophobicContact CB-CD1 3.76Å; E525-L538 HydrophobicContact CB-CD2 4.14Å; E525-L538 HydrophobicContact CB-CG 3.91Å; E525-T560 HydrophobicContact CG-CG2 3.58Å; E525-T560 WeakPolarHBondContact OE1-CG2 3.02Å; E525-Y562 HydrophobicContact CB-CD1 4.44Å; E525-Y562 HydrophobicContact CB-CE1 4.42Å; E525-Y562 HydrophobicContact CG-CE1 4.5Å
526	V	75.4	Confident	69.5	Low	30 Å²	30	57.5 Å²	57.5	18%	0.182	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	108.5	173.4	-172.9	0	0	0	0	108.5	I524 P535 I561	I524-V526 HydrophobicContact CG2-CG2 4.27Å; V526-P535 HydrophobicContact CG2-CB 4.14Å; V526-I561 HydrophobicContact CB-CB 4.31Å; V526-I561 PolarHBondContact N-O 2.74Å; V526-I561 PolarHBondContact O-N 2.79Å
527	D	68.1	Low	68.7	Low	44 Å²	44	58.9 Å²	58.9	24%	0.235	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	126.7	177.3	-175.9	0.7	0	0	0	110.5	V529 S530	D527-V529 VanDerWaalsContact C-N 3.31Å; D527-V529 PolarHBondContact O-N 2.87Å; D527-V529 PolarHBondContact OD1-N 2.85Å; D527-S530 PolarHBondContact O-OG 2.83Å
528	R	63.8	Low	68.6	Low	109 Å²	109	58.9 Å²	58.9	41%	0.411	33%	0.332	S	S	.	.	S	Bend	trans	-72.8	-22.6	178.3	-62.2	-164.5	-155	-171.9	19.9	113.7	V486 G559	V486-R528 PolarHBondContact O-NH2 2.86Å; R528-G559 WeakPolarHBondContact CG-O 3.43Å
529	V	55.2	Low	68.4	Low	100 Å²	100	53.2 Å²	53.2	61%	0.606	30%	0.303	S	S	*	.	S	Bend	trans	-88.8	-27.1	-172.6	-174.8	0	0	0	0	111.6	D527 S531 N558	D527-V529 VanDerWaalsContact C-N 3.31Å; D527-V529 PolarHBondContact O-N 2.87Å; D527-V529 PolarHBondContact OD1-N 2.85Å; V529-S531 PolarHBondContact O-N 2.85Å; V529-N558 HydrophobicContact CG2-CB 4.34Å
530	S	50	Low	68.3	Low	39 Å²	39	54.9 Å²	54.9	27%	0.273	31%	0.311	S	S	.	.			trans	-64.2	120.2	177.5	73.8	0	0	0	0	110.4	D527 T532 G533	D527-S530 PolarHBondContact O-OG 2.83Å; S530-T532 PolarHBondContact O-N 3.24Å; S530-G533 PolarHBondContact O-N 2.78Å; S530-G533 PolarHBondContact OG-N 2.82Å
531	S	40.1	Very low	68.4	Low	111 Å²	111	56.5 Å²	56.5	78%	0.776	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-12.2	175.8	53.4	0	0	0	0	113.5	V529	V529-S531 PolarHBondContact O-N 2.85Å
532	T	46.8	Very low	68.3	Low	107 Å²	107	60 Å²	60	66%	0.656	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-14	177.8	56	0	0	0	0	113.9	S530 K534	S530-T532 PolarHBondContact O-N 3.24Å; T532-K534 PolarHBondContact O-N 3.35Å
533	G	47.5	Very low	68.2	Low	41 Å²	41	58.1 Å²	58.1	42%	0.423	33%	0.329	S	S	.	.			trans	51.7	23.5	-178.8	0	0	0	0	0	114.1	S530 P535	S530-G533 PolarHBondContact O-N 2.78Å; S530-G533 PolarHBondContact OG-N 2.82Å; G533-P535 WeakPolarHBondContact O-CD 3.3Å
534	K	52.5	Low	68.4	Low	153 Å²	153	62.1 Å²	62.1	67%	0.665	35%	0.354	S	S	*	.			trans	-76.5	121	-167.8	-172.7	178.4	177.6	-177.9	0	109.4	T532	T532-K534 PolarHBondContact O-N 3.35Å
535	P	65.1	Low	68.9	Low	75 Å²	75	62.9 Å²	62.9	49%	0.487	36%	0.358	S	S	.	.			trans	-66.7	136.9	176.3	26.4	-32.7	0	0	0	110.7	I524 V526 G533	I524-P535 HydrophobicContact CG2-CB 3.59Å; V526-P535 HydrophobicContact CG2-CB 4.14Å; G533-P535 WeakPolarHBondContact O-CD 3.3Å
536	T	65.4	Low	69.5	Low	68 Å²	68	66.6 Å²	66.6	42%	0.417	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117	173.3	40.7	0	0	0	0	110	I524 E525 L538	I524-T536 WeakPolarHBondContact CA-O 3.15Å; E525-T536 PolarHBondContact N-O 2.94Å; E525-T536 PolarHBondContact O-N 2.88Å; E525-T536 PolarHBondContact O-OG1 2.78Å; E525-T536 VanDerWaalsContact O-OG1 3.07Å; T536-L538 PolarHBondContact O-N 2.77Å
537	I	66.9	Low	70.4	Confident	97 Å²	97	71.1 Å²	71.1	50%	0.497	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	114.7	174.9	-58.2	171.7	0	0	0	107.9	I524 E540	I524-I537 HydrophobicContact CG1-CG1 4.3Å; I537-E540 HydrophobicContact CG2-CB 4.39Å
538	L	75.3	Confident	71.6	Confident	23 Å²	23	72.2 Å²	72.2	12%	0.12	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-38.1	177.9	-62.5	-175.9	0	0	0	111.3	F523 E525 T536 Y552 Y562	F523-L538 HydrophobicContact CD1-CB 3.67Å; F523-L538 HydrophobicContact CD1-CD1 3.83Å; F523-L538 HydrophobicContact CD1-CG 4.33Å; F523-L538 HydrophobicContact CE1-CB 4.08Å; F523-L538 HydrophobicContact CE1-CD1 3.38Å; F523-L538 HydrophobicContact CE1-CG 4.34Å; F523-L538 HydrophobicContact CZ-CD1 3.99Å; F523-L538 PolarHBondContact O-N 2.97Å; E525-L538 HydrophobicContact CB-CD1 3.76Å; E525-L538 HydrophobicContact CB-CD2 4.14Å; E525-L538 HydrophobicContact CB-CG 3.91Å; T536-L538 PolarHBondContact O-N 2.77Å; L538-Y552 HydrophobicContact CB-CE2 4.44Å; L538-Y552 HydrophobicContact CD1-CD1 3.88Å; L538-Y552 HydrophobicContact CD1-CD2 4.23Å; L538-Y552 HydrophobicContact CD1-CE1 3.69Å; L538-Y552 HydrophobicContact CD1-CE2 4.06Å; L538-Y552 HydrophobicContact CD1-CG 4.15Å; L538-Y552 HydrophobicContact CD2-CE1 4.33Å; L538-Y552 HydrophobicContact CD2-CE2 3.8Å; L538-Y552 WeakPolarHBondContact CD2-OH 3.37Å; L538-Y552 HydrophobicContact CG-CE2 4.32Å; L538-Y562 HydrophobicContact CD1-CE1 4.47Å
539	S	76.9	Confident	72.9	Confident	21 Å²	21	70.7 Å²	70.7	15%	0.147	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	155.1	179.8	-63.4	0	0	0	0	111.5	F523 M550	F523-S539 PolarHBondContact N-O 2.86Å; F523-S539 PolarHBondContact O-N 3.39Å; S539-M550 VanDerWaalsContact OG-CE 3.25Å; S539-M550 WeakPolarHBondContact OG-CE 3.47Å
540	E	79.6	Confident	74.5	Confident	36 Å²	36	67.6 Å²	67.6	17%	0.168	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	138.9	-178.4	177.7	-167.3	139	0	0	110.8	F521 Y522 I537 R790	F521-E540 CarbonylContact O-C 3.57Å; F521-E540 WeakPolarHBondContact O-CA 3.27Å; Y522-E540 HydrophobicContact CD1-CB 3.9Å; Y522-E540 HydrophobicContact CD1-CG 3.43Å; Y522-E540 VanDerWaalsContact CD1-CG 3.43Å; Y522-E540 HydrophobicContact CE1-CB 4.2Å; Y522-E540 HydrophobicContact CE1-CG 3.28Å; Y522-E540 VanDerWaalsContact CE1-OE2 3.25Å; Y522-E540 WeakPolarHBondContact CE1-OE2 3.29Å; Y522-E540 HydrophobicContact CG-CG 4.19Å; I537-E540 HydrophobicContact CG2-CB 4.39Å; E540-R790 VanDerWaalsContact CB-CZ 3.48Å; E540-R790 PolarHBondContact O-NE 2.87Å; E540-R790 PolarHBondContact O-NH2 2.62Å; E540-R790 IonicContact OE1-CZ 3.67Å; E540-R790 IonicContact OE1-NH1 3.81Å; E540-R790 PolarHBondContact OE1-NH1 2.86Å; E540-R790 IonicContact OE1-NH2 2.76Å; E540-R790 PolarHBondContact OE1-NH2 2.85Å; E540-R790 IonicContact OE2-CZ 3.58Å; E540-R790 IonicContact OE2-NH1 3.78Å; E540-R790 PolarHBondContact OE2-NH1 2.8Å; E540-R790 IonicContact OE2-NH2 3.69Å
541	W	84.8	Confident	76.3	Confident	39 Å²	39	72.6 Å²	72.6	15%	0.148	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137.1	-172.4	-70.2	-78.8	0	0	0	110.2	F509 F511 F521 F523 L545 M550	F509-W541 HydrophobicContact CE2-CH2 4.23Å; F509-W541 HydrophobicContact CE2-CZ3 4.48Å; F509-W541 AromaticContact CZ-CH2 3.74Å; F509-W541 HydrophobicContact CZ-CH2 3.74Å; F509-W541 HydrophobicContact CZ-CZ3 4.12Å; F511-W541 HydrophobicContact CE1-CD2 4.38Å; F511-W541 HydrophobicContact CE1-CH2 4.34Å; F511-W541 AromaticContact CE1-CZ2 3.99Å; F511-W541 HydrophobicContact CE1-CZ2 3.99Å; F511-W541 HydrophobicContact CE2-CD2 4.12Å; F511-W541 HydrophobicContact CE2-CE3 4.45Å; F511-W541 HydrophobicContact CE2-CG 4.16Å; F511-W541 AromaticContact CZ-CD1 3.88Å; F511-W541 AromaticContact CZ-CD2 3.54Å; F511-W541 HydrophobicContact CZ-CD2 3.54Å; F511-W541 AromaticContact CZ-CE2 3.47Å; F511-W541 VanDerWaalsContact CZ-CE2 3.47Å; F511-W541 HydrophobicContact CZ-CE3 4.06Å; F511-W541 AromaticContact CZ-CG 3.82Å; F511-W541 HydrophobicContact CZ-CG 3.82Å; F511-W541 HydrophobicContact CZ-CH2 4.4Å; F511-W541 AromaticContact CZ-CZ2 3.94Å; F511-W541 HydrophobicContact CZ-CZ2 3.94Å; F511-W541 HydrophobicContact CZ-CZ3 4.46Å; F511-W541 AromaticContact CZ-NE1 3.67Å; F521-W541 HydrophobicContact CB-CB 4.25Å; F521-W541 HydrophobicContact CD1-CD2 4.3Å; F521-W541 AromaticContact CD1-CE3 3.56Å; F521-W541 HydrophobicContact CD1-CE3 3.56Å; F521-W541 HydrophobicContact CD1-CZ3 4.09Å; F521-W541 HydrophobicContact CE1-CE3 4.14Å; F521-W541 HydrophobicContact CE1-CZ3 4.23Å; F521-W541 HydrophobicContact CG-CE3 4.47Å; F521-W541 PolarHBondContact N-O 2.87Å; F521-W541 PolarHBondContact O-N 2.81Å; F523-W541 HydrophobicContact CB-CH2 4.17Å; F523-W541 HydrophobicContact CB-CZ3 3.79Å; W541-L545 HydrophobicContact CB-CD1 3.46Å; W541-L545 VanDerWaalsContact CB-CD1 3.46Å; W541-L545 HydrophobicContact CG-CD1 3.77Å; W541-M550 HydrophobicContact CH2-CB 4.22Å; W541-M550 HydrophobicContact CH2-CG 3.92Å; W541-M550 HydrophobicContact CZ2-CB 4.06Å; W541-M550 HydrophobicContact CZ2-CG 3.92Å; W541-M550 HydrophobicContact CZ2-SD 4.16Å
542	N	85.1	Confident	78.5	Confident	74 Å²	74	69.1 Å²	69.1	40%	0.396	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142.4	-178.2	-64	-19.1	0	0	0	111	C519	C519-N542 CarbonylContact O-C 3.55Å; C519-N542 VanDerWaalsContact O-CA 3.24Å; C519-N542 WeakPolarHBondContact O-CA 3.34Å
543	G	84	Confident	80.1	Confident	9 Å²	9	65.2 Å²	65.2	9%	0.093	36%	0.359	C	S	.	.	S	Bend	trans	75.5	-163.1	175.9	0	0	0	0	0	114.8	T513 C519	T513-G543 WeakPolarHBondContact CB-O 3.08Å; T513-G543 PolarHBondContact OG1-O 3.37Å; C519-G543 PolarHBondContact O-N 3.16Å; C519-G543 PolarHBondContact SG-O 3.4Å; C519-G543 VanDerWaalsContact SG-O 3.36Å
544	T	91.5	Very high	81.8	Confident	84 Å²	84	63.3 Å²	63.3	52%	0.515	34%	0.339	S	S	.	.			trans	-77.3	124.5	179.4	-67.5	0	0	0	0	110.9	T513 C515	T513-T544 CarbonylContact O-C 3.53Å; T513-T544 WeakPolarHBondContact O-CA 3.38Å; T513-T544 WeakPolarHBondContact O-CG2 3.46Å; C515-T544 PolarHBondContact N-OG1 3.16Å; C515-T544 PolarHBondContact O-OG1 2.77Å
545	L	92	Very high	82.7	Confident	37 Å²	37	58.4 Å²	58.4	19%	0.194	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.4	-178.6	-64.5	171.9	0	0	0	111.6	F511 T513 W541	F511-L545 HydrophobicContact CE2-CD1 4.16Å; T513-L545 PolarHBondContact N-O 3.26Å; T513-L545 PolarHBondContact O-N 2.81Å; T513-L545 VanDerWaalsContact OG1-CB 3.27Å; T513-L545 WeakPolarHBondContact OG1-CB 3.48Å; T513-L545 WeakPolarHBondContact OG1-CG 3.28Å; T513-L545 PolarHBondContact OG1-N 3.43Å; W541-L545 HydrophobicContact CB-CD1 3.46Å; W541-L545 VanDerWaalsContact CB-CD1 3.46Å; W541-L545 HydrophobicContact CG-CD1 3.77Å
546	P	93.1	Very high	83.1	Confident	101 Å²	101	57.4 Å²	57.4	66%	0.656	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	161.3	171.7	31.5	-35.5	0	0	0	110.3	Q548	P546-Q548 PolarHBondContact O-N 3.14Å; P546-Q548 VanDerWaalsContact O-N 3.14Å
547	K	94.3	Very high	83.8	Confident	125 Å²	125	55.6 Å²	55.6	54%	0.543	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	119.7	177.6	-171.6	177.4	-61.3	-162.6	0	110.7	V510 F511 D512 Y583	V510-K547 HydrophobicContact CG1-CD 4.18Å; V510-K547 HydrophobicContact CG1-CG 3.8Å; F511-K547 WeakPolarHBondContact O-CA 3.33Å; D512-K547 HydrophobicContact CB-CB 4.49Å; K547-Y583 HydrophobicContact CD-CD2 4.25Å; K547-Y583 HydrophobicContact CD-CE2 4.23Å; K547-Y583 VanDerWaalsContact CE-CE2 3.47Å; K547-Y583 VanDerWaalsContact CE-CZ 3.46Å; K547-Y583 HydrophobicContact CG-CD2 4.37Å; K547-Y583 HydrophobicContact CG-CE2 4.31Å; K547-Y583 VanDerWaalsContact NZ-CE1 3.27Å
548	Q	93.1	Very high	84.5	Confident	68 Å²	68	54.8 Å²	54.8	32%	0.318	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	166.4	-177.3	67.7	-175.7	-64.3	0	0	111.6	V510 F511 P546	V510-Q548 CarbonylContact C-O 3.59Å; V510-Q548 VanDerWaalsContact CA-O 3.3Å; V510-Q548 WeakPolarHBondContact CA-O 3.45Å; F511-Q548 HydrophobicContact CD1-CG 4.29Å; F511-Q548 HydrophobicContact CE1-CG 3.72Å; F511-Q548 HydrophobicContact CE2-CG 4.48Å; F511-Q548 HydrophobicContact CZ-CG 3.82Å; F511-Q548 PolarHBondContact N-O 3.1Å; F511-Q548 PolarHBondContact O-N 2.92Å; P546-Q548 PolarHBondContact O-N 3.14Å; P546-Q548 VanDerWaalsContact O-N 3.14Å
549	A	91.7	Very high	85	Confident	77 Å²	77	54.3 Å²	54.3	64%	0.636	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	137.1	179.9	0	0	0	0	0	111	F509 V510	F509-A549 WeakPolarHBondContact O-CA 3.25Å; V510-A549 HydrophobicContact CG2-CB 4.06Å
550	M	87.9	Confident	85.4	Confident	34 Å²	34	53.4 Å²	53.4	17%	0.167	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.8	170.4	178.2	59	-176.3	0	0	109.6	S508 F509 F511 S539 W541	S508-M550 CarbonylContact C-O 3.47Å; S508-M550 WeakPolarHBondContact CA-O 3.38Å; S508-M550 WeakPolarHBondContact CB-O 3.23Å; F509-M550 HydrophobicContact CD1-CB 4.48Å; F509-M550 HydrophobicContact CE1-CB 4.02Å; F509-M550 HydrophobicContact CE1-CG 4.02Å; F509-M550 HydrophobicContact CE2-CB 4.07Å; F509-M550 HydrophobicContact CZ-CB 3.8Å; F509-M550 HydrophobicContact CZ-CG 3.97Å; F509-M550 PolarHBondContact N-O 3.47Å; F509-M550 PolarHBondContact O-N 3.22Å; F511-M550 HydrophobicContact CE1-CB 4.41Å; S539-M550 VanDerWaalsContact OG-CE 3.25Å; S539-M550 WeakPolarHBondContact OG-CE 3.47Å; W541-M550 HydrophobicContact CH2-CB 4.22Å; W541-M550 HydrophobicContact CH2-CG 3.92Å; W541-M550 HydrophobicContact CZ2-CB 4.06Å; W541-M550 HydrophobicContact CZ2-CG 3.92Å; W541-M550 HydrophobicContact CZ2-SD 4.16Å
551	K	88.1	Confident	85.8	Confident	144 Å²	144	53.5 Å²	53.5	63%	0.626	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135	126.7	176.9	-173.2	174.3	-177.8	177.8	0	110	T506	T506-K551 HydrophobicContact CG2-CD 4.02Å; T506-K551 HydrophobicContact CG2-CG 3.44Å; T506-K551 VanDerWaalsContact CG2-CG 3.44Å
552	Y	86.5	Confident	86.1	Confident	38 Å²	38	51.6 Å²	51.6	15%	0.149	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.3	-177.5	179.1	-97.2	0	0	0	111.5	I507 F523 L538	I507-Y552 HydrophobicContact CG2-CD1 3.81Å; I507-Y552 HydrophobicContact CG2-CG 4.27Å; I507-Y552 PolarHBondContact N-O 3.19Å; I507-Y552 PolarHBondContact O-N 2.67Å; F523-Y552 HydrophobicContact CE1-CG 4.39Å; L538-Y552 HydrophobicContact CB-CE2 4.44Å; L538-Y552 HydrophobicContact CD1-CD1 3.88Å; L538-Y552 HydrophobicContact CD1-CD2 4.23Å; L538-Y552 HydrophobicContact CD1-CE1 3.69Å; L538-Y552 HydrophobicContact CD1-CE2 4.06Å; L538-Y552 HydrophobicContact CD1-CG 4.15Å; L538-Y552 HydrophobicContact CD2-CE1 4.33Å; L538-Y552 HydrophobicContact CD2-CE2 3.8Å; L538-Y552 WeakPolarHBondContact CD2-OH 3.37Å; L538-Y552 HydrophobicContact CG-CE2 4.32Å
553	P	81.1	Confident	86.3	Confident	26 Å²	26	50.3 Å²	50.3	17%	0.169	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	126.6	176.7	29.5	-31.4	0	0	0	111.3	A503	A503-P553 HydrophobicContact CB-CB 3.69Å
554	V	82.6	Confident	86.7	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120	-179.9	-177.7	0	0	0	0	109.7	Y489 A503 V504 G505 I507 N556	Y489-V554 HydrophobicContact CD2-CG1 3.92Å; Y489-V554 HydrophobicContact CE1-CB 4.43Å; Y489-V554 HydrophobicContact CE1-CG1 4.34Å; Y489-V554 HydrophobicContact CE1-CG2 4.18Å; Y489-V554 HydrophobicContact CE2-CB 4.48Å; Y489-V554 HydrophobicContact CE2-CG1 3.59Å; Y489-V554 HydrophobicContact CE2-CG2 4.48Å; Y489-V554 HydrophobicContact CG-CG1 4.44Å; A503-V554 CarbonylContact C-O 3.47Å; A503-V554 VanDerWaalsContact CA-O 3.24Å; A503-V554 WeakPolarHBondContact CA-O 3.47Å; V504-V554 PolarHBondContact N-O 3.14Å; G505-V554 PolarHBondContact O-N 2.96Å; I507-V554 HydrophobicContact CG2-CG2 4.28Å; V554-N556 WeakPolarHBondContact CG1-O 3.33Å
555	M	71.5	Confident	86.5	Confident	49 Å²	49	46.5 Å²	46.5	24%	0.241	25%	0.253	C	S	.	.			trans	-95.9	-20.4	-174.4	-58.4	-57.1	-71.5	0	0	114	A503 V504	A503-M555 HydrophobicContact CB-SD 4.27Å; V504-M555 WeakPolarHBondContact CG2-O 3.44Å
556	N	74.1	Confident	86.4	Confident	54 Å²	54	44.8 Å²	44.8	29%	0.289	24%	0.244	S	C	.	.			trans	-110.6	141.5	-177.6	-61	-35.8	0	0	0	110.5	V554 N558 R754	V554-N556 WeakPolarHBondContact CG1-O 3.33Å; N556-N558 VanDerWaalsContact C-N 3.31Å; N556-R754 PolarHBondContact OD1-NH1 3.2Å
557	A	78.9	Confident	85.8	Confident	31 Å²	31	41.1 Å²	41.1	26%	0.256	22%	0.219	S	C	.	.			trans	-85.2	-4.7	179.1	0	0	0	0	0	114	G488 Y489 V504	G488-A557 WeakPolarHBondContact CA-O 3.36Å; Y489-A557 PolarHBondContact N-O 3.26Å; V504-A557 HydrophobicContact CG1-CB 4.08Å
558	N	82.6	Confident	85.2	Confident	80 Å²	80	35.4 Å²	35.4	43%	0.428	19%	0.193	S	C	.	.	S	Bend	trans	-73.9	166.5	-173.6	-66.1	-6.8	0	0	0	112.2	V529 N556 T560	V529-N558 HydrophobicContact CG2-CB 4.34Å; N556-N558 VanDerWaalsContact C-N 3.31Å; N558-T560 PolarHBondContact O-N 2.76Å
559	G	84.9	Confident	84.3	Confident	13 Å²	13	32.1 Å²	32.1	13%	0.134	18%	0.178	C	C	.	.			trans	-69.5	126.3	174.2	0	0	0	0	0	112.2	V486 L487 R528	V486-G559 WeakPolarHBondContact O-CA 3.47Å; L487-G559 VanDerWaalsContact C-CA 3.47Å; L487-G559 WeakPolarHBondContact O-CA 2.91Å; L487-G559 PolarHBondContact O-N 3.38Å; R528-G559 WeakPolarHBondContact CG-O 3.43Å
560	T	85.3	Confident	83.4	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.2	-172.8	-64	0	0	0	0	110.5	V486 E525 N558 Y562	V486-T560 PolarHBondContact N-O 3.23Å; V486-T560 PolarHBondContact O-N 3.28Å; V486-T560 VanDerWaalsContact O-O 3.05Å; E525-T560 HydrophobicContact CG-CG2 3.58Å; E525-T560 WeakPolarHBondContact OE1-CG2 3.02Å; N558-T560 PolarHBondContact O-N 2.76Å; T560-Y562 HydrophobicContact CG2-CD1 4.23Å; T560-Y562 HydrophobicContact CG2-CD2 4.33Å; T560-Y562 HydrophobicContact CG2-CE1 3.78Å; T560-Y562 HydrophobicContact CG2-CE2 3.88Å; T560-Y562 HydrophobicContact CG2-CG 4.48Å
561	I	88.1	Confident	82.3	Confident	38 Å²	38	34.9 Å²	34.9	20%	0.195	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	123.1	168.3	-57.8	173.2	0	0	0	108.1	L484 V526 Q563	L484-I561 WeakPolarHBondContact O-CA 3.32Å; V526-I561 HydrophobicContact CB-CB 4.31Å; V526-I561 PolarHBondContact N-O 2.74Å; V526-I561 PolarHBondContact O-N 2.79Å; I561-Q563 HydrophobicContact CG2-CG 4.03Å
562	Y	91.3	Very high	80.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.3	172.8	-61.8	-75.8	0	0	0	109.4	S483 L484 V486 Y489 I507 F523 I524 E525 L538 T560	S483-Y562 CarbonylContact C-O 3.6Å; S483-Y562 WeakPolarHBondContact CA-O 3.31Å; L484-Y562 PolarHBondContact N-O 3.09Å; L484-Y562 PolarHBondContact O-N 3.32Å; V486-Y562 HydrophobicContact CB-CE2 4.44Å; V486-Y562 HydrophobicContact CG2-CD2 3.99Å; V486-Y562 HydrophobicContact CG2-CE2 3.92Å; Y489-Y562 WeakPolarHBondContact OH-CE2 3.49Å; Y489-Y562 PolarHBondContact OH-OH 3.01Å; I507-Y562 HydrophobicContact CD1-CD1 4.12Å; I507-Y562 HydrophobicContact CD1-CD2 3.75Å; I507-Y562 HydrophobicContact CD1-CE2 4.25Å; I507-Y562 HydrophobicContact CD1-CG 3.68Å; I507-Y562 HydrophobicContact CG2-CE1 4.37Å; F523-Y562 HydrophobicContact CE2-CD1 4.11Å; F523-Y562 HydrophobicContact CE2-CG 4.36Å; F523-Y562 AromaticContact CZ-CD1 3.74Å; F523-Y562 HydrophobicContact CZ-CD1 3.74Å; F523-Y562 HydrophobicContact CZ-CE1 4.46Å; F523-Y562 HydrophobicContact CZ-CG 4.32Å; I524-Y562 CarbonylContact O-C 3.57Å; I524-Y562 WeakPolarHBondContact O-CA 2.96Å; E525-Y562 HydrophobicContact CB-CD1 4.44Å; E525-Y562 HydrophobicContact CB-CE1 4.42Å; E525-Y562 HydrophobicContact CG-CE1 4.5Å; L538-Y562 HydrophobicContact CD1-CE1 4.47Å; T560-Y562 HydrophobicContact CG2-CD1 4.23Å; T560-Y562 HydrophobicContact CG2-CD2 4.33Å; T560-Y562 HydrophobicContact CG2-CE1 3.78Å; T560-Y562 HydrophobicContact CG2-CE2 3.88Å; T560-Y562 HydrophobicContact CG2-CG 4.48Å
563	Q	89.9	Confident	79.6	Confident	47 Å²	47	39.7 Å²	39.7	22%	0.22	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	139	-178.9	-58.1	-172.9	-51.6	0	0	111.6	T481 L482 S483 F523 I524 I561 V565	T481-Q563 HydrophobicContact CG2-CB 4.13Å; T481-Q563 HydrophobicContact CG2-CG 4.36Å; L482-Q563 CarbonylContact O-C 3.58Å; L482-Q563 WeakPolarHBondContact O-CA 3.23Å; S483-Q563 PolarHBondContact OG-NE2 3.05Å; F523-Q563 CarbonylContact C-O 3.54Å; F523-Q563 WeakPolarHBondContact CA-O 3.5Å; I524-Q563 HydrophobicContact CB-CB 4.3Å; I524-Q563 PolarHBondContact N-O 3.17Å; I524-Q563 PolarHBondContact O-N 2.79Å; I561-Q563 HydrophobicContact CG2-CG 4.03Å; Q563-V565 HydrophobicContact CB-CG2 4.49Å
564	W	92.8	Very high	78.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117.1	166	-59.6	-93.7	0	0	0	108.2	W461 T481 L482 L484 I507 F509 F521 Y522 F523 I582 I585	W461-W564 HydrophobicContact CZ2-CB 4.34Å; T481-W564 CarbonylContact C-O 3.58Å; T481-W564 WeakPolarHBondContact CA-O 3.47Å; L482-W564 HydrophobicContact CB-CB 4.3Å; L482-W564 HydrophobicContact CB-CE3 4.12Å; L482-W564 HydrophobicContact CD2-CE3 3.89Å; L482-W564 HydrophobicContact CD2-CZ3 4.33Å; L482-W564 HydrophobicContact CG-CE3 4.09Å; L482-W564 PolarHBondContact N-O 2.77Å; L482-W564 PolarHBondContact O-N 3.3Å; L484-W564 HydrophobicContact CB-CH2 3.91Å; L484-W564 HydrophobicContact CB-CZ3 3.67Å; L484-W564 HydrophobicContact CD2-CH2 4.15Å; I507-W564 HydrophobicContact CD1-CH2 4.26Å; I507-W564 HydrophobicContact CD1-CZ2 4.18Å; F509-W564 HydrophobicContact CD1-CZ2 4.06Å; F509-W564 AromaticContact CD1-NE1 3.51Å; F509-W564 AromaticContact CD2-NE1 3.62Å; F509-W564 AromaticContact CE1-NE1 3.38Å; F509-W564 AromaticContact CE2-CD1 3.88Å; F509-W564 AromaticContact CE2-NE1 3.49Å; F509-W564 HydrophobicContact CG-CZ2 4.37Å; F509-W564 AromaticContact CG-NE1 3.62Å; F509-W564 AromaticContact CZ-CD1 3.9Å; F509-W564 AromaticContact CZ-NE1 3.36Å; F521-W564 HydrophobicContact CE2-CB 3.91Å; F521-W564 HydrophobicContact CZ-CB 4Å; F521-W564 AromaticContact CZ-CD1 3.63Å; F521-W564 HydrophobicContact CZ-CG 4.15Å; Y522-W564 CarbonylContact O-C 3.58Å; Y522-W564 VanDerWaalsContact O-CA 3.28Å; Y522-W564 WeakPolarHBondContact O-CA 3.34Å; F523-W564 AromaticContact CD2-CD1 3.82Å; F523-W564 HydrophobicContact CD2-CD2 4.34Å; F523-W564 AromaticContact CD2-CE2 3.82Å; F523-W564 HydrophobicContact CD2-CG 4.35Å; F523-W564 HydrophobicContact CD2-CZ2 4.33Å; F523-W564 AromaticContact CD2-NE1 3.47Å; F523-W564 AromaticContact CE2-CE2 3.82Å; F523-W564 AromaticContact CE2-CZ2 3.86Å; F523-W564 HydrophobicContact CE2-CZ2 3.86Å; F523-W564 AromaticContact CE2-NE1 3.86Å; W564-I582 HydrophobicContact CB-CD1 3.99Å; W564-I582 HydrophobicContact CD2-CD1 3.93Å; W564-I582 HydrophobicContact CG-CD1 3.63Å; W564-I585 HydrophobicContact CE3-CD1 4.36Å; W564-I585 HydrophobicContact CH2-CD1 3.51Å; W564-I585 HydrophobicContact CH2-CG1 4.13Å; W564-I585 HydrophobicContact CH2-CG2 4.01Å; W564-I585 HydrophobicContact CZ2-CD1 3.75Å; W564-I585 HydrophobicContact CZ2-CG1 4.02Å; W564-I585 HydrophobicContact CZ2-CG2 4.29Å; W564-I585 HydrophobicContact CZ3-CD1 3.84Å
565	V	87.2	Confident	78.3	Confident	13 Å²	13	42.5 Å²	42.5	8%	0.079	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.9	-178.7	-176.2	0	0	0	0	108.3	Y479 L480 T481 F521 Y522 I524 Q563 I567	Y479-V565 HydrophobicContact CD1-CG1 4.16Å; L480-V565 WeakPolarHBondContact O-CA 3.41Å; T481-V565 HydrophobicContact CG2-CG2 3.97Å; F521-V565 CarbonylContact C-O 3.13Å; F521-V565 WeakPolarHBondContact CA-O 3.27Å; Y522-V565 PolarHBondContact N-O 2.71Å; Y522-V565 PolarHBondContact O-N 2.99Å; I524-V565 HydrophobicContact CD1-CB 4.49Å; I524-V565 HydrophobicContact CD1-CG2 3.79Å; Q563-V565 HydrophobicContact CB-CG2 4.49Å; V565-I567 HydrophobicContact CG1-CG1 4.33Å
566	F	88.7	Confident	78.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.2	172.2	-175.9	-112.7	0	0	0	110.2	W461 T470 L480 T513 C519 G520 F521 R568 D578 A580	W461-F566 HydrophobicContact CZ2-CB 4.3Å; T470-F566 HydrophobicContact CG2-CB 3.64Å; T470-F566 HydrophobicContact CG2-CD1 3.72Å; T470-F566 HydrophobicContact CG2-CG 3.88Å; L480-F566 HydrophobicContact CB-CB 4.43Å; L480-F566 HydrophobicContact CD1-CD1 4.33Å; L480-F566 PolarHBondContact N-O 3.31Å; L480-F566 PolarHBondContact O-N 2.81Å; T513-F566 HydrophobicContact CG2-CE2 4.48Å; C519-F566 HydrophobicContact CB-CE2 3.8Å; C519-F566 HydrophobicContact CB-CZ 3.84Å; G520-F566 CarbonylContact O-C 3.51Å; G520-F566 WeakPolarHBondContact O-CA 3.39Å; G520-F566 WeakPolarHBondContact O-CD2 3.36Å; F521-F566 HydrophobicContact CB-CD2 4.22Å; F521-F566 HydrophobicContact CD2-CB 4.23Å; F521-F566 HydrophobicContact CD2-CD2 4.2Å; F566-R568 HydrophobicContact CD1-CG 4.28Å; F566-R568 HydrophobicContact CE1-CG 3.75Å; F566-D578 HydrophobicContact CE1-CB 4.15Å; F566-D578 HydrophobicContact CZ-CB 4.04Å; F566-A580 HydrophobicContact CB-CB 4.2Å; F566-A580 HydrophobicContact CD1-CB 4.44Å; F566-A580 HydrophobicContact CD2-CB 3.55Å; F566-A580 HydrophobicContact CE2-CB 3.93Å; F566-A580 HydrophobicContact CG-CB 3.82Å
567	I	82.1	Confident	78.6	Confident	25 Å²	25	41.1 Å²	41.1	13%	0.128	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	131.7	175.8	-52.4	178.8	0	0	0	106.6	Y479 C519 G520 Y522 V565	Y479-I567 HydrophobicContact CD1-CD1 3.9Å; Y479-I567 HydrophobicContact CD1-CG1 3.93Å; Y479-I567 HydrophobicContact CE1-CD1 3.45Å; Y479-I567 VanDerWaalsContact CE1-CD1 3.45Å; Y479-I567 HydrophobicContact CE1-CG1 3.96Å; C519-I567 CarbonylContact C-O 3.55Å; C519-I567 WeakPolarHBondContact CA-O 3.44Å; C519-I567 WeakPolarHBondContact CB-O 3.4Å; G520-I567 PolarHBondContact N-O 2.81Å; G520-I567 PolarHBondContact O-N 2.89Å; Y522-I567 HydrophobicContact CD2-CD1 4.23Å; Y522-I567 HydrophobicContact CD2-CG1 4.4Å; Y522-I567 HydrophobicContact CE2-CB 4.49Å; Y522-I567 HydrophobicContact CE2-CD1 3.56Å; Y522-I567 HydrophobicContact CE2-CG1 3.96Å; V565-I567 HydrophobicContact CG1-CG1 4.33Å
568	R	80.2	Confident	79	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.015	21%	0.214	C	C	.	.			trans	-79.7	163.4	-178.7	-69.5	-174.4	178.3	157.5	-5	112.9	S471 S473 R475 F566 V575 D578	S471-R568 PolarHBondContact O-NH2 3.31Å; S473-R568 VanDerWaalsContact C-NH1 3.29Å; S473-R568 PolarHBondContact O-NH1 3.06Å; R475-R568 PolarHBondContact O-NH1 2.82Å; F566-R568 HydrophobicContact CD1-CG 4.28Å; F566-R568 HydrophobicContact CE1-CG 3.75Å; R568-V575 HydrophobicContact CB-CG1 3.88Å; R568-D578 HydrophobicContact CB-CB 4.29Å; R568-D578 HydrophobicContact CG-CB 3.89Å
569	S	75.8	Confident	79.4	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.198	C	C	.	.			trans	-57.9	137.1	172.8	-50.2	0	0	0	0	110.8	G517 D518 C519 I571 V575 D578	G517-S569 WeakPolarHBondContact CA-OG 3.39Å; G517-S569 PolarHBondContact N-OG 3.33Å; G517-S569 PolarHBondContact O-OG 2.84Å; D518-S569 PolarHBondContact N-OG 2.79Å; C519-S569 PolarHBondContact N-OG 3.08Å; S569-I571 VanDerWaalsContact C-N 3.31Å; S569-I571 PolarHBondContact O-N 3.33Å; S569-V575 WeakPolarHBondContact O-CG1 3.17Å; S569-D578 WeakPolarHBondContact CB-OD2 3.34Å; S569-D578 PolarHBondContact N-OD2 2.87Å; S569-D578 PolarHBondContact OG-OD2 3.24Å
570	Q	71	Confident	79.9	Confident	105 Å²	105	36.2 Å²	36.2	49%	0.491	19%	0.192	S	C	.	.			trans	-96.2	56	177.1	-60.1	-62.3	-20.2	0	0	110.7	S476	S476-Q570 PolarHBondContact O-NE2 3.29Å; S476-Q570 PolarHBondContact OG-OE1 3.1Å; S476-Q570 VanDerWaalsContact OG-OE1 3.13Å
571	I	66.5	Low	80.4	Confident	63 Å²	63	36.2 Å²	36.2	32%	0.323	19%	0.192	S	C	.	.			trans	-106.8	160	179	61.9	174.5	0	0	0	111.1	V516 S569 E573 V575	V516-I571 HydrophobicContact CB-CD1 3.81Å; V516-I571 HydrophobicContact CG1-CD1 3.5Å; S569-I571 VanDerWaalsContact C-N 3.31Å; S569-I571 PolarHBondContact O-N 3.33Å; I571-E573 HydrophobicContact CD1-CB 4Å; I571-E573 HydrophobicContact CG1-CB 4.32Å; I571-E573 PolarHBondContact O-N 3.02Å; I571-V575 HydrophobicContact CG1-CG2 3.72Å
572	T	56.4	Low	80.8	Confident	154 Å²	154	34.4 Å²	34.4	95%	0.945	18%	0.183	S	C	*	.	S	Bend	trans	-76.4	-5.6	-180	50.1	0	0	0	0	114.1
573	E	60.8	Low	81.1	Confident	130 Å²	130	35.6 Å²	35.6	61%	0.607	19%	0.187	S	C	*	.	S	Bend	trans	-85.8	173.4	179.4	-61.8	-173.2	170.6	0	0	111.7	I571 V575	I571-E573 HydrophobicContact CD1-CB 4Å; I571-E573 HydrophobicContact CG1-CB 4.32Å; I571-E573 PolarHBondContact O-N 3.02Å; E573-V575 WeakPolarHBondContact O-CG2 3.37Å; E573-V575 PolarHBondContact O-N 2.8Å
574	D	66.3	Low	81.4	Confident	77 Å²	77	35.4 Å²	35.4	41%	0.412	19%	0.19	S	C	.	.			trans	-69.5	97.4	177.8	-167.8	-10.9	0	0	0	110.6	R474 S576	R474-D574 IonicContact NH1-OD2 2.77Å; D574-S576 VanDerWaalsContact CG-OG 3.25Å; D574-S576 PolarHBondContact O-N 2.87Å; D574-S576 WeakPolarHBondContact OD1-CB 3.25Å; D574-S576 PolarHBondContact OD1-N 2.95Å; D574-S576 PolarHBondContact OD1-OG 3.32Å; D574-S576 PolarHBondContact OD2-OG 2.81Å
575	V	69.9	Low	81.6	Confident	8 Å²	8	35.4 Å²	35.4	5%	0.048	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-81.3	8.8	180	-154.5	0	0	0	0	112.3	R568 S569 I571 E573 T577 D578	R568-V575 HydrophobicContact CB-CG1 3.88Å; S569-V575 WeakPolarHBondContact O-CG1 3.17Å; I571-V575 HydrophobicContact CG1-CG2 3.72Å; E573-V575 WeakPolarHBondContact O-CG2 3.37Å; E573-V575 PolarHBondContact O-N 2.8Å; V575-T577 PolarHBondContact O-N 2.81Å; V575-D578 HydrophobicContact CG1-CB 3.83Å; V575-D578 WeakPolarHBondContact CG1-OD2 3.4Å; V575-D578 WeakPolarHBondContact O-CB 3.46Å; V575-D578 PolarHBondContact O-N 2.88Å; V575-D578 VanDerWaalsContact O-N 3.12Å
576	S	72.2	Confident	82	Confident	5 Å²	5	37.2 Å²	37.2	4%	0.035	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-66.8	-16.3	-179.4	64	0	0	0	0	114.3	S473 D574	S473-S576 VanDerWaalsContact O-CA 3.29Å; S473-S576 WeakPolarHBondContact O-CA 3.45Å; S473-S576 VanDerWaalsContact O-CB 3.31Å; S473-S576 WeakPolarHBondContact O-CB 3.36Å; D574-S576 VanDerWaalsContact CG-OG 3.25Å; D574-S576 PolarHBondContact O-N 2.87Å; D574-S576 WeakPolarHBondContact OD1-CB 3.25Å; D574-S576 PolarHBondContact OD1-N 2.95Å; D574-S576 PolarHBondContact OD1-OG 3.32Å; D574-S576 PolarHBondContact OD2-OG 2.81Å
577	T	79.8	Confident	82.3	Confident	69 Å²	69	37.2 Å²	37.2	42%	0.423	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-82.9	-14.3	175.1	52.3	0	0	0	0	113.3	V516 V575 Q579	V516-T577 WeakPolarHBondContact CG2-OG1 3.44Å; V575-T577 PolarHBondContact O-N 2.81Å; T577-Q579 PolarHBondContact O-N 3.34Å
578	D	88	Confident	82.7	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.207	C	C	.	.			trans	-63.7	119.7	175.6	-80.5	20.7	0	0	0	110.5	T514 C515 V516 F566 R568 S569 V575	T514-D578 CarbonylContact O-C 3.52Å; T514-D578 VanDerWaalsContact O-CA 3.31Å; T514-D578 WeakPolarHBondContact O-CA 3.3Å; C515-D578 VanDerWaalsContact CA-OD1 3.22Å; C515-D578 WeakPolarHBondContact CA-OD1 3.19Å; V516-D578 PolarHBondContact N-OD1 2.8Å; F566-D578 HydrophobicContact CE1-CB 4.15Å; F566-D578 HydrophobicContact CZ-CB 4.04Å; R568-D578 HydrophobicContact CB-CB 4.29Å; R568-D578 HydrophobicContact CG-CB 3.89Å; S569-D578 WeakPolarHBondContact CB-OD2 3.34Å; S569-D578 PolarHBondContact N-OD2 2.87Å; S569-D578 PolarHBondContact OG-OD2 3.24Å; V575-D578 HydrophobicContact CG1-CB 3.83Å; V575-D578 WeakPolarHBondContact CG1-OD2 3.4Å; V575-D578 WeakPolarHBondContact O-CB 3.46Å; V575-D578 PolarHBondContact O-N 2.88Å; V575-D578 VanDerWaalsContact O-N 3.12Å
579	Q	90.6	Very high	83.1	Confident	21 Å²	21	39.1 Å²	39.1	10%	0.098	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	135.2	-172.1	-175.2	171.7	5.8	0	0	110.9	S469 T470 R472 T513 T514 T577	S469-Q579 PolarHBondContact OG-NE2 3.06Å; T470-Q579 WeakPolarHBondContact OG1-CA 3.49Å; R472-Q579 VanDerWaalsContact NH2-OE1 3.1Å; T513-Q579 WeakPolarHBondContact CA-O 3.07Å; T514-Q579 PolarHBondContact N-O 2.87Å; T514-Q579 PolarHBondContact O-N 3.09Å; T577-Q579 PolarHBondContact O-N 3.34Å
580	A	94.3	Very high	83.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.4	162.6	0	0	0	0	0	109.3	W461 S469 T470 D512 T513 F521 F566	W461-A580 HydrophobicContact CH2-CB 3.91Å; S469-A580 CarbonylContact C-O 3.52Å; S469-A580 VanDerWaalsContact CA-O 3.25Å; S469-A580 WeakPolarHBondContact CA-O 3.2Å; T470-A580 HydrophobicContact CG2-CB 3.95Å; T470-A580 PolarHBondContact N-O 2.78Å; T470-A580 PolarHBondContact OG1-N 2.77Å; T470-A580 PolarHBondContact OG1-O 3.29Å; D512-A580 WeakPolarHBondContact O-CA 2.83Å; T513-A580 HydrophobicContact CG2-CB 4.06Å; F521-A580 HydrophobicContact CD2-CB 3.9Å; F521-A580 HydrophobicContact CE2-CB 4.06Å; F566-A580 HydrophobicContact CB-CB 4.2Å; F566-A580 HydrophobicContact CD1-CB 4.44Å; F566-A580 HydrophobicContact CD2-CB 3.55Å; F566-A580 HydrophobicContact CE2-CB 3.93Å; F566-A580 HydrophobicContact CG-CB 3.82Å
581	S	95.8	Very high	84.7	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.014	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	137.8	174.4	-42.2	0	0	0	0	111	I468 S469 F511 D512	I468-S581 CarbonylContact O-C 3.46Å; I468-S581 WeakPolarHBondContact O-CA 3.15Å; S469-S581 VanDerWaalsContact OG-CB 3.22Å; S469-S581 WeakPolarHBondContact OG-CB 3.46Å; S469-S581 PolarHBondContact OG-OG 2.77Å; F511-S581 CarbonylContact C-O 3.47Å; F511-S581 WeakPolarHBondContact CA-O 2.96Å; F511-S581 VanDerWaalsContact CB-O 3.23Å; F511-S581 WeakPolarHBondContact CB-O 3.32Å; D512-S581 PolarHBondContact N-O 2.76Å; D512-S581 PolarHBondContact O-N 2Å; D512-S581 WeakPolarHBondContact OD1-CB 2.93Å; D512-S581 PolarHBondContact OD1-OG 2.77Å
582	I	97.5	Very high	85.9	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	124.7	172.9	-57.1	170.5	0	0	0	107.6	W461 R467 I468 L482 F509 V510 F511 F521 W564 I585	W461-I582 HydrophobicContact CH2-CD1 3.82Å; W461-I582 HydrophobicContact CH2-CG1 4.05Å; W461-I582 HydrophobicContact CZ3-CD1 3.88Å; W461-I582 HydrophobicContact CZ3-CG1 3.92Å; R467-I582 WeakPolarHBondContact CA-O 3.5Å; R467-I582 WeakPolarHBondContact CB-O 3.3Å; I468-I582 HydrophobicContact CG2-CB 3.84Å; I468-I582 PolarHBondContact N-O 2.91Å; I468-I582 PolarHBondContact O-N 2.93Å; L482-I582 HydrophobicContact CD2-CD1 3.99Å; F509-I582 HydrophobicContact CB-CG2 4.3Å; V510-I582 CarbonylContact O-C 3.48Å; V510-I582 WeakPolarHBondContact O-CA 3.37Å; F511-I582 HydrophobicContact CB-CG1 4.11Å; F521-I582 HydrophobicContact CZ-CD1 4.06Å; F521-I582 HydrophobicContact CZ-CG1 4.17Å; W564-I582 HydrophobicContact CB-CD1 3.99Å; W564-I582 HydrophobicContact CD2-CD1 3.93Å; W564-I582 HydrophobicContact CG-CD1 3.63Å; I582-I585 HydrophobicContact CD1-CD1 4.42Å; I582-I585 HydrophobicContact CG2-CD1 3.84Å; I582-I585 HydrophobicContact CG2-CG1 3.6Å
583	Y	96.5	Very high	87.4	Confident	24 Å²	24	28.3 Å²	28.3	9%	0.094	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-43.5	-178	-64.1	-90.5	0	0	0	111.3	W436 R467 V510 D512 K547	W436-Y583 PolarHBondContact NE1-O 3.36Å; R467-Y583 HydrophobicContact CB-CD1 3.73Å; R467-Y583 HydrophobicContact CB-CE1 3.89Å; R467-Y583 HydrophobicContact CB-CG 4.26Å; R467-Y583 HydrophobicContact CG-CE1 4.38Å; R467-Y583 PolarHBondContact NH1-OH 2.03Å; R467-Y583 VanDerWaalsContact NH1-OH 3.16Å; V510-Y583 HydrophobicContact CG1-CD2 4.36Å; V510-Y583 PolarHBondContact O-N 3Å; D512-Y583 HydrophobicContact CB-CE2 4.36Å; D512-Y583 VanDerWaalsContact OD2-CE2 3.27Å; D512-Y583 WeakPolarHBondContact OD2-CE2 3.01Å; D512-Y583 PolarHBondContact OD2-OH 2.78Å; K547-Y583 HydrophobicContact CD-CD2 4.25Å; K547-Y583 HydrophobicContact CD-CE2 4.23Å; K547-Y583 VanDerWaalsContact CE-CE2 3.47Å; K547-Y583 VanDerWaalsContact CE-CZ 3.46Å; K547-Y583 HydrophobicContact CG-CD2 4.37Å; K547-Y583 HydrophobicContact CG-CE2 4.31Å; K547-Y583 VanDerWaalsContact NZ-CE1 3.27Å
584	V	96.4	Very high	88.8	Confident	44 Å²	44	22.4 Å²	22.4	27%	0.267	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137	-175.6	-178.4	0	0	0	0	109.3	F433 V434 F509 V510	F433-V584 CarbonylContact O-C 3.6Å; F433-V584 VanDerWaalsContact O-CA 3.27Å; F433-V584 WeakPolarHBondContact O-CA 3.42Å; V434-V584 HydrophobicContact CG1-CG1 4.04Å; V434-V584 HydrophobicContact CG1-CG2 4.21Å; F509-V584 CarbonylContact C-O 3.6Å; F509-V584 WeakPolarHBondContact CA-O 3.45Å; F509-V584 WeakPolarHBondContact CB-O 2.97Å; V510-V584 HydrophobicContact CB-CB 4.19Å; V510-V584 HydrophobicContact CB-CG2 4.48Å; V510-V584 HydrophobicContact CG2-CB 4.1Å; V510-V584 HydrophobicContact CG2-CG2 4.42Å; V510-V584 PolarHBondContact N-O 2.74Å
585	I	97.1	Very high	90	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	120.2	164.1	-69	167.6	0	0	0	108.1	F433 W436 L482 L484 F509 W564 I582 V587	F433-I585 HydrophobicContact CB-CB 4.33Å; F433-I585 HydrophobicContact CD2-CB 4.04Å; F433-I585 HydrophobicContact CD2-CG2 4.04Å; F433-I585 PolarHBondContact N-O 2.91Å; F433-I585 PolarHBondContact O-N 3.32Å; W436-I585 HydrophobicContact CH2-CD1 3.74Å; W436-I585 HydrophobicContact CH2-CG1 4.45Å; W436-I585 HydrophobicContact CZ2-CB 4.44Å; W436-I585 HydrophobicContact CZ2-CD1 3.91Å; W436-I585 HydrophobicContact CZ2-CG1 4.19Å; L482-I585 HydrophobicContact CD2-CD1 4.24Å; L484-I585 HydrophobicContact CD2-CG2 4.04Å; F509-I585 HydrophobicContact CB-CG1 3.85Å; W564-I585 HydrophobicContact CE3-CD1 4.36Å; W564-I585 HydrophobicContact CH2-CD1 3.51Å; W564-I585 HydrophobicContact CH2-CG1 4.13Å; W564-I585 HydrophobicContact CH2-CG2 4.01Å; W564-I585 HydrophobicContact CZ2-CD1 3.75Å; W564-I585 HydrophobicContact CZ2-CG1 4.02Å; W564-I585 HydrophobicContact CZ2-CG2 4.29Å; W564-I585 HydrophobicContact CZ3-CD1 3.84Å; I582-I585 HydrophobicContact CD1-CD1 4.42Å; I582-I585 HydrophobicContact CG2-CD1 3.84Å; I582-I585 HydrophobicContact CG2-CG1 3.6Å; I585-V587 HydrophobicContact CG2-CG2 4.28Å
586	N	95.4	Very high	90.9	Very high	50 Å²	50	20.8 Å²	20.8	27%	0.267	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.6	178.1	-178	12.4	0	0	0	110.6	Y431 I507 S508	Y431-N586 CarbonylContact O-C 3.57Å; Y431-N586 VanDerWaalsContact O-CA 3.23Å; Y431-N586 WeakPolarHBondContact O-CA 3.44Å; Y431-N586 PolarHBondContact O-OD1 2.84Å; I507-N586 CarbonylContact C-O 3.46Å; I507-N586 WeakPolarHBondContact CA-O 3.32Å; S508-N586 PolarHBondContact N-O 2.8Å; S508-N586 PolarHBondContact O-N 2.86Å; S508-N586 PolarHBondContact OG-O 3.04Å
587	V	95.3	Very high	91.7	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121.2	176.2	-170.8	0	0	0	0	109.1	G430 Y431 L484 V486 Y489 T506 I507 I585 T590	G430-V587 CarbonylContact C-O 3.15Å; G430-V587 WeakPolarHBondContact CA-O 3.48Å; Y431-V587 HydrophobicContact CD2-CB 4.17Å; Y431-V587 HydrophobicContact CD2-CG2 4.48Å; Y431-V587 PolarHBondContact N-O 2.94Å; Y431-V587 PolarHBondContact O-N 2.78Å; L484-V587 HydrophobicContact CD2-CG2 3.63Å; V486-V587 HydrophobicContact CG2-CG1 4.5Å; Y489-V587 HydrophobicContact CE1-CG1 3.73Å; Y489-V587 WeakPolarHBondContact OH-CG1 3.27Å; T506-V587 CarbonylContact O-C 3.58Å; T506-V587 WeakPolarHBondContact O-CA 3.28Å; I507-V587 HydrophobicContact CB-CG2 4.27Å; I507-V587 HydrophobicContact CD1-CG2 3.85Å; I507-V587 HydrophobicContact CG1-CG2 3.9Å; I585-V587 HydrophobicContact CG2-CG2 4.28Å; V587-T590 HydrophobicContact CB-CG2 4.2Å; V587-T590 HydrophobicContact CG1-CG2 3.52Å
588	T	91.3	Very high	92.1	Very high	50 Å²	50	20.3 Å²	20.3	31%	0.307	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	154.3	-177.3	63.9	0	0	0	0	113	Y489 T506 T590	Y489-T588 WeakPolarHBondContact CD1-O 3.43Å; Y489-T588 WeakPolarHBondContact CE1-O 3.48Å; T506-T588 PolarHBondContact N-OG1 2.95Å; T506-T588 PolarHBondContact O-N 2.91Å; T506-T588 PolarHBondContact O-OG1 3.14Å; T588-T590 PolarHBondContact O-N 2.81Å
589	N	88	Confident	91.9	Very high	20 Å²	20	22.6 Å²	22.6	11%	0.107	14%	0.142	C	C	.	.	S	Bend	trans	59.6	39.7	171.1	-163.8	42.8	0	0	0	115.2	R429 Y489 K490 V504 L638	R429-N589 VanDerWaalsContact O-CA 3.27Å; R429-N589 WeakPolarHBondContact O-CA 3.16Å; R429-N589 PolarHBondContact O-N 3.38Å; Y489-N589 VanDerWaalsContact CA-O 3.29Å; Y489-N589 WeakPolarHBondContact CA-O 3.48Å; Y489-N589 WeakPolarHBondContact CB-O 3.38Å; Y489-N589 WeakPolarHBondContact CD1-O 3.4Å; K490-N589 WeakPolarHBondContact CB-OD1 3.31Å; K490-N589 PolarHBondContact N-O 3.2Å; K490-N589 PolarHBondContact O-ND2 2.85Å; V504-N589 PolarHBondContact O-ND2 3.02Å; N589-L638 HydrophobicContact CB-CD2 4.02Å; N589-L638 WeakPolarHBondContact ND2-CD2 3.37Å
590	T	92	Very high	91.4	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.006	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-84.5	154.5	178	63.5	0	0	0	0	111.8	R429 G430 Y431 V486 G488 Y489 V587 T588 G593	R429-T590 WeakPolarHBondContact CB-O 3.37Å; R429-T590 PolarHBondContact O-N 3.06Å; R429-T590 VanDerWaalsContact O-N 3.09Å; G430-T590 WeakPolarHBondContact CA-OG1 3.45Å; Y431-T590 HydrophobicContact CD2-CG2 3.97Å; Y431-T590 HydrophobicContact CE2-CG2 4.08Å; V486-T590 HydrophobicContact CG1-CG2 3.84Å; G488-T590 WeakPolarHBondContact O-CA 3.46Å; Y489-T590 HydrophobicContact CD1-CG2 4.29Å; Y489-T590 HydrophobicContact CE1-CG2 3.99Å; V587-T590 HydrophobicContact CB-CG2 4.2Å; V587-T590 HydrophobicContact CG1-CG2 3.52Å; T588-T590 PolarHBondContact O-N 2.81Å; T590-G593 VanDerWaalsContact OG1-CA 3.25Å; T590-G593 WeakPolarHBondContact OG1-CA 3.4Å; T590-G593 PolarHBondContact OG1-N 2.79Å
591	V	89.2	Confident	90.6	Very high	71 Å²	71	23.3 Å²	23.3	43%	0.43	15%	0.148	S	C	.	.	S	Bend	trans	-80.4	-27.6	175.6	-60.2	0	0	0	0	112.7	R429 L487 G488	R429-V591 PolarHBondContact NH1-O 3.04Å; L487-V591 HydrophobicContact CB-CG2 4.18Å; G488-V591 PolarHBondContact O-N 3.43Å
592	D	89.9	Confident	89.6	Confident	22 Å²	22	24 Å²	24	12%	0.118	15%	0.153	C	C	.	.	S	Bend	trans	-113.3	-1.2	-170	61.2	-40.4	0	0	0	114.4	Y431 L487	Y431-D592 PolarHBondContact OH-O 3.2Å; Y431-D592 PolarHBondContact OH-OD1 2.86Å; Y431-D592 PolarHBondContact OH-OD2 2.88Å; L487-D592 HydrophobicContact CB-CB 4.01Å; L487-D592 WeakPolarHBondContact CB-OD2 3.09Å; L487-D592 HydrophobicContact CD1-CB 3.75Å; L487-D592 HydrophobicContact CG-CB 4.16Å; L487-D592 VanDerWaalsContact CG-OD2 3.23Å; L487-D592 WeakPolarHBondContact CG-OD2 3.4Å; L487-D592 PolarHBondContact N-OD1 3.04Å; L487-D592 PolarHBondContact N-OD2 2.84Å; L487-D592 VanDerWaalsContact N-OD2 3.13Å
593	G	89.8	Confident	88.3	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.164	C	C	.	.			trans	-76.8	167	173.4	0	0	0	0	0	113.9	R429 G430 T590	R429-G593 PolarHBondContact NH1-O 3.41Å; G430-G593 CarbonylContact O-C 3.58Å; G430-G593 WeakPolarHBondContact O-CA 3.23Å; T590-G593 VanDerWaalsContact OG1-CA 3.25Å; T590-G593 WeakPolarHBondContact OG1-CA 3.4Å; T590-G593 PolarHBondContact OG1-N 2.79Å
594	G	90.3	Very high	86.9	Confident	7 Å²	7	27.5 Å²	27.5	7%	0.072	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	171.8	172.8	0	0	0	0	0	111.8	G389 R429 G430	G389-G594 WeakPolarHBondContact O-CA 3.38Å; R429-G594 CarbonylContact C-O 3.55Å; R429-G594 WeakPolarHBondContact CA-O 3.45Å; G430-G594 PolarHBondContact N-O 3.3Å; G430-G594 PolarHBondContact O-N 2.97Å; G430-G594 VanDerWaalsContact O-N 3.07Å
595	A	90.4	Very high	85.5	Confident	2 Å²	2	33.5 Å²	33.5	2%	0.017	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	120.9	-179.3	0	0	0	0	0	111.7	G389 Y405 S406 P427 D428 G597	G389-A595 VanDerWaalsContact CA-C 3.42Å; G389-A595 VanDerWaalsContact CA-O 3.3Å; G389-A595 WeakPolarHBondContact CA-O 3.49Å; Y405-A595 CarbonylContact C-O 3.57Å; Y405-A595 WeakPolarHBondContact CA-O 3.32Å; Y405-A595 VanDerWaalsContact CB-O 3.26Å; Y405-A595 WeakPolarHBondContact CB-O 3.2Å; S406-A595 PolarHBondContact N-O 3.01Å; P427-A595 HydrophobicContact CB-CB 3.46Å; P427-A595 VanDerWaalsContact CB-CB 3.46Å; D428-A595 WeakPolarHBondContact O-CA 3.3Å; D428-A595 WeakPolarHBondContact O-CB 3.49Å; A595-G597 VanDerWaalsContact C-N 3.28Å
596	A	89.1	Confident	84	Confident	49 Å²	49	41.8 Å²	41.8	41%	0.405	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	-27.2	175.3	0	0	0	0	0	112.2	P388 S406	P388-A596 HydrophobicContact CB-CB 3.64Å; S406-A596 WeakPolarHBondContact O-CA 3.4Å
597	G	88.8	Confident	82.7	Confident	27 Å²	27	42.8 Å²	42.8	28%	0.278	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	-178.6	-179.8	0	0	0	0	0	111.1	D428 A595	D428-G597 PolarHBondContact N-O 2.8Å; A595-G597 VanDerWaalsContact C-N 3.28Å
598	C	88.6	Confident	81.2	Confident	37 Å²	37	48.7 Å²	48.7	25%	0.25	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	141.4	175.9	-48	0	0	0	0	109.8	Y405 C421 T425 A426	Y405-C598 WeakPolarHBondContact CD1-SG 3.12Å; Y405-C598 VanDerWaalsContact CG-SG 3.58Å; C421-C598 WeakPolarHBondContact CA-SG 3.46Å; C421-C598 HydrophobicContact CB-CB 3.92Å; C421-C598 WeakPolarHBondContact CB-SG 3.22Å; C421-C598 WeakPolarHBondContact SG-CB 3.5Å; C421-C598 CovalentContact SG-SG 2.04Å; C421-C598 PolarHBondContact SG-SG 2.6Å; T425-C598 WeakPolarHBondContact OG1-CB 3.39Å; A426-C598 CarbonylContact O-C 3.56Å; A426-C598 WeakPolarHBondContact O-CA 3.13Å; A426-C598 WeakPolarHBondContact O-CB 3.14Å
599	I	83.9	Confident	80	Confident	48 Å²	48	52.5 Å²	52.5	25%	0.246	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	146.9	177.2	52.2	168.7	0	0	0	110.1	T425 A426 D428 E641	T425-I599 CarbonylContact C-O 3.57Å; T425-I599 WeakPolarHBondContact CA-O 3.01Å; T425-I599 WeakPolarHBondContact CB-O 3Å; A426-I599 PolarHBondContact N-O 3.29Å; A426-I599 WeakPolarHBondContact O-CG1 3.45Å; A426-I599 PolarHBondContact O-N 3.29Å; D428-I599 HydrophobicContact CB-CD1 4.44Å; D428-I599 HydrophobicContact CB-CG1 4.22Å; D428-I599 HydrophobicContact CB-CG2 3.87Å; I599-E641 WeakPolarHBondContact CB-OE1 3.41Å; I599-E641 WeakPolarHBondContact CG2-OE1 3.09Å
600	P	80	Confident	79.3	Confident	27 Å²	27	53.8 Å²	53.8	18%	0.175	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	139.6	178.1	25.4	-32.8	0	0	0	110.7	I619	P600-I619 HydrophobicContact CB-CG2 4.21Å; P600-I619 HydrophobicContact CG-CG2 4.24Å
601	C	78.1	Confident	78.4	Confident	8 Å²	8	57.8 Å²	57.8	5%	0.054	32%	0.321	C	S	.	.			trans	-140.9	147.5	175.9	77.9	0	0	0	0	110.7	N424 A426 M603 C610	N424-C601 PolarHBondContact O-N 3Å; A426-C601 HydrophobicContact CB-CB 4.11Å; C601-M603 PolarHBondContact O-N 2.79Å; C601-C610 HydrophobicContact CB-CB 3.57Å; C601-C610 WeakPolarHBondContact CB-SG 3.2Å; C601-C610 WeakPolarHBondContact SG-CB 3.03Å; C601-C610 CovalentContact SG-SG 2.03Å; C601-C610 PolarHBondContact SG-SG 2.87Å
602	P	73	Confident	77.5	Confident	17 Å²	17	58.2 Å²	58.2	11%	0.11	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-70.7	127.5	169.4	14.5	-6.7	0	0	0	108.8	C610 I611 G624 C626	P602-C610 CarbonylContact O-C 3.32Å; P602-C610 WeakPolarHBondContact O-CA 3Å; P602-I611 HydrophobicContact CB-CG1 4.04Å; P602-I611 HydrophobicContact CG-CG1 4.31Å; P602-I611 WeakPolarHBondContact CG-O 3.24Å; P602-I611 WeakPolarHBondContact O-CG1 3.47Å; P602-I611 PolarHBondContact O-N 2.79Å; P602-G624 WeakPolarHBondContact CA-O 3.43Å; P602-G624 WeakPolarHBondContact CB-O 3.36Å; P602-C626 WeakPolarHBondContact CG-SG 3.32Å
603	M	71.1	Confident	76.8	Confident	48 Å²	48	58.4 Å²	58.4	24%	0.236	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-101.6	135.5	-173.4	-157.5	171.3	-169.7	0	0	110.1	N424 C601 M605 L608	N424-M603 PolarHBondContact N-SD 2.91Å; N424-M603 PolarHBondContact OD1-SD 3.43Å; N424-M603 VanDerWaalsContact OD1-SD 3.42Å; C601-M603 PolarHBondContact O-N 2.79Å; M603-M605 PolarHBondContact O-N 2.97Å; M603-L608 HydrophobicContact CE-CB 3.55Å; M603-L608 HydrophobicContact CE-CD2 3.39Å; M603-L608 HydrophobicContact CE-CG 4.07Å; M603-L608 WeakPolarHBondContact CE-O 3.47Å; M603-L608 HydrophobicContact SD-CD2 4.13Å
604	N	67.5	Low	76.3	Confident	50 Å²	50	62 Å²	62	27%	0.267	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-69.1	123.6	164.7	-175.7	-5.1	0	0	0	108.6	E606 T607 L608 E609 I611	N604-E606 PolarHBondContact O-N 2.72Å; N604-E606 PolarHBondContact OD1-N 2.96Å; N604-T607 WeakPolarHBondContact CB-OG1 3.03Å; N604-T607 PolarHBondContact ND2-OG1 3.22Å; N604-L608 WeakPolarHBondContact O-CA 3.41Å; N604-L608 PolarHBondContact O-N 3.21Å; N604-E609 PolarHBondContact N-O 3.16Å; N604-I611 HydrophobicContact CB-CG2 4.02Å
605	M	67	Low	75.6	Confident	169 Å²	169	66.5 Å²	66.5	83%	0.833	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.2	179.5	-66.2	-62.7	-65.8	0	0	112.8	M603	M603-M605 PolarHBondContact O-N 2.97Å
606	E	66.4	Low	75	Confident	175 Å²	175	66.6 Å²	66.6	82%	0.818	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-48.2	-178.4	-65	-177.7	171.5	0	0	113.2	N604	N604-E606 PolarHBondContact O-N 2.72Å; N604-E606 PolarHBondContact OD1-N 2.96Å
607	T	67.7	Low	74.8	Confident	71 Å²	71	66.4 Å²	66.4	44%	0.436	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-9.2	-175.7	61.5	0	0	0	0	114	N604 E609	N604-T607 WeakPolarHBondContact CB-OG1 3.03Å; N604-T607 PolarHBondContact ND2-OG1 3.22Å; T607-E609 PolarHBondContact O-N 2.94Å
608	L	63.6	Low	74.5	Confident	123 Å²	123	66.5 Å²	66.5	64%	0.644	37%	0.366	S	S	*	.			trans	56.3	25	-172.6	-68.8	164	0	0	0	112.9	M603 N604	M603-L608 HydrophobicContact CE-CB 3.55Å; M603-L608 HydrophobicContact CE-CD2 3.39Å; M603-L608 HydrophobicContact CE-CG 4.07Å; M603-L608 WeakPolarHBondContact CE-O 3.47Å; M603-L608 HydrophobicContact SD-CD2 4.13Å; N604-L608 WeakPolarHBondContact O-CA 3.41Å; N604-L608 PolarHBondContact O-N 3.21Å
609	E	66.5	Low	74	Confident	131 Å²	131	65.6 Å²	65.6	61%	0.612	36%	0.359	S	S	*	.			trans	-106	147.2	179.2	-67	177.7	155.9	0	0	111.4	N604 T607 I611	N604-E609 PolarHBondContact N-O 3.16Å; T607-E609 PolarHBondContact O-N 2.94Å; E609-I611 PolarHBondContact O-N 2.98Å
610	C	72.8	Confident	73.9	Confident	47 Å²	47	67 Å²	67	32%	0.318	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-70.9	123.6	175.7	-61.4	0	0	0	0	111.1	A426 C601 P602	A426-C610 HydrophobicContact CB-CB 4.36Å; A426-C610 WeakPolarHBondContact CB-SG 3.41Å; C601-C610 HydrophobicContact CB-CB 3.57Å; C601-C610 WeakPolarHBondContact CB-SG 3.2Å; C601-C610 WeakPolarHBondContact SG-CB 3.03Å; C601-C610 CovalentContact SG-SG 2.03Å; C601-C610 PolarHBondContact SG-SG 2.87Å; P602-C610 CarbonylContact O-C 3.32Å; P602-C610 WeakPolarHBondContact O-CA 3Å
611	I	73.3	Confident	73.6	Confident	84 Å²	84	70.6 Å²	70.6	43%	0.431	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-92.3	145	173.2	56.3	168.3	0	0	0	110.8	P602 N604 E609	P602-I611 HydrophobicContact CB-CG1 4.04Å; P602-I611 HydrophobicContact CG-CG1 4.31Å; P602-I611 WeakPolarHBondContact CG-O 3.24Å; P602-I611 WeakPolarHBondContact O-CG1 3.47Å; P602-I611 PolarHBondContact O-N 2.79Å; N604-I611 HydrophobicContact CB-CG2 4.02Å; E609-I611 PolarHBondContact O-N 2.98Å
612	P	69.6	Low	73.1	Confident	81 Å²	81	77.9 Å²	77.9	53%	0.526	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-68.3	140.4	174.3	30.1	-35.1	0	0	0	110.8	T492	T492-P612 HydrophobicContact CG2-CB 3.37Å
613	C	76.3	Confident	73	Confident	26 Å²	26	80.2 Å²	80.2	18%	0.176	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-64.1	147.5	170.4	-76.9	0	0	0	0	111.1	H617 I619 C626	C613-H617 HydrophobicContact CB-CB 4.25Å; C613-I619 VanDerWaalsContact SG-CG1 3.6Å; C613-C626 WeakPolarHBondContact CA-SG 3.44Å; C613-C626 HydrophobicContact CB-CB 3.9Å; C613-C626 WeakPolarHBondContact CB-SG 3.22Å; C613-C626 WeakPolarHBondContact SG-CB 3.44Å; C613-C626 CovalentContact SG-SG 2.05Å; C613-C626 PolarHBondContact SG-SG 3.47Å
614	P	77.7	Confident	73	Confident	76 Å²	76	78.2 Å²	78.2	49%	0.494	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-55.6	151.3	168.8	-20	30.9	0	0	0	110.7	G616 H617	P614-G616 PolarHBondContact O-N 2.67Å; P614-H617 WeakPolarHBondContact O-CB 3.18Å; P614-H617 PolarHBondContact O-N 2.62Å
615	S	76.6	Confident	73.7	Confident	101 Å²	101	80.4 Å²	80.4	71%	0.706	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	138.7	175.4	-57.6	0	0	0	0	111.4	H617	S615-H617 VanDerWaalsContact C-N 3.3Å; S615-H617 PolarHBondContact O-N 3.37Å; S615-H617 PolarHBondContact O-ND1 2.87Å
616	G	77.3	Confident	74.4	Confident	4 Å²	4	74.3 Å²	74.3	4%	0.041	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	7.4	179	0	0	0	0	0	115.8	P614 C629 G658	P614-G616 PolarHBondContact O-N 2.67Å; G616-C629 PolarHBondContact O-N 2.65Å; G616-G658 VanDerWaalsContact CA-O 3.26Å; G616-G658 WeakPolarHBondContact CA-O 3.34Å
617	H	85.1	Confident	75.4	Confident	45 Å²	45	68.2 Å²	68.2	21%	0.208	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.3	175.9	-61.8	59.6	0	0	0	110.7	C613 P614 S615 C626 V627 Q628	C613-H617 HydrophobicContact CB-CB 4.25Å; P614-H617 WeakPolarHBondContact O-CB 3.18Å; P614-H617 PolarHBondContact O-N 2.62Å; S615-H617 VanDerWaalsContact C-N 3.3Å; S615-H617 PolarHBondContact O-N 3.37Å; S615-H617 PolarHBondContact O-ND1 2.87Å; H617-C626 HydrophobicContact CB-CB 4.06Å; H617-V627 CarbonylContact C-O 3.53Å; H617-V627 VanDerWaalsContact CA-O 3.23Å; H617-V627 WeakPolarHBondContact CA-O 3.35Å; H617-V627 WeakPolarHBondContact CB-O 3.29Å; H617-Q628 VanDerWaalsContact CD2-CA 3.44Å; H617-Q628 WeakPolarHBondContact CD2-CA 3.36Å; H617-Q628 PolarHBondContact CD2-N 2.86Å; H617-Q628 VanDerWaalsContact CD2-N 3.25Å
618	Y	82.5	Confident	76.3	Confident	29 Å²	29	69 Å²	69	11%	0.114	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	157.6	174	71.3	-87.7	0	0	0	110.4	C626 V627 S640 G642 C646	Y618-C626 WeakPolarHBondContact O-CA 3.49Å; Y618-V627 HydrophobicContact CD1-CB 4.47Å; Y618-V627 WeakPolarHBondContact CD1-O 3.39Å; Y618-V627 HydrophobicContact CE1-CB 3.93Å; Y618-V627 HydrophobicContact CE1-CG1 3.91Å; Y618-V627 HydrophobicContact CE2-CB 4.34Å; Y618-V627 PolarHBondContact N-O 3.05Å; Y618-V627 PolarHBondContact O-N 3.4Å; Y618-S640 WeakPolarHBondContact CA-O 3.39Å; Y618-S640 WeakPolarHBondContact CB-O 3.36Å; Y618-G642 VanDerWaalsContact CD2-O 3.3Å; Y618-G642 WeakPolarHBondContact CD2-O 3.37Å; Y618-C646 WeakPolarHBondContact CD1-SG 3.28Å
619	I	79.1	Confident	77.5	Confident	18 Å²	18	63.4 Å²	63.4	9%	0.092	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	123.5	178.2	-58.3	169.3	0	0	0	108.7	P600 C613 S640 G642	P600-I619 HydrophobicContact CB-CG2 4.21Å; P600-I619 HydrophobicContact CG-CG2 4.24Å; C613-I619 VanDerWaalsContact SG-CG1 3.6Å; I619-S640 PolarHBondContact N-O 2.97Å; I619-G642 PolarHBondContact O-N 3.41Å
620	Q	80.4	Confident	78.6	Confident	76 Å²	76	59.7 Å²	59.7	36%	0.355	34%	0.341	S	S	.	.			trans	-77.7	122.8	176.6	-173.6	175.3	28.5	0	0	111	I622 T623 G624 N625 V627	Q620-I622 PolarHBondContact O-N 2.79Å; Q620-T623 WeakPolarHBondContact CB-OG1 3.27Å; Q620-T623 PolarHBondContact O-N 2.78Å; Q620-T623 PolarHBondContact OE1-OG1 2.77Å; Q620-G624 PolarHBondContact O-N 3.49Å; Q620-N625 PolarHBondContact N-O 2.86Å; Q620-V627 HydrophobicContact CB-CG2 4.07Å
621	N	73.4	Confident	79.2	Confident	103 Å²	103	65.6 Å²	65.6	55%	0.551	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-31.2	-172.3	-70.8	15.1	0	0	0	115.9	G642	N621-G642 PolarHBondContact OD1-N 2.94Å
622	I	67.7	Low	79.6	Confident	161 Å²	161	65.1 Å²	65.1	83%	0.826	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-41.2	-171	-59.3	172.7	0	0	0	111.7	Q620	Q620-I622 PolarHBondContact O-N 2.79Å
623	T	71.2	Confident	80.5	Confident	66 Å²	66	61.9 Å²	61.9	41%	0.405	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-20.4	-172.2	53.7	0	0	0	0	112.8	Q620 N625	Q620-T623 WeakPolarHBondContact CB-OG1 3.27Å; Q620-T623 PolarHBondContact O-N 2.78Å; Q620-T623 PolarHBondContact OE1-OG1 2.77Å; T623-N625 PolarHBondContact O-N 3.1Å; T623-N625 PolarHBondContact OG1-N 2.92Å
624	G	71.7	Confident	80.7	Confident	6 Å²	6	61.1 Å²	61.1	6%	0.062	33%	0.333	C	S	.	.			trans	71.1	2.2	-171	0	0	0	0	0	113.9	P602 Q620	P602-G624 WeakPolarHBondContact CA-O 3.43Å; P602-G624 WeakPolarHBondContact CB-O 3.36Å; Q620-G624 PolarHBondContact O-N 3.49Å
625	N	81.1	Confident	80.7	Confident	97 Å²	97	59.6 Å²	59.6	52%	0.519	32%	0.32	S	S	.	.			trans	-76.5	144.9	-178.6	-69.2	-18.7	0	0	0	111.3	Q620 T623 V627	Q620-N625 PolarHBondContact N-O 2.86Å; T623-N625 PolarHBondContact O-N 3.1Å; T623-N625 PolarHBondContact OG1-N 2.92Å; N625-V627 PolarHBondContact O-N 3.39Å
626	C	83.1	Confident	80.3	Confident	40 Å²	40	61.1 Å²	61.1	27%	0.27	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	117.4	170	-58.6	0	0	0	0	109.9	P602 C613 H617 Y618	P602-C626 WeakPolarHBondContact CG-SG 3.32Å; C613-C626 WeakPolarHBondContact CA-SG 3.44Å; C613-C626 HydrophobicContact CB-CB 3.9Å; C613-C626 WeakPolarHBondContact CB-SG 3.22Å; C613-C626 WeakPolarHBondContact SG-CB 3.44Å; C613-C626 CovalentContact SG-SG 2.05Å; C613-C626 PolarHBondContact SG-SG 3.47Å; H617-C626 HydrophobicContact CB-CB 4.06Å; Y618-C626 WeakPolarHBondContact O-CA 3.49Å
627	V	86.5	Confident	79.7	Confident	47 Å²	47	61.8 Å²	61.8	29%	0.285	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.5	176.4	-179.1	0	0	0	0	108.6	H617 Y618 Q620 N625 C629	H617-V627 CarbonylContact C-O 3.53Å; H617-V627 VanDerWaalsContact CA-O 3.23Å; H617-V627 WeakPolarHBondContact CA-O 3.35Å; H617-V627 WeakPolarHBondContact CB-O 3.29Å; Y618-V627 HydrophobicContact CD1-CB 4.47Å; Y618-V627 WeakPolarHBondContact CD1-O 3.39Å; Y618-V627 HydrophobicContact CE1-CB 3.93Å; Y618-V627 HydrophobicContact CE1-CG1 3.91Å; Y618-V627 HydrophobicContact CE2-CB 4.34Å; Y618-V627 PolarHBondContact N-O 3.05Å; Y618-V627 PolarHBondContact O-N 3.4Å; Q620-V627 HydrophobicContact CB-CG2 4.07Å; N625-V627 PolarHBondContact O-N 3.39Å; V627-C629 PolarHBondContact O-N 2.85Å
628	Q	87.7	Confident	78.5	Confident	89 Å²	89	64.1 Å²	64.1	42%	0.416	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	137	176.7	-163.6	-179.2	4.6	0	0	109.9	H617 N656	H617-Q628 VanDerWaalsContact CD2-CA 3.44Å; H617-Q628 WeakPolarHBondContact CD2-CA 3.36Å; H617-Q628 PolarHBondContact CD2-N 2.86Å; H617-Q628 VanDerWaalsContact CD2-N 3.25Å; Q628-N656 PolarHBondContact NE2-O 3.04Å; Q628-N656 VanDerWaalsContact NE2-O 3.14Å
629	C	88	Confident	77.7	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.034	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-54.7	137.8	169.2	-82.1	0	0	0	0	109.5	G616 V627 T633 C646	G616-C629 PolarHBondContact O-N 2.65Å; V627-C629 PolarHBondContact O-N 2.85Å; C629-T633 WeakPolarHBondContact CB-OG1 3.28Å; C629-C646 WeakPolarHBondContact CA-SG 3.4Å; C629-C646 HydrophobicContact CB-CB 3.98Å; C629-C646 WeakPolarHBondContact CB-SG 3.45Å; C629-C646 WeakPolarHBondContact SG-CB 3.45Å; C629-C646 CovalentContact SG-SG 2.06Å; C629-C646 PolarHBondContact SG-SG 2.9Å
630	P	89.3	Confident	77.2	Confident	52 Å²	52	68.3 Å²	68.3	34%	0.338	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-59.5	159.3	-179.2	22.6	-31	0	0	0	111.4	D632 T633 M643	P630-D632 PolarHBondContact O-N 3.19Å; P630-T633 WeakPolarHBondContact CD-OG1 3.07Å; P630-T633 HydrophobicContact CG-CG2 3.93Å; P630-T633 WeakPolarHBondContact CG-OG1 3.47Å; P630-T633 WeakPolarHBondContact O-CB 3.29Å; P630-T633 PolarHBondContact O-N 2.81Å; P630-T633 VanDerWaalsContact O-N 3.1Å; P630-T633 PolarHBondContact O-OG1 2.86Å; P630-M643 HydrophobicContact CG-CE 4.32Å
631	K	85.5	Confident	76.7	Confident	172 Å²	172	67.5 Å²	67.5	75%	0.748	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	143.3	176.9	-71	-169.1	176.2	-173.8	0	111.6	T633	K631-T633 PolarHBondContact O-N 2.85Å
632	D	82.7	Confident	77	Confident	73 Å²	73	63.1 Å²	63.1	39%	0.39	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	21.6	-178.1	-52.9	-44.3	0	0	0	114.4	P630 C649 Q654 S655	P630-D632 PolarHBondContact O-N 3.19Å; D632-C649 WeakPolarHBondContact O-CB 3.45Å; D632-C649 PolarHBondContact O-N 2.82Å; D632-Q654 WeakPolarHBondContact OD1-CA 3.39Å; D632-Q654 VanDerWaalsContact OD1-CB 3.3Å; D632-Q654 WeakPolarHBondContact OD1-CB 3.27Å; D632-Q654 VanDerWaalsContact OD1-CG 3.31Å; D632-Q654 WeakPolarHBondContact OD1-CG 3.18Å; D632-S655 PolarHBondContact N-O 2.8Å; D632-S655 VanDerWaalsContact N-O 3.13Å
633	T	86.8	Confident	77.6	Confident	14 Å²	14	61.8 Å²	61.8	9%	0.086	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	155	170.6	74.3	0	0	0	0	110.1	C629 P630 K631 A647 K648 S655 G658	C629-T633 WeakPolarHBondContact CB-OG1 3.28Å; P630-T633 WeakPolarHBondContact CD-OG1 3.07Å; P630-T633 HydrophobicContact CG-CG2 3.93Å; P630-T633 WeakPolarHBondContact CG-OG1 3.47Å; P630-T633 WeakPolarHBondContact O-CB 3.29Å; P630-T633 PolarHBondContact O-N 2.81Å; P630-T633 VanDerWaalsContact O-N 3.1Å; P630-T633 PolarHBondContact O-OG1 2.86Å; K631-T633 PolarHBondContact O-N 2.85Å; T633-A647 CarbonylContact C-O 3.54Å; T633-A647 WeakPolarHBondContact CA-O 3.3Å; T633-A647 VanDerWaalsContact CB-O 3.31Å; T633-A647 WeakPolarHBondContact CB-O 3.25Å; T633-K648 HydrophobicContact CG2-CG 4.27Å; T633-S655 WeakPolarHBondContact O-CB 3.35Å; T633-G658 WeakPolarHBondContact O-CA 3.5Å
634	F	80.6	Confident	77.9	Confident	10 Å²	10	68.6 Å²	68.6	4%	0.044	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	158.7	179.5	73.8	-74.8	0	0	0	110.3	K636 C646 A647 G658 C661 M757	F634-K636 HydrophobicContact CE2-CB 4.37Å; F634-K636 PolarHBondContact O-N 2.7Å; F634-C646 CarbonylContact O-C 3.49Å; F634-C646 VanDerWaalsContact O-CA 3.32Å; F634-C646 WeakPolarHBondContact O-CA 3.36Å; F634-A647 HydrophobicContact CD1-CB 4.3Å; F634-A647 VanDerWaalsContact CD1-O 3.23Å; F634-A647 WeakPolarHBondContact CD1-O 3.31Å; F634-A647 HydrophobicContact CE1-CB 3.52Å; F634-A647 WeakPolarHBondContact CE1-O 3.43Å; F634-A647 HydrophobicContact CE2-CB 4.48Å; F634-A647 HydrophobicContact CZ-CB 3.58Å; F634-A647 PolarHBondContact N-O 3.44Å; F634-A647 PolarHBondContact O-N 3.13Å; F634-G658 CarbonylContact C-O 3.57Å; F634-G658 WeakPolarHBondContact CA-O 3.27Å; F634-C661 WeakPolarHBondContact CD1-SG 3.26Å; F634-M757 HydrophobicContact CD2-SD 4.08Å; F634-M757 HydrophobicContact CE1-CE 3.95Å; F634-M757 HydrophobicContact CE1-SD 3.79Å; F634-M757 HydrophobicContact CE2-CE 4.19Å; F634-M757 HydrophobicContact CE2-SD 3.16Å; F634-M757 WeakPolarHBondContact CE2-SD 3.19Å; F634-M757 HydrophobicContact CZ-CE 3.42Å; F634-M757 VanDerWaalsContact CZ-CE 3.42Å; F634-M757 HydrophobicContact CZ-SD 3.01Å; F634-M757 WeakPolarHBondContact CZ-SD 3.41Å
635	L	77.7	Confident	78.2	Confident	43 Å²	43	68.6 Å²	68.6	23%	0.225	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	114	177.9	-166.2	73.2	0	0	0	110.6	G637 A645 G658	L635-G637 PolarHBondContact O-N 3.37Å; L635-G637 VanDerWaalsContact O-N 3.16Å; L635-A645 HydrophobicContact CD1-CB 3.71Å; L635-G658 PolarHBondContact N-O 2.66Å
636	K	69.3	Low	78.4	Confident	133 Å²	133	64.9 Å²	64.9	58%	0.578	34%	0.339	S	S	*	.			trans	-66.8	-14.8	-175.9	-170.7	175.1	175.7	179.1	0	114	F634 A645 A647	F634-K636 HydrophobicContact CE2-CB 4.37Å; F634-K636 PolarHBondContact O-N 2.7Å; K636-A645 PolarHBondContact N-O 2.89Å; K636-A647 HydrophobicContact CB-CB 4.13Å; K636-A647 HydrophobicContact CD-CB 4.34Å
637	G	65.2	Low	78.3	Confident	19 Å²	19	64.2 Å²	64.2	20%	0.196	34%	0.337	C	S	.	.	S	Bend	trans	124.8	-157.9	-173.6	0	0	0	0	0	111.3	L635 P639	L635-G637 PolarHBondContact O-N 3.37Å; L635-G637 VanDerWaalsContact O-N 3.16Å; G637-P639 CarbonylContact O-C 3.58Å
638	L	60	Low	78.1	Confident	94 Å²	94	70.6 Å²	70.6	49%	0.492	36%	0.361	S	S	.	.	S	Bend	trans	-78.2	144.6	174.1	-76.7	94.7	0	0	0	111.8	N589	N589-L638 HydrophobicContact CB-CD2 4.02Å; N589-L638 WeakPolarHBondContact ND2-CD2 3.37Å
639	P	64.1	Low	77.9	Confident	98 Å²	98	67.4 Å²	67.4	64%	0.636	35%	0.348	S	S	*	.			cis	-75.3	145	-2.7	30.4	-33.6	0	0	0	112.5	G637 E641 A645	G637-P639 CarbonylContact O-C 3.58Å; P639-E641 VanDerWaalsContact C-N 3.29Å; P639-E641 PolarHBondContact O-N 2.91Å; P639-A645 WeakPolarHBondContact O-CB 3.2Å
640	S	68.9	Low	77.2	Confident	36 Å²	36	68.1 Å²	68.1	25%	0.252	36%	0.356	S	S	.	.			trans	-92.4	22.4	-177.7	55.3	0	0	0	0	113.4	Y618 I619	Y618-S640 WeakPolarHBondContact CA-O 3.39Å; Y618-S640 WeakPolarHBondContact CB-O 3.36Å; I619-S640 PolarHBondContact N-O 2.97Å
641	E	71.3	Confident	76.6	Confident	60 Å²	60	70.7 Å²	70.7	28%	0.28	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-97.2	129.8	-172.1	-70.9	173.6	-151.9	0	0	113.1	I599 P639	I599-E641 WeakPolarHBondContact CB-OE1 3.41Å; I599-E641 WeakPolarHBondContact CG2-OE1 3.09Å; P639-E641 VanDerWaalsContact C-N 3.29Å; P639-E641 PolarHBondContact O-N 2.91Å
642	G	77.7	Confident	75.9	Confident	11 Å²	11	65.4 Å²	65.4	11%	0.113	35%	0.346	C	S	.	.	S	Bend	trans	65.4	178.3	176	0	0	0	0	0	114.7	Y618 I619 N621 K644 A645	Y618-G642 VanDerWaalsContact CD2-O 3.3Å; Y618-G642 WeakPolarHBondContact CD2-O 3.37Å; I619-G642 PolarHBondContact O-N 3.41Å; N621-G642 PolarHBondContact OD1-N 2.94Å; G642-K644 PolarHBondContact O-N 3.24Å; G642-K644 VanDerWaalsContact O-N 3.11Å; G642-A645 WeakPolarHBondContact O-CB 3.44Å; G642-A645 PolarHBondContact O-N 2.88Å; G642-A645 VanDerWaalsContact O-N 3.1Å
643	M	80.8	Confident	75.7	Confident	132 Å²	132	62.3 Å²	62.3	65%	0.65	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-62.8	-20.4	-178.3	-167.9	179.6	-173.8	0	0	113.2	P630 A645 C646	P630-M643 HydrophobicContact CG-CE 4.32Å; M643-A645 PolarHBondContact O-N 2.78Å; M643-C646 PolarHBondContact O-N 2.76Å; M643-C646 VanDerWaalsContact O-N 3.15Å
644	K	78.6	Confident	75.4	Confident	209 Å²	209	66 Å²	66	91%	0.909	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-66.9	-19.5	176.6	-67.2	-175.6	-179.4	-179.3	0	113.1	G642 C646	G642-K644 PolarHBondContact O-N 3.24Å; G642-K644 VanDerWaalsContact O-N 3.11Å; K644-C646 VanDerWaalsContact C-N 3.26Å
645	A	77.8	Confident	75.5	Confident	7 Å²	7	65.6 Å²	65.6	6%	0.058	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-71.2	-22.3	173.9	0	0	0	0	0	112.7	L635 K636 P639 G642 M643	L635-A645 HydrophobicContact CD1-CB 3.71Å; K636-A645 PolarHBondContact N-O 2.89Å; P639-A645 WeakPolarHBondContact O-CB 3.2Å; G642-A645 WeakPolarHBondContact O-CB 3.44Å; G642-A645 PolarHBondContact O-N 2.88Å; G642-A645 VanDerWaalsContact O-N 3.1Å; M643-A645 PolarHBondContact O-N 2.78Å
646	C	84.8	Confident	75.7	Confident	18 Å²	18	69.4 Å²	69.4	12%	0.122	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	119.8	176.9	-55.1	0	0	0	0	110.4	Y618 C629 F634 M643 K644	Y618-C646 WeakPolarHBondContact CD1-SG 3.28Å; C629-C646 WeakPolarHBondContact CA-SG 3.4Å; C629-C646 HydrophobicContact CB-CB 3.98Å; C629-C646 WeakPolarHBondContact CB-SG 3.45Å; C629-C646 WeakPolarHBondContact SG-CB 3.45Å; C629-C646 CovalentContact SG-SG 2.06Å; C629-C646 PolarHBondContact SG-SG 2.9Å; F634-C646 CarbonylContact O-C 3.49Å; F634-C646 VanDerWaalsContact O-CA 3.32Å; F634-C646 WeakPolarHBondContact O-CA 3.36Å; M643-C646 PolarHBondContact O-N 2.76Å; M643-C646 VanDerWaalsContact O-N 3.15Å; K644-C646 VanDerWaalsContact C-N 3.26Å
647	A	81.3	Confident	76.1	Confident	26 Å²	26	66.8 Å²	66.8	22%	0.215	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	142.3	173	0	0	0	0	0	110.4	T633 F634 K636	T633-A647 CarbonylContact C-O 3.54Å; T633-A647 WeakPolarHBondContact CA-O 3.3Å; T633-A647 VanDerWaalsContact CB-O 3.31Å; T633-A647 WeakPolarHBondContact CB-O 3.25Å; F634-A647 HydrophobicContact CD1-CB 4.3Å; F634-A647 VanDerWaalsContact CD1-O 3.23Å; F634-A647 WeakPolarHBondContact CD1-O 3.31Å; F634-A647 HydrophobicContact CE1-CB 3.52Å; F634-A647 WeakPolarHBondContact CE1-O 3.43Å; F634-A647 HydrophobicContact CE2-CB 4.48Å; F634-A647 HydrophobicContact CZ-CB 3.58Å; F634-A647 PolarHBondContact N-O 3.44Å; F634-A647 PolarHBondContact O-N 3.13Å; K636-A647 HydrophobicContact CB-CB 4.13Å; K636-A647 HydrophobicContact CD-CB 4.34Å
648	K	83	Confident	76.8	Confident	182 Å²	182	66 Å²	66	79%	0.791	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	139.3	175.3	-70.9	-174.8	178.6	179.9	0	110.3	T633	T633-K648 HydrophobicContact CG2-CG 4.27Å
649	C	81.6	Confident	77.5	Confident	21 Å²	21	64.1 Å²	64.1	14%	0.142	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-63.9	150.8	170.3	-74.3	0	0	0	0	111.6	D632 T653 C661	D632-C649 WeakPolarHBondContact O-CB 3.45Å; D632-C649 PolarHBondContact O-N 2.82Å; C649-T653 WeakPolarHBondContact CB-OG1 3.41Å; C649-C661 WeakPolarHBondContact CA-SG 3.36Å; C649-C661 HydrophobicContact CB-CB 3.87Å; C649-C661 WeakPolarHBondContact CB-SG 3.5Å; C649-C661 WeakPolarHBondContact SG-CB 3.41Å; C649-C661 CovalentContact SG-SG 2.05Å; C649-C661 PolarHBondContact SG-SG 2.67Å
650	G	74.9	Confident	77.9	Confident	21 Å²	21	62.1 Å²	62.1	22%	0.216	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-61.5	169.2	175	0	0	0	0	0	114.1	N652 T653 V759	G650-N652 PolarHBondContact O-N 2.05Å; G650-T653 WeakPolarHBondContact CA-OG1 3.22Å; G650-T653 PolarHBondContact N-OG1 3.37Å; G650-T653 PolarHBondContact O-N 2.96Å; G650-T653 VanDerWaalsContact O-N 3.1Å; G650-T653 PolarHBondContact O-OG1 2.85Å; G650-V759 WeakPolarHBondContact CA-O 3.43Å
651	L	75.1	Confident	78.4	Confident	105 Å²	105	60.5 Å²	60.5	55%	0.55	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	130.2	172.9	-74.8	162.5	0	0	0	111.3	T653 I761	L651-T653 PolarHBondContact O-N 2.84Å; L651-I761 PolarHBondContact O-N 2.77Å
652	N	72.2	Confident	78.6	Confident	61 Å²	61	61 Å²	61	33%	0.326	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	22.5	-178.9	-49.5	-62.4	0	0	0	115.9	G650 L667 I761	G650-N652 PolarHBondContact O-N 2.05Å; N652-L667 HydrophobicContact CB-CD2 3.85Å; N652-I761 HydrophobicContact CB-CB 4.16Å; N652-I761 HydrophobicContact CB-CD1 4.38Å; N652-I761 PolarHBondContact ND2-O 3.01Å
653	T	79.1	Confident	78.5	Confident	8 Å²	8	61.1 Å²	61.1	5%	0.049	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151.2	170.6	61.4	0	0	0	0	110	C649 G650 L651 T662 Q758 I761	C649-T653 WeakPolarHBondContact CB-OG1 3.41Å; G650-T653 WeakPolarHBondContact CA-OG1 3.22Å; G650-T653 PolarHBondContact N-OG1 3.37Å; G650-T653 PolarHBondContact O-N 2.96Å; G650-T653 VanDerWaalsContact O-N 3.1Å; G650-T653 PolarHBondContact O-OG1 2.85Å; L651-T653 PolarHBondContact O-N 2.84Å; T653-T662 WeakPolarHBondContact CA-O 3.47Å; T653-Q758 HydrophobicContact CG2-CG 4.23Å; T653-I761 HydrophobicContact CG2-CD1 3.83Å; T653-I761 HydrophobicContact CG2-CG1 4.08Å
654	Q	80.4	Confident	78.2	Confident	92 Å²	92	57.7 Å²	57.7	43%	0.43	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	150.7	-177.3	-63.1	-178.7	5.9	0	0	109.9	D632 T662	D632-Q654 WeakPolarHBondContact OD1-CA 3.39Å; D632-Q654 VanDerWaalsContact OD1-CB 3.3Å; D632-Q654 WeakPolarHBondContact OD1-CB 3.27Å; D632-Q654 VanDerWaalsContact OD1-CG 3.31Å; D632-Q654 WeakPolarHBondContact OD1-CG 3.18Å; Q654-T662 PolarHBondContact N-O 2.66Å; Q654-T662 PolarHBondContact O-N 3.42Å; Q654-T662 PolarHBondContact O-OG1 3.25Å
655	S	82.5	Confident	78.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	27%	0.266	C	S	.	.			trans	-130.2	124.7	172.9	-168.8	0	0	0	0	109.1	D632 T633 D657 G658 E660	D632-S655 PolarHBondContact N-O 2.8Å; D632-S655 VanDerWaalsContact N-O 3.13Å; T633-S655 WeakPolarHBondContact O-CB 3.35Å; S655-D657 PolarHBondContact OG-OD1 3.15Å; S655-G658 WeakPolarHBondContact OG-CA 3.42Å; S655-G658 PolarHBondContact OG-N 3.23Å; S655-E660 WeakPolarHBondContact CB-O 3.25Å; S655-E660 PolarHBondContact OG-O 2.92Å
656	N	81	Confident	78.9	Confident	123 Å²	123	51.6 Å²	51.6	66%	0.658	28%	0.282	S	S	*	.	S	Bend	trans	-100.9	-32.8	-179.3	-73.3	-32.1	0	0	0	112.1	Q628	Q628-N656 PolarHBondContact NE2-O 3.04Å; Q628-N656 VanDerWaalsContact NE2-O 3.14Å
657	D	78.7	Confident	78.8	Confident	79 Å²	79	50.8 Å²	50.8	42%	0.422	28%	0.277	S	S	.	.	S	Bend	trans	-97.2	-11.7	-179.2	62.8	-18.2	0	0	0	112.4	S655 T659	S655-D657 PolarHBondContact OG-OD1 3.15Å; D657-T659 VanDerWaalsContact C-N 3.29Å; D657-T659 HydrophobicContact CB-CG2 4.32Å; D657-T659 PolarHBondContact OD1-N 2.9Å; D657-T659 PolarHBondContact OD1-OG1 2.8Å; D657-T659 WeakPolarHBondContact OD2-CG2 3.41Å; D657-T659 PolarHBondContact OD2-OG1 3.46Å
658	G	78.8	Confident	78.7	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.01	30%	0.298	C	S	.	.	S	Bend	trans	78.1	11.1	-179.3	0	0	0	0	0	113.8	G616 T633 F634 L635 S655	G616-G658 VanDerWaalsContact CA-O 3.26Å; G616-G658 WeakPolarHBondContact CA-O 3.34Å; T633-G658 WeakPolarHBondContact O-CA 3.5Å; F634-G658 CarbonylContact C-O 3.57Å; F634-G658 WeakPolarHBondContact CA-O 3.27Å; L635-G658 PolarHBondContact N-O 2.66Å; S655-G658 WeakPolarHBondContact OG-CA 3.42Å; S655-G658 PolarHBondContact OG-N 3.23Å
659	T	75	Confident	78.3	Confident	56 Å²	56	49 Å²	49	34%	0.344	27%	0.265	S	S	.	.	S	Bend	trans	-98.1	-42.7	-176.4	72.9	0	0	0	0	112.5	D657	D657-T659 VanDerWaalsContact C-N 3.29Å; D657-T659 HydrophobicContact CB-CG2 4.32Å; D657-T659 PolarHBondContact OD1-N 2.9Å; D657-T659 PolarHBondContact OD1-OG1 2.8Å; D657-T659 WeakPolarHBondContact OD2-CG2 3.41Å; D657-T659 PolarHBondContact OD2-OG1 3.46Å
660	E	73	Confident	77.6	Confident	55 Å²	55	54 Å²	54	26%	0.257	29%	0.29	S	S	.	.			trans	-146.1	149.3	-174.9	-173.3	165.7	-173.3	0	0	110.3	S655 K711	S655-E660 WeakPolarHBondContact CB-O 3.25Å; S655-E660 PolarHBondContact OG-O 2.92Å; E660-K711 IonicContact OE2-NZ 3.36Å
661	C	78.4	Confident	77.6	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.014	32%	0.321	C	S	.	.			trans	-88.9	121.1	171.7	-62.8	0	0	0	0	109.5	F634 C649	F634-C661 WeakPolarHBondContact CD1-SG 3.26Å; C649-C661 WeakPolarHBondContact CA-SG 3.36Å; C649-C661 HydrophobicContact CB-CB 3.87Å; C649-C661 WeakPolarHBondContact CB-SG 3.5Å; C649-C661 WeakPolarHBondContact SG-CB 3.41Å; C649-C661 CovalentContact SG-SG 2.05Å; C649-C661 PolarHBondContact SG-SG 2.67Å
662	T	76	Confident	77.8	Confident	70 Å²	70	57 Å²	57	43%	0.429	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	148.4	179.9	60.3	0	0	0	0	111	T653 Q654	T653-T662 WeakPolarHBondContact CA-O 3.47Å; Q654-T662 PolarHBondContact N-O 2.66Å; Q654-T662 PolarHBondContact O-N 3.42Å; Q654-T662 PolarHBondContact O-OG1 3.25Å
663	A	76.2	Confident	78.4	Confident	14 Å²	14	55.8 Å²	55.8	12%	0.116	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	128.2	172.1	0	0	0	0	0	110.1	C665 I761 F781	A663-C665 PolarHBondContact O-N 2.82Å; A663-I761 HydrophobicContact CB-CD1 3.54Å; A663-F781 HydrophobicContact CB-CE2 4.22Å; A663-F781 HydrophobicContact CB-CZ 4.34Å
664	S	73.8	Confident	78.8	Confident	61 Å²	61	56 Å²	56	43%	0.427	30%	0.3	S	S	.	.			trans	-66.7	-15.4	169.8	63.1	0	0	0	0	112.6	H666	S664-H666 PolarHBondContact O-N 3.22Å; S664-H666 PolarHBondContact OG-O 3.02Å
665	C	85.1	Confident	79.1	Confident	1 Å²	1	52 Å²	52	1%	0.007	28%	0.282	C	S	.	.	S	Bend	trans	57.5	8	-177.8	-70.5	0	0	0	0	116	A663 L676 R677 C707	A663-C665 PolarHBondContact O-N 2.82Å; C665-L676 HydrophobicContact CB-CB 4.02Å; C665-L676 PolarHBondContact O-N 3.45Å; C665-R677 HydrophobicContact CB-CG 4.22Å; C665-C707 HydrophobicContact CB-CB 3.71Å; C665-C707 WeakPolarHBondContact CB-SG 3.38Å; C665-C707 VanDerWaalsContact SG-CA 3.56Å; C665-C707 WeakPolarHBondContact SG-CB 3.29Å; C665-C707 CovalentContact SG-SG 1.98Å; C665-C707 PolarHBondContact SG-SG 3.21Å
666	H	85.4	Confident	79.4	Confident	86 Å²	86	51.9 Å²	51.9	40%	0.398	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	92.9	163	-179	-81.8	0	0	0	107.3	S664 T673 F674	S664-H666 PolarHBondContact O-N 3.22Å; S664-H666 PolarHBondContact OG-O 3.02Å; H666-T673 VanDerWaalsContact CE1-CG2 3.45Å; H666-T673 WeakPolarHBondContact CE1-CG2 3.17Å; H666-T673 WeakPolarHBondContact NE2-CG2 3.45Å; H666-F674 CarbonylContact C-O 3.59Å; H666-F674 WeakPolarHBondContact CA-O 3.5Å
667	L	83.5	Confident	79.8	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.1	-167.9	-53.5	172.5	0	0	0	109.8	N652 M669 T673 F674 L676 I761 I779 F781	N652-L667 HydrophobicContact CB-CD2 3.85Å; L667-M669 HydrophobicContact CB-CG 4.32Å; L667-M669 HydrophobicContact CB-SD 4.13Å; L667-M669 HydrophobicContact CD1-SD 4.35Å; L667-T673 CarbonylContact O-C 3.5Å; L667-T673 WeakPolarHBondContact O-CA 3.25Å; L667-F674 HydrophobicContact CB-CB 4.34Å; L667-F674 PolarHBondContact N-O 2.85Å; L667-F674 PolarHBondContact O-N 3.5Å; L667-L676 HydrophobicContact CD1-CD1 3.75Å; L667-I761 HydrophobicContact CD1-CG2 3.88Å; L667-I761 HydrophobicContact CD2-CD1 4.05Å; L667-I761 HydrophobicContact CD2-CG2 4.31Å; L667-I779 HydrophobicContact CD1-CD1 4.27Å; L667-I779 HydrophobicContact CD1-CG2 3.83Å; L667-F781 HydrophobicContact CD1-CE1 4.14Å
668	K	78.6	Confident	80.2	Confident	154 Å²	154	52 Å²	52	67%	0.67	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.6	110.3	171.9	-170.9	176.7	-178.4	178.7	0	108.9	A672	K668-A672 WeakPolarHBondContact CA-O 3.41Å
669	M	74.1	Confident	80.6	Confident	18 Å²	18	53 Å²	53	9%	0.089	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	124.8	-170.6	-58	175.2	78.9	0	0	109.6	L667 N671 A672 F674 I761 A763 I779	L667-M669 HydrophobicContact CB-CG 4.32Å; L667-M669 HydrophobicContact CB-SD 4.13Å; L667-M669 HydrophobicContact CD1-SD 4.35Å; M669-N671 PolarHBondContact O-N 3.25Å; M669-A672 PolarHBondContact N-O 2.82Å; M669-A672 PolarHBondContact O-N 3.28Å; M669-A672 VanDerWaalsContact O-O 3.11Å; M669-F674 HydrophobicContact CB-CE2 4.34Å; M669-I761 HydrophobicContact SD-CG2 4.49Å; M669-A763 HydrophobicContact CE-CB 3.6Å; M669-I779 HydrophobicContact SD-CG2 4.43Å
670	N	68.1	Low	81.2	Confident	125 Å²	125	57 Å²	57	67%	0.668	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.4	55.5	178.1	-64.8	-9.5	0	0	0	114.3	A672 F764	N670-A672 PolarHBondContact O-N 2.58Å; N670-F764 WeakPolarHBondContact ND2-CE2 3.09Å
671	N	74.5	Confident	81.9	Confident	161 Å²	161	55.1 Å²	55.1	86%	0.861	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	-6	-176	-65.8	-15.4	0	0	0	116.8	M669	M669-N671 PolarHBondContact O-N 3.25Å
672	A	79.3	Confident	82.3	Confident	27 Å²	27	60 Å²	60	22%	0.223	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	145.2	171.6	0	0	0	0	0	111.1	K668 M669 N670 F674 P840	K668-A672 WeakPolarHBondContact CA-O 3.41Å; M669-A672 PolarHBondContact N-O 2.82Å; M669-A672 PolarHBondContact O-N 3.28Å; M669-A672 VanDerWaalsContact O-O 3.11Å; N670-A672 PolarHBondContact O-N 2.58Å; A672-F674 HydrophobicContact CB-CD2 4.42Å; A672-F674 HydrophobicContact CB-CE2 3.62Å; A672-F674 HydrophobicContact CB-CZ 3.93Å; A672-P840 HydrophobicContact CB-CB 3.96Å
673	T	84.6	Confident	83	Confident	37 Å²	37	58 Å²	58	23%	0.227	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132.5	173	-52.3	0	0	0	0	108.4	H666 L667 P840 I841	H666-T673 VanDerWaalsContact CE1-CG2 3.45Å; H666-T673 WeakPolarHBondContact CE1-CG2 3.17Å; H666-T673 WeakPolarHBondContact NE2-CG2 3.45Å; L667-T673 CarbonylContact O-C 3.5Å; L667-T673 WeakPolarHBondContact O-CA 3.25Å; T673-P840 WeakPolarHBondContact O-CA 3.04Å; T673-I841 HydrophobicContact CG2-CD1 4.04Å; T673-I841 WeakPolarHBondContact O-CG1 2.99Å; T673-I841 PolarHBondContact O-N 3.16Å
674	F	86.5	Confident	83.7	Confident	11 Å²	11	63.4 Å²	63.4	5%	0.048	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.8	179.7	-58.7	-95.7	0	0	0	109.2	H666 L667 M669 A672 P777 I779 A838 P840	H666-F674 CarbonylContact C-O 3.59Å; H666-F674 WeakPolarHBondContact CA-O 3.5Å; L667-F674 HydrophobicContact CB-CB 4.34Å; L667-F674 PolarHBondContact N-O 2.85Å; L667-F674 PolarHBondContact O-N 3.5Å; M669-F674 HydrophobicContact CB-CE2 4.34Å; A672-F674 HydrophobicContact CB-CD2 4.42Å; A672-F674 HydrophobicContact CB-CE2 3.62Å; A672-F674 HydrophobicContact CB-CZ 3.93Å; F674-P777 HydrophobicContact CE1-CB 4.34Å; F674-P777 HydrophobicContact CE1-CG 4.3Å; F674-P777 HydrophobicContact CZ-CB 4.24Å; F674-I779 HydrophobicContact CB-CD1 3.91Å; F674-I779 HydrophobicContact CD1-CD1 3.67Å; F674-I779 HydrophobicContact CD1-CG1 4.37Å; F674-I779 HydrophobicContact CD2-CD1 4.37Å; F674-I779 HydrophobicContact CE1-CD1 4.22Å; F674-I779 HydrophobicContact CE1-CG1 4.45Å; F674-I779 HydrophobicContact CG-CD1 3.74Å; F674-A838 WeakPolarHBondContact CD1-O 2.99Å; F674-A838 WeakPolarHBondContact CE1-O 3.42Å; F674-P840 HydrophobicContact CD1-CB 4.33Å; F674-P840 HydrophobicContact CE1-CB 3.87Å; F674-P840 HydrophobicContact CE1-CG 4.36Å; F674-P840 HydrophobicContact CZ-CB 4.08Å
675	D	88.1	Confident	84.6	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.043	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	98.4	177.5	-172.2	4.4	0	0	0	110.5	R677 P678 I841 I872	D675-R677 WeakPolarHBondContact OD1-CB 3.29Å; D675-R677 WeakPolarHBondContact OD1-CG 3.05Å; D675-R677 IonicContact OD1-CZ 3.7Å; D675-R677 PolarHBondContact OD1-N 3.43Å; D675-R677 VanDerWaalsContact OD1-N 3.08Å; D675-R677 IonicContact OD1-NE 2.81Å; D675-R677 PolarHBondContact OD1-NE 2.98Å; D675-R677 IonicContact OD1-NH2 3.73Å; D675-R677 IonicContact OD2-CZ 3.39Å; D675-R677 IonicContact OD2-NE 3.25Å; D675-R677 PolarHBondContact OD2-NE 2.87Å; D675-R677 IonicContact OD2-NH2 2.7Å; D675-R677 PolarHBondContact OD2-NH2 3.23Å; D675-P678 WeakPolarHBondContact O-CD 3.37Å; D675-I841 HydrophobicContact CB-CD1 4.1Å; D675-I872 HydrophobicContact CB-CD1 3.72Å
676	L	88.4	Confident	84.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.321	C	S	.	.			trans	-90.6	-0.2	177.4	-57.3	174.8	0	0	0	112.2	C665 L667 P678 L679 I779 F781 F802 Y837 A838	C665-L676 HydrophobicContact CB-CB 4.02Å; C665-L676 PolarHBondContact O-N 3.45Å; L667-L676 HydrophobicContact CD1-CD1 3.75Å; L676-P678 VanDerWaalsContact C-N 3.26Å; L676-L679 HydrophobicContact CB-CD1 4.47Å; L676-L679 HydrophobicContact CD2-CD1 3.86Å; L676-L679 WeakPolarHBondContact O-CA 3.42Å; L676-L679 VanDerWaalsContact O-CB 3.29Å; L676-L679 WeakPolarHBondContact O-CB 3.38Å; L676-L679 PolarHBondContact O-N 2.77Å; L676-I779 HydrophobicContact CD1-CD1 4.14Å; L676-I779 HydrophobicContact CD2-CD1 4.2Å; L676-I779 HydrophobicContact CG-CD1 4.43Å; L676-F781 HydrophobicContact CD1-CE1 3.9Å; L676-F781 HydrophobicContact CD1-CZ 3.71Å; L676-F802 HydrophobicContact CD1-CD1 4.49Å; L676-F802 HydrophobicContact CD1-CD2 4.44Å; L676-F802 HydrophobicContact CD1-CE1 4.48Å; L676-F802 HydrophobicContact CD1-CE2 4.44Å; L676-F802 HydrophobicContact CD1-CG 4.47Å; L676-F802 HydrophobicContact CD1-CZ 4.45Å; L676-F802 HydrophobicContact CD2-CD1 4.15Å; L676-Y837 WeakPolarHBondContact CD2-O 3.22Å; L676-A838 HydrophobicContact CD2-CB 4.49Å
677	R	88.3	Confident	84.8	Confident	139 Å²	139	61.9 Å²	61.9	53%	0.525	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-54.6	-34.5	178.5	-64.1	176.3	-66.3	179.2	-0.3	113.6	C665 D675 L679 K680	C665-R677 HydrophobicContact CB-CG 4.22Å; D675-R677 WeakPolarHBondContact OD1-CB 3.29Å; D675-R677 WeakPolarHBondContact OD1-CG 3.05Å; D675-R677 IonicContact OD1-CZ 3.7Å; D675-R677 PolarHBondContact OD1-N 3.43Å; D675-R677 VanDerWaalsContact OD1-N 3.08Å; D675-R677 IonicContact OD1-NE 2.81Å; D675-R677 PolarHBondContact OD1-NE 2.98Å; D675-R677 IonicContact OD1-NH2 3.73Å; D675-R677 IonicContact OD2-CZ 3.39Å; D675-R677 IonicContact OD2-NE 3.25Å; D675-R677 PolarHBondContact OD2-NE 2.87Å; D675-R677 IonicContact OD2-NH2 2.7Å; D675-R677 PolarHBondContact OD2-NH2 3.23Å; R677-L679 PolarHBondContact O-N 2.93Å; R677-K680 WeakPolarHBondContact O-CB 3.32Å; R677-K680 PolarHBondContact O-N 3.03Å
678	P	87.9	Confident	85	Confident	66 Å²	66	65.4 Å²	65.4	43%	0.429	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-63.9	-15.9	173.7	-24.9	37.2	0	0	0	114.6	D675 L676 K680 Y837	D675-P678 WeakPolarHBondContact O-CD 3.37Å; L676-P678 VanDerWaalsContact C-N 3.26Å; P678-K680 VanDerWaalsContact C-N 3.31Å; P678-Y837 HydrophobicContact CB-CD1 3.79Å; P678-Y837 HydrophobicContact CB-CD2 3.82Å; P678-Y837 HydrophobicContact CB-CE1 3.67Å; P678-Y837 HydrophobicContact CB-CE2 3.68Å; P678-Y837 HydrophobicContact CB-CG 3.86Å; P678-Y837 HydrophobicContact CG-CD1 3.64Å; P678-Y837 HydrophobicContact CG-CE1 3.68Å; P678-Y837 HydrophobicContact CG-CG 4.1Å
679	L	87.6	Confident	85.3	Confident	21 Å²	21	62.1 Å²	62.1	11%	0.11	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-88.4	2.9	173.8	-57.4	179.1	0	0	0	113	L676 R677 G681 I706 F802 S811 Y837	L676-L679 HydrophobicContact CB-CD1 4.47Å; L676-L679 HydrophobicContact CD2-CD1 3.86Å; L676-L679 WeakPolarHBondContact O-CA 3.42Å; L676-L679 VanDerWaalsContact O-CB 3.29Å; L676-L679 WeakPolarHBondContact O-CB 3.38Å; L676-L679 PolarHBondContact O-N 2.77Å; R677-L679 PolarHBondContact O-N 2.93Å; L679-G681 PolarHBondContact O-N 2.88Å; L679-I706 HydrophobicContact CB-CG2 3.95Å; L679-F802 HydrophobicContact CD1-CD1 3.82Å; L679-F802 HydrophobicContact CD1-CE1 3.7Å; L679-S811 WeakPolarHBondContact CD2-OG 3.46Å; L679-Y837 HydrophobicContact CD2-CD2 3.87Å; L679-Y837 HydrophobicContact CG-CD2 4.32Å
680	K	86.8	Confident	85.7	Confident	139 Å²	139	64 Å²	64	60%	0.604	32%	0.324	S	S	*	.			trans	-56.7	120.8	178.6	-178.8	178.5	-178.8	-177.2	0	110.4	R677 P678 I706 C707 Q708	R677-K680 WeakPolarHBondContact O-CB 3.32Å; R677-K680 PolarHBondContact O-N 3.03Å; P678-K680 VanDerWaalsContact C-N 3.31Å; K680-I706 WeakPolarHBondContact CA-O 3.36Å; K680-C707 HydrophobicContact CB-CB 4.26Å; K680-C707 HydrophobicContact CG-CB 4.49Å; K680-Q708 HydrophobicContact CG-CB 4.37Å
681	G	87.6	Confident	86.3	Confident	16 Å²	16	64.3 Å²	64.3	17%	0.165	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	144.5	-163	-177.8	0	0	0	0	0	112.5	L679 I706	L679-G681 PolarHBondContact O-N 2.88Å; G681-I706 PolarHBondContact N-O 2.63Å; G681-I706 PolarHBondContact O-N 3Å
682	F	88.5	Confident	86.3	Confident	105 Å²	105	58.5 Å²	58.5	46%	0.461	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.6	175.8	-56.3	-79.7	0	0	0	110.3	V704 S710 A712	F682-V704 CarbonylContact C-O 3.51Å; F682-V704 VanDerWaalsContact CA-O 3.32Å; F682-V704 WeakPolarHBondContact CA-O 3.44Å; F682-S710 WeakPolarHBondContact CZ-OG 3.46Å; F682-A712 HydrophobicContact CD1-CB 4.32Å; F682-A712 HydrophobicContact CE1-CB 4.46Å
683	I	90.7	Very high	85.6	Confident	29 Å²	29	62.5 Å²	62.5	15%	0.149	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	145.1	169.7	-161.8	165.3	0	0	0	109.5	V704 I706 A813 I833	I683-V704 HydrophobicContact CG2-CB 3.82Å; I683-V704 HydrophobicContact CG2-CG1 4.19Å; I683-V704 PolarHBondContact N-O 2.8Å; I683-V704 PolarHBondContact O-N 2.76Å; I683-I706 HydrophobicContact CB-CD1 4.29Å; I683-I706 HydrophobicContact CG2-CD1 3.55Å; I683-I706 HydrophobicContact CG2-CG1 4.4Å; I683-A813 HydrophobicContact CD1-CB 3.8Å; I683-A813 HydrophobicContact CG1-CB 3.79Å; I683-A813 HydrophobicContact CG2-CB 4.18Å; I683-I833 HydrophobicContact CD1-CG2 4.28Å; I683-I833 HydrophobicContact CG2-CD1 3.94Å
684	Q	91.1	Very high	85	Confident	126 Å²	126	67.4 Å²	67.4	59%	0.589	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	134.4	178.9	-65.3	-179.5	5.4	0	0	110.5	F702	Q684-F702 CarbonylContact C-O 3.6Å; Q684-F702 VanDerWaalsContact CA-O 3.25Å; Q684-F702 WeakPolarHBondContact CA-O 3.3Å
685	A	91	Very high	84.5	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124.4	166.4	0	0	0	0	0	109.4	F702 A813 L815 I831	A685-F702 HydrophobicContact CB-CB 4.26Å; A685-F702 PolarHBondContact N-O 3.48Å; A685-F702 PolarHBondContact O-N 2.79Å; A685-A813 HydrophobicContact CB-CB 3.87Å; A685-L815 HydrophobicContact CB-CD2 4.09Å; A685-I831 HydrophobicContact CB-CG2 3.96Å
686	K	89.4	Confident	84	Confident	108 Å²	108	71.9 Å²	71.9	47%	0.47	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125.6	174.2	-169.5	-170.3	167.5	-178.4	0	108.6	E689 F699 L701	K686-E689 IonicContact NZ-OE2 2.62Å; K686-E689 PolarHBondContact NZ-OE2 2.73Å; K686-F699 HydrophobicContact CD-CD2 4.12Å; K686-F699 HydrophobicContact CD-CE2 4.02Å; K686-F699 HydrophobicContact CD-CZ 4.48Å; K686-F699 HydrophobicContact CG-CD2 3.58Å; K686-F699 HydrophobicContact CG-CE2 3.78Å; K686-F699 HydrophobicContact CG-CG 4.33Å; K686-L701 HydrophobicContact CB-CD2 4.12Å; K686-L701 HydrophobicContact CG-CD2 4.18Å
687	G	86.4	Confident	83.8	Confident	8 Å²	8	72.7 Å²	72.7	8%	0.082	37%	0.368	C	S	.	.			trans	-71.9	174.6	168.3	0	0	0	0	0	112.5	H700 L815	G687-H700 PolarHBondContact N-O 3.11Å; G687-L815 VanDerWaalsContact CA-CD1 3.47Å
688	V	86.5	Confident	83.7	Confident	76 Å²	76	69.3 Å²	69.3	46%	0.461	36%	0.356	S	S	.	.			trans	-63.8	149.8	174.3	-62.9	0	0	0	0	110.6	I690 F699 P820	V688-I690 HydrophobicContact CG2-CD1 4.4Å; V688-I690 HydrophobicContact CG2-CG1 3.99Å; V688-I690 PolarHBondContact O-N 3.31Å; V688-F699 WeakPolarHBondContact O-CB 3.37Å; V688-P820 HydrophobicContact CB-CB 4.4Å; V688-P820 HydrophobicContact CG1-CB 3.74Å; V688-P820 HydrophobicContact CG2-CB 3.75Å
689	E	85.8	Confident	83.7	Confident	85 Å²	85	67.1 Å²	67.1	40%	0.397	34%	0.34	S	S	.	.			trans	-80	115.9	174.8	-164.9	156.3	171.4	0	0	109	K686 F691 S697 F699	K686-E689 IonicContact NZ-OE2 2.62Å; K686-E689 PolarHBondContact NZ-OE2 2.73Å; E689-F691 HydrophobicContact CG-CE2 4.41Å; E689-F691 HydrophobicContact CG-CZ 4.3Å; E689-S697 WeakPolarHBondContact OE1-CB 3.39Å; E689-S697 PolarHBondContact OE1-OG 3.27Å; E689-F699 HydrophobicContact CG-CD1 4.45Å
690	I	83.4	Confident	83.7	Confident	57 Å²	57	66.8 Å²	66.8	29%	0.292	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	141.6	-179.5	-52.6	172.7	0	0	0	107	V688 S697 Y698	V688-I690 HydrophobicContact CG2-CD1 4.4Å; V688-I690 HydrophobicContact CG2-CG1 3.99Å; V688-I690 PolarHBondContact O-N 3.31Å; I690-S697 CarbonylContact O-C 3.5Å; I690-S697 WeakPolarHBondContact O-CA 3.08Å; I690-Y698 HydrophobicContact CB-CD1 4.47Å; I690-Y698 HydrophobicContact CB-CE1 3.98Å; I690-Y698 HydrophobicContact CB-CE2 4.14Å; I690-Y698 HydrophobicContact CD1-CE2 4.34Å; I690-Y698 HydrophobicContact CG2-CE1 3.84Å; I690-Y698 HydrophobicContact CG2-CE2 4.44Å; I690-Y698 WeakPolarHBondContact CG2-OH 3.33Å; I690-Y698 PolarHBondContact N-O 2.86Å; I690-Y698 VanDerWaalsContact O-CD1 3.31Å; I690-Y698 WeakPolarHBondContact O-CD1 3.22Å; I690-Y698 PolarHBondContact O-N 2.81Å
691	F	80.5	Confident	83.9	Confident	131 Å²	131	61.4 Å²	61.4	58%	0.575	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	129.5	179.8	-64.8	-94.7	0	0	0	109.3	E689 G695	E689-F691 HydrophobicContact CG-CE2 4.41Å; E689-F691 HydrophobicContact CG-CZ 4.3Å; F691-G695 WeakPolarHBondContact CD1-O 3.26Å
692	S	74.2	Confident	84	Confident	39 Å²	39	60.8 Å²	60.8	27%	0.273	31%	0.308	S	S	.	.			trans	-62.3	162.9	162.6	67.4	0	0	0	0	109.6	E694 G695 S696	S692-E694 PolarHBondContact O-N 3.36Å; S692-E694 VanDerWaalsContact O-N 3.09Å; S692-G695 PolarHBondContact O-N 2.67Å; S692-S696 WeakPolarHBondContact CB-O 3.24Å; S692-S696 PolarHBondContact N-O 2Å; S692-S696 WeakPolarHBondContact OG-CB 3.42Å; S692-S696 PolarHBondContact OG-N 3.03Å; S692-S696 PolarHBondContact OG-O 2.04Å
693	R	64.2	Low	84.1	Confident	111 Å²	111	57 Å²	57	42%	0.419	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-20.5	178.7	-180	164.9	155.9	-147.3	-2.5	113.7	F223 G695	F223-R693 HydrophobicContact CE1-CG 4.45Å; F223-R693 HydrophobicContact CZ-CB 4.02Å; F223-R693 VanDerWaalsContact CZ-CD 3.42Å; F223-R693 HydrophobicContact CZ-CG 3.88Å; F223-R693 VanDerWaalsContact CZ-NH1 3.26Å; R693-G695 VanDerWaalsContact C-N 3.25Å; R693-G695 PolarHBondContact O-N 3.34Å
694	E	71.6	Confident	84	Confident	141 Å²	141	55.7 Å²	55.7	66%	0.659	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.2	176.2	-65.2	167.6	-174.2	0	0	112.9	S692 S696	S692-E694 PolarHBondContact O-N 3.36Å; S692-E694 VanDerWaalsContact O-N 3.09Å; E694-S696 VanDerWaalsContact C-N 3.3Å
695	G	76.8	Confident	83.8	Confident	51 Å²	51	50 Å²	50	53%	0.526	26%	0.26	S	S	.	.	S	Bend	trans	84.9	-1.1	-174	0	0	0	0	0	113.9	F691 S692 R693 S697	F691-G695 WeakPolarHBondContact CD1-O 3.26Å; S692-G695 PolarHBondContact O-N 2.67Å; R693-G695 VanDerWaalsContact C-N 3.25Å; R693-G695 PolarHBondContact O-N 3.34Å; G695-S697 PolarHBondContact O-N 3.36Å
696	S	77.7	Confident	83.6	Confident	61 Å²	61	50.2 Å²	50.2	43%	0.427	26%	0.261	S	S	.	.			trans	-72.4	124.7	171.9	-54.1	0	0	0	0	109.4	S692 E694	S692-S696 WeakPolarHBondContact CB-O 3.24Å; S692-S696 PolarHBondContact N-O 2Å; S692-S696 WeakPolarHBondContact OG-CB 3.42Å; S692-S696 PolarHBondContact OG-N 3.03Å; S692-S696 PolarHBondContact OG-O 2.04Å; E694-S696 VanDerWaalsContact C-N 3.3Å
697	S	83.8	Confident	83.1	Confident	17 Å²	17	46.6 Å²	46.6	12%	0.119	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	151.1	177.1	65	0	0	0	0	112.2	E689 I690 G695 P740	E689-S697 WeakPolarHBondContact OE1-CB 3.39Å; E689-S697 PolarHBondContact OE1-OG 3.27Å; I690-S697 CarbonylContact O-C 3.5Å; I690-S697 WeakPolarHBondContact O-CA 3.08Å; G695-S697 PolarHBondContact O-N 3.36Å; S697-P740 VanDerWaalsContact O-CD 3.27Å; S697-P740 WeakPolarHBondContact O-CD 3.15Å; S697-P740 WeakPolarHBondContact O-CG 3.31Å; S697-P740 WeakPolarHBondContact OG-CG 3.36Å
698	Y	86.4	Confident	82.3	Confident	68 Å²	68	49.3 Å²	49.3	27%	0.267	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155.2	170.2	71.2	-84.4	0	0	0	109.8	I690 H700 T737 S738	I690-Y698 HydrophobicContact CB-CD1 4.47Å; I690-Y698 HydrophobicContact CB-CE1 3.98Å; I690-Y698 HydrophobicContact CB-CE2 4.14Å; I690-Y698 HydrophobicContact CD1-CE2 4.34Å; I690-Y698 HydrophobicContact CG2-CE1 3.84Å; I690-Y698 HydrophobicContact CG2-CE2 4.44Å; I690-Y698 WeakPolarHBondContact CG2-OH 3.33Å; I690-Y698 PolarHBondContact N-O 2.86Å; I690-Y698 VanDerWaalsContact O-CD1 3.31Å; I690-Y698 WeakPolarHBondContact O-CD1 3.22Å; I690-Y698 PolarHBondContact O-N 2.81Å; Y698-H700 AromaticContact CE2-NE2 3.96Å; Y698-T737 HydrophobicContact CD2-CG2 4.09Å; Y698-S738 CarbonylContact C-O 3.55Å; Y698-S738 WeakPolarHBondContact CA-O 3.47Å; Y698-S738 WeakPolarHBondContact CB-O 3.22Å
699	F	87.4	Confident	81.3	Confident	20 Å²	20	51.2 Å²	51.2	9%	0.088	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	160.3	176.9	55.5	-88.9	0	0	0	110.4	K686 V688 E689 L701 S738 P740	K686-F699 HydrophobicContact CD-CD2 4.12Å; K686-F699 HydrophobicContact CD-CE2 4.02Å; K686-F699 HydrophobicContact CD-CZ 4.48Å; K686-F699 HydrophobicContact CG-CD2 3.58Å; K686-F699 HydrophobicContact CG-CE2 3.78Å; K686-F699 HydrophobicContact CG-CG 4.33Å; V688-F699 WeakPolarHBondContact O-CB 3.37Å; E689-F699 HydrophobicContact CG-CD1 4.45Å; F699-L701 HydrophobicContact CD2-CD1 4.49Å; F699-L701 HydrophobicContact CD2-CD2 4.25Å; F699-L701 HydrophobicContact CD2-CG 3.9Å; F699-L701 HydrophobicContact CE2-CD1 3.76Å; F699-L701 HydrophobicContact CE2-CD2 3.81Å; F699-L701 HydrophobicContact CE2-CG 3.56Å; F699-S738 VanDerWaalsContact CZ-OG 3.23Å; F699-S738 WeakPolarHBondContact CZ-OG 3.31Å; F699-S738 PolarHBondContact N-O 3.36Å; F699-S738 PolarHBondContact O-N 2.75Å; F699-P740 HydrophobicContact CD1-CG 4.41Å; F699-P740 HydrophobicContact CE1-CG 3.96Å
700	H	88.8	Confident	80.8	Confident	14 Å²	14	49.2 Å²	49.2	7%	0.065	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.6	177.4	-60.4	-68.3	0	0	0	110.8	G687 Y698 F702 R735 T737 D821	G687-H700 PolarHBondContact N-O 3.11Å; Y698-H700 AromaticContact CE2-NE2 3.96Å; H700-F702 HydrophobicContact CB-CE2 4.09Å; H700-R735 HydrophobicContact CB-CG 4.34Å; H700-R735 PolarHBondContact CD2-NH2 2.02Å; H700-R735 PolarHBondContact CE1-NH2 3.23Å; H700-R735 PolarHBondContact ND1-NE 3.32Å; H700-R735 VanDerWaalsContact ND1-NE 3.13Å; H700-R735 PolarHBondContact ND1-NH2 2.7Å; H700-R735 PolarHBondContact NE2-NH2 2.8Å; H700-T737 PolarHBondContact CE1-OG1 2.89Å; H700-T737 PolarHBondContact ND1-OG1 3.29Å; H700-D821 IonicContact CD2-OD1 3.67Å; H700-D821 PolarHBondContact CD2-OD1 3.25Å; H700-D821 IonicContact CD2-OD2 3.4Å; H700-D821 IonicContact CG-OD1 2.83Å; H700-D821 IonicContact NE2-OD1 3.35Å; H700-D821 IonicContact NE2-OD2 2.78Å
701	L	89.6	Confident	80.5	Confident	26 Å²	26	48.4 Å²	48.4	14%	0.136	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.4	174.6	-77.9	166.4	0	0	0	109.1	K686 F699 R735 V736 F747	K686-L701 HydrophobicContact CB-CD2 4.12Å; K686-L701 HydrophobicContact CG-CD2 4.18Å; F699-L701 HydrophobicContact CD2-CD1 4.49Å; F699-L701 HydrophobicContact CD2-CD2 4.25Å; F699-L701 HydrophobicContact CD2-CG 3.9Å; F699-L701 HydrophobicContact CE2-CD1 3.76Å; F699-L701 HydrophobicContact CE2-CD2 3.81Å; F699-L701 HydrophobicContact CE2-CG 3.56Å; L701-R735 CarbonylContact O-C 3.56Å; L701-R735 VanDerWaalsContact O-CA 3.26Å; L701-R735 WeakPolarHBondContact O-CA 3.48Å; L701-V736 HydrophobicContact CB-CG1 3.94Å; L701-V736 PolarHBondContact N-O 2.88Å; L701-V736 PolarHBondContact O-N 3.41Å; L701-F747 HydrophobicContact CD1-CD1 4.38Å; L701-F747 HydrophobicContact CD1-CE1 3.62Å
702	F	90.5	Very high	80.7	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.2	173.1	-62.4	-95.7	0	0	0	108.7	Q684 A685 H700 C734 R735 L815 Y829 I831	Q684-F702 CarbonylContact C-O 3.6Å; Q684-F702 VanDerWaalsContact CA-O 3.25Å; Q684-F702 WeakPolarHBondContact CA-O 3.3Å; A685-F702 HydrophobicContact CB-CB 4.26Å; A685-F702 PolarHBondContact N-O 3.48Å; A685-F702 PolarHBondContact O-N 2.79Å; H700-F702 HydrophobicContact CB-CE2 4.09Å; F702-C734 CarbonylContact C-O 3.53Å; F702-C734 VanDerWaalsContact CA-O 3.31Å; F702-C734 WeakPolarHBondContact CA-O 3.38Å; F702-R735 HydrophobicContact CD1-CB 3.98Å; F702-R735 HydrophobicContact CD1-CG 4.29Å; F702-R735 HydrophobicContact CE1-CB 3.89Å; F702-R735 HydrophobicContact CE1-CG 3.89Å; F702-R735 HydrophobicContact CZ-CG 4.07Å; F702-L815 HydrophobicContact CD2-CD1 4.07Å; F702-L815 HydrophobicContact CD2-CD2 3.95Å; F702-L815 HydrophobicContact CE2-CD1 3.63Å; F702-L815 HydrophobicContact CE2-CD2 4.03Å; F702-L815 HydrophobicContact CE2-CG 4.48Å; F702-Y829 AromaticContact CE1-CD1 3.81Å; F702-Y829 HydrophobicContact CE1-CD1 3.81Å; F702-Y829 HydrophobicContact CE1-CE1 4.35Å; F702-Y829 HydrophobicContact CZ-CD1 4.12Å; F702-Y829 HydrophobicContact CZ-CE1 4.49Å; F702-I831 HydrophobicContact CB-CD1 3.73Å; F702-I831 HydrophobicContact CD1-CD1 4.03Å; F702-I831 HydrophobicContact CG-CD1 4.02Å
703	N	90.1	Very high	81.1	Confident	26 Å²	26	43.2 Å²	43.2	14%	0.139	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124	173.4	-162.9	11.5	0	0	0	108.5	A712 V713 V733 C734	N703-A712 HydrophobicContact CB-CB 4.1Å; N703-A712 VanDerWaalsContact O-CB 3.27Å; N703-A712 WeakPolarHBondContact O-CB 3.34Å; N703-V713 PolarHBondContact ND2-O 3.15Å; N703-V733 WeakPolarHBondContact O-CA 3.49Å; N703-C734 PolarHBondContact N-O 3.11Å; N703-C734 PolarHBondContact O-N 2.59Å
704	V	88.8	Confident	82	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.4	-170.1	177.3	0	0	0	0	109	F682 I683 I706 V733 I800 I831	F682-V704 CarbonylContact C-O 3.51Å; F682-V704 VanDerWaalsContact CA-O 3.32Å; F682-V704 WeakPolarHBondContact CA-O 3.44Å; I683-V704 HydrophobicContact CG2-CB 3.82Å; I683-V704 HydrophobicContact CG2-CG1 4.19Å; I683-V704 PolarHBondContact N-O 2.8Å; I683-V704 PolarHBondContact O-N 2.76Å; V704-I706 HydrophobicContact CG1-CD1 4.42Å; V704-I706 HydrophobicContact CG1-CG1 3.9Å; V704-V733 HydrophobicContact CG1-CG2 4.19Å; V704-V733 HydrophobicContact CG2-CG1 4.04Å; V704-V733 HydrophobicContact CG2-CG2 4.15Å; V704-I800 HydrophobicContact CG1-CD1 3.46Å; V704-I800 VanDerWaalsContact CG1-CD1 3.46Å; V704-I831 HydrophobicContact CG2-CD1 3.56Å
705	S	87.8	Confident	82.4	Confident	7 Å²	7	35 Å²	35	5%	0.049	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127	170.7	-177.9	0	0	0	0	109.9	S710 A732	S705-S710 WeakPolarHBondContact CB-O 3.03Å; S705-S710 PolarHBondContact OG-O 2.74Å; S705-A732 PolarHBondContact N-O 3.43Å
706	I	85.8	Confident	82.4	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.3	-177.3	-60	169.6	0	0	0	108.7	L679 K680 G681 I683 V704 Q708 F802 I833	L679-I706 HydrophobicContact CB-CG2 3.95Å; K680-I706 WeakPolarHBondContact CA-O 3.36Å; G681-I706 PolarHBondContact N-O 2.63Å; G681-I706 PolarHBondContact O-N 3Å; I683-I706 HydrophobicContact CB-CD1 4.29Å; I683-I706 HydrophobicContact CG2-CD1 3.55Å; I683-I706 HydrophobicContact CG2-CG1 4.4Å; V704-I706 HydrophobicContact CG1-CD1 4.42Å; V704-I706 HydrophobicContact CG1-CG1 3.9Å; I706-Q708 PolarHBondContact O-N 3.48Å; I706-F802 HydrophobicContact CD1-CE1 4.25Å; I706-F802 HydrophobicContact CD1-CZ 4.43Å; I706-F802 HydrophobicContact CG2-CE1 4.32Å; I706-F802 HydrophobicContact CG2-CZ 4.15Å; I706-I833 HydrophobicContact CD1-CD1 3.42Å; I706-I833 VanDerWaalsContact CD1-CD1 3.42Å; I706-I833 HydrophobicContact CG1-CD1 4.34Å
707	C	78.6	Confident	82.1	Confident	32 Å²	32	32.5 Å²	32.5	22%	0.216	18%	0.184	C	C	.	.	S	Bend	trans	55	24.3	172.8	-49.1	0	0	0	0	114.8	C665 K680	C665-C707 HydrophobicContact CB-CB 3.71Å; C665-C707 WeakPolarHBondContact CB-SG 3.38Å; C665-C707 VanDerWaalsContact SG-CA 3.56Å; C665-C707 WeakPolarHBondContact SG-CB 3.29Å; C665-C707 CovalentContact SG-SG 1.98Å; C665-C707 PolarHBondContact SG-SG 3.21Å; K680-C707 HydrophobicContact CB-CB 4.26Å; K680-C707 HydrophobicContact CG-CB 4.49Å
708	Q	70.2	Confident	81.1	Confident	66 Å²	66	35.1 Å²	35.1	31%	0.308	20%	0.195	S	C	.	.			trans	-126.1	147	-174.3	-164.7	173.7	0.4	0	0	110.4	K680 I706 S710	K680-Q708 HydrophobicContact CG-CB 4.37Å; I706-Q708 PolarHBondContact O-N 3.48Å; Q708-S710 VanDerWaalsContact CG-OG 3.25Å; Q708-S710 WeakPolarHBondContact CG-OG 3.05Å; Q708-S710 PolarHBondContact NE2-OG 3.21Å
709	S	65.5	Low	79.5	Confident	115 Å²	115	33.3 Å²	33.3	80%	0.804	19%	0.192	S	C	*	.	S	Bend	trans	-74	-27.4	175.5	50.2	0	0	0	0	113
710	S	76	Confident	77.8	Confident	44 Å²	44	38.7 Å²	38.7	31%	0.308	22%	0.218	S	C	.	.	S	Bend	trans	-78.3	128.9	175.5	58.4	0	0	0	0	111.2	F682 S705 Q708	F682-S710 WeakPolarHBondContact CZ-OG 3.46Å; S705-S710 WeakPolarHBondContact CB-O 3.03Å; S705-S710 PolarHBondContact OG-O 2.74Å; Q708-S710 VanDerWaalsContact CG-OG 3.25Å; Q708-S710 WeakPolarHBondContact CG-OG 3.05Å; Q708-S710 PolarHBondContact NE2-OG 3.21Å
711	K	77.2	Confident	76.1	Confident	40 Å²	40	46.6 Å²	46.6	17%	0.174	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-76	150.8	179.8	-68.3	-178.4	-177.8	-173.1	0	111.5	E660 S730	E660-K711 IonicContact OE2-NZ 3.36Å; K711-S730 WeakPolarHBondContact CB-OG 3.49Å
712	A	84	Confident	74.2	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	139.6	170.9	0	0	0	0	0	109.3	F682 N703 S730 S731	F682-A712 HydrophobicContact CD1-CB 4.32Å; F682-A712 HydrophobicContact CE1-CB 4.46Å; N703-A712 HydrophobicContact CB-CB 4.1Å; N703-A712 VanDerWaalsContact O-CB 3.27Å; N703-A712 WeakPolarHBondContact O-CB 3.34Å; A712-S730 WeakPolarHBondContact O-CA 3.14Å; A712-S731 WeakPolarHBondContact CA-O 3.46Å; A712-S731 WeakPolarHBondContact CB-O 3.28Å; A712-S731 PolarHBondContact N-O 2.9Å; A712-S731 PolarHBondContact O-N 3.16Å; A712-S731 VanDerWaalsContact O-O 3.1Å
713	V	83.3	Confident	72	Confident	60 Å²	60	60.5 Å²	60.5	36%	0.364	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.3	-175.9	-176.4	0	0	0	0	109.4	N703 N715 P728 V729	N703-V713 PolarHBondContact ND2-O 3.15Å; V713-N715 WeakPolarHBondContact CG1-OD1 3.39Å; V713-P728 HydrophobicContact CG1-CB 4.05Å; V713-V729 WeakPolarHBondContact CA-O 3.28Å
714	C	82.6	Confident	69.9	Low	5 Å²	5	60.1 Å²	60.1	3%	0.034	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	119.8	175	-73	0	0	0	0	109.4	V729 C734 V736 P750	C714-V729 PolarHBondContact N-O 2.78Å; C714-V729 PolarHBondContact O-N 3.45Å; C714-C734 HydrophobicContact CB-CB 3.75Å; C714-C734 WeakPolarHBondContact CB-SG 3.12Å; C714-C734 PolarHBondContact N-SG 2.99Å; C714-C734 WeakPolarHBondContact SG-CB 3.23Å; C714-C734 PolarHBondContact SG-O 3.38Å; C714-C734 CovalentContact SG-SG 2.04Å; C714-C734 PolarHBondContact SG-SG 2.97Å; C714-V736 HydrophobicContact CB-CB 4.25Å; C714-P750 HydrophobicContact CB-CB 4.06Å
715	N	80	Confident	67.7	Low	74 Å²	74	64.8 Å²	64.8	40%	0.396	36%	0.357	S	S	.	.			trans	-108.2	145.5	-175.5	-67.3	-2.9	0	0	0	111.1	V713 P728 F747	V713-N715 WeakPolarHBondContact CG1-OD1 3.39Å; N715-P728 WeakPolarHBondContact OD1-CB 3.39Å; N715-F747 WeakPolarHBondContact O-CB 3.26Å
716	D	76.7	Confident	65.9	Low	16 Å²	16	67.5 Å²	67.5	9%	0.086	37%	0.373	C	S	.	.			trans	-95.6	119.5	169.3	-177.6	-15.2	0	0	0	109.5	M718 S719 T726 F747 P750	D716-M718 PolarHBondContact OD1-N 2.88Å; D716-S719 VanDerWaalsContact CG-OG 3.32Å; D716-S719 PolarHBondContact OD1-N 2.75Å; D716-S719 WeakPolarHBondContact OD2-CB 3.46Å; D716-S719 PolarHBondContact OD2-OG 3.36Å; D716-T726 WeakPolarHBondContact CB-OG1 3.17Å; D716-F747 WeakPolarHBondContact CA-O 3.32Å; D716-P750 HydrophobicContact CB-CG 4.04Å
717	T	72	Confident	64.6	Low	45 Å²	45	72 Å²	72	28%	0.276	40%	0.397	S	S	.	.	H	α-helix	trans	-91.7	-17.4	180	59.6	0	0	0	0	113	F747	T717-F747 HydrophobicContact CG2-CB 4.25Å; T717-F747 HydrophobicContact CG2-CD2 3.88Å; T717-F747 PolarHBondContact N-O 3.48Å; T717-F747 PolarHBondContact OG1-N 3.33Å; T717-F747 PolarHBondContact OG1-O 2.9Å
718	M	62.1	Low	64.1	Low	71 Å²	71	72.9 Å²	72.9	35%	0.35	40%	0.402	S	S	.	.	H	α-helix	trans	-80.4	-39.2	178.1	-79.6	-72.4	-86.7	0	0	112	D716 Q720 R721 N722 L746 V748	D716-M718 PolarHBondContact OD1-N 2.88Å; M718-Q720 VanDerWaalsContact C-N 3.33Å; M718-Q720 PolarHBondContact O-N 2.89Å; M718-R721 WeakPolarHBondContact O-CB 3.46Å; M718-R721 PolarHBondContact O-N 2.9Å; M718-R721 VanDerWaalsContact O-N 3.09Å; M718-N722 PolarHBondContact O-N 3.43Å; M718-L746 HydrophobicContact SD-CD1 3.94Å; M718-L746 HydrophobicContact SD-CD2 4.27Å; M718-V748 HydrophobicContact CB-CG1 3.83Å; M718-V748 HydrophobicContact CG-CG1 3.49Å; M718-V748 VanDerWaalsContact CG-CG1 3.49Å
719	S	53.6	Low	64	Low	30 Å²	30	70.3 Å²	70.3	21%	0.21	39%	0.391	C	S	.	.	H	α-helix	trans	-63.8	-38.6	177.7	-69.6	0	0	0	0	112	D716 R721 N722 G724 T726	D716-S719 VanDerWaalsContact CG-OG 3.32Å; D716-S719 PolarHBondContact OD1-N 2.75Å; D716-S719 WeakPolarHBondContact OD2-CB 3.46Å; D716-S719 PolarHBondContact OD2-OG 3.36Å; S719-R721 PolarHBondContact O-N 3.4Å; S719-N722 PolarHBondContact O-N 2.97Å; S719-N722 VanDerWaalsContact O-N 3.16Å; S719-G724 CarbonylContact C-O 3.51Å; S719-G724 VanDerWaalsContact CB-O 3.28Å; S719-G724 WeakPolarHBondContact CB-O 3.27Å; S719-G724 CarbonylContact O-C 3.53Å; S719-G724 PolarHBondContact O-N 3.32Å; S719-T726 WeakPolarHBondContact CB-OG1 3.31Å; S719-T726 WeakPolarHBondContact OG-CG2 3.36Å; S719-T726 PolarHBondContact OG-OG1 3.07Å
720	Q	50.7	Low	64.3	Low	134 Å²	134	66 Å²	66	63%	0.626	36%	0.36	S	S	*	.	H	α-helix	trans	-59.8	-32.7	172.3	-69.8	-173.9	10.4	0	0	112.9	M718	M718-Q720 VanDerWaalsContact C-N 3.33Å; M718-Q720 PolarHBondContact O-N 2.89Å
721	R	53.3	Low	64.3	Low	180 Å²	180	64 Å²	64	68%	0.679	35%	0.346	S	S	*	.	H	α-helix	trans	-70.6	-31.9	178	-159.6	178.9	-142.6	173	9.6	112.8	M718 S719	M718-R721 WeakPolarHBondContact O-CB 3.46Å; M718-R721 PolarHBondContact O-N 2.9Å; M718-R721 VanDerWaalsContact O-N 3.09Å; S719-R721 PolarHBondContact O-N 3.4Å
722	N	50.1	Low	64.4	Low	130 Å²	130	62.7 Å²	62.7	70%	0.695	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	19.4	-176.5	-76.5	-14.7	0	0	0	114.1	M718 S719 G724	M718-N722 PolarHBondContact O-N 3.43Å; S719-N722 PolarHBondContact O-N 2.97Å; S719-N722 VanDerWaalsContact O-N 3.16Å; N722-G724 PolarHBondContact O-N 2.99Å
723	Q	44.5	Very low	64.4	Low	192 Å²	192	63 Å²	63	90%	0.897	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	18.4	-177.1	-60.9	-179.7	3.3	0	0	114.5
724	G	44.3	Very low	64.5	Low	18 Å²	18	60.2 Å²	60.2	19%	0.186	33%	0.328	C	S	.	.			trans	-101.4	99.1	169.1	0	0	0	0	0	108.8	S719 N722 T726	S719-G724 CarbonylContact C-O 3.51Å; S719-G724 VanDerWaalsContact CB-O 3.28Å; S719-G724 WeakPolarHBondContact CB-O 3.27Å; S719-G724 CarbonylContact O-C 3.53Å; S719-G724 PolarHBondContact O-N 3.32Å; N722-G724 PolarHBondContact O-N 2.99Å; G724-T726 PolarHBondContact O-N 3.22Å
725	A	43.8	Very low	64.7	Low	98 Å²	98	61.5 Å²	61.5	81%	0.81	33%	0.332	S	S	*	.			trans	-70.2	94.9	176.9	0	0	0	0	0	110.2
726	T	50.4	Low	64.9	Low	64 Å²	64	58.5 Å²	58.5	39%	0.393	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-75.5	127.9	163.1	49.9	0	0	0	0	108.7	D716 S719 G724	D716-T726 WeakPolarHBondContact CB-OG1 3.17Å; S719-T726 WeakPolarHBondContact CB-OG1 3.31Å; S719-T726 WeakPolarHBondContact OG-CG2 3.36Å; S719-T726 PolarHBondContact OG-OG1 3.07Å; G724-T726 PolarHBondContact O-N 3.22Å
727	L	57.6	Low	65.3	Low	99 Å²	99	58.4 Å²	58.4	52%	0.518	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-63.9	134.3	177	-77.6	159	0	0	0	109.8	M497	M497-L727 HydrophobicContact CG-CD2 4.44Å; M497-L727 HydrophobicContact SD-CD2 4.34Å
728	P	67.7	Low	65.8	Low	50 Å²	50	56.3 Å²	56.3	33%	0.325	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-62.1	144.6	177.6	28.8	-36.1	0	0	0	110.9	M498 V713 N715	M498-P728 HydrophobicContact CE-CG 4.44Å; V713-P728 HydrophobicContact CG1-CB 4.05Å; N715-P728 WeakPolarHBondContact OD1-CB 3.39Å
729	V	69.2	Low	66.8	Low	12 Å²	12	55.7 Å²	55.7	7%	0.073	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	122.3	179.5	-177.6	0	0	0	0	109.5	V713 C714 P750	V713-V729 WeakPolarHBondContact CA-O 3.28Å; C714-V729 PolarHBondContact N-O 2.78Å; C714-V729 PolarHBondContact O-N 3.45Å; V729-P750 HydrophobicContact CB-CB 4.28Å; V729-P750 HydrophobicContact CG2-CB 3.82Å; V729-P750 HydrophobicContact CG2-CG 4.1Å
730	S	72.1	Confident	68.1	Low	23 Å²	23	56 Å²	56	16%	0.161	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	116.2	-179.8	-168.5	0	0	0	0	111.1	K711 A712	K711-S730 WeakPolarHBondContact CB-OG 3.49Å; A712-S730 WeakPolarHBondContact O-CA 3.14Å
731	S	75	Confident	69.3	Low	2 Å²	2	53.1 Å²	53.1	1%	0.014	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	168.3	-178.6	47.4	0	0	0	0	111.5	A712 V733 C734 S756	A712-S731 WeakPolarHBondContact CA-O 3.46Å; A712-S731 WeakPolarHBondContact CB-O 3.28Å; A712-S731 PolarHBondContact N-O 2.9Å; A712-S731 PolarHBondContact O-N 3.16Å; A712-S731 VanDerWaalsContact O-O 3.1Å; S731-V733 WeakPolarHBondContact CB-O 3.3Å; S731-V733 PolarHBondContact O-N 2.79Å; S731-V733 VanDerWaalsContact OG-C 3.31Å; S731-V733 PolarHBondContact OG-O 3.32Å; S731-C734 WeakPolarHBondContact OG-CB 3.39Å; S731-S756 WeakPolarHBondContact CB-OG 3.42Å
732	A	79.9	Confident	70.3	Confident	14 Å²	14	49.6 Å²	49.6	12%	0.116	30%	0.304	C	S	.	.	S	Bend	trans	-59.9	-36	175.9	0	0	0	0	0	111.9	S705 Y783	S705-A732 PolarHBondContact N-O 3.43Å; A732-Y783 HydrophobicContact CB-CD1 3.87Å; A732-Y783 HydrophobicContact CB-CE1 3.4Å; A732-Y783 VanDerWaalsContact CB-CE1 3.4Å
733	V	84	Confident	71.5	Confident	6 Å²	6	50.7 Å²	50.7	4%	0.036	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	130.3	169.6	-177.7	0	0	0	0	108.7	N703 V704 S731 T798 I800 I831	N703-V733 WeakPolarHBondContact O-CA 3.49Å; V704-V733 HydrophobicContact CG1-CG2 4.19Å; V704-V733 HydrophobicContact CG2-CG1 4.04Å; V704-V733 HydrophobicContact CG2-CG2 4.15Å; S731-V733 WeakPolarHBondContact CB-O 3.3Å; S731-V733 PolarHBondContact O-N 2.79Å; S731-V733 VanDerWaalsContact OG-C 3.31Å; S731-V733 PolarHBondContact OG-O 3.32Å; V733-T798 HydrophobicContact CB-CG2 4.11Å; V733-T798 HydrophobicContact CG1-CG2 4.04Å; V733-T798 HydrophobicContact CG2-CG2 3.98Å; V733-I800 HydrophobicContact CG2-CD1 3.87Å; V733-I800 HydrophobicContact CG2-CG1 4.34Å; V733-I831 HydrophobicContact CG1-CD1 3.82Å
734	C	85.5	Confident	73.1	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.7	171.5	72.8	0	0	0	0	110.4	F702 N703 C714 S731	F702-C734 CarbonylContact C-O 3.53Å; F702-C734 VanDerWaalsContact CA-O 3.31Å; F702-C734 WeakPolarHBondContact CA-O 3.38Å; N703-C734 PolarHBondContact N-O 3.11Å; N703-C734 PolarHBondContact O-N 2.59Å; C714-C734 HydrophobicContact CB-CB 3.75Å; C714-C734 WeakPolarHBondContact CB-SG 3.12Å; C714-C734 PolarHBondContact N-SG 2.99Å; C714-C734 WeakPolarHBondContact SG-CB 3.23Å; C714-C734 PolarHBondContact SG-O 3.38Å; C714-C734 CovalentContact SG-SG 2.04Å; C714-C734 PolarHBondContact SG-SG 2.97Å; S731-C734 WeakPolarHBondContact OG-CB 3.39Å
735	R	85.4	Confident	74.7	Confident	32 Å²	32	50 Å²	50	12%	0.121	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	143.9	176.7	178.8	-164	177.8	-172.9	10.7	109.2	H700 L701 F702 P750 L751 D821	H700-R735 HydrophobicContact CB-CG 4.34Å; H700-R735 PolarHBondContact CD2-NH2 2.02Å; H700-R735 PolarHBondContact CE1-NH2 3.23Å; H700-R735 PolarHBondContact ND1-NE 3.32Å; H700-R735 VanDerWaalsContact ND1-NE 3.13Å; H700-R735 PolarHBondContact ND1-NH2 2.7Å; H700-R735 PolarHBondContact NE2-NH2 2.8Å; L701-R735 CarbonylContact O-C 3.56Å; L701-R735 VanDerWaalsContact O-CA 3.26Å; L701-R735 WeakPolarHBondContact O-CA 3.48Å; F702-R735 HydrophobicContact CD1-CB 3.98Å; F702-R735 HydrophobicContact CD1-CG 4.29Å; F702-R735 HydrophobicContact CE1-CB 3.89Å; F702-R735 HydrophobicContact CE1-CG 3.89Å; F702-R735 HydrophobicContact CZ-CG 4.07Å; R735-P750 CarbonylContact O-C 3.54Å; R735-P750 WeakPolarHBondContact O-CA 3.46Å; R735-L751 WeakPolarHBondContact CA-O 3.37Å; R735-L751 HydrophobicContact CB-CB 4.29Å; R735-L751 WeakPolarHBondContact CB-O 3.34Å; R735-L751 PolarHBondContact N-O 2.86Å; R735-L751 PolarHBondContact O-N 2.82Å; R735-D821 IonicContact NH2-OD1 3.37Å; R735-D821 IonicContact NH2-OD2 3.8Å; R735-D821 PolarHBondContact NH2-OD2 2.84Å
736	V	85.4	Confident	76.5	Confident	11 Å²	11	46.8 Å²	46.8	7%	0.067	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	148.9	166.5	69.2	0	0	0	0	110	L701 C714 F747 V748	L701-V736 HydrophobicContact CB-CG1 3.94Å; L701-V736 PolarHBondContact N-O 2.88Å; L701-V736 PolarHBondContact O-N 3.41Å; C714-V736 HydrophobicContact CB-CB 4.25Å; V736-F747 HydrophobicContact CG1-CD1 3.83Å; V736-F747 HydrophobicContact CG2-CB 3.7Å; V736-F747 HydrophobicContact CG2-CD1 4.27Å; V736-F747 HydrophobicContact CG2-CG 4.41Å; V736-V748 WeakPolarHBondContact CG2-O 3.29Å
737	T	83.9	Confident	77.8	Confident	14 Å²	14	46.4 Å²	46.4	9%	0.086	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	119.3	174.3	-55.4	0	0	0	0	108.9	Y698 H700 F747 V748	Y698-T737 HydrophobicContact CD2-CG2 4.09Å; H700-T737 PolarHBondContact CE1-OG1 2.89Å; H700-T737 PolarHBondContact ND1-OG1 3.29Å; T737-F747 WeakPolarHBondContact O-CA 3.2Å; T737-V748 WeakPolarHBondContact CB-O 3.4Å; T737-V748 HydrophobicContact CG2-CG2 4.21Å; T737-V748 PolarHBondContact N-O 3.31Å; T737-V748 PolarHBondContact O-N 3.07Å
738	S	84.2	Confident	78.6	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.007	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.2	176.8	-179.5	0	0	0	0	110	Y698 F699 P740 L746	Y698-S738 CarbonylContact C-O 3.55Å; Y698-S738 WeakPolarHBondContact CA-O 3.47Å; Y698-S738 WeakPolarHBondContact CB-O 3.22Å; F699-S738 VanDerWaalsContact CZ-OG 3.23Å; F699-S738 WeakPolarHBondContact CZ-OG 3.31Å; F699-S738 PolarHBondContact N-O 3.36Å; F699-S738 PolarHBondContact O-N 2.75Å; S738-P740 WeakPolarHBondContact O-CD 3.4Å; S738-L746 CarbonylContact C-O 3.55Å; S738-L746 WeakPolarHBondContact CA-O 3.06Å
739	L	83.1	Confident	78.6	Confident	58 Å²	58	45.4 Å²	45.4	30%	0.304	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	88.6	173.5	-71.9	155.7	0	0	0	107.9	T741 L746 V748	L739-T741 PolarHBondContact O-N 2.82Å; L739-L746 HydrophobicContact CB-CB 4.14Å; L739-L746 PolarHBondContact N-O 2.82Å; L739-L746 PolarHBondContact O-N 2.67Å; L739-V748 HydrophobicContact CD1-CB 4.42Å; L739-V748 HydrophobicContact CD1-CG1 3.92Å; L739-V748 HydrophobicContact CD1-CG2 3.58Å; L739-V748 HydrophobicContact CG-CG2 4.39Å
740	P	80.7	Confident	78.5	Confident	36 Å²	36	46.1 Å²	46.1	23%	0.234	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	122.4	170.5	26.4	-36.4	0	0	0	111	S697 F699 S738 T745	S697-P740 VanDerWaalsContact O-CD 3.27Å; S697-P740 WeakPolarHBondContact O-CD 3.15Å; S697-P740 WeakPolarHBondContact O-CG 3.31Å; S697-P740 WeakPolarHBondContact OG-CG 3.36Å; F699-P740 HydrophobicContact CD1-CG 4.41Å; F699-P740 HydrophobicContact CE1-CG 3.96Å; S738-P740 WeakPolarHBondContact O-CD 3.4Å; P740-T745 HydrophobicContact CB-CG2 4.31Å
741	T	75.9	Confident	78.2	Confident	74 Å²	74	49.5 Å²	49.5	45%	0.454	28%	0.283	S	S	.	.			trans	-110.4	170.8	168.4	73.1	0	0	0	0	109.6	L739 N743 E744 L746	L739-T741 PolarHBondContact O-N 2.82Å; T741-N743 PolarHBondContact O-N 3.01Å; T741-N743 VanDerWaalsContact O-N 3.09Å; T741-E744 WeakPolarHBondContact CA-O 3.32Å; T741-E744 WeakPolarHBondContact CB-O 3.41Å; T741-E744 PolarHBondContact N-O 3.06Å; T741-E744 PolarHBondContact OG1-N 3.01Å; T741-E744 PolarHBondContact OG1-O 3.4Å; T741-L746 HydrophobicContact CG2-CD1 3.96Å; T741-L746 HydrophobicContact CG2-CG 4.43Å
742	A	73.8	Confident	77.4	Confident	107 Å²	107	50.2 Å²	50.2	88%	0.884	29%	0.29	S	S	*	.	S	Bend	trans	-55.2	-30.7	-176.2	0	0	0	0	0	114.4
743	N	74.7	Confident	76	Confident	153 Å²	153	50.7 Å²	50.7	82%	0.818	29%	0.292	S	S	*	.	S	Bend	trans	-113.1	-30.2	-176.1	-62.7	-4	0	0	0	113.2	T741	T741-N743 PolarHBondContact O-N 3.01Å; T741-N743 VanDerWaalsContact O-N 3.09Å
744	E	79	Confident	74.2	Confident	124 Å²	124	55.5 Å²	55.5	58%	0.579	31%	0.31	S	S	*	.			trans	-146.2	152	-170.8	-66.7	-178.6	169.5	0	0	112.1	T741	T741-E744 WeakPolarHBondContact CA-O 3.32Å; T741-E744 WeakPolarHBondContact CB-O 3.41Å; T741-E744 PolarHBondContact N-O 3.06Å; T741-E744 PolarHBondContact OG1-N 3.01Å; T741-E744 PolarHBondContact OG1-O 3.4Å
745	T	78.2	Confident	72.3	Confident	72 Å²	72	56 Å²	56	44%	0.442	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	115.9	170.5	53.6	0	0	0	0	109.8	P740	P740-T745 HydrophobicContact CB-CG2 4.31Å
746	L	80.1	Confident	70.6	Confident	29 Å²	29	54.8 Å²	54.8	15%	0.152	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	141.2	175.9	-64.6	168.1	0	0	0	110.1	M718 S738 L739 T741	M718-L746 HydrophobicContact SD-CD1 3.94Å; M718-L746 HydrophobicContact SD-CD2 4.27Å; S738-L746 CarbonylContact C-O 3.55Å; S738-L746 WeakPolarHBondContact CA-O 3.06Å; L739-L746 HydrophobicContact CB-CB 4.14Å; L739-L746 PolarHBondContact N-O 2.82Å; L739-L746 PolarHBondContact O-N 2.67Å; T741-L746 HydrophobicContact CG2-CD1 3.96Å; T741-L746 HydrophobicContact CG2-CG 4.43Å
747	F	78.1	Confident	69	Low	56 Å²	56	56 Å²	56	25%	0.246	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.6	178.7	-62.2	-71.9	0	0	0	110	L701 N715 D716 T717 V736 T737	L701-F747 HydrophobicContact CD1-CD1 4.38Å; L701-F747 HydrophobicContact CD1-CE1 3.62Å; N715-F747 WeakPolarHBondContact O-CB 3.26Å; D716-F747 WeakPolarHBondContact CA-O 3.32Å; T717-F747 HydrophobicContact CG2-CB 4.25Å; T717-F747 HydrophobicContact CG2-CD2 3.88Å; T717-F747 PolarHBondContact N-O 3.48Å; T717-F747 PolarHBondContact OG1-N 3.33Å; T717-F747 PolarHBondContact OG1-O 2.9Å; V736-F747 HydrophobicContact CG1-CD1 3.83Å; V736-F747 HydrophobicContact CG2-CB 3.7Å; V736-F747 HydrophobicContact CG2-CD1 4.27Å; V736-F747 HydrophobicContact CG2-CG 4.41Å; T737-F747 WeakPolarHBondContact O-CA 3.2Å
748	V	74.6	Confident	67.5	Low	21 Å²	21	56 Å²	56	13%	0.127	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	161.9	-177.8	-60.1	0	0	0	0	111.6	M718 V736 T737 L739	M718-V748 HydrophobicContact CB-CG1 3.83Å; M718-V748 HydrophobicContact CG-CG1 3.49Å; M718-V748 VanDerWaalsContact CG-CG1 3.49Å; V736-V748 WeakPolarHBondContact CG2-O 3.29Å; T737-V748 WeakPolarHBondContact CB-O 3.4Å; T737-V748 HydrophobicContact CG2-CG2 4.21Å; T737-V748 PolarHBondContact N-O 3.31Å; T737-V748 PolarHBondContact O-N 3.07Å; L739-V748 HydrophobicContact CD1-CB 4.42Å; L739-V748 HydrophobicContact CD1-CG1 3.92Å; L739-V748 HydrophobicContact CD1-CG2 3.58Å; L739-V748 HydrophobicContact CG-CG2 4.39Å
749	N	69	Low	66	Low	107 Å²	107	57.8 Å²	57.8	57%	0.572	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.7	57.8	177.2	-61.5	-12	0	0	0	113.7	L751	N749-L751 PolarHBondContact O-N 2.81Å; N749-L751 VanDerWaalsContact O-N 3.15Å
750	P	66.1	Low	64.6	Low	27 Å²	27	56 Å²	56	18%	0.175	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	121	174.4	29.1	-35	0	0	0	109.4	C714 D716 V729 R735	C714-P750 HydrophobicContact CB-CB 4.06Å; D716-P750 HydrophobicContact CB-CG 4.04Å; V729-P750 HydrophobicContact CB-CB 4.28Å; V729-P750 HydrophobicContact CG2-CB 3.82Å; V729-P750 HydrophobicContact CG2-CG 4.1Å; R735-P750 CarbonylContact O-C 3.54Å; R735-P750 WeakPolarHBondContact O-CA 3.46Å
751	L	66.4	Low	63.5	Low	95 Å²	95	54.3 Å²	54.3	50%	0.497	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	107.2	-179.8	-79.8	159.8	0	0	0	107.5	R735 N749	R735-L751 WeakPolarHBondContact CA-O 3.37Å; R735-L751 HydrophobicContact CB-CB 4.29Å; R735-L751 WeakPolarHBondContact CB-O 3.34Å; R735-L751 PolarHBondContact N-O 2.86Å; R735-L751 PolarHBondContact O-N 2.82Å; N749-L751 PolarHBondContact O-N 2.81Å; N749-L751 VanDerWaalsContact O-N 3.15Å
752	G	57.2	Low	62.7	Low	17 Å²	17	52.2 Å²	52.2	18%	0.175	30%	0.297	C	S	.	.			trans	-127.3	138.4	167.1	0	0	0	0	0	107	R754	G752-R754 VanDerWaalsContact C-N 3.25Å; G752-R754 PolarHBondContact O-N 3.24Å
753	P	50.7	Low	61.8	Low	23 Å²	23	48.7 Å²	48.7	15%	0.149	27%	0.268	C	S	.	.			trans	-58.7	97.2	165	22	-28.8	0	0	0	108	G755 S756 S785	P753-G755 PolarHBondContact O-N 3.12Å; P753-S756 WeakPolarHBondContact O-CB 3.21Å; P753-S756 PolarHBondContact O-N 2.76Å; P753-S756 PolarHBondContact O-OG 3.07Å; P753-S785 VanDerWaalsContact CB-OG 3.26Å; P753-S785 WeakPolarHBondContact CB-OG 3.41Å
754	R	46.7	Very low	60.8	Low	107 Å²	107	48 Å²	48	40%	0.404	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	123.4	170.1	-80.5	-174.1	179.9	-177.3	1.6	105.8	N556 G752	N556-R754 PolarHBondContact OD1-NH1 3.2Å; G752-R754 VanDerWaalsContact C-N 3.25Å; G752-R754 PolarHBondContact O-N 3.24Å
755	G	45.6	Very low	59.3	Low	12 Å²	12	44.1 Å²	44.1	12%	0.124	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	18.3	-173.3	0	0	0	0	0	115.2	A501 P753 M757	A501-G755 VanDerWaalsContact O-CA 3.24Å; A501-G755 WeakPolarHBondContact O-CA 3.29Å; P753-G755 PolarHBondContact O-N 3.12Å; G755-M757 PolarHBondContact O-N 3.05Å
756	S	49.5	Very low	57.6	Low	6 Å²	6	48.9 Å²	48.9	4%	0.042	26%	0.259	C	S	.	.			trans	-58.4	122.2	170.1	33.6	0	0	0	0	110.8	S731 P753 E784	S731-S756 WeakPolarHBondContact CB-OG 3.42Å; P753-S756 WeakPolarHBondContact O-CB 3.21Å; P753-S756 PolarHBondContact O-N 2.76Å; P753-S756 PolarHBondContact O-OG 3.07Å; S756-E784 VanDerWaalsContact CA-O 3.28Å; S756-E784 WeakPolarHBondContact CA-O 3.41Å
757	M	51	Low	55.8	Low	38 Å²	38	53.4 Å²	53.4	19%	0.187	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	138.1	177	-168.1	176.4	82.9	0	0	109.2	F634 G755 V759 Y783 E784	F634-M757 HydrophobicContact CD2-SD 4.08Å; F634-M757 HydrophobicContact CE1-CE 3.95Å; F634-M757 HydrophobicContact CE1-SD 3.79Å; F634-M757 HydrophobicContact CE2-CE 4.19Å; F634-M757 HydrophobicContact CE2-SD 3.16Å; F634-M757 WeakPolarHBondContact CE2-SD 3.19Å; F634-M757 HydrophobicContact CZ-CE 3.42Å; F634-M757 VanDerWaalsContact CZ-CE 3.42Å; F634-M757 HydrophobicContact CZ-SD 3.01Å; F634-M757 WeakPolarHBondContact CZ-SD 3.41Å; G755-M757 PolarHBondContact O-N 3.05Å; M757-V759 HydrophobicContact CE-CG2 4.49Å; M757-V759 WeakPolarHBondContact O-CG2 3.38Å; M757-V759 PolarHBondContact O-N 3.31Å; M757-V759 VanDerWaalsContact O-N 3.15Å; M757-Y783 WeakPolarHBondContact O-CA 3.35Å; M757-E784 PolarHBondContact N-O 3.26Å; M757-E784 PolarHBondContact O-N 3.4Å; M757-E784 VanDerWaalsContact O-N 3.09Å
758	Q	53.8	Low	54.1	Low	14 Å²	14	53.2 Å²	53.2	7%	0.065	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	107.2	171.7	-167.7	173.1	6.4	0	0	109	T653 Y783	T653-Q758 HydrophobicContact CG2-CG 4.23Å; Q758-Y783 HydrophobicContact CB-CD1 3.93Å; Q758-Y783 HydrophobicContact CB-CE1 3.71Å; Q758-Y783 HydrophobicContact CG-CD1 4.3Å; Q758-Y783 HydrophobicContact CG-CE1 3.9Å
759	V	52.4	Low	52.1	Low	38 Å²	38	60.5 Å²	60.5	23%	0.23	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-37.1	-172.3	179	0	0	0	0	112.1	G650 M757 L782 E784	G650-V759 WeakPolarHBondContact CA-O 3.43Å; M757-V759 HydrophobicContact CE-CG2 4.49Å; M757-V759 WeakPolarHBondContact O-CG2 3.38Å; M757-V759 PolarHBondContact O-N 3.31Å; M757-V759 VanDerWaalsContact O-N 3.15Å; V759-L782 HydrophobicContact CB-CD2 4.47Å; V759-L782 PolarHBondContact N-O 2.57Å; V759-E784 HydrophobicContact CG2-CB 3.37Å
760	A	54.2	Low	50.7	Low	21 Å²	21	60.2 Å²	60.2	17%	0.174	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	152.4	-178	0	0	0	0	0	112.9	L782	A760-L782 PolarHBondContact O-N 2.99Å
761	I	56.8	Low	49.4	Very low	0 Å²	0	62 Å²	62	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	114.6	163.3	-57.7	168.4	0	0	0	108.4	L651 N652 T653 A663 L667 M669 I779 Y780 F781	L651-I761 PolarHBondContact O-N 2.77Å; N652-I761 HydrophobicContact CB-CB 4.16Å; N652-I761 HydrophobicContact CB-CD1 4.38Å; N652-I761 PolarHBondContact ND2-O 3.01Å; T653-I761 HydrophobicContact CG2-CD1 3.83Å; T653-I761 HydrophobicContact CG2-CG1 4.08Å; A663-I761 HydrophobicContact CB-CD1 3.54Å; L667-I761 HydrophobicContact CD1-CG2 3.88Å; L667-I761 HydrophobicContact CD2-CD1 4.05Å; L667-I761 HydrophobicContact CD2-CG2 4.31Å; M669-I761 HydrophobicContact SD-CG2 4.49Å; I761-I779 HydrophobicContact CG2-CG2 3.77Å; I761-Y780 VanDerWaalsContact CA-O 3.27Å; I761-Y780 WeakPolarHBondContact CA-O 3.03Å; I761-F781 HydrophobicContact CB-CD1 4.29Å; I761-F781 HydrophobicContact CB-CE1 4.42Å; I761-F781 HydrophobicContact CD1-CD1 4.24Å; I761-F781 HydrophobicContact CD1-CE1 3.89Å; I761-F781 HydrophobicContact CD1-CE2 4.44Å; I761-F781 HydrophobicContact CD1-CZ 4Å; I761-F781 HydrophobicContact CG1-CD1 3.77Å; I761-F781 HydrophobicContact CG1-CE1 3.91Å; I761-F781 HydrophobicContact CG1-CG 4.17Å; I761-F781 HydrophobicContact CG1-CZ 4.42Å; I761-F781 HydrophobicContact CG2-CD1 3.79Å; I761-F781 HydrophobicContact CG2-CE1 3.67Å
762	S	59.1	Low	48	Very low	29 Å²	29	61.9 Å²	61.9	20%	0.203	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	157.8	-178.8	72.1	0	0	0	0	112.2	F764 Y780	S762-F764 WeakPolarHBondContact CB-O 3.34Å; S762-F764 PolarHBondContact OG-O 2.78Å; S762-Y780 PolarHBondContact N-O 2.85Å; S762-Y780 WeakPolarHBondContact O-CD2 3.29Å; S762-Y780 PolarHBondContact O-N 2.95Å
763	A	54.6	Low	47.2	Very low	33 Å²	33	67.1 Å²	67.1	27%	0.273	39%	0.389	S	S	.	.	S	Bend	trans	-96.5	-6.1	170.9	0	0	0	0	0	111.6	M669	M669-A763 HydrophobicContact CE-CB 3.6Å
764	F	54.5	Low	47	Very low	138 Å²	138	68.3 Å²	68.3	61%	0.605	41%	0.405	S	S	*	.	S	Bend	trans	-128.4	135.9	177.1	-62.6	-72.3	0	0	0	109.7	N670 S762 K766	N670-F764 WeakPolarHBondContact ND2-CE2 3.09Å; S762-F764 WeakPolarHBondContact CB-O 3.34Å; S762-F764 PolarHBondContact OG-O 2.78Å; F764-K766 PolarHBondContact O-N 2.9Å; F764-K766 VanDerWaalsContact O-N 3.12Å
765	P	47.6	Very low	47.6	Very low	43 Å²	43	72.9 Å²	72.9	28%	0.279	43%	0.431	S	S	.	.			trans	-65.9	111.9	167.3	27.4	-30	0	0	0	107.3	S767 I768	P765-S767 PolarHBondContact O-N 2.92Å; P765-S767 VanDerWaalsContact O-N 3.14Å; P765-I768 HydrophobicContact CB-CB 4.47Å
766	K	41	Very low	48.6	Very low	173 Å²	173	75.6 Å²	75.6	75%	0.752	44%	0.443	S	S	*	.	S	Bend	trans	-64.4	117.2	162	-77.1	-175.2	177.1	-179.4	0	105.9	F764 I768	F764-K766 PolarHBondContact O-N 2.9Å; F764-K766 VanDerWaalsContact O-N 3.12Å; K766-I768 PolarHBondContact O-N 3.12Å
767	S	42.6	Very low	49.6	Very low	124 Å²	124	77.3 Å²	77.3	87%	0.867	45%	0.454	S	S	*	.	S	Bend	trans	62.2	22	168	77.2	0	0	0	0	120.9	P765	P765-S767 PolarHBondContact O-N 2.92Å; P765-S767 VanDerWaalsContact O-N 3.14Å
768	I	42.1	Very low	51	Low	51 Å²	51	76.8 Å²	76.8	26%	0.262	45%	0.451	S	S	.	.			trans	-117.1	97.8	172.7	-54.7	172.8	0	0	0	109.5	P765 K766 C770 F771 L828	P765-I768 HydrophobicContact CB-CB 4.47Å; K766-I768 PolarHBondContact O-N 3.12Å; I768-C770 HydrophobicContact CG2-CB 4.07Å; I768-C770 PolarHBondContact O-N 3.24Å; I768-F771 HydrophobicContact CG2-CE2 4.48Å; I768-L828 HydrophobicContact CD1-CD2 3.83Å
769	N	34	Very low	52.5	Low	175 Å²	175	76.1 Å²	76.1	94%	0.936	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	21	-176.7	-93.5	-4.3	0	0	0	115
770	C	38.4	Very low	54	Low	101 Å²	101	75.1 Å²	75.1	68%	0.682	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	1.4	-170.5	-65.8	0	0	0	0	115.9	I768	I768-C770 HydrophobicContact CG2-CB 4.07Å; I768-C770 PolarHBondContact O-N 3.24Å
771	F	38.6	Very low	55.6	Low	63 Å²	63	74.1 Å²	74.1	28%	0.276	43%	0.432	S	S	.	.			trans	-109.7	118.9	-172.5	-65	-77.3	0	0	0	113	I768 S773 M799 I801	I768-F771 HydrophobicContact CG2-CE2 4.48Å; F771-S773 PolarHBondContact O-N 2.88Å; F771-M799 HydrophobicContact CE2-CE 3.94Å; F771-M799 HydrophobicContact CZ-CE 3.83Å; F771-I801 HydrophobicContact CE1-CD1 3.73Å; F771-I801 HydrophobicContact CZ-CD1 3.65Å
772	A	38.1	Very low	56.8	Low	94 Å²	94	76.8 Å²	76.8	78%	0.777	45%	0.446	S	S	*	.			trans	-57.8	132.5	167.7	0	0	0	0	0	109.8	G774	A772-G774 VanDerWaalsContact C-N 3.26Å; A772-G774 PolarHBondContact O-N 2.81Å
773	S	39.1	Very low	57.7	Low	127 Å²	127	76 Å²	76	89%	0.888	44%	0.438	S	S	*	.			trans	-60.4	81.8	176.4	174.7	0	0	0	0	111.1	F771	F771-S773 PolarHBondContact O-N 2.88Å
774	G	48.1	Very low	58.5	Low	47 Å²	47	77.6 Å²	77.6	49%	0.485	44%	0.44	S	S	.	.			trans	-70.3	143.8	169.8	0	0	0	0	0	110.9	A772 L776	A772-G774 VanDerWaalsContact C-N 3.26Å; A772-G774 PolarHBondContact O-N 2.81Å; G774-L776 PolarHBondContact O-N 2.85Å
775	Q	58.9	Low	59.1	Low	203 Å²	203	71.1 Å²	71.1	95%	0.949	41%	0.412	S	S	*	.	S	Bend	trans	-64.5	-15	179.9	-81.1	-176.7	-27.1	0	0	114.7
776	L	65.8	Low	59.6	Low	69 Å²	69	72 Å²	72	36%	0.361	41%	0.411	S	S	.	.	S	Bend	trans	-105.8	142.7	-175	-67.7	168.3	0	0	0	111.8	G774 C804 H868	G774-L776 PolarHBondContact O-N 2.85Å; L776-C804 HydrophobicContact CB-CB 4.37Å; L776-C804 WeakPolarHBondContact CD1-O 3.38Å; L776-H868 HydrophobicContact CD2-CB 4.3Å
777	P	71.5	Confident	60.3	Low	42 Å²	42	65.9 Å²	65.9	27%	0.273	39%	0.393	S	S	.	.			trans	-65	147.7	-178.6	26.1	-32.6	0	0	0	112.1	F674 C804 P840	F674-P777 HydrophobicContact CE1-CB 4.34Å; F674-P777 HydrophobicContact CE1-CG 4.3Å; F674-P777 HydrophobicContact CZ-CB 4.24Å; P777-C804 HydrophobicContact CG-CB 4.27Å; P777-C804 WeakPolarHBondContact O-CB 3.09Å; P777-C804 PolarHBondContact O-N 3.47Å; P777-P840 HydrophobicContact CG-CG 4.22Å
778	Q	79.9	Confident	60.8	Low	27 Å²	27	63.7 Å²	63.7	13%	0.126	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	145.3	177.1	-63.4	-178.6	17.9	0	0	110.7	Y780 I801 F802	Q778-Y780 HydrophobicContact CB-CE2 4.04Å; Q778-Y780 PolarHBondContact OE1-OH 2.91Å; Q778-Y780 VanDerWaalsContact OE1-OH 3.13Å; Q778-I801 HydrophobicContact CB-CG2 4.47Å; Q778-F802 VanDerWaalsContact CA-O 3.28Å; Q778-F802 WeakPolarHBondContact CA-O 3.43Å
779	I	84.6	Confident	61.5	Low	1 Å²	1	62.6 Å²	62.6	1%	0.005	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.4	177.8	-49.2	164.9	0	0	0	108.2	L667 M669 F674 L676 I761 F781 F802	L667-I779 HydrophobicContact CD1-CD1 4.27Å; L667-I779 HydrophobicContact CD1-CG2 3.83Å; M669-I779 HydrophobicContact SD-CG2 4.43Å; F674-I779 HydrophobicContact CB-CD1 3.91Å; F674-I779 HydrophobicContact CD1-CD1 3.67Å; F674-I779 HydrophobicContact CD1-CG1 4.37Å; F674-I779 HydrophobicContact CD2-CD1 4.37Å; F674-I779 HydrophobicContact CE1-CD1 4.22Å; F674-I779 HydrophobicContact CE1-CG1 4.45Å; F674-I779 HydrophobicContact CG-CD1 3.74Å; L676-I779 HydrophobicContact CD1-CD1 4.14Å; L676-I779 HydrophobicContact CD2-CD1 4.2Å; L676-I779 HydrophobicContact CG-CD1 4.43Å; I761-I779 HydrophobicContact CG2-CG2 3.77Å; I779-F781 HydrophobicContact CG2-CD1 4.19Å; I779-F781 HydrophobicContact CG2-CE1 3.91Å; I779-F802 HydrophobicContact CB-CB 4.09Å; I779-F802 HydrophobicContact CB-CD2 4.4Å; I779-F802 PolarHBondContact N-O 2.93Å; I779-F802 PolarHBondContact O-N 2.94Å
780	Y	84.9	Confident	62.2	Low	16 Å²	16	61.2 Å²	61.2	6%	0.063	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.9	-176.5	-56.5	-91.5	0	0	0	109.8	I761 S762 Q778 M799 I800 I801	I761-Y780 VanDerWaalsContact CA-O 3.27Å; I761-Y780 WeakPolarHBondContact CA-O 3.03Å; S762-Y780 PolarHBondContact N-O 2.85Å; S762-Y780 WeakPolarHBondContact O-CD2 3.29Å; S762-Y780 PolarHBondContact O-N 2.95Å; Q778-Y780 HydrophobicContact CB-CE2 4.04Å; Q778-Y780 PolarHBondContact OE1-OH 2.91Å; Q778-Y780 VanDerWaalsContact OE1-OH 3.13Å; Y780-M799 HydrophobicContact CD1-CG 4.23Å; Y780-M799 HydrophobicContact CD1-SD 3.73Å; Y780-M799 HydrophobicContact CE1-SD 4.41Å; Y780-I800 CarbonylContact C-O 3.23Å; Y780-I800 WeakPolarHBondContact CA-O 3.47Å; Y780-I801 HydrophobicContact CD1-CB 4.49Å; Y780-I801 HydrophobicContact CD1-CG1 3.92Å; Y780-I801 HydrophobicContact CD1-CG2 4.27Å; Y780-I801 HydrophobicContact CE1-CG1 4.05Å; Y780-I801 HydrophobicContact CE1-CG2 3.94Å
781	F	86.5	Confident	63.2	Low	1 Å²	1	61.7 Å²	61.7	0%	0.004	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	119.6	167.3	-71	20.5	0	0	0	107.8	A663 L667 L676 I761 I779 Y783 M799 I800 F802	A663-F781 HydrophobicContact CB-CE2 4.22Å; A663-F781 HydrophobicContact CB-CZ 4.34Å; L667-F781 HydrophobicContact CD1-CE1 4.14Å; L676-F781 HydrophobicContact CD1-CE1 3.9Å; L676-F781 HydrophobicContact CD1-CZ 3.71Å; I761-F781 HydrophobicContact CB-CD1 4.29Å; I761-F781 HydrophobicContact CB-CE1 4.42Å; I761-F781 HydrophobicContact CD1-CD1 4.24Å; I761-F781 HydrophobicContact CD1-CE1 3.89Å; I761-F781 HydrophobicContact CD1-CE2 4.44Å; I761-F781 HydrophobicContact CD1-CZ 4Å; I761-F781 HydrophobicContact CG1-CD1 3.77Å; I761-F781 HydrophobicContact CG1-CE1 3.91Å; I761-F781 HydrophobicContact CG1-CG 4.17Å; I761-F781 HydrophobicContact CG1-CZ 4.42Å; I761-F781 HydrophobicContact CG2-CD1 3.79Å; I761-F781 HydrophobicContact CG2-CE1 3.67Å; I779-F781 HydrophobicContact CG2-CD1 4.19Å; I779-F781 HydrophobicContact CG2-CE1 3.91Å; F781-Y783 HydrophobicContact CB-CE2 3.84Å; F781-M799 CarbonylContact O-C 3.51Å; F781-M799 WeakPolarHBondContact O-CA 3.44Å; F781-I800 HydrophobicContact CB-CB 4.18Å; F781-I800 PolarHBondContact N-O 2.68Å; F781-I800 PolarHBondContact O-N 3.25Å; F781-F802 HydrophobicContact CB-CE2 4.48Å; F781-F802 HydrophobicContact CD1-CD2 4.02Å; F781-F802 AromaticContact CD1-CE2 3.59Å; F781-F802 HydrophobicContact CD1-CE2 3.59Å; F781-F802 AromaticContact CD2-CE2 3.85Å; F781-F802 HydrophobicContact CD2-CE2 3.85Å; F781-F802 HydrophobicContact CD2-CZ 4.35Å; F781-F802 HydrophobicContact CE1-CD2 4.06Å; F781-F802 AromaticContact CE1-CE2 3.64Å; F781-F802 HydrophobicContact CE1-CE2 3.64Å; F781-F802 HydrophobicContact CE1-CZ 4.48Å; F781-F802 AromaticContact CE2-CE2 3.9Å; F781-F802 HydrophobicContact CE2-CE2 3.9Å; F781-F802 HydrophobicContact CE2-CZ 4.15Å; F781-F802 HydrophobicContact CG-CD2 4.5Å; F781-F802 AromaticContact CG-CE2 3.71Å; F781-F802 HydrophobicContact CG-CE2 3.71Å; F781-F802 AromaticContact CZ-CE2 3.8Å; F781-F802 HydrophobicContact CZ-CE2 3.8Å; F781-F802 HydrophobicContact CZ-CZ 4.22Å
782	L	82.1	Confident	64.7	Low	56 Å²	56	59 Å²	59	29%	0.293	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.7	177.9	-177.1	67	0	0	0	110	V759 A760	V759-L782 HydrophobicContact CB-CD2 4.47Å; V759-L782 PolarHBondContact N-O 2.57Å; A760-L782 PolarHBondContact O-N 2.99Å
783	Y	79.2	Confident	65.9	Low	13 Å²	13	59.3 Å²	59.3	5%	0.051	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.7	170.4	-58.6	-94.6	0	0	0	109.3	A732 M757 Q758 F781 H797 T798 I800	A732-Y783 HydrophobicContact CB-CD1 3.87Å; A732-Y783 HydrophobicContact CB-CE1 3.4Å; A732-Y783 VanDerWaalsContact CB-CE1 3.4Å; M757-Y783 WeakPolarHBondContact O-CA 3.35Å; Q758-Y783 HydrophobicContact CB-CD1 3.93Å; Q758-Y783 HydrophobicContact CB-CE1 3.71Å; Q758-Y783 HydrophobicContact CG-CD1 4.3Å; Q758-Y783 HydrophobicContact CG-CE1 3.9Å; F781-Y783 HydrophobicContact CB-CE2 3.84Å; Y783-H797 CarbonylContact O-C 3.56Å; Y783-H797 WeakPolarHBondContact O-CA 3.34Å; Y783-T798 PolarHBondContact N-O 3.15Å; Y783-T798 PolarHBondContact O-N 2.81Å; Y783-I800 HydrophobicContact CD2-CD1 4.35Å; Y783-I800 HydrophobicContact CD2-CG1 4.41Å; Y783-I800 HydrophobicContact CE2-CD1 3.47Å; Y783-I800 VanDerWaalsContact CE2-CD1 3.47Å; Y783-I800 HydrophobicContact CE2-CG1 3.91Å
784	E	72.1	Confident	67	Low	66 Å²	66	55.6 Å²	55.6	31%	0.308	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.2	177.6	-173	-176.8	160.7	0	0	109.5	S756 M757 V759	S756-E784 VanDerWaalsContact CA-O 3.28Å; S756-E784 WeakPolarHBondContact CA-O 3.41Å; M757-E784 PolarHBondContact N-O 3.26Å; M757-E784 PolarHBondContact O-N 3.4Å; M757-E784 VanDerWaalsContact O-N 3.09Å; V759-E784 HydrophobicContact CG2-CB 3.37Å
785	S	67	Low	67.9	Low	1 Å²	1	53.5 Å²	53.5	1%	0.007	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.3	176	-172.8	0	0	0	0	110.4	P753 A787 Y796	P753-S785 VanDerWaalsContact CB-OG 3.26Å; P753-S785 WeakPolarHBondContact CB-OG 3.41Å; S785-A787 PolarHBondContact O-N 3.18Å; S785-A787 PolarHBondContact OG-N 3.13Å; S785-Y796 WeakPolarHBondContact CB-O 3.06Å; S785-Y796 PolarHBondContact N-O 2.97Å
786	F	57.5	Low	68.7	Low	62 Å²	62	47.2 Å²	47.2	27%	0.272	26%	0.263	S	S	.	.			trans	-73.5	-5.5	173.4	-56.8	-69.5	0	0	0	113.8	I788	F786-I788 PolarHBondContact O-N 2.88Å; F786-I788 VanDerWaalsContact O-N 3.15Å
787	A	55.5	Low	69.4	Low	44 Å²	44	46.5 Å²	46.5	36%	0.364	26%	0.258	S	S	.	.			trans	-71.2	107.9	175.2	0	0	0	0	0	109.6	S785 G795 Y796	S785-A787 PolarHBondContact O-N 3.18Å; S785-A787 PolarHBondContact OG-N 3.13Å; A787-G795 WeakPolarHBondContact O-CA 3.49Å; A787-Y796 HydrophobicContact CB-CD2 4.14Å; A787-Y796 HydrophobicContact CB-CE2 4.33Å; A787-Y796 WeakPolarHBondContact O-CD2 3.4Å; A787-Y796 WeakPolarHBondContact O-CE2 3.02Å
788	I	53.7	Low	70	Confident	79 Å²	79	44.9 Å²	44.9	41%	0.405	25%	0.247	S	C	.	.			trans	-93.2	137.5	176	-61.8	166.6	0	0	0	108.2	F786	F786-I788 PolarHBondContact O-N 2.88Å; F786-I788 VanDerWaalsContact O-N 3.15Å
789	S	56.1	Low	70.3	Confident	28 Å²	28	44 Å²	44	20%	0.196	24%	0.243	C	C	.	.			trans	-128.5	169.7	172.6	77.2	0	0	0	0	111	T791 C792 S793 Y796	S789-T791 VanDerWaalsContact C-N 3.27Å; S789-T791 PolarHBondContact O-N 3.25Å; S789-C792 PolarHBondContact N-O 3.29Å; S789-C792 CarbonylContact O-C 3.54Å; S789-C792 PolarHBondContact O-N 3.25Å; S789-C792 VanDerWaalsContact O-N 3.11Å; S789-C792 WeakPolarHBondContact OG-CB 3.32Å; S789-C792 PolarHBondContact OG-N 2.84Å; S789-S793 PolarHBondContact O-N 2.68Å; S789-Y796 WeakPolarHBondContact CB-OH 3.33Å; S789-Y796 PolarHBondContact OG-OH 3.26Å
790	R	49.1	Very low	70.5	Confident	145 Å²	145	43.9 Å²	43.9	55%	0.547	24%	0.243	S	C	.	.	S	Bend	trans	-59	-36.4	179.5	-152.2	-179.6	-167.1	-171.6	1.4	113.1	E540	E540-R790 VanDerWaalsContact CB-CZ 3.48Å; E540-R790 PolarHBondContact O-NE 2.87Å; E540-R790 PolarHBondContact O-NH2 2.62Å; E540-R790 IonicContact OE1-CZ 3.67Å; E540-R790 IonicContact OE1-NH1 3.81Å; E540-R790 PolarHBondContact OE1-NH1 2.86Å; E540-R790 IonicContact OE1-NH2 2.76Å; E540-R790 PolarHBondContact OE1-NH2 2.85Å; E540-R790 IonicContact OE2-CZ 3.58Å; E540-R790 IonicContact OE2-NH1 3.78Å; E540-R790 PolarHBondContact OE2-NH1 2.8Å; E540-R790 IonicContact OE2-NH2 3.69Å
791	T	59.1	Low	70.7	Confident	111 Å²	111	43.2 Å²	43.2	68%	0.681	24%	0.24	S	C	*	.	S	Bend	trans	-81.1	-30.3	176.5	-44.4	0	0	0	0	111.5	S789 C827	S789-T791 VanDerWaalsContact C-N 3.27Å; S789-T791 PolarHBondContact O-N 3.25Å; T791-C827 PolarHBondContact O-SG 2.93Å; T791-C827 VanDerWaalsContact O-SG 3.4Å
792	C	70.2	Confident	70.9	Confident	6 Å²	6	43.1 Å²	43.1	4%	0.041	24%	0.24	C	C	.	.			trans	-121.7	72.9	-173	-49.5	0	0	0	0	111.2	S789 G794 G795 Y796 C827	S789-C792 PolarHBondContact N-O 3.29Å; S789-C792 CarbonylContact O-C 3.54Å; S789-C792 PolarHBondContact O-N 3.25Å; S789-C792 VanDerWaalsContact O-N 3.11Å; S789-C792 WeakPolarHBondContact OG-CB 3.32Å; S789-C792 PolarHBondContact OG-N 2.84Å; C792-G794 PolarHBondContact O-N 2.75Å; C792-G795 PolarHBondContact O-N 3.36Å; C792-Y796 HydrophobicContact CB-CD1 4.46Å; C792-Y796 HydrophobicContact CB-CE1 4.25Å; C792-Y796 VanDerWaalsContact SG-CE1 3.59Å; C792-C827 WeakPolarHBondContact CA-SG 3.36Å; C792-C827 HydrophobicContact CB-CB 3.74Å; C792-C827 WeakPolarHBondContact CB-SG 3.49Å; C792-C827 WeakPolarHBondContact SG-CA 3.21Å; C792-C827 WeakPolarHBondContact SG-CB 3.39Å; C792-C827 CovalentContact SG-SG 2.03Å; C792-C827 PolarHBondContact SG-SG 3.49Å
793	S	62.2	Low	71.3	Confident	102 Å²	102	45.4 Å²	45.4	71%	0.713	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-32.1	179.6	56.8	0	0	0	0	113.3	S789 G795	S789-S793 PolarHBondContact O-N 2.68Å; S793-G795 VanDerWaalsContact C-N 3.25Å; S793-G795 PolarHBondContact O-N 3.22Å
794	G	62.9	Low	71.7	Confident	49 Å²	49	44.8 Å²	44.8	51%	0.505	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	2.7	174.3	0	0	0	0	0	114.7	C792 H797	C792-G794 PolarHBondContact O-N 2.75Å; G794-H797 PolarHBondContact O-CE1 2.86Å
795	G	66.7	Low	72.4	Confident	3 Å²	3	44.2 Å²	44.2	3%	0.031	24%	0.241	C	C	.	.			trans	81.7	173.4	-172.1	0	0	0	0	0	113.5	A787 C792 S793 H797	A787-G795 WeakPolarHBondContact O-CA 3.49Å; C792-G795 PolarHBondContact O-N 3.36Å; S793-G795 VanDerWaalsContact C-N 3.25Å; S793-G795 PolarHBondContact O-N 3.22Å; G795-H797 PolarHBondContact O-ND1 3.27Å; G795-H797 VanDerWaalsContact O-ND1 3.1Å
796	Y	75.4	Confident	73.2	Confident	70 Å²	70	46.2 Å²	46.2	28%	0.275	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	131.8	178.8	-62.6	-83.7	0	0	0	110.9	S785 A787 S789 C792 Y829	S785-Y796 WeakPolarHBondContact CB-O 3.06Å; S785-Y796 PolarHBondContact N-O 2.97Å; A787-Y796 HydrophobicContact CB-CD2 4.14Å; A787-Y796 HydrophobicContact CB-CE2 4.33Å; A787-Y796 WeakPolarHBondContact O-CD2 3.4Å; A787-Y796 WeakPolarHBondContact O-CE2 3.02Å; S789-Y796 WeakPolarHBondContact CB-OH 3.33Å; S789-Y796 PolarHBondContact OG-OH 3.26Å; C792-Y796 HydrophobicContact CB-CD1 4.46Å; C792-Y796 HydrophobicContact CB-CE1 4.25Å; C792-Y796 VanDerWaalsContact SG-CE1 3.59Å; Y796-Y829 HydrophobicContact CD1-CE2 4.15Å
797	H	81	Confident	74.4	Confident	54 Å²	54	47.3 Å²	47.3	25%	0.25	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.1	178.9	-63.3	82.2	0	0	0	109.4	Y783 G794 G795 C827 L828 Y829	Y783-H797 CarbonylContact O-C 3.56Å; Y783-H797 WeakPolarHBondContact O-CA 3.34Å; G794-H797 PolarHBondContact O-CE1 2.86Å; G795-H797 PolarHBondContact O-ND1 3.27Å; G795-H797 VanDerWaalsContact O-ND1 3.1Å; H797-C827 PolarHBondContact N-O 3.24Å; H797-L828 HydrophobicContact CB-CD1 3.81Å; H797-L828 WeakPolarHBondContact O-CA 3.16Å; H797-Y829 PolarHBondContact O-N 3.45Å
798	T	84.7	Confident	75.8	Confident	8 Å²	8	46.9 Å²	46.9	5%	0.049	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.2	172.2	-57.9	0	0	0	0	109.2	V733 Y783 Y829	V733-T798 HydrophobicContact CB-CG2 4.11Å; V733-T798 HydrophobicContact CG1-CG2 4.04Å; V733-T798 HydrophobicContact CG2-CG2 3.98Å; Y783-T798 PolarHBondContact N-O 3.15Å; Y783-T798 PolarHBondContact O-N 2.81Å; T798-Y829 CarbonylContact C-O 3.51Å; T798-Y829 WeakPolarHBondContact CA-O 3.31Å
799	M	86.5	Confident	77.3	Confident	8 Å²	8	52 Å²	52	4%	0.039	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	116.7	-179.5	-175.1	171.9	54.8	0	0	109.7	F771 Y780 F781 I801 L828 Y829 Q830 I831	F771-M799 HydrophobicContact CE2-CE 3.94Å; F771-M799 HydrophobicContact CZ-CE 3.83Å; Y780-M799 HydrophobicContact CD1-CG 4.23Å; Y780-M799 HydrophobicContact CD1-SD 3.73Å; Y780-M799 HydrophobicContact CE1-SD 4.41Å; F781-M799 CarbonylContact O-C 3.51Å; F781-M799 WeakPolarHBondContact O-CA 3.44Å; M799-I801 HydrophobicContact CE-CD1 4.06Å; M799-I801 HydrophobicContact CE-CG1 4.3Å; M799-I801 HydrophobicContact CG-CG1 4.1Å; M799-I801 HydrophobicContact SD-CG1 4.49Å; M799-L828 HydrophobicContact CB-CD1 4.28Å; M799-Y829 PolarHBondContact N-O 2.88Å; M799-Q830 HydrophobicContact CE-CG 3.82Å; M799-Q830 WeakPolarHBondContact O-CA 3.37Å; M799-I831 PolarHBondContact O-N 2.04Å
800	I	88.9	Confident	78.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.4	171.2	-51.6	176.2	0	0	0	108.1	V704 V733 Y780 F781 Y783 F802 I831 I833	V704-I800 HydrophobicContact CG1-CD1 3.46Å; V704-I800 VanDerWaalsContact CG1-CD1 3.46Å; V733-I800 HydrophobicContact CG2-CD1 3.87Å; V733-I800 HydrophobicContact CG2-CG1 4.34Å; Y780-I800 CarbonylContact C-O 3.23Å; Y780-I800 WeakPolarHBondContact CA-O 3.47Å; F781-I800 HydrophobicContact CB-CB 4.18Å; F781-I800 PolarHBondContact N-O 2.68Å; F781-I800 PolarHBondContact O-N 3.25Å; Y783-I800 HydrophobicContact CD2-CD1 4.35Å; Y783-I800 HydrophobicContact CD2-CG1 4.41Å; Y783-I800 HydrophobicContact CE2-CD1 3.47Å; Y783-I800 VanDerWaalsContact CE2-CD1 3.47Å; Y783-I800 HydrophobicContact CE2-CG1 3.91Å; I800-F802 HydrophobicContact CB-CE2 4.37Å; I800-F802 HydrophobicContact CG2-CD2 4.27Å; I800-F802 HydrophobicContact CG2-CE2 3.76Å; I800-F802 HydrophobicContact CG2-CZ 3.99Å; I800-I831 CarbonylContact C-O 3.59Å; I800-I831 WeakPolarHBondContact CA-O 3.03Å; I800-I833 HydrophobicContact CG2-CD1 3.46Å; I800-I833 VanDerWaalsContact CG2-CD1 3.46Å; I800-I833 HydrophobicContact CG2-CG1 3.92Å
801	I	89.3	Confident	80.7	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	108.1	-177.3	-53.2	167.1	0	0	0	108.1	F771 Q778 Y780 M799 R803 I831 V832 I833	F771-I801 HydrophobicContact CE1-CD1 3.73Å; F771-I801 HydrophobicContact CZ-CD1 3.65Å; Q778-I801 HydrophobicContact CB-CG2 4.47Å; Y780-I801 HydrophobicContact CD1-CB 4.49Å; Y780-I801 HydrophobicContact CD1-CG1 3.92Å; Y780-I801 HydrophobicContact CD1-CG2 4.27Å; Y780-I801 HydrophobicContact CE1-CG1 4.05Å; Y780-I801 HydrophobicContact CE1-CG2 3.94Å; M799-I801 HydrophobicContact CE-CD1 4.06Å; M799-I801 HydrophobicContact CE-CG1 4.3Å; M799-I801 HydrophobicContact CG-CG1 4.1Å; M799-I801 HydrophobicContact SD-CG1 4.49Å; I801-R803 PolarHBondContact O-N 3.06Å; I801-I831 PolarHBondContact N-O 2.93Å; I801-V832 HydrophobicContact CB-CG2 4.34Å; I801-V832 HydrophobicContact CD1-CG2 4.1Å; I801-V832 CarbonylContact O-C 3.5Å; I801-V832 WeakPolarHBondContact O-CA 3.17Å; I801-I833 PolarHBondContact O-N 3.12Å
802	F	89.9	Confident	82.3	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	114	171	-63.4	-92.9	0	0	0	109.2	L676 L679 I706 Q778 I779 F781 I800 I833 A838	L676-F802 HydrophobicContact CD1-CD1 4.49Å; L676-F802 HydrophobicContact CD1-CD2 4.44Å; L676-F802 HydrophobicContact CD1-CE1 4.48Å; L676-F802 HydrophobicContact CD1-CE2 4.44Å; L676-F802 HydrophobicContact CD1-CG 4.47Å; L676-F802 HydrophobicContact CD1-CZ 4.45Å; L676-F802 HydrophobicContact CD2-CD1 4.15Å; L679-F802 HydrophobicContact CD1-CD1 3.82Å; L679-F802 HydrophobicContact CD1-CE1 3.7Å; I706-F802 HydrophobicContact CD1-CE1 4.25Å; I706-F802 HydrophobicContact CD1-CZ 4.43Å; I706-F802 HydrophobicContact CG2-CE1 4.32Å; I706-F802 HydrophobicContact CG2-CZ 4.15Å; Q778-F802 VanDerWaalsContact CA-O 3.28Å; Q778-F802 WeakPolarHBondContact CA-O 3.43Å; I779-F802 HydrophobicContact CB-CB 4.09Å; I779-F802 HydrophobicContact CB-CD2 4.4Å; I779-F802 PolarHBondContact N-O 2.93Å; I779-F802 PolarHBondContact O-N 2.94Å; F781-F802 HydrophobicContact CB-CE2 4.48Å; F781-F802 HydrophobicContact CD1-CD2 4.02Å; F781-F802 AromaticContact CD1-CE2 3.59Å; F781-F802 HydrophobicContact CD1-CE2 3.59Å; F781-F802 AromaticContact CD2-CE2 3.85Å; F781-F802 HydrophobicContact CD2-CE2 3.85Å; F781-F802 HydrophobicContact CD2-CZ 4.35Å; F781-F802 HydrophobicContact CE1-CD2 4.06Å; F781-F802 AromaticContact CE1-CE2 3.64Å; F781-F802 HydrophobicContact CE1-CE2 3.64Å; F781-F802 HydrophobicContact CE1-CZ 4.48Å; F781-F802 AromaticContact CE2-CE2 3.9Å; F781-F802 HydrophobicContact CE2-CE2 3.9Å; F781-F802 HydrophobicContact CE2-CZ 4.15Å; F781-F802 HydrophobicContact CG-CD2 4.5Å; F781-F802 AromaticContact CG-CE2 3.71Å; F781-F802 HydrophobicContact CG-CE2 3.71Å; F781-F802 AromaticContact CZ-CE2 3.8Å; F781-F802 HydrophobicContact CZ-CE2 3.8Å; F781-F802 HydrophobicContact CZ-CZ 4.22Å; I800-F802 HydrophobicContact CB-CE2 4.37Å; I800-F802 HydrophobicContact CG2-CD2 4.27Å; I800-F802 HydrophobicContact CG2-CE2 3.76Å; I800-F802 HydrophobicContact CG2-CZ 3.99Å; F802-I833 CarbonylContact C-O 3.54Å; F802-I833 WeakPolarHBondContact CA-O 3.16Å; F802-I833 HydrophobicContact CD1-CB 4.01Å; F802-I833 HydrophobicContact CD1-CD1 4.38Å; F802-I833 HydrophobicContact CD1-CG2 4.07Å; F802-I833 HydrophobicContact CE1-CB 4.28Å; F802-I833 HydrophobicContact CE1-CD1 3.81Å; F802-I833 HydrophobicContact CE1-CG2 4.23Å; F802-I833 HydrophobicContact CZ-CD1 4.1Å; F802-A838 HydrophobicContact CB-CB 3.8Å
803	R	89.6	Confident	83.3	Confident	103 Å²	103	53.8 Å²	53.8	39%	0.389	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	123.2	176.7	179.2	175.8	-81.1	152.5	-6.7	109.8	I801 D805 V832 I833 T834 S835	I801-R803 PolarHBondContact O-N 3.06Å; R803-D805 PolarHBondContact O-N 3.03Å; R803-V832 HydrophobicContact CB-CG1 4.19Å; R803-I833 PolarHBondContact N-O 2.89Å; R803-T834 WeakPolarHBondContact O-CA 3.08Å; R803-S835 PolarHBondContact O-N 2.81Å
804	C	88.3	Confident	84.7	Confident	1 Å²	1	52 Å²	52	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	124.6	172.5	165.8	0	0	0	0	110.8	L776 P777 C839	L776-C804 HydrophobicContact CB-CB 4.37Å; L776-C804 WeakPolarHBondContact CD1-O 3.38Å; P777-C804 HydrophobicContact CG-CB 4.27Å; P777-C804 WeakPolarHBondContact O-CB 3.09Å; P777-C804 PolarHBondContact O-N 3.47Å; C804-C839 WeakPolarHBondContact CA-SG 3.34Å; C804-C839 HydrophobicContact CB-CB 3.96Å; C804-C839 WeakPolarHBondContact CB-SG 3.43Å; C804-C839 WeakPolarHBondContact SG-CA 3.24Å; C804-C839 WeakPolarHBondContact SG-CB 3.36Å; C804-C839 CovalentContact SG-SG 2.04Å; C804-C839 PolarHBondContact SG-SG 2.85Å
805	D	87.8	Confident	85.9	Confident	53 Å²	53	50.8 Å²	50.8	28%	0.283	26%	0.262	S	S	.	.			trans	-141.3	103.7	164.2	-172.6	-18.4	0	0	0	109.9	R803 A807 V808 T834 S835 R836	R803-D805 PolarHBondContact O-N 3.03Å; D805-A807 PolarHBondContact O-N 2.89Å; D805-A807 WeakPolarHBondContact OD1-CB 3.49Å; D805-A807 PolarHBondContact OD1-N 2.89Å; D805-V808 HydrophobicContact CB-CB 4.26Å; D805-V808 HydrophobicContact CB-CG2 3.9Å; D805-V808 VanDerWaalsContact CG-CG2 3.46Å; D805-V808 PolarHBondContact O-N 3.17Å; D805-V808 WeakPolarHBondContact OD2-CG2 3.21Å; D805-T834 HydrophobicContact CB-CG2 3.55Å; D805-S835 PolarHBondContact N-O 3.34Å; D805-S835 VanDerWaalsContact N-O 3.12Å; D805-S835 CarbonylContact O-C 3.57Å; D805-R836 WeakPolarHBondContact O-CA 3.44Å; D805-R836 WeakPolarHBondContact O-CB 3.48Å; D805-R836 PolarHBondContact O-N 3.4Å
806	P	83.3	Confident	86.9	Confident	43 Å²	43	51.5 Å²	51.5	28%	0.279	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-24	-179.9	-16.8	28	0	0	0	114.1	V808 R867	P806-V808 VanDerWaalsContact C-N 3.33Å; P806-R867 VanDerWaalsContact CG-O 3.31Å; P806-R867 WeakPolarHBondContact CG-O 3.45Å
807	A	82.2	Confident	87.2	Confident	86 Å²	86	54 Å²	54	71%	0.711	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-20.3	-176.8	0	0	0	0	0	112.5	D805 K809	D805-A807 PolarHBondContact O-N 2.89Å; D805-A807 WeakPolarHBondContact OD1-CB 3.49Å; D805-A807 PolarHBondContact OD1-N 2.89Å; A807-K809 PolarHBondContact O-N 2.87Å
808	V	85.9	Confident	87.2	Confident	34 Å²	34	56.4 Å²	56.4	21%	0.206	31%	0.312	C	S	.	.			trans	-78.1	120.9	-176.8	170.1	0	0	0	0	111.1	D805 P806 V810 T834	D805-V808 HydrophobicContact CB-CB 4.26Å; D805-V808 HydrophobicContact CB-CG2 3.9Å; D805-V808 VanDerWaalsContact CG-CG2 3.46Å; D805-V808 PolarHBondContact O-N 3.17Å; D805-V808 WeakPolarHBondContact OD2-CG2 3.21Å; P806-V808 VanDerWaalsContact C-N 3.33Å; V808-V810 WeakPolarHBondContact CG1-O 3.09Å; V808-T834 HydrophobicContact CG2-CG2 4.32Å
809	K	84.1	Confident	87.2	Confident	188 Å²	188	56.4 Å²	56.4	82%	0.817	31%	0.312	S	S	*	.	S	Bend	trans	-80	-33.7	174.2	-65.1	-175.1	-178.7	179.9	0	113.4	A807	A807-K809 PolarHBondContact O-N 2.87Å
810	V	87.4	Confident	86.9	Confident	103 Å²	103	59 Å²	59	62%	0.624	33%	0.329	S	S	*	.	S	Bend	trans	-121.9	120	-176.1	-178.8	0	0	0	0	109.3	V808	V808-V810 WeakPolarHBondContact CG1-O 3.09Å
811	S	90.1	Very high	86.5	Confident	30 Å²	30	61 Å²	61	21%	0.21	34%	0.34	C	S	.	.			trans	-60.6	137.1	178.2	-52	0	0	0	0	111.3	L679 T834 S835	L679-S811 WeakPolarHBondContact CD2-OG 3.46Å; S811-T834 WeakPolarHBondContact CA-O 3.48Å; S811-S835 WeakPolarHBondContact OG-CB 3.35Å; S811-S835 PolarHBondContact OG-OG 3.18Å
812	R	91.1	Very high	86.2	Confident	179 Å²	179	61 Å²	61	68%	0.675	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	136.6	179.8	-65.6	179.4	-175.3	166.9	-0.3	110.4	I833 T834	R812-I833 WeakPolarHBondContact O-CA 3.26Å; R812-T834 PolarHBondContact N-O 3.16Å; R812-T834 PolarHBondContact O-N 3.31Å
813	A	91.9	Very high	86	Confident	14 Å²	14	62 Å²	62	12%	0.116	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	130.3	171	0	0	0	0	0	110	I683 A685 I831 V832 I833	I683-A813 HydrophobicContact CD1-CB 3.8Å; I683-A813 HydrophobicContact CG1-CB 3.79Å; I683-A813 HydrophobicContact CG2-CB 4.18Å; A685-A813 HydrophobicContact CB-CB 3.87Å; A813-I831 HydrophobicContact CB-CG2 4.28Å; A813-V832 CarbonylContact C-O 3.6Å; A813-V832 WeakPolarHBondContact CA-O 3.09Å; A813-I833 HydrophobicContact CB-CG1 4.12Å
814	T	91.3	Very high	85.7	Confident	66 Å²	66	61.5 Å²	61.5	41%	0.405	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	152.3	-176.2	52.5	0	0	0	0	109.8	V832	T814-V832 PolarHBondContact N-O 2.85Å; T814-V832 WeakPolarHBondContact O-CA 3.3Å; T814-V832 PolarHBondContact O-N 2.9Å; T814-V832 PolarHBondContact OG1-O 3.01Å
815	L	89.5	Confident	85.3	Confident	23 Å²	23	65.8 Å²	65.8	12%	0.12	38%	0.38	C	S	.	.			trans	-87.1	151.1	172.1	-55.3	-179	0	0	0	110.1	A685 G687 F702 P820 I831	A685-L815 HydrophobicContact CB-CD2 4.09Å; G687-L815 VanDerWaalsContact CA-CD1 3.47Å; F702-L815 HydrophobicContact CD2-CD1 4.07Å; F702-L815 HydrophobicContact CD2-CD2 3.95Å; F702-L815 HydrophobicContact CE2-CD1 3.63Å; F702-L815 HydrophobicContact CE2-CD2 4.03Å; F702-L815 HydrophobicContact CE2-CG 4.48Å; L815-P820 WeakPolarHBondContact CD1-O 3.31Å; L815-I831 HydrophobicContact CD2-CG1 4.04Å
816	P	86.8	Confident	84.8	Confident	17 Å²	17	64.6 Å²	64.6	11%	0.11	38%	0.38	C	S	.	.			trans	-57.9	141.3	175.9	-22.4	32.2	0	0	0	112	T818 C819 Q830 V832	P816-T818 PolarHBondContact O-N 3.04Å; P816-C819 CarbonylContact O-C 3.51Å; P816-C819 PolarHBondContact O-N 3.01Å; P816-C819 VanDerWaalsContact O-N 3.08Å; P816-Q830 VanDerWaalsContact CD-O 3.29Å; P816-Q830 WeakPolarHBondContact CD-O 3.13Å; P816-Q830 HydrophobicContact CG-CB 3.72Å; P816-V832 HydrophobicContact CG-CG2 4.22Å
817	S	81.7	Confident	84.7	Confident	122 Å²	122	63.3 Å²	63.3	85%	0.853	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.9	177.6	56	0	0	0	0	113.4
818	T	81	Confident	84.9	Confident	106 Å²	106	60.5 Å²	60.5	65%	0.65	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-28.2	175.4	51.3	0	0	0	0	112.7	P816 C824	P816-T818 PolarHBondContact O-N 3.04Å; T818-C824 PolarHBondContact O-SG 2.66Å; T818-C824 VanDerWaalsContact O-SG 3.36Å
819	C	84	Confident	84.9	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.047	34%	0.342	C	S	.	.			trans	-130.2	78.6	-178	-45.8	0	0	0	0	108.4	P816 D821 G822 C824	P816-C819 CarbonylContact O-C 3.51Å; P816-C819 PolarHBondContact O-N 3.01Å; P816-C819 VanDerWaalsContact O-N 3.08Å; C819-D821 PolarHBondContact O-N 2.8Å; C819-D821 VanDerWaalsContact O-N 3.15Å; C819-G822 WeakPolarHBondContact O-CA 3.29Å; C819-G822 PolarHBondContact O-N 2.03Å; C819-C824 HydrophobicContact CB-CB 4.21Å; C819-C824 WeakPolarHBondContact CB-SG 3.17Å; C819-C824 WeakPolarHBondContact SG-CB 3.04Å; C819-C824 CovalentContact SG-SG 2.03Å; C819-C824 PolarHBondContact SG-SG 3.05Å
820	P	80.2	Confident	85.2	Confident	62 Å²	62	52.6 Å²	52.6	40%	0.403	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-16	-172.1	27.5	-36	0	0	0	114	V688 L815 G822	V688-P820 HydrophobicContact CB-CB 4.4Å; V688-P820 HydrophobicContact CG1-CB 3.74Å; V688-P820 HydrophobicContact CG2-CB 3.75Å; L815-P820 WeakPolarHBondContact CD1-O 3.31Å; P820-G822 VanDerWaalsContact C-N 3.34Å
821	D	80.7	Confident	85.3	Confident	44 Å²	44	47.7 Å²	47.7	24%	0.235	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	12.5	170.2	-161.3	16.3	0	0	0	113	H700 R735 C819 T823	H700-D821 IonicContact CD2-OD1 3.67Å; H700-D821 PolarHBondContact CD2-OD1 3.25Å; H700-D821 IonicContact CD2-OD2 3.4Å; H700-D821 IonicContact CG-OD1 2.83Å; H700-D821 IonicContact NE2-OD1 3.35Å; H700-D821 IonicContact NE2-OD2 2.78Å; R735-D821 IonicContact NH2-OD1 3.37Å; R735-D821 IonicContact NH2-OD2 3.8Å; R735-D821 PolarHBondContact NH2-OD2 2.84Å; C819-D821 PolarHBondContact O-N 2.8Å; C819-D821 VanDerWaalsContact O-N 3.15Å; D821-T823 PolarHBondContact O-N 2.7Å
822	G	83.4	Confident	85.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	78.3	-8.1	-179.8	0	0	0	0	0	114.4	C819 P820 Y829 Q830	C819-G822 WeakPolarHBondContact O-CA 3.29Å; C819-G822 PolarHBondContact O-N 2.03Å; P820-G822 VanDerWaalsContact C-N 3.34Å; G822-Y829 CarbonylContact O-C 3.56Å; G822-Y829 VanDerWaalsContact O-CA 3.29Å; G822-Y829 WeakPolarHBondContact O-CA 3.15Å; G822-Q830 PolarHBondContact O-N 3.32Å
823	T	86.2	Confident	85.4	Confident	22 Å²	22	38.1 Å²	38.1	14%	0.135	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-141.2	148.3	175.7	-175.7	0	0	0	0	110.9	D821 D825 G826 L828 Y829	D821-T823 PolarHBondContact O-N 2.7Å; T823-D825 PolarHBondContact OG1-OD1 3.34Å; T823-D825 VanDerWaalsContact OG1-OD1 3.13Å; T823-G826 WeakPolarHBondContact OG1-CA 3.21Å; T823-G826 PolarHBondContact OG1-N 3.3Å; T823-L828 WeakPolarHBondContact CA-O 3.45Å; T823-L828 WeakPolarHBondContact CB-O 3.38Å; T823-L828 PolarHBondContact OG1-O 2.74Å; T823-Y829 HydrophobicContact CG2-CD1 4.11Å; T823-Y829 HydrophobicContact CG2-CE1 3.65Å
824	C	82.8	Confident	85.5	Confident	92 Å²	92	38.7 Å²	38.7	62%	0.622	24%	0.24	S	C	*	.	S	Bend	trans	-109.3	-19	176.5	-82	0	0	0	0	112.9	T818 C819	T818-C824 PolarHBondContact O-SG 2.66Å; T818-C824 VanDerWaalsContact O-SG 3.36Å; C819-C824 HydrophobicContact CB-CB 4.21Å; C819-C824 WeakPolarHBondContact CB-SG 3.17Å; C819-C824 WeakPolarHBondContact SG-CB 3.04Å; C819-C824 CovalentContact SG-SG 2.03Å; C819-C824 PolarHBondContact SG-SG 3.05Å
825	D	79.3	Confident	85.5	Confident	91 Å²	91	35.6 Å²	35.6	49%	0.487	22%	0.221	S	C	.	.	S	Bend	trans	-119.2	-6.1	-178.4	62	-3.2	0	0	0	112.8	T823 C827 L828	T823-D825 PolarHBondContact OG1-OD1 3.34Å; T823-D825 VanDerWaalsContact OG1-OD1 3.13Å; D825-C827 VanDerWaalsContact C-N 3.25Å; D825-C827 PolarHBondContact O-N 3.43Å; D825-C827 PolarHBondContact OD1-N 3.45Å; D825-L828 PolarHBondContact OD1-N 2.83Å
826	G	78.4	Confident	85.4	Confident	27 Å²	27	38.7 Å²	38.7	28%	0.278	23%	0.231	S	C	.	.	S	Bend	trans	82.2	-5.3	-174.5	0	0	0	0	0	114.5	T823 Y829	T823-G826 WeakPolarHBondContact OG1-CA 3.21Å; T823-G826 PolarHBondContact OG1-N 3.3Å; G826-Y829 WeakPolarHBondContact O-CE2 3.39Å; G826-Y829 PolarHBondContact O-OH 2.75Å
827	C	81.6	Confident	85.6	Confident	16 Å²	16	41.3 Å²	41.3	11%	0.108	24%	0.239	C	C	.	.	S	Bend	trans	-114.9	-41.4	-171.6	-56.9	0	0	0	0	112.9	T791 C792 H797 D825	T791-C827 PolarHBondContact O-SG 2.93Å; T791-C827 VanDerWaalsContact O-SG 3.4Å; C792-C827 WeakPolarHBondContact CA-SG 3.36Å; C792-C827 HydrophobicContact CB-CB 3.74Å; C792-C827 WeakPolarHBondContact CB-SG 3.49Å; C792-C827 WeakPolarHBondContact SG-CA 3.21Å; C792-C827 WeakPolarHBondContact SG-CB 3.39Å; C792-C827 CovalentContact SG-SG 2.03Å; C792-C827 PolarHBondContact SG-SG 3.49Å; H797-C827 PolarHBondContact N-O 3.24Å; D825-C827 VanDerWaalsContact C-N 3.25Å; D825-C827 PolarHBondContact O-N 3.43Å; D825-C827 PolarHBondContact OD1-N 3.45Å
828	L	85	Confident	85.9	Confident	28 Å²	28	35.5 Å²	35.5	15%	0.147	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	112.8	176.4	177.7	63.9	0	0	0	109.9	I768 H797 M799 T823 D825 Q830	I768-L828 HydrophobicContact CD1-CD2 3.83Å; H797-L828 HydrophobicContact CB-CD1 3.81Å; H797-L828 WeakPolarHBondContact O-CA 3.16Å; M799-L828 HydrophobicContact CB-CD1 4.28Å; T823-L828 WeakPolarHBondContact CA-O 3.45Å; T823-L828 WeakPolarHBondContact CB-O 3.38Å; T823-L828 PolarHBondContact OG1-O 2.74Å; D825-L828 PolarHBondContact OD1-N 2.83Å; L828-Q830 HydrophobicContact CD2-CG 4.42Å; L828-Q830 HydrophobicContact CG-CG 4.13Å
829	Y	86.8	Confident	86.2	Confident	37 Å²	37	30.5 Å²	30.5	15%	0.145	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	136.6	173.7	-67.8	-95.7	0	0	0	110.2	F702 Y796 H797 T798 M799 G822 T823 G826	F702-Y829 AromaticContact CE1-CD1 3.81Å; F702-Y829 HydrophobicContact CE1-CD1 3.81Å; F702-Y829 HydrophobicContact CE1-CE1 4.35Å; F702-Y829 HydrophobicContact CZ-CD1 4.12Å; F702-Y829 HydrophobicContact CZ-CE1 4.49Å; Y796-Y829 HydrophobicContact CD1-CE2 4.15Å; H797-Y829 PolarHBondContact O-N 3.45Å; T798-Y829 CarbonylContact C-O 3.51Å; T798-Y829 WeakPolarHBondContact CA-O 3.31Å; M799-Y829 PolarHBondContact N-O 2.88Å; G822-Y829 CarbonylContact O-C 3.56Å; G822-Y829 VanDerWaalsContact O-CA 3.29Å; G822-Y829 WeakPolarHBondContact O-CA 3.15Å; T823-Y829 HydrophobicContact CG2-CD1 4.11Å; T823-Y829 HydrophobicContact CG2-CE1 3.65Å; G826-Y829 WeakPolarHBondContact O-CE2 3.39Å; G826-Y829 PolarHBondContact O-OH 2.75Å
830	Q	89.2	Confident	86.5	Confident	18 Å²	18	30.6 Å²	30.6	8%	0.084	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127.5	-175.4	-61.4	-174.4	1.5	0	0	110.5	M799 P816 G822 L828	M799-Q830 HydrophobicContact CE-CG 3.82Å; M799-Q830 WeakPolarHBondContact O-CA 3.37Å; P816-Q830 VanDerWaalsContact CD-O 3.29Å; P816-Q830 WeakPolarHBondContact CD-O 3.13Å; P816-Q830 HydrophobicContact CG-CB 3.72Å; G822-Q830 PolarHBondContact O-N 3.32Å; L828-Q830 HydrophobicContact CD2-CG 4.42Å; L828-Q830 HydrophobicContact CG-CG 4.13Å
831	I	90.6	Very high	86.7	Confident	1 Å²	1	30 Å²	30	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	123.9	177.6	-58	173.1	0	0	0	108.1	A685 F702 V704 V733 M799 I800 I801 A813 L815 I833	A685-I831 HydrophobicContact CB-CG2 3.96Å; F702-I831 HydrophobicContact CB-CD1 3.73Å; F702-I831 HydrophobicContact CD1-CD1 4.03Å; F702-I831 HydrophobicContact CG-CD1 4.02Å; V704-I831 HydrophobicContact CG2-CD1 3.56Å; V733-I831 HydrophobicContact CG1-CD1 3.82Å; M799-I831 PolarHBondContact O-N 2.04Å; I800-I831 CarbonylContact C-O 3.59Å; I800-I831 WeakPolarHBondContact CA-O 3.03Å; I801-I831 PolarHBondContact N-O 2.93Å; A813-I831 HydrophobicContact CB-CG2 4.28Å; L815-I831 HydrophobicContact CD2-CG1 4.04Å; I831-I833 HydrophobicContact CG2-CG1 4.46Å
832	V	91.5	Very high	86.8	Confident	8 Å²	8	28.5 Å²	28.5	5%	0.048	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.4	179.9	-175.1	0	0	0	0	109.4	I801 R803 A813 T814 P816	I801-V832 HydrophobicContact CB-CG2 4.34Å; I801-V832 HydrophobicContact CD1-CG2 4.1Å; I801-V832 CarbonylContact O-C 3.5Å; I801-V832 WeakPolarHBondContact O-CA 3.17Å; R803-V832 HydrophobicContact CB-CG1 4.19Å; A813-V832 CarbonylContact C-O 3.6Å; A813-V832 WeakPolarHBondContact CA-O 3.09Å; T814-V832 PolarHBondContact N-O 2.85Å; T814-V832 WeakPolarHBondContact O-CA 3.3Å; T814-V832 PolarHBondContact O-N 2.9Å; T814-V832 PolarHBondContact OG1-O 3.01Å; P816-V832 HydrophobicContact CG-CG2 4.22Å
833	I	92.4	Very high	86.6	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	107.4	174.6	-58	-179.5	0	0	0	108.3	I683 I706 I800 I801 F802 R803 R812 A813 I831	I683-I833 HydrophobicContact CD1-CG2 4.28Å; I683-I833 HydrophobicContact CG2-CD1 3.94Å; I706-I833 HydrophobicContact CD1-CD1 3.42Å; I706-I833 VanDerWaalsContact CD1-CD1 3.42Å; I706-I833 HydrophobicContact CG1-CD1 4.34Å; I800-I833 HydrophobicContact CG2-CD1 3.46Å; I800-I833 VanDerWaalsContact CG2-CD1 3.46Å; I800-I833 HydrophobicContact CG2-CG1 3.92Å; I801-I833 PolarHBondContact O-N 3.12Å; F802-I833 CarbonylContact C-O 3.54Å; F802-I833 WeakPolarHBondContact CA-O 3.16Å; F802-I833 HydrophobicContact CD1-CB 4.01Å; F802-I833 HydrophobicContact CD1-CD1 4.38Å; F802-I833 HydrophobicContact CD1-CG2 4.07Å; F802-I833 HydrophobicContact CE1-CB 4.28Å; F802-I833 HydrophobicContact CE1-CD1 3.81Å; F802-I833 HydrophobicContact CE1-CG2 4.23Å; F802-I833 HydrophobicContact CZ-CD1 4.1Å; R803-I833 PolarHBondContact N-O 2.89Å; R812-I833 WeakPolarHBondContact O-CA 3.26Å; A813-I833 HydrophobicContact CB-CG1 4.12Å; I831-I833 HydrophobicContact CG2-CG1 4.46Å
834	T	92	Very high	86	Confident	26 Å²	26	36.3 Å²	36.3	16%	0.16	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.1	175.7	-55.7	0	0	0	0	109.1	R803 D805 V808 S811 R812	R803-T834 WeakPolarHBondContact O-CA 3.08Å; D805-T834 HydrophobicContact CB-CG2 3.55Å; V808-T834 HydrophobicContact CG2-CG2 4.32Å; S811-T834 WeakPolarHBondContact CA-O 3.48Å; R812-T834 PolarHBondContact N-O 3.16Å; R812-T834 PolarHBondContact O-N 3.31Å
835	S	91.4	Very high	85.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	150.1	-178.6	-173.1	0	0	0	0	112.7	R803 D805 S811 Y837 A838	R803-S835 PolarHBondContact O-N 2.81Å; D805-S835 PolarHBondContact N-O 3.34Å; D805-S835 VanDerWaalsContact N-O 3.12Å; D805-S835 CarbonylContact O-C 3.57Å; S811-S835 WeakPolarHBondContact OG-CB 3.35Å; S811-S835 PolarHBondContact OG-OG 3.18Å; S835-Y837 PolarHBondContact O-N 2.89Å; S835-Y837 WeakPolarHBondContact OG-CD2 3.39Å; S835-Y837 PolarHBondContact OG-N 3.05Å; S835-A838 WeakPolarHBondContact O-CB 3.21Å; S835-A838 PolarHBondContact O-N 2.95Å
836	R	89.2	Confident	85.4	Confident	88 Å²	88	38 Å²	38	33%	0.332	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-63.6	-29.3	167.2	67.6	179.1	-65.6	168.7	1.6	113.1	D805 A838 C839 I870	D805-R836 WeakPolarHBondContact O-CA 3.44Å; D805-R836 WeakPolarHBondContact O-CB 3.48Å; D805-R836 PolarHBondContact O-N 3.4Å; R836-A838 PolarHBondContact O-N 3.19Å; R836-C839 WeakPolarHBondContact O-CB 3.38Å; R836-C839 PolarHBondContact O-N 3.43Å; R836-C839 VanDerWaalsContact O-N 3.15Å; R836-C839 PolarHBondContact O-SG 2.61Å; R836-C839 VanDerWaalsContact O-SG 3.41Å; R836-I870 WeakPolarHBondContact O-CD1 3.06Å; R836-I870 WeakPolarHBondContact O-CG2 3.38Å
837	Y	89.2	Confident	85.4	Confident	73 Å²	73	39.9 Å²	39.9	29%	0.286	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-76.1	-14	-179.5	-57.7	-65.8	0	0	0	112.8	L676 P678 L679 S835 C839 I870	L676-Y837 WeakPolarHBondContact CD2-O 3.22Å; P678-Y837 HydrophobicContact CB-CD1 3.79Å; P678-Y837 HydrophobicContact CB-CD2 3.82Å; P678-Y837 HydrophobicContact CB-CE1 3.67Å; P678-Y837 HydrophobicContact CB-CE2 3.68Å; P678-Y837 HydrophobicContact CB-CG 3.86Å; P678-Y837 HydrophobicContact CG-CD1 3.64Å; P678-Y837 HydrophobicContact CG-CE1 3.68Å; P678-Y837 HydrophobicContact CG-CG 4.1Å; L679-Y837 HydrophobicContact CD2-CD2 3.87Å; L679-Y837 HydrophobicContact CG-CD2 4.32Å; S835-Y837 PolarHBondContact O-N 2.89Å; S835-Y837 WeakPolarHBondContact OG-CD2 3.39Å; S835-Y837 PolarHBondContact OG-N 3.05Å; Y837-C839 PolarHBondContact O-N 3.3Å; Y837-I870 HydrophobicContact CD1-CD1 4.36Å
838	A	89	Confident	85.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-76.8	-4.6	169.7	0	0	0	0	0	112.7	F674 L676 F802 S835 R836	F674-A838 WeakPolarHBondContact CD1-O 2.99Å; F674-A838 WeakPolarHBondContact CE1-O 3.42Å; L676-A838 HydrophobicContact CD2-CB 4.49Å; F802-A838 HydrophobicContact CB-CB 3.8Å; S835-A838 WeakPolarHBondContact O-CB 3.21Å; S835-A838 PolarHBondContact O-N 2.95Å; R836-A838 PolarHBondContact O-N 3.19Å
839	C	88.3	Confident	84.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-83.6	151.3	174.2	-58.2	0	0	0	0	111.8	C804 R836 Y837 I870	C804-C839 WeakPolarHBondContact CA-SG 3.34Å; C804-C839 HydrophobicContact CB-CB 3.96Å; C804-C839 WeakPolarHBondContact CB-SG 3.43Å; C804-C839 WeakPolarHBondContact SG-CA 3.24Å; C804-C839 WeakPolarHBondContact SG-CB 3.36Å; C804-C839 CovalentContact SG-SG 2.04Å; C804-C839 PolarHBondContact SG-SG 2.85Å; R836-C839 WeakPolarHBondContact O-CB 3.38Å; R836-C839 PolarHBondContact O-N 3.43Å; R836-C839 VanDerWaalsContact O-N 3.15Å; R836-C839 PolarHBondContact O-SG 2.61Å; R836-C839 VanDerWaalsContact O-SG 3.41Å; Y837-C839 PolarHBondContact O-N 3.3Å; C839-I870 HydrophobicContact CB-CG1 4.22Å; C839-I870 HydrophobicContact CB-CG2 3.8Å
840	P	88.2	Confident	84.6	Confident	10 Å²	10	52.1 Å²	52.1	7%	0.065	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-65.2	148.4	175.3	29.1	-36.5	0	0	0	111.1	A672 T673 F674 P777 H868 C869 I870	A672-P840 HydrophobicContact CB-CB 3.96Å; T673-P840 WeakPolarHBondContact O-CA 3.04Å; F674-P840 HydrophobicContact CD1-CB 4.33Å; F674-P840 HydrophobicContact CE1-CB 3.87Å; F674-P840 HydrophobicContact CE1-CG 4.36Å; F674-P840 HydrophobicContact CZ-CB 4.08Å; P777-P840 HydrophobicContact CG-CG 4.22Å; P840-H868 VanDerWaalsContact CD-O 3.22Å; P840-H868 WeakPolarHBondContact CD-O 3.5Å; P840-H868 VanDerWaalsContact CG-O 3.3Å; P840-H868 WeakPolarHBondContact CG-O 3.3Å; P840-C869 HydrophobicContact CG-CB 4.22Å; P840-C869 CarbonylContact O-C 3.58Å; P840-C869 WeakPolarHBondContact O-CA 3.23Å; P840-C869 WeakPolarHBondContact O-CB 3.47Å; P840-I870 PolarHBondContact O-N 3.21Å
841	I	86	Confident	84.2	Confident	48 Å²	48	55.1 Å²	55.1	25%	0.246	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-71.4	131.9	168.1	-57.7	171.5	0	0	0	108	T673 D675 S843 I870 I872	T673-I841 HydrophobicContact CG2-CD1 4.04Å; T673-I841 WeakPolarHBondContact O-CG1 2.99Å; T673-I841 PolarHBondContact O-N 3.16Å; D675-I841 HydrophobicContact CB-CD1 4.1Å; I841-S843 PolarHBondContact O-N 3.36Å; I841-I870 WeakPolarHBondContact CA-O 3.05Å; I841-I872 HydrophobicContact CD1-CD1 3.78Å; I841-I872 HydrophobicContact CG1-CD1 3.76Å; I841-I872 HydrophobicContact CG1-CG1 4.39Å
842	C	83	Confident	83.6	Confident	14 Å²	14	56.4 Å²	56.4	10%	0.095	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-59	126.6	179.9	-58.5	0	0	0	0	111.5	D846 Y847 C869 I870 L871	C842-D846 HydrophobicContact CB-CB 4.37Å; C842-Y847 HydrophobicContact CB-CE2 4.11Å; C842-C869 VanDerWaalsContact CA-SG 3.51Å; C842-C869 HydrophobicContact CB-CB 3.91Å; C842-C869 WeakPolarHBondContact CB-SG 3.41Å; C842-C869 WeakPolarHBondContact SG-CB 3.38Å; C842-C869 CovalentContact SG-SG 2.04Å; C842-C869 PolarHBondContact SG-SG 3.19Å; C842-I870 PolarHBondContact N-O 3.21Å; C842-L871 HydrophobicContact CB-CD2 4.19Å
843	S	78.9	Confident	83.1	Confident	47 Å²	47	63.6 Å²	63.6	33%	0.329	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-89.3	169	169.5	76.6	0	0	0	0	110.6	I841 Q845 D846 Y847	I841-S843 PolarHBondContact O-N 3.36Å; S843-Q845 PolarHBondContact O-N 3.28Å; S843-Q845 PolarHBondContact OG-N 2.68Å; S843-D846 WeakPolarHBondContact CB-OD2 3.4Å; S843-D846 PolarHBondContact N-OD2 2.04Å; S843-D846 PolarHBondContact O-N 2.76Å; S843-D846 PolarHBondContact OG-OD2 3.43Å; S843-Y847 WeakPolarHBondContact O-CD2 3.19Å; S843-Y847 WeakPolarHBondContact O-CE2 3.37Å
844	Q	73.2	Confident	82.5	Confident	139 Å²	139	65.2 Å²	65.2	65%	0.65	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-57.2	-23.1	175.9	-70.3	-68.4	-36	0	0	113.4
845	Q	72	Confident	81.7	Confident	182 Å²	182	68.3 Å²	68.3	85%	0.85	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-82.7	-14.1	179.5	-62.2	178.5	-0.3	0	0	113.2	S843 Y847	S843-Q845 PolarHBondContact O-N 3.28Å; S843-Q845 PolarHBondContact OG-N 2.68Å; Q845-Y847 VanDerWaalsContact C-N 3.33Å
846	D	77.2	Confident	81	Confident	36 Å²	36	71.5 Å²	71.5	19%	0.193	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-89.7	2.3	-177.8	-61	-64.7	0	0	0	112.8	C842 S843 A866 H868	C842-D846 HydrophobicContact CB-CB 4.37Å; S843-D846 WeakPolarHBondContact CB-OD2 3.4Å; S843-D846 PolarHBondContact N-OD2 2.04Å; S843-D846 PolarHBondContact O-N 2.76Å; S843-D846 PolarHBondContact OG-OD2 3.43Å; D846-A866 HydrophobicContact CB-CB 4.33Å; D846-A866 VanDerWaalsContact O-CB 3.25Å; D846-A866 WeakPolarHBondContact O-CB 3.25Å; D846-A866 PolarHBondContact O-N 3.11Å; D846-H868 IonicContact OD1-CE1 2.65Å; D846-H868 PolarHBondContact OD1-CE1 2.97Å; D846-H868 IonicContact OD1-NE2 3.62Å; D846-H868 PolarHBondContact OD1-NE2 2.84Å
847	Y	78.2	Confident	80.5	Confident	67 Å²	67	68.6 Å²	68.6	26%	0.263	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	132.2	178.8	-67.5	-91	0	0	0	111.2	C842 S843 Q845 R863 I864 P865 L871	C842-Y847 HydrophobicContact CB-CE2 4.11Å; S843-Y847 WeakPolarHBondContact O-CD2 3.19Å; S843-Y847 WeakPolarHBondContact O-CE2 3.37Å; Q845-Y847 VanDerWaalsContact C-N 3.33Å; Y847-R863 HydrophobicContact CD1-CB 4.17Å; Y847-I864 WeakPolarHBondContact CA-O 3.49Å; Y847-P865 HydrophobicContact CD1-CB 4.36Å; Y847-P865 HydrophobicContact CE1-CB 4.16Å; Y847-L871 HydrophobicContact CE1-CD2 4.14Å; Y847-L871 WeakPolarHBondContact OH-CD2 3.43Å
848	K	78.1	Confident	80.1	Confident	158 Å²	158	68.9 Å²	68.9	69%	0.687	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	122.6	166.4	-169.6	174.4	-178.5	179.4	0	108.8	I864	K848-I864 PolarHBondContact N-O 3.26Å; K848-I864 PolarHBondContact O-N 3.12Å
849	E	79.6	Confident	79.6	Confident	94 Å²	94	71 Å²	71	44%	0.439	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	124.7	173.9	-65.2	-172.5	167.7	0	0	109.5	I861 R863	E849-I861 HydrophobicContact CB-CG2 4.1Å; E849-I861 HydrophobicContact CG-CG2 4.38Å; E849-R863 HydrophobicContact CG-CG 3.83Å; E849-R863 IonicContact OE1-CZ 3.23Å; E849-R863 VanDerWaalsContact OE1-CZ 3.23Å; E849-R863 IonicContact OE1-NE 2.81Å; E849-R863 PolarHBondContact OE1-NE 3.17Å; E849-R863 IonicContact OE1-NH2 2.76Å; E849-R863 PolarHBondContact OE1-NH2 2.8Å
850	I	79	Confident	79.3	Confident	85 Å²	85	76.8 Å²	76.8	44%	0.436	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112	168.4	-56.5	-174	0	0	0	106.6	H862 I864	I850-H862 HydrophobicContact CB-CB 4.41Å; I850-H862 PolarHBondContact N-O 3.43Å; I850-H862 PolarHBondContact O-N 3.18Å; I850-I864 HydrophobicContact CD1-CD1 3.45Å; I850-I864 VanDerWaalsContact CD1-CD1 3.45Å; I850-I864 HydrophobicContact CD1-CG1 4.32Å; I850-I864 HydrophobicContact CG1-CD1 4.26Å
851	V	80.8	Confident	78.9	Confident	82 Å²	82	77.3 Å²	77.3	50%	0.497	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	119.6	-179.9	-177.1	0	0	0	0	108.2	Q859	V851-Q859 HydrophobicContact CG1-CG 3.98Å
852	G	79.3	Confident	78.6	Confident	27 Å²	27	78.3 Å²	78.3	28%	0.278	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	179.7	174.3	0	0	0	0	0	112.9	Q859 K860	G852-Q859 VanDerWaalsContact O-CG 3.26Å; G852-Q859 WeakPolarHBondContact O-CG 2.95Å; G852-Q859 PolarHBondContact O-NE2 2.82Å; G852-K860 WeakPolarHBondContact CA-O 3.4Å; G852-K860 PolarHBondContact N-O 2.95Å
853	E	79.2	Confident	78.3	Confident	160 Å²	160	80.6 Å²	80.6	75%	0.748	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	151.6	171.9	52	-177.8	-169.9	0	0	112.4	V855	E853-V855 HydrophobicContact CB-CG2 4.39Å; E853-V855 HydrophobicContact CG-CG2 3.82Å
854	C	80.6	Confident	78.3	Confident	33 Å²	33	82 Å²	82	22%	0.223	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	112.2	174.4	-177.8	0	0	0	0	108.4	C884 E886	C854-C884 WeakPolarHBondContact CA-SG 3.39Å; C854-C884 HydrophobicContact CB-CB 3.89Å; C854-C884 WeakPolarHBondContact CB-SG 3.45Å; C854-C884 WeakPolarHBondContact SG-CB 3.2Å; C854-C884 CovalentContact SG-SG 2.01Å; C854-C884 PolarHBondContact SG-SG 2.84Å; C854-E886 HydrophobicContact CB-CG 4.31Å; C854-E886 VanDerWaalsContact SG-CG 3.6Å
855	V	75.6	Confident	78.5	Confident	92 Å²	92	76.6 Å²	76.6	56%	0.558	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.7	118.6	-177.2	-178.4	0	0	0	0	108.9	E853 G857 I858	E853-V855 HydrophobicContact CB-CG2 4.39Å; E853-V855 HydrophobicContact CG-CG2 3.82Å; V855-G857 VanDerWaalsContact C-N 3.31Å; V855-G857 PolarHBondContact O-N 2.8Å; V855-I858 PolarHBondContact N-O 3.16Å; V855-I858 PolarHBondContact O-N 3.05Å
856	G	77.4	Confident	78.7	Confident	66 Å²	66	69.5 Å²	69.5	68%	0.68	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.8	30	-177.7	0	0	0	0	0	113.3	I858 E886	G856-I858 VanDerWaalsContact C-N 3.29Å; G856-I858 PolarHBondContact O-N 3.26Å; G856-E886 PolarHBondContact N-OE1 2.77Å
857	G	77.1	Confident	78.4	Confident	27 Å²	27	79.2 Å²	79.2	28%	0.278	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	11.1	-177.6	0	0	0	0	0	115.1	V855 E883 C884	V855-G857 VanDerWaalsContact C-N 3.31Å; V855-G857 PolarHBondContact O-N 2.8Å; G857-E883 WeakPolarHBondContact O-CA 3.35Å; G857-C884 CarbonylContact C-O 3.44Å; G857-C884 VanDerWaalsContact C-O 3.32Å; G857-C884 WeakPolarHBondContact CA-O 3.08Å; G857-C884 PolarHBondContact O-N 3.48Å
858	I	80.9	Confident	78.3	Confident	79 Å²	79	79.6 Å²	79.6	41%	0.405	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.7	179	-53.9	172.8	0	0	0	110	V855 G856 M881 C884	V855-I858 PolarHBondContact N-O 3.16Å; V855-I858 PolarHBondContact O-N 3.05Å; G856-I858 VanDerWaalsContact C-N 3.29Å; G856-I858 PolarHBondContact O-N 3.26Å; I858-M881 HydrophobicContact CG2-CB 3.94Å; I858-M881 HydrophobicContact CG2-CE 3.65Å; I858-M881 HydrophobicContact CG2-CG 4.45Å; I858-M881 HydrophobicContact CG2-SD 4.06Å; I858-C884 PolarHBondContact N-SG 3.33Å
859	Q	79.4	Confident	78.4	Confident	46 Å²	46	72.6 Å²	72.6	22%	0.215	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.2	179.3	-166.2	164.4	35.7	0	0	110.4	V851 G852 V882 C884	V851-Q859 HydrophobicContact CG1-CG 3.98Å; G852-Q859 VanDerWaalsContact O-CG 3.26Å; G852-Q859 WeakPolarHBondContact O-CG 2.95Å; G852-Q859 PolarHBondContact O-NE2 2.82Å; Q859-V882 PolarHBondContact N-O 3.46Å; Q859-V882 PolarHBondContact O-N 3Å; Q859-C884 HydrophobicContact CB-CB 3.82Å; Q859-C884 PolarHBondContact N-SG 3.44Å
860	K	80.7	Confident	78.5	Confident	120 Å²	120	68.5 Å²	68.5	52%	0.522	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	113.8	173.7	-77.7	174.8	-176.6	175.6	0	109.9	G852 M881	G852-K860 WeakPolarHBondContact CA-O 3.4Å; G852-K860 PolarHBondContact N-O 2.95Å; K860-M881 HydrophobicContact CB-SD 4.47Å; K860-M881 HydrophobicContact CD-SD 4.41Å; K860-M881 HydrophobicContact CG-CE 4.14Å; K860-M881 HydrophobicContact CG-SD 3.42Å; K860-M881 WeakPolarHBondContact CG-SD 3.39Å
861	I	80.6	Confident	78.4	Confident	22 Å²	22	66.3 Å²	66.3	11%	0.113	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	120	172.4	-55.2	-179.8	0	0	0	108.8	E849 T879 R880 V882	E849-I861 HydrophobicContact CB-CG2 4.1Å; E849-I861 HydrophobicContact CG-CG2 4.38Å; I861-T879 WeakPolarHBondContact O-CA 3.36Å; I861-R880 PolarHBondContact N-O 3.13Å; I861-R880 PolarHBondContact O-N 3.01Å; I861-V882 HydrophobicContact CD1-CB 4.25Å; I861-V882 HydrophobicContact CD1-CG2 3.64Å; I861-V882 HydrophobicContact CG1-CG2 4.34Å
862	H	79.9	Confident	77.6	Confident	69 Å²	69	66.4 Å²	66.4	32%	0.319	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.8	175.6	-68.4	-89.6	0	0	0	110.1	I850 T879	I850-H862 HydrophobicContact CB-CB 4.41Å; I850-H862 PolarHBondContact N-O 3.43Å; I850-H862 PolarHBondContact O-N 3.18Å; H862-T879 WeakPolarHBondContact ND1-CG2 3.27Å
863	R	76.7	Confident	76.8	Confident	62 Å²	62	69 Å²	69	23%	0.234	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.9	170.4	-83.5	174.7	167.8	-158.8	-10.2	110.5	Y847 E849 E878	Y847-R863 HydrophobicContact CD1-CB 4.17Å; E849-R863 HydrophobicContact CG-CG 3.83Å; E849-R863 IonicContact OE1-CZ 3.23Å; E849-R863 VanDerWaalsContact OE1-CZ 3.23Å; E849-R863 IonicContact OE1-NE 2.81Å; E849-R863 PolarHBondContact OE1-NE 3.17Å; E849-R863 IonicContact OE1-NH2 2.76Å; E849-R863 PolarHBondContact OE1-NH2 2.8Å; R863-E878 PolarHBondContact N-O 2.66Å
864	I	77.8	Confident	75.6	Confident	75 Å²	75	70.2 Å²	70.2	39%	0.385	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128	177.9	-53.6	-174.5	0	0	0	109.7	Y847 K848 I850	Y847-I864 WeakPolarHBondContact CA-O 3.49Å; K848-I864 PolarHBondContact N-O 3.26Å; K848-I864 PolarHBondContact O-N 3.12Å; I850-I864 HydrophobicContact CD1-CD1 3.45Å; I850-I864 VanDerWaalsContact CD1-CD1 3.45Å; I850-I864 HydrophobicContact CD1-CG1 4.32Å; I850-I864 HydrophobicContact CG1-CD1 4.26Å
865	P	77.4	Confident	74.3	Confident	27 Å²	27	75.8 Å²	75.8	18%	0.175	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	150.5	176.9	30.6	-36.9	0	0	0	112.3	Y847 L871	Y847-P865 HydrophobicContact CD1-CB 4.36Å; Y847-P865 HydrophobicContact CE1-CB 4.16Å; P865-L871 HydrophobicContact CB-CD2 4.45Å; P865-L871 HydrophobicContact CG-CD1 4.01Å; P865-L871 HydrophobicContact CG-CG 4.32Å
866	A	76.2	Confident	73.3	Confident	32 Å²	32	77.5 Å²	77.5	26%	0.264	41%	0.414	S	S	.	.			trans	-66.3	152.3	173.9	0	0	0	0	0	112.2	D846 H868 C869	D846-A866 HydrophobicContact CB-CB 4.33Å; D846-A866 VanDerWaalsContact O-CB 3.25Å; D846-A866 WeakPolarHBondContact O-CB 3.25Å; D846-A866 PolarHBondContact O-N 3.11Å; A866-H868 WeakPolarHBondContact CB-CE1 2.98Å; A866-H868 WeakPolarHBondContact CB-ND1 3.11Å; A866-H868 PolarHBondContact O-N 3.44Å; A866-H868 VanDerWaalsContact O-N 3.13Å; A866-C869 PolarHBondContact O-N 2.88Å; A866-C869 PolarHBondContact O-SG 3.49Å
867	R	71.7	Confident	72.3	Confident	240 Å²	240	77.8 Å²	77.8	91%	0.906	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.5	-175.1	-68.5	-173.7	178.5	-176.1	0.1	114.1	P806	P806-R867 VanDerWaalsContact CG-O 3.31Å; P806-R867 WeakPolarHBondContact CG-O 3.45Å
868	H	76.3	Confident	71.7	Confident	76 Å²	76	82.8 Å²	82.8	35%	0.352	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-3.9	-177.6	62.2	-85.6	0	0	0	114.3	L776 P840 D846 A866	L776-H868 HydrophobicContact CD2-CB 4.3Å; P840-H868 VanDerWaalsContact CD-O 3.22Å; P840-H868 WeakPolarHBondContact CD-O 3.5Å; P840-H868 VanDerWaalsContact CG-O 3.3Å; P840-H868 WeakPolarHBondContact CG-O 3.3Å; D846-H868 IonicContact OD1-CE1 2.65Å; D846-H868 PolarHBondContact OD1-CE1 2.97Å; D846-H868 IonicContact OD1-NE2 3.62Å; D846-H868 PolarHBondContact OD1-NE2 2.84Å; A866-H868 WeakPolarHBondContact CB-CE1 2.98Å; A866-H868 WeakPolarHBondContact CB-ND1 3.11Å; A866-H868 PolarHBondContact O-N 3.44Å; A866-H868 VanDerWaalsContact O-N 3.13Å
869	C	80	Confident	71.1	Confident	10 Å²	10	82.6 Å²	82.6	7%	0.068	42%	0.422	C	S	.	.			trans	-124.9	161.7	-176	70.6	0	0	0	0	112.8	P840 C842 A866	P840-C869 HydrophobicContact CG-CB 4.22Å; P840-C869 CarbonylContact O-C 3.58Å; P840-C869 WeakPolarHBondContact O-CA 3.23Å; P840-C869 WeakPolarHBondContact O-CB 3.47Å; C842-C869 VanDerWaalsContact CA-SG 3.51Å; C842-C869 HydrophobicContact CB-CB 3.91Å; C842-C869 WeakPolarHBondContact CB-SG 3.41Å; C842-C869 WeakPolarHBondContact SG-CB 3.38Å; C842-C869 CovalentContact SG-SG 2.04Å; C842-C869 PolarHBondContact SG-SG 3.19Å; A866-C869 PolarHBondContact O-N 2.88Å; A866-C869 PolarHBondContact O-SG 3.49Å
870	I	81.7	Confident	70.9	Confident	8 Å²	8	88 Å²	88	4%	0.041	44%	0.441	C	S	.	.	B	Isolated β-bridge	trans	-116.5	150.5	177.4	57.6	157	0	0	0	111.9	R836 Y837 C839 P840 I841 C842 I872	R836-I870 WeakPolarHBondContact O-CD1 3.06Å; R836-I870 WeakPolarHBondContact O-CG2 3.38Å; Y837-I870 HydrophobicContact CD1-CD1 4.36Å; C839-I870 HydrophobicContact CB-CG1 4.22Å; C839-I870 HydrophobicContact CB-CG2 3.8Å; P840-I870 PolarHBondContact O-N 3.21Å; I841-I870 WeakPolarHBondContact CA-O 3.05Å; C842-I870 PolarHBondContact N-O 3.21Å; I870-I872 HydrophobicContact CD1-CD1 4.27Å; I870-I872 HydrophobicContact CD1-CG1 4.17Å
871	L	76	Confident	70.7	Confident	40 Å²	40	87.6 Å²	87.6	21%	0.209	44%	0.442	C	S	.	.			trans	-95.1	133.2	170.8	-62.1	170.4	0	0	0	109.5	C842 Y847 P865 L876	C842-L871 HydrophobicContact CB-CD2 4.19Å; Y847-L871 HydrophobicContact CE1-CD2 4.14Å; Y847-L871 WeakPolarHBondContact OH-CD2 3.43Å; P865-L871 HydrophobicContact CB-CD2 4.45Å; P865-L871 HydrophobicContact CG-CD1 4.01Å; P865-L871 HydrophobicContact CG-CG 4.32Å; L871-L876 HydrophobicContact CD1-CB 4.41Å; L871-L876 HydrophobicContact CD1-CD2 3.85Å; L871-L876 HydrophobicContact CD1-CG 4.08Å
872	I	65.4	Low	70.6	Confident	84 Å²	84	88.5 Å²	88.5	43%	0.431	45%	0.448	S	S	.	.			trans	-115.7	111.5	171.8	-57.1	-178	0	0	0	107.5	D675 I841 I870	D675-I872 HydrophobicContact CB-CD1 3.72Å; I841-I872 HydrophobicContact CD1-CD1 3.78Å; I841-I872 HydrophobicContact CG1-CD1 3.76Å; I841-I872 HydrophobicContact CG1-CG1 4.39Å; I870-I872 HydrophobicContact CD1-CD1 4.27Å; I870-I872 HydrophobicContact CD1-CG1 4.17Å
873	G	62.5	Low	70.5	Confident	80 Å²	80	93.9 Å²	93.9	83%	0.825	47%	0.473	S	S	*	.	S	Bend	trans	93.1	0.2	162.8	0	0	0	0	0	119.3
874	K	53.9	Low	70.5	Confident	186 Å²	186	92.1 Å²	92.1	81%	0.809	47%	0.47	S	S	*	.	S	Bend	trans	-147	147.5	169.4	-97.8	-177.6	177.5	-179.7	0	112.7
875	D	53.5	Low	70.4	Confident	151 Å²	151	92.4 Å²	92.4	81%	0.807	48%	0.479	S	S	*	.			trans	-46.9	145.7	-172.3	-90.8	-38.3	0	0	0	114.7	T877	D875-T877 PolarHBondContact O-N 3.32Å
876	L	54.5	Low	69.9	Low	127 Å²	127	96.9 Å²	96.9	67%	0.665	50%	0.498	S	S	*	.	S	Bend	trans	-60.5	-4.8	-169.7	-84	144.2	0	0	0	116.2	L871	L871-L876 HydrophobicContact CD1-CB 4.41Å; L871-L876 HydrophobicContact CD1-CD2 3.85Å; L871-L876 HydrophobicContact CD1-CG 4.08Å
877	T	57	Low	69.4	Low	73 Å²	73	98.7 Å²	98.7	45%	0.448	50%	0.502	S	S	.	.			trans	-150.5	106.6	-177.9	49	0	0	0	0	109.5	D875 T879	D875-T877 PolarHBondContact O-N 3.32Å; T877-T879 PolarHBondContact O-N 3.24Å
878	E	63.3	Low	69.3	Low	132 Å²	132	90.4 Å²	90.4	62%	0.617	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	106.9	164.6	-166	168.7	-151.6	0	0	107.1	R863	R863-E878 PolarHBondContact N-O 2.66Å
879	T	68.3	Low	69	Low	75 Å²	75	92.3 Å²	92.3	46%	0.46	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	114.2	173.4	53.2	0	0	0	0	108.8	I861 H862 T877	I861-T879 WeakPolarHBondContact O-CA 3.36Å; H862-T879 WeakPolarHBondContact ND1-CG2 3.27Å; T877-T879 PolarHBondContact O-N 3.24Å
880	R	75.7	Confident	68.6	Low	160 Å²	160	99.4 Å²	99.4	60%	0.604	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	126.4	172.6	-171.3	-178.5	176.4	-172	-1.9	108.9	I861 V882	I861-R880 PolarHBondContact N-O 3.13Å; I861-R880 PolarHBondContact O-N 3.01Å; R880-V882 HydrophobicContact CG-CG2 3.81Å
881	M	76.6	Confident	68.3	Low	110 Å²	110	104 Å²	104	54%	0.542	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.2	119	167.1	-60	-63.1	-101.4	0	0	107.4	I858 K860	I858-M881 HydrophobicContact CG2-CB 3.94Å; I858-M881 HydrophobicContact CG2-CE 3.65Å; I858-M881 HydrophobicContact CG2-CG 4.45Å; I858-M881 HydrophobicContact CG2-SD 4.06Å; K860-M881 HydrophobicContact CB-SD 4.47Å; K860-M881 HydrophobicContact CD-SD 4.41Å; K860-M881 HydrophobicContact CG-CE 4.14Å; K860-M881 HydrophobicContact CG-SD 3.42Å; K860-M881 WeakPolarHBondContact CG-SD 3.39Å
882	V	79	Confident	68.3	Low	41 Å²	41	107.1 Å²	107.1	25%	0.248	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.1	133.1	176.2	-178.2	0	0	0	0	108.1	Q859 I861 R880 C884	Q859-V882 PolarHBondContact N-O 3.46Å; Q859-V882 PolarHBondContact O-N 3Å; I861-V882 HydrophobicContact CD1-CB 4.25Å; I861-V882 HydrophobicContact CD1-CG2 3.64Å; I861-V882 HydrophobicContact CG1-CG2 4.34Å; R880-V882 HydrophobicContact CG-CG2 3.81Å; V882-C884 PolarHBondContact O-N 2.97Å
883	E	77.6	Confident	68.9	Low	182 Å²	182	106.1 Å²	106.1	85%	0.85	57%	0.57	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-62.1	123.9	171	-66.9	177.9	-178.6	0	0	108.8	G857	G857-E883 WeakPolarHBondContact O-CA 3.35Å
884	C	76.9	Confident	69.8	Low	25 Å²	25	106.2 Å²	106.2	17%	0.169	56%	0.555	C	S	.	*			trans	-125.2	151.4	179.9	59.9	0	0	0	0	108.8	C854 G857 I858 Q859 V882	C854-C884 WeakPolarHBondContact CA-SG 3.39Å; C854-C884 HydrophobicContact CB-CB 3.89Å; C854-C884 WeakPolarHBondContact CB-SG 3.45Å; C854-C884 WeakPolarHBondContact SG-CB 3.2Å; C854-C884 CovalentContact SG-SG 2.01Å; C854-C884 PolarHBondContact SG-SG 2.84Å; G857-C884 CarbonylContact C-O 3.44Å; G857-C884 VanDerWaalsContact C-O 3.32Å; G857-C884 WeakPolarHBondContact CA-O 3.08Å; G857-C884 PolarHBondContact O-N 3.48Å; I858-C884 PolarHBondContact N-SG 3.33Å; Q859-C884 HydrophobicContact CB-CB 3.82Å; Q859-C884 PolarHBondContact N-SG 3.44Å; V882-C884 PolarHBondContact O-N 2.97Å
885	S	74.3	Confident	71.2	Confident	82 Å²	82	101.5 Å²	101.5	57%	0.573	54%	0.538	S	S	*	.			trans	-100.4	118.9	170.3	-168	0	0	0	0	108.2	I887	S885-I887 WeakPolarHBondContact CB-O 3.38Å; S885-I887 PolarHBondContact O-N 2.04Å; S885-I887 PolarHBondContact OG-O 2.77Å
886	E	67.4	Low	72.7	Confident	120 Å²	120	96 Å²	96	56%	0.561	52%	0.516	S	S	*	.	S	Bend	trans	-60.6	-23.4	172.2	-69	178.3	-172.8	0	0	111.5	C854 G856	C854-E886 HydrophobicContact CB-CG 4.31Å; C854-E886 VanDerWaalsContact SG-CG 3.6Å; G856-E886 PolarHBondContact N-OE1 2.77Å
887	I	65.8	Low	74.2	Confident	71 Å²	71	92.3 Å²	92.3	36%	0.364	50%	0.504	S	S	.	.	S	Bend	trans	-124.7	121.8	-174	-54.3	176.4	0	0	0	108.4	S885 M891 Q892	S885-I887 WeakPolarHBondContact CB-O 3.38Å; S885-I887 PolarHBondContact O-N 2.04Å; S885-I887 PolarHBondContact OG-O 2.77Å; I887-M891 HydrophobicContact CG2-CB 3.65Å; I887-M891 HydrophobicContact CG2-CG 3.7Å; I887-Q892 HydrophobicContact CB-CG 4.29Å; I887-Q892 HydrophobicContact CG2-CG 3.62Å
888	S	68.7	Low	75.5	Confident	66 Å²	66	91.8 Å²	91.8	46%	0.462	51%	0.507	S	S	.	.			trans	-63	147.8	176.2	75.4	0	0	0	0	110.5	Q890 M891 Q892	S888-Q890 PolarHBondContact O-N 3.13Å; S888-Q890 VanDerWaalsContact O-N 3.1Å; S888-M891 WeakPolarHBondContact O-CA 3.01Å; S888-M891 WeakPolarHBondContact O-CB 3.17Å; S888-M891 PolarHBondContact O-N 3.31Å; S888-M891 PolarHBondContact OG-N 2.97Å; S888-M891 VanDerWaalsContact OG-N 3.14Å; S888-Q892 PolarHBondContact O-N 3.02Å
889	V	70.5	Confident	76.6	Confident	116 Å²	116	89.7 Å²	89.7	70%	0.703	50%	0.503	S	S	*	.	H	α-helix	trans	-54.1	-32.2	174.8	177.9	0	0	0	0	111	Q892 A893	V889-Q892 PolarHBondContact O-N 3.2Å; V889-A893 WeakPolarHBondContact O-CB 3.06Å; V889-A893 PolarHBondContact O-N 2.72Å
890	Q	72	Confident	77.6	Confident	159 Å²	159	88.7 Å²	88.7	74%	0.743	50%	0.503	S	S	*	.	H	α-helix	trans	-62.9	-42.4	172.6	-79.3	-176.6	-35.4	0	0	112.9	S888 A893 T894	S888-Q890 PolarHBondContact O-N 3.13Å; S888-Q890 VanDerWaalsContact O-N 3.1Å; Q890-A893 PolarHBondContact O-N 2.86Å; Q890-T894 PolarHBondContact O-N 2.85Å; Q890-T894 PolarHBondContact O-OG1 3.35Å; Q890-T894 VanDerWaalsContact O-OG1 3.11Å
891	M	76.5	Confident	78.2	Confident	103 Å²	103	86.1 Å²	86.1	51%	0.507	50%	0.5	S	S	.	.	H	α-helix	trans	-69.2	-37	177.6	-175.1	70.9	91.4	0	0	112	I887 S888 A893 T894 I895	I887-M891 HydrophobicContact CG2-CB 3.65Å; I887-M891 HydrophobicContact CG2-CG 3.7Å; S888-M891 WeakPolarHBondContact O-CA 3.01Å; S888-M891 WeakPolarHBondContact O-CB 3.17Å; S888-M891 PolarHBondContact O-N 3.31Å; S888-M891 PolarHBondContact OG-N 2.97Å; S888-M891 VanDerWaalsContact OG-N 3.14Å; M891-A893 VanDerWaalsContact C-N 3.34Å; M891-T894 VanDerWaalsContact CA-OG1 3.28Å; M891-T894 WeakPolarHBondContact CA-OG1 3.25Å; M891-T894 PolarHBondContact O-N 2.03Å; M891-T894 PolarHBondContact O-OG1 2.86Å; M891-I895 HydrophobicContact CG-CD1 4.07Å; M891-I895 WeakPolarHBondContact O-CD1 3.45Å; M891-I895 VanDerWaalsContact O-CG1 3.26Å; M891-I895 WeakPolarHBondContact O-CG1 3.39Å; M891-I895 PolarHBondContact O-N 2.85Å
892	Q	74.7	Confident	78.8	Confident	107 Å²	107	82.6 Å²	82.6	50%	0.5	49%	0.492	S	S	.	.	H	α-helix	trans	-64.9	-40.3	173.2	-69.2	-177.7	-17.8	0	0	111.7	I887 S888 V889 I895 G896	I887-Q892 HydrophobicContact CB-CG 4.29Å; I887-Q892 HydrophobicContact CG2-CG 3.62Å; S888-Q892 PolarHBondContact O-N 3.02Å; V889-Q892 PolarHBondContact O-N 3.2Å; Q892-I895 PolarHBondContact O-N 2.84Å; Q892-G896 PolarHBondContact O-N 2.78Å
893	A	79	Confident	79.4	Confident	62 Å²	62	83 Å²	83	51%	0.512	50%	0.5	S	S	.	.	H	α-helix	trans	-65.3	-39	176.5	0	0	0	0	0	112.3	V889 Q890 M891 G896 A897	V889-A893 WeakPolarHBondContact O-CB 3.06Å; V889-A893 PolarHBondContact O-N 2.72Å; Q890-A893 PolarHBondContact O-N 2.86Å; M891-A893 VanDerWaalsContact C-N 3.34Å; A893-G896 PolarHBondContact O-N 3.4Å; A893-A897 WeakPolarHBondContact O-CB 3.47Å; A893-A897 PolarHBondContact O-N 2.82Å
894	T	80.5	Confident	80	Confident	82 Å²	82	78.3 Å²	78.3	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-68.7	-40	175.5	43.2	0	0	0	0	112.5	Q890 M891 A897 A898	Q890-T894 PolarHBondContact O-N 2.85Å; Q890-T894 PolarHBondContact O-OG1 3.35Å; Q890-T894 VanDerWaalsContact O-OG1 3.11Å; M891-T894 VanDerWaalsContact CA-OG1 3.28Å; M891-T894 WeakPolarHBondContact CA-OG1 3.25Å; M891-T894 PolarHBondContact O-N 2.03Å; M891-T894 PolarHBondContact O-OG1 2.86Å; T894-A897 PolarHBondContact O-N 3.04Å; T894-A898 VanDerWaalsContact O-CB 3.27Å; T894-A898 WeakPolarHBondContact O-CB 3.26Å; T894-A898 PolarHBondContact O-N 3.41Å
895	I	84.5	Confident	80.6	Confident	88 Å²	88	82 Å²	82	45%	0.451	50%	0.501	S	S	.	.	H	α-helix	trans	-64.3	-43.1	174.3	-65.5	165.2	0	0	0	110.5	M891 Q892 A898 T899	M891-I895 HydrophobicContact CG-CD1 4.07Å; M891-I895 WeakPolarHBondContact O-CD1 3.45Å; M891-I895 VanDerWaalsContact O-CG1 3.26Å; M891-I895 WeakPolarHBondContact O-CG1 3.39Å; M891-I895 PolarHBondContact O-N 2.85Å; Q892-I895 PolarHBondContact O-N 2.84Å; I895-A898 PolarHBondContact O-N 3.43Å; I895-T899 HydrophobicContact CG2-CG2 4.4Å; I895-T899 WeakPolarHBondContact O-CB 3.02Å; I895-T899 WeakPolarHBondContact O-CG2 3.24Å; I895-T899 PolarHBondContact O-N 3.45Å; I895-T899 PolarHBondContact O-OG1 2.86Å
896	G	83.3	Confident	81.3	Confident	35 Å²	35	84.2 Å²	84.2	36%	0.361	50%	0.5	S	S	.	.	H	α-helix	trans	-61.2	-44.1	175.3	0	0	0	0	0	112.8	Q892 A893 T899 A900	Q892-G896 PolarHBondContact O-N 2.78Å; A893-G896 PolarHBondContact O-N 3.4Å; G896-T899 WeakPolarHBondContact CA-OG1 3.45Å; G896-T899 PolarHBondContact O-OG1 3.48Å; G896-A900 WeakPolarHBondContact O-CB 3.47Å; G896-A900 PolarHBondContact O-N 3.06Å
897	A	86	Confident	82.3	Confident	50 Å²	50	83.1 Å²	83.1	41%	0.413	50%	0.497	S	S	.	.	H	α-helix	trans	-64.8	-44.4	175.8	0	0	0	0	0	111.8	A893 T894 A900 I901	A893-A897 WeakPolarHBondContact O-CB 3.47Å; A893-A897 PolarHBondContact O-N 2.82Å; T894-A897 PolarHBondContact O-N 3.04Å; A897-A900 PolarHBondContact O-N 3.47Å; A897-I901 WeakPolarHBondContact O-CB 3.34Å; A897-I901 WeakPolarHBondContact O-CD1 3.18Å; A897-I901 WeakPolarHBondContact O-CG1 3.35Å; A897-I901 PolarHBondContact O-N 2.87Å
898	A	85.9	Confident	83.3	Confident	61 Å²	61	83.7 Å²	83.7	50%	0.504	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-41.9	179.4	0	0	0	0	0	112.2	T894 I895 I901 G902	T894-A898 VanDerWaalsContact O-CB 3.27Å; T894-A898 WeakPolarHBondContact O-CB 3.26Å; T894-A898 PolarHBondContact O-N 3.41Å; I895-A898 PolarHBondContact O-N 3.43Å; A898-I901 PolarHBondContact O-N 2.02Å; A898-G902 PolarHBondContact O-N 2.72Å
899	T	86.6	Confident	84.1	Confident	88 Å²	88	84.6 Å²	84.6	54%	0.54	50%	0.503	S	S	.	.	H	α-helix	trans	-67.9	-39.6	176.3	51.2	0	0	0	0	112.2	I895 G896 G902 A903	I895-T899 HydrophobicContact CG2-CG2 4.4Å; I895-T899 WeakPolarHBondContact O-CB 3.02Å; I895-T899 WeakPolarHBondContact O-CG2 3.24Å; I895-T899 PolarHBondContact O-N 3.45Å; I895-T899 PolarHBondContact O-OG1 2.86Å; G896-T899 WeakPolarHBondContact CA-OG1 3.45Å; G896-T899 PolarHBondContact O-OG1 3.48Å; T899-G902 PolarHBondContact O-N 3.08Å; T899-A903 WeakPolarHBondContact O-CB 3.41Å; T899-A903 PolarHBondContact O-N 2.84Å
900	A	88.1	Confident	84.8	Confident	55 Å²	55	82.8 Å²	82.8	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-44.4	173.9	0	0	0	0	0	111.9	G896 A897 A903 V904	G896-A900 WeakPolarHBondContact O-CB 3.47Å; G896-A900 PolarHBondContact O-N 3.06Å; A897-A900 PolarHBondContact O-N 3.47Å; A900-A903 PolarHBondContact O-N 2.88Å; A900-V904 VanDerWaalsContact O-CG2 3.3Å; A900-V904 WeakPolarHBondContact O-CG2 3.3Å; A900-V904 PolarHBondContact O-N 3.27Å
901	I	89.3	Confident	85.3	Confident	105 Å²	105	80.1 Å²	80.1	54%	0.538	48%	0.48	S	S	.	.	H	α-helix	trans	-61.6	-45.7	174.9	-68.5	163.1	0	0	0	110.2	A897 A898 A903 V904 L905	A897-I901 WeakPolarHBondContact O-CB 3.34Å; A897-I901 WeakPolarHBondContact O-CD1 3.18Å; A897-I901 WeakPolarHBondContact O-CG1 3.35Å; A897-I901 PolarHBondContact O-N 2.87Å; A898-I901 PolarHBondContact O-N 2.02Å; I901-A903 PolarHBondContact O-N 3.05Å; I901-V904 PolarHBondContact O-N 3.4Å; I901-L905 HydrophobicContact CG2-CD1 3.95Å; I901-L905 HydrophobicContact CG2-CG 4.35Å; I901-L905 WeakPolarHBondContact O-CB 2.97Å; I901-L905 WeakPolarHBondContact O-CG 3.17Å; I901-L905 PolarHBondContact O-N 2.84Å
902	G	89.4	Confident	85.6	Confident	36 Å²	36	80.3 Å²	80.3	37%	0.371	48%	0.481	S	S	.	.	H	α-helix	trans	-59.1	-42.9	176.7	0	0	0	0	0	112.8	A898 T899 L905 F906	A898-G902 PolarHBondContact O-N 2.72Å; T899-G902 PolarHBondContact O-N 3.08Å; G902-L905 PolarHBondContact O-N 3.12Å; G902-F906 WeakPolarHBondContact O-CB 3.14Å; G902-F906 PolarHBondContact O-N 2.85Å
903	A	90.4	Very high	85.7	Confident	50 Å²	50	82.7 Å²	82.7	41%	0.413	49%	0.486	S	S	.	.	H	α-helix	trans	-66.8	-41	176.6	0	0	0	0	0	112.3	T899 A900 I901 F906 I907	T899-A903 WeakPolarHBondContact O-CB 3.41Å; T899-A903 PolarHBondContact O-N 2.84Å; A900-A903 PolarHBondContact O-N 2.88Å; I901-A903 PolarHBondContact O-N 3.05Å; A903-F906 PolarHBondContact O-N 3.01Å; A903-I907 WeakPolarHBondContact O-CB 3.42Å; A903-I907 VanDerWaalsContact O-CG1 3.27Å; A903-I907 WeakPolarHBondContact O-CG1 3.47Å; A903-I907 PolarHBondContact O-N 2.65Å
904	V	90.2	Very high	85.6	Confident	84 Å²	84	87 Å²	87	51%	0.509	49%	0.493	S	S	.	.	H	α-helix	trans	-63.8	-43.3	175.2	170.2	0	0	0	0	110.8	A900 I901 F906 I907 L908	A900-V904 VanDerWaalsContact O-CG2 3.3Å; A900-V904 WeakPolarHBondContact O-CG2 3.3Å; A900-V904 PolarHBondContact O-N 3.27Å; I901-V904 PolarHBondContact O-N 3.4Å; V904-F906 VanDerWaalsContact C-N 3.35Å; V904-I907 PolarHBondContact O-N 3.11Å; V904-L908 HydrophobicContact CG1-CD1 3.95Å; V904-L908 WeakPolarHBondContact O-CB 3.42Å; V904-L908 WeakPolarHBondContact O-CG 3.49Å; V904-L908 PolarHBondContact O-N 2.72Å
905	L	89.9	Confident	85.1	Confident	101 Å²	101	90.5 Å²	90.5	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-40.8	174.3	-72	174.7	0	0	0	111.4	I901 G902 L908 V909	I901-L905 HydrophobicContact CG2-CD1 3.95Å; I901-L905 HydrophobicContact CG2-CG 4.35Å; I901-L905 WeakPolarHBondContact O-CB 2.97Å; I901-L905 WeakPolarHBondContact O-CG 3.17Å; I901-L905 PolarHBondContact O-N 2.84Å; G902-L905 PolarHBondContact O-N 3.12Å; L905-L908 PolarHBondContact O-N 2.87Å; L905-V909 WeakPolarHBondContact O-CB 3.18Å; L905-V909 VanDerWaalsContact O-CG2 3.27Å; L905-V909 WeakPolarHBondContact O-CG2 3.08Å; L905-V909 PolarHBondContact O-N 3.09Å
906	F	88.7	Confident	84.3	Confident	130 Å²	130	89.7 Å²	89.7	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-65	-41.7	176	-174.1	-104.9	0	0	0	112.1	G902 A903 V904 V909 L910	G902-F906 WeakPolarHBondContact O-CB 3.14Å; G902-F906 PolarHBondContact O-N 2.85Å; A903-F906 PolarHBondContact O-N 3.01Å; V904-F906 VanDerWaalsContact C-N 3.35Å; F906-V909 PolarHBondContact O-N 3.26Å; F906-L910 HydrophobicContact CD1-CD1 3.81Å; F906-L910 HydrophobicContact CD1-CG 4.28Å; F906-L910 HydrophobicContact CE1-CD1 3.43Å; F906-L910 VanDerWaalsContact CE1-CD1 3.43Å; F906-L910 HydrophobicContact CE1-CG 4Å; F906-L910 HydrophobicContact CZ-CD1 4.08Å; F906-L910 HydrophobicContact CZ-CD2 4.39Å; F906-L910 HydrophobicContact CZ-CG 4.24Å; F906-L910 WeakPolarHBondContact O-CB 3.45Å; F906-L910 WeakPolarHBondContact O-CG 3.15Å; F906-L910 PolarHBondContact O-N 2.83Å
907	I	88.5	Confident	83.5	Confident	97 Å²	97	92.9 Å²	92.9	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-64.4	-42.3	173.7	-69	166.7	0	0	0	110.4	A903 V904 V909 L910 L911	A903-I907 WeakPolarHBondContact O-CB 3.42Å; A903-I907 VanDerWaalsContact O-CG1 3.27Å; A903-I907 WeakPolarHBondContact O-CG1 3.47Å; A903-I907 PolarHBondContact O-N 2.65Å; V904-I907 PolarHBondContact O-N 3.11Å; I907-V909 VanDerWaalsContact C-N 3.35Å; I907-L910 CarbonylContact O-C 3.59Å; I907-L910 PolarHBondContact O-N 2.93Å; I907-L911 HydrophobicContact CG2-CD1 3.99Å; I907-L911 HydrophobicContact CG2-CG 4.24Å; I907-L911 WeakPolarHBondContact O-CB 3.09Å; I907-L911 VanDerWaalsContact O-CG 3.25Å; I907-L911 WeakPolarHBondContact O-CG 3.32Å; I907-L911 PolarHBondContact O-N 3.26Å
908	L	86.2	Confident	82.3	Confident	82 Å²	82	99.5 Å²	99.5	43%	0.429	52%	0.518	S	S	.	.	H	α-helix	trans	-62.3	-42.7	174.9	-79.7	165.2	0	0	0	111.2	V904 L905 L911 I912	V904-L908 HydrophobicContact CG1-CD1 3.95Å; V904-L908 WeakPolarHBondContact O-CB 3.42Å; V904-L908 WeakPolarHBondContact O-CG 3.49Å; V904-L908 PolarHBondContact O-N 2.72Å; L905-L908 PolarHBondContact O-N 2.87Å; L908-L911 PolarHBondContact O-N 3.14Å; L908-I912 VanDerWaalsContact O-CB 3.3Å; L908-I912 WeakPolarHBondContact O-CB 3.44Å; L908-I912 WeakPolarHBondContact O-CG1 3.32Å; L908-I912 PolarHBondContact O-N 2.78Å
909	V	85.9	Confident	81.1	Confident	85 Å²	85	100 Å²	100	52%	0.515	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-43.4	173.3	169.6	0	0	0	0	110.1	L905 F906 I907 L911 I912 W913	L905-V909 WeakPolarHBondContact O-CB 3.18Å; L905-V909 VanDerWaalsContact O-CG2 3.27Å; L905-V909 WeakPolarHBondContact O-CG2 3.08Å; L905-V909 PolarHBondContact O-N 3.09Å; F906-V909 PolarHBondContact O-N 3.26Å; I907-V909 VanDerWaalsContact C-N 3.35Å; V909-L911 PolarHBondContact O-N 2.99Å; V909-I912 CarbonylContact O-C 3.47Å; V909-I912 PolarHBondContact O-N 3.41Å; V909-W913 WeakPolarHBondContact O-CA 3.45Å; V909-W913 WeakPolarHBondContact O-CB 3.42Å; V909-W913 PolarHBondContact O-N 3.03Å
910	L	84.6	Confident	79.6	Confident	78 Å²	78	101.3 Å²	101.3	41%	0.408	51%	0.512	S	S	.	.	H	α-helix	trans	-64.8	-37.9	175.3	-74.8	177.1	0	0	0	112.6	F906 I907 W913 K914	F906-L910 HydrophobicContact CD1-CD1 3.81Å; F906-L910 HydrophobicContact CD1-CG 4.28Å; F906-L910 HydrophobicContact CE1-CD1 3.43Å; F906-L910 VanDerWaalsContact CE1-CD1 3.43Å; F906-L910 HydrophobicContact CE1-CG 4Å; F906-L910 HydrophobicContact CZ-CD1 4.08Å; F906-L910 HydrophobicContact CZ-CD2 4.39Å; F906-L910 HydrophobicContact CZ-CG 4.24Å; F906-L910 WeakPolarHBondContact O-CB 3.45Å; F906-L910 WeakPolarHBondContact O-CG 3.15Å; F906-L910 PolarHBondContact O-N 2.83Å; I907-L910 CarbonylContact O-C 3.59Å; I907-L910 PolarHBondContact O-N 2.93Å; L910-W913 PolarHBondContact O-N 2.89Å; L910-K914 WeakPolarHBondContact O-CB 3.41Å; L910-K914 PolarHBondContact O-N 3.49Å
911	L	83.6	Confident	78.1	Confident	104 Å²	104	107.1 Å²	107.1	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-68.6	-42.4	175.4	-73.1	174.8	0	0	0	110.9	I907 L908 V909 K915	I907-L911 HydrophobicContact CG2-CD1 3.99Å; I907-L911 HydrophobicContact CG2-CG 4.24Å; I907-L911 WeakPolarHBondContact O-CB 3.09Å; I907-L911 VanDerWaalsContact O-CG 3.25Å; I907-L911 WeakPolarHBondContact O-CG 3.32Å; I907-L911 PolarHBondContact O-N 3.26Å; L908-L911 PolarHBondContact O-N 3.14Å; V909-L911 PolarHBondContact O-N 2.99Å; L911-K915 WeakPolarHBondContact O-CB 3.44Å; L911-K915 PolarHBondContact O-N 2.94Å
912	I	82.2	Confident	76.5	Confident	106 Å²	106	108.7 Å²	108.7	54%	0.544	53%	0.526	S	S	.	.	H	α-helix	trans	-63.4	-47.3	173.4	-70.6	165.2	0	0	0	108.8	L908 V909 K914 K915 N916	L908-I912 VanDerWaalsContact O-CB 3.3Å; L908-I912 WeakPolarHBondContact O-CB 3.44Å; L908-I912 WeakPolarHBondContact O-CG1 3.32Å; L908-I912 PolarHBondContact O-N 2.78Å; V909-I912 CarbonylContact O-C 3.47Å; V909-I912 PolarHBondContact O-N 3.41Å; I912-K914 PolarHBondContact O-N 3.42Å; I912-K915 CarbonylContact O-C 3.58Å; I912-K915 PolarHBondContact O-N 3.19Å; I912-K915 VanDerWaalsContact O-N 3.17Å; I912-N916 WeakPolarHBondContact O-CA 3.27Å; I912-N916 WeakPolarHBondContact O-CB 3.35Å; I912-N916 PolarHBondContact O-N 3.23Å
913	W	76.8	Confident	74.7	Confident	158 Å²	158	114.1 Å²	114.1	60%	0.598	54%	0.536	S	S	*	.	H	α-helix	trans	-65	-41	-179.2	-156.8	66.8	0	0	0	111.4	V909 L910 N916 Q917	V909-W913 WeakPolarHBondContact O-CA 3.45Å; V909-W913 WeakPolarHBondContact O-CB 3.42Å; V909-W913 PolarHBondContact O-N 3.03Å; L910-W913 PolarHBondContact O-N 2.89Å; W913-N916 CarbonylContact O-C 3.58Å; W913-N916 PolarHBondContact O-N 2.66Å; W913-Q917 PolarHBondContact O-N 2.85Å
914	K	76.5	Confident	73.1	Confident	153 Å²	153	118.7 Å²	118.7	67%	0.665	55%	0.551	S	S	*	*	H	α-helix	trans	-66.9	-37.8	172.8	-170.2	175.8	-176.1	175.2	0	112.1	L910 I912 N916 R918	L910-K914 WeakPolarHBondContact O-CB 3.41Å; L910-K914 PolarHBondContact O-N 3.49Å; I912-K914 PolarHBondContact O-N 3.42Å; K914-N916 VanDerWaalsContact C-N 3.34Å; K914-R918 PolarHBondContact O-N 3.28Å
915	K	71.5	Confident	71.3	Confident	154 Å²	154	122.8 Å²	122.8	67%	0.67	56%	0.562	S	S	*	*	H	α-helix	trans	-72.6	-31	174.6	-160.9	178.9	-177.4	-174.6	0	111.1	L911 I912 R918 L919	L911-K915 WeakPolarHBondContact O-CB 3.44Å; L911-K915 PolarHBondContact O-N 2.94Å; I912-K915 CarbonylContact O-C 3.58Å; I912-K915 PolarHBondContact O-N 3.19Å; I912-K915 VanDerWaalsContact O-N 3.17Å; K915-R918 WeakPolarHBondContact O-CB 3.48Å; K915-R918 PolarHBondContact O-N 3.49Å; K915-L919 WeakPolarHBondContact O-CG 3.34Å; K915-L919 PolarHBondContact O-N 3.3Å
916	N	66.3	Low	69.4	Low	72 Å²	72	124 Å²	124	39%	0.385	57%	0.568	S	S	.	*	H	α-helix	trans	-77.7	-37.4	179.1	-151.3	36	0	0	0	110.7	I912 W913 K914 R918 L919 E920	I912-N916 WeakPolarHBondContact O-CA 3.27Å; I912-N916 WeakPolarHBondContact O-CB 3.35Å; I912-N916 PolarHBondContact O-N 3.23Å; W913-N916 CarbonylContact O-C 3.58Å; W913-N916 PolarHBondContact O-N 2.66Å; K914-N916 VanDerWaalsContact C-N 3.34Å; N916-R918 PolarHBondContact O-N 2.87Å; N916-L919 CarbonylContact O-C 3.43Å; N916-L919 WeakPolarHBondContact O-CA 3.47Å; N916-L919 WeakPolarHBondContact O-CB 3.47Å; N916-L919 PolarHBondContact O-N 2.9Å; N916-E920 PolarHBondContact O-N 2.57Å
917	Q	66.2	Low	67.7	Low	101 Å²	101	122.6 Å²	122.6	47%	0.472	57%	0.57	S	S	.	*	H	α-helix	trans	-59	-36.6	166.4	-85.3	-173.5	-18.3	0	0	111.7	W913 L919 Y921	W913-Q917 PolarHBondContact O-N 2.85Å; Q917-L919 VanDerWaalsContact C-N 3.29Å; Q917-L919 PolarHBondContact O-N 2.97Å; Q917-Y921 PolarHBondContact O-N 2.83Å; Q917-Y921 VanDerWaalsContact O-N 3.15Å
918	R	61.8	Low	65.7	Low	190 Å²	190	126 Å²	126	72%	0.717	58%	0.584	S	S	*	*	H	α-helix	trans	-70.7	-26.1	173.4	-159.5	179.6	-174.6	-171	2.1	112.6	K914 K915 N916	K914-R918 PolarHBondContact O-N 3.28Å; K915-R918 WeakPolarHBondContact O-CB 3.48Å; K915-R918 PolarHBondContact O-N 3.49Å; N916-R918 PolarHBondContact O-N 2.87Å
919	L	59.9	Low	63.9	Low	70 Å²	70	129.2 Å²	129.2	37%	0.366	60%	0.601	S	S	.	*	H	α-helix	trans	-82	-40.9	174.2	-78.4	154.5	0	0	0	111.5	K915 N916 Q917 Y921 K922 Y923	K915-L919 WeakPolarHBondContact O-CG 3.34Å; K915-L919 PolarHBondContact O-N 3.3Å; N916-L919 CarbonylContact O-C 3.43Å; N916-L919 WeakPolarHBondContact O-CA 3.47Å; N916-L919 WeakPolarHBondContact O-CB 3.47Å; N916-L919 PolarHBondContact O-N 2.9Å; Q917-L919 VanDerWaalsContact C-N 3.29Å; Q917-L919 PolarHBondContact O-N 2.97Å; L919-Y921 VanDerWaalsContact C-N 3.27Å; L919-Y921 PolarHBondContact O-N 3.41Å; L919-K922 CarbonylContact O-C 3.43Å; L919-K922 WeakPolarHBondContact O-CA 3.33Å; L919-K922 WeakPolarHBondContact O-CB 3.3Å; L919-K922 PolarHBondContact O-N 2.96Å; L919-Y923 HydrophobicContact CB-CD2 4.28Å; L919-Y923 HydrophobicContact CD2-CD2 4.3Å; L919-Y923 HydrophobicContact CD2-CE2 4.02Å; L919-Y923 WeakPolarHBondContact O-CB 3.38Å; L919-Y923 WeakPolarHBondContact O-CD2 3.43Å; L919-Y923 PolarHBondContact O-N 3.44Å
920	E	56.8	Low	61.8	Low	117 Å²	117	129.5 Å²	129.5	55%	0.547	61%	0.607	S	S	.	*	H	α-helix	trans	-59.4	-38	174.1	-76.9	179.3	174.5	0	0	111	N916 K922 Y923 M924	N916-E920 PolarHBondContact O-N 2.57Å; E920-K922 VanDerWaalsContact C-N 3.25Å; E920-K922 PolarHBondContact O-N 3.27Å; E920-Y923 PolarHBondContact O-N 3.3Å; E920-M924 WeakPolarHBondContact O-CB 3.41Å; E920-M924 PolarHBondContact O-N 2.89Å
921	Y	56.4	Low	59.2	Low	176 Å²	176	132.6 Å²	132.6	69%	0.69	63%	0.629	S	S	*	*	H	α-helix	trans	-64	-29.1	171.4	-168.8	-97.8	0	0	0	113.3	Q917 L919	Q917-Y921 PolarHBondContact O-N 2.83Å; Q917-Y921 VanDerWaalsContact O-N 3.15Å; L919-Y921 VanDerWaalsContact C-N 3.27Å; L919-Y921 PolarHBondContact O-N 3.41Å
922	K	54.5	Low	56.9	Low	138 Å²	138	130.9 Å²	130.9	60%	0.6	64%	0.637	S	S	*	*	H	α-helix	trans	-87.5	-31.5	176.2	-74	-174	175	-170.8	0	113.3	L919 E920	L919-K922 CarbonylContact O-C 3.43Å; L919-K922 WeakPolarHBondContact O-CA 3.33Å; L919-K922 WeakPolarHBondContact O-CB 3.3Å; L919-K922 PolarHBondContact O-N 2.96Å; E920-K922 VanDerWaalsContact C-N 3.25Å; E920-K922 PolarHBondContact O-N 3.27Å
923	Y	52	Low	54.5	Low	150 Å²	150	134.5 Å²	134.5	59%	0.588	65%	0.649	S	S	*	*	H	α-helix	trans	-79.9	-38	179.4	-93.8	-89.3	0	0	0	111.4	L919 E920 K925 L926 V927	L919-Y923 HydrophobicContact CB-CD2 4.28Å; L919-Y923 HydrophobicContact CD2-CD2 4.3Å; L919-Y923 HydrophobicContact CD2-CE2 4.02Å; L919-Y923 WeakPolarHBondContact O-CB 3.38Å; L919-Y923 WeakPolarHBondContact O-CD2 3.43Å; L919-Y923 PolarHBondContact O-N 3.44Å; E920-Y923 PolarHBondContact O-N 3.3Å; Y923-K925 PolarHBondContact O-N 3.3Å; Y923-L926 PolarHBondContact O-N 3.47Å; Y923-V927 WeakPolarHBondContact O-CB 3.34Å; Y923-V927 VanDerWaalsContact O-CG2 3.25Å; Y923-V927 WeakPolarHBondContact O-CG2 3.38Å; Y923-V927 PolarHBondContact O-N 2.96Å
924	M	57	Low	52.3	Low	146 Å²	146	132.5 Å²	132.5	72%	0.719	65%	0.65	S	S	*	*	H	α-helix	trans	-64.4	-29.1	176.2	-164.4	162.2	72	0	0	112	E920 L926	E920-M924 WeakPolarHBondContact O-CB 3.41Å; E920-M924 PolarHBondContact O-N 2.89Å; M924-L926 VanDerWaalsContact C-N 3.35Å
925	K	52.4	Low	50	Low	170 Å²	170	131.2 Å²	131.2	74%	0.739	65%	0.65	S	S	*	*	H	α-helix	trans	-79.7	-14.1	173.7	-153.3	176.8	-177.4	-179.8	0	113.9	Y923	Y923-K925 PolarHBondContact O-N 3.3Å
926	L	50.6	Low	47.9	Very low	127 Å²	127	130.1 Å²	130.1	67%	0.665	65%	0.652	S	S	*	*	H	α-helix	trans	-97.9	-31.6	176.7	-135.4	90.8	0	0	0	112.1	Y923 M924 N929	Y923-L926 PolarHBondContact O-N 3.47Å; M924-L926 VanDerWaalsContact C-N 3.35Å; L926-N929 PolarHBondContact O-N 3.41Å
927	V	51.1	Low	46.1	Very low	101 Å²	101	133.7 Å²	133.7	61%	0.612	67%	0.67	S	S	*	*	H	α-helix	trans	-83.4	-9.4	-172.3	175.2	0	0	0	0	113.3	Y923 N929	Y923-V927 WeakPolarHBondContact O-CB 3.34Å; Y923-V927 VanDerWaalsContact O-CG2 3.25Å; Y923-V927 WeakPolarHBondContact O-CG2 3.38Å; Y923-V927 PolarHBondContact O-N 2.96Å; V927-N929 PolarHBondContact O-N 3.02Å
928	E	48.2	Very low	44.1	Very low	169 Å²	169	134 Å²	134	79%	0.79	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-11.9	169.1	-149	170.5	-162.7	0	0	112.9
929	N	47.9	Very low	42.4	Very low	148 Å²	148	129.8 Å²	129.8	79%	0.791	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	17.2	-172.9	-89.6	-3.3	0	0	0	116	L926 V927	L926-N929 PolarHBondContact O-N 3.41Å; V927-N929 PolarHBondContact O-N 3.02Å
930	S	40.6	Very low	41.1	Very low	92 Å²	92	130.6 Å²	130.6	64%	0.643	71%	0.706	S	S	*	*			trans	-142.5	62.3	171.6	69.2	0	0	0	0	112.2	G932	S930-G932 PolarHBondContact O-N 3.48Å
931	T	31.8	Very low	39.7	Very low	142 Å²	142	133.8 Å²	133.8	87%	0.871	72%	0.721	S	S	*	*			trans	-62	118.8	147	46.5	0	0	0	0	108.6
932	G	34	Very low	38.4	Very low	68 Å²	68	130.1 Å²	130.1	70%	0.701	72%	0.721	S	S	*	*			trans	152.1	111.5	161.5	0	0	0	0	0	114.6	S930	S930-G932 PolarHBondContact O-N 3.48Å
933	K	32.8	Very low	37.7	Very low	183 Å²	183	129.6 Å²	129.6	80%	0.796	73%	0.733	S	S	*	*			trans	95.5	111.4	143.9	-75.6	-170	152.6	-176.2	0	119.3
934	D	29.8	Very low	36.6	Very low	116 Å²	116	126.1 Å²	126.1	62%	0.62	74%	0.735	S	S	*	*				88.4	105.5	116.9	-61	-8.3	0	0	0	116.5
935	D	28.1	Very low	35.8	Very low	126 Å²	126	127.6 Å²	127.6	67%	0.674	75%	0.745	S	S	*	*				75.8	119.1	116	-82.8	0.6	0	0	0	119.2
936	N	27.5	Very low	35	Very low	130 Å²	130	125 Å²	125	70%	0.695	74%	0.74	S	S	*	*				90.2	147.1	121.5	-78.1	-28.6	0	0	0	119.2
937	L	28.5	Very low	34.1	Very low	147 Å²	147	127.4 Å²	127.4	77%	0.77	75%	0.747	S	S	*	*			trans	89.5	91.3	157.7	-95.5	72.2	0	0	0	117.4
938	S	25.3	Very low	33.3	Very low	108 Å²	108	126.2 Å²	126.2	76%	0.755	76%	0.755	S	S	*	*				46.1	126.6	99.4	-51.3	0	0	0	0	119.6
939	A	25.8	Very low	32.5	Very low	102 Å²	102	127.3 Å²	127.3	84%	0.843	76%	0.761	S	S	*	*			trans	78.9	138	134.2	0	0	0	0	0	119
940	A	31.2	Very low	31.7	Very low	86 Å²	86	128.5 Å²	128.5	71%	0.711	76%	0.762	S	S	*	*			trans	134.3	96.5	139.8	0	0	0	0	0	108.3
941	E	28.5	Very low	31.3	Very low	184 Å²	184	132.5 Å²	132.5	86%	0.86	78%	0.776	S	S	*	*				69.4	123	79.6	-75.1	-170.9	161.5	0	0	113.1
942	S	28.7	Very low	31.2	Very low	100 Å²	100	131 Å²	131	70%	0.699	77%	0.766	S	S	*	*				65.1	126.9	129.9	-170.1	0	0	0	0	117.5
943	C	40.9	Very low	31	Very low	126 Å²	126	133 Å²	133	85%	0.851	77%	0.77	S	S	*	*				-173.4	119.3	104	-88	0	0	0	0	110.8
944	A	29	Very low	30.8	Very low	77 Å²	77	128 Å²	128	64%	0.636	77%	0.77	S	S	*	*			trans	-44.7	146.4	170.2	0	0	0	0	0	116.2
945	L	39.7	Very low	30.9	Very low	177 Å²	177	127.9 Å²	127.9	93%	0.927	78%	0.776	S	S	*	*			trans	-147.5	88.6	131.1	-72.5	-179.7	0	0	0	105.1
946	N	34.3	Very low	30.6	Very low	116 Å²	116	130.6 Å²	130.6	62%	0.62	79%	0.786	S	S	*	*				53.8	119.5	83.9	-114	35.9	0	0	0	115.6
947	E	31.9	Very low	30.7	Very low	177 Å²	177	130.8 Å²	130.8	83%	0.827	79%	0.792	S	S	*	*			trans	77.6	133.4	138.2	-70.7	171.4	-177.2	0	0	120.6
948	G	34.5	Very low	30.6	Very low	76 Å²	76	130.2 Å²	130.2	78%	0.784	79%	0.79	S	S	*	*			trans	132.9	82.4	152.6	0	0	0	0	0	113.7
949	E	31.2	Very low	30.7	Very low	192 Å²	192	134.6 Å²	134.6	90%	0.897	80%	0.795	S	S	*	*			trans	-45.9	134.3	161.1	-64.4	166.5	137.3	0	0	111.8
950	E	32.6	Very low	30.8	Very low	174 Å²	174	136.7 Å²	136.7	81%	0.813	79%	0.791	S	S	*	*				-177.4	98.7	127.8	-102.6	177.4	178	0	0	108.8	T952	E950-T952 PolarHBondContact O-N 3.04Å; E950-T952 VanDerWaalsContact O-N 3.08Å
951	D	31.1	Very low	30.6	Very low	176 Å²	176	138.1 Å²	138.1	94%	0.941	79%	0.79	S	S	*	*			trans	-66.8	97	157.1	-81.9	-39.3	0	0	0	107.7
952	T	30.5	Very low	30.6	Very low	109 Å²	109	139.1 Å²	139.1	67%	0.669	79%	0.792	S	S	*	*			trans	-132.8	99.6	160.1	-3.8	0	0	0	0	111.2	E950 G954	E950-T952 PolarHBondContact O-N 3.04Å; E950-T952 VanDerWaalsContact O-N 3.08Å; T952-G954 PolarHBondContact O-N 2.96Å
953	S	30.1	Very low	30.6	Very low	111 Å²	111	141.5 Å²	141.5	78%	0.776	80%	0.796	S	S	*	*			trans	-41.2	117.1	150.9	45.7	0	0	0	0	111.4	P955	S953-P955 WeakPolarHBondContact O-CD 3.45Å
954	G	28.4	Very low	29.8	Very low	78 Å²	78	145.1 Å²	145.1	80%	0.804	80%	0.797	S	S	*	*			trans	-111.6	89.4	164.2	0	0	0	0	0	110.2	T952	T952-G954 PolarHBondContact O-N 2.96Å
955	P	30	Very low	29.7	Very low	113 Å²	113	147.6 Å²	147.6	73%	0.734	81%	0.805	S	S	*	*			trans	-77.5	164.8	162.4	33.5	-30.9	0	0	0	110.6	S953	S953-P955 WeakPolarHBondContact O-CD 3.45Å
956	M	23.8	Very low	28.9	Very low	183 Å²	183	148.1 Å²	148.1	90%	0.901	80%	0.8	S	S	*	*			trans	-26.4	141.4	167	-71.8	-176.9	172.1	0	0	115
957	V	29.4	Very low	28.6	Very low	135 Å²	135	148.6 Å²	148.6	82%	0.818	81%	0.809	S	S	*	*				-176.4	134.4	114.3	154.4	0	0	0	0	109.4
958	D	26.2	Very low	28.1	Very low	134 Å²	134	149.2 Å²	149.2	72%	0.717	81%	0.809	S	S	*	*			trans	-33.8	130.8	161.1	-71.9	-52.1	0	0	0	114.3
959	K	27.4	Very low	27.7	Very low	201 Å²	201	153.6 Å²	153.6	87%	0.874	81%	0.811	S	S	*	*			trans	-150	70.9	143.4	-111.7	168.4	-170.7	175.8	0	109.6	V961	K959-V961 PolarHBondContact O-N 3.48Å
960	I	28	Very low	27.3	Very low	146 Å²	146	154 Å²	154	75%	0.749	81%	0.805	S	S	*	*			trans	-60	117.1	157.4	-69.6	168.5	0	0	0	107.2	F962	I960-F962 PolarHBondContact O-N 3.34Å
961	V	27.1	Very low	26.9	Very low	115 Å²	115	151.1 Å²	151.1	70%	0.697	80%	0.804	S	S	*	*			trans	-65	122	-178.1	171.7	0	0	0	0	110	K959 L963	K959-V961 PolarHBondContact O-N 3.48Å; V961-L963 VanDerWaalsContact C-N 3.34Å; V961-L963 PolarHBondContact O-N 3.07Å
962	F	26.9	Very low	26.8	Very low	206 Å²	206	150.1 Å²	150.1	90%	0.904	79%	0.793	S	S	*	*			trans	-67	88.4	168.6	-72.8	-88.2	0	0	0	110.2	I960 K964	I960-F962 PolarHBondContact O-N 3.34Å; F962-K964 PolarHBondContact O-N 2.98Å
963	L	29.6	Very low	26.5	Very low	150 Å²	150	154.8 Å²	154.8	79%	0.785	80%	0.804	S	S	*	*			trans	-71.4	105.7	162.2	-83.6	162	0	0	0	108.9	V961 T965	V961-L963 VanDerWaalsContact C-N 3.34Å; V961-L963 PolarHBondContact O-N 3.07Å; L963-T965 PolarHBondContact O-N 3.08Å
964	K	24.2	Very low	26.5	Very low	201 Å²	201	159.4 Å²	159.4	87%	0.874	81%	0.805	S	S	*	*			trans	-49.5	123.6	157.3	-77.3	173.7	173.7	170.8	0	109.2	F962	F962-K964 PolarHBondContact O-N 2.98Å
965	T	27	Very low	26.4	Very low	130 Å²	130	167.4 Å²	167.4	80%	0.798	81%	0.811	S	S	*	*			trans	-145.6	110.2	150.3	-5.9	0	0	0	0	109.5	L963	L963-T965 PolarHBondContact O-N 3.08Å
966	K	22.8	Very low	26.3	Very low	188 Å²	188	173.7 Å²	173.7	82%	0.817	82%	0.82	S	S	*	*			trans	-61.3	136.7	168.8	-66.3	174.8	173	179.2	0	109.3
967	P	27.5	Very low	26.5	Very low	126 Å²	126	174.1 Å²	174.1	82%	0.818	82%	0.82	S	S	*	*			trans	-93.2	110.4	144.9	20.8	-5	0	0	0	108.2
968	K	22.2	Very low	26.2	Very low	190 Å²	190	176 Å²	176	83%	0.826	82%	0.819	S	S	*	*			trans	-67.3	130.6	152.1	-73	175.3	173.8	176.4	0	107.4
969	M	25.1	Very low	26.2	Very low	167 Å²	167	181.2 Å²	181.2	82%	0.823	83%	0.829	S	S	*	*			trans	173.7	146.2	146.5	-96.9	-142.5	167.7	0	0	107.6
970	R	23.5	Very low	26.4	Very low	202 Å²	202	179 Å²	179	76%	0.762	83%	0.827	S	S	*	*			cis	-170.4	136.9	-17	-179.3	174.7	-179.8	169.2	-0.4	101.8	E972	R970-E972 PolarHBondContact O-N 3.32Å
971	S	24.7	Very low	26.3	Very low	113 Å²	113	176.8 Å²	176.8	79%	0.79	82%	0.824	S	S	*	*			trans	-60.9	120.8	176.2	46.1	0	0	0	0	110.7
972	E	27.8	Very low	26.3	Very low	154 Å²	154	182.2 Å²	182.2	72%	0.72	83%	0.834	S	S	*	*			trans	-104.7	102.7	161.4	-85.9	-164.8	166.4	0	0	109	R970 R974	R970-E972 PolarHBondContact O-N 3.32Å; E972-R974 PolarHBondContact O-N 3.44Å; E972-R974 IonicContact OE2-NE 3.23Å; E972-R974 IonicContact OE2-NH2 3.43Å
973	K	25.5	Very low	26.4	Very low	208 Å²	208	181.4 Å²	181.4	90%	0.904	83%	0.833	S	S	*	*			trans	-57.8	117.3	156	-80.7	174.7	170.9	176.6	0	107.7
974	R	28.8	Very low	26.4	Very low	208 Å²	208	181.7 Å²	181.7	79%	0.785	84%	0.835	S	S	*	*			trans	-120.3	126.3	158.5	-79.5	-172.5	-174.5	-174.9	1.9	109.9	E972	E972-R974 PolarHBondContact O-N 3.44Å; E972-R974 IonicContact OE2-NE 3.23Å; E972-R974 IonicContact OE2-NH2 3.43Å
975	R	26.1	Very low	26.5	Very low	246 Å²	246	178.4 Å²	178.4	93%	0.928	83%	0.832	S	S	*	*			trans	-37.9	128.9	179.8	-77.1	168.2	-176	164.2	3.8	112.4
976	R	27.7	Very low	26.5	Very low	244 Å²	244	176.6 Å²	176.6	92%	0.921	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-75.3	123.4	153.4	-87	-179.8	-173.5	170.5	1	107.3
977	E	29.6	Very low	26.7	Very low	193 Å²	193	175.4 Å²	175.4	90%	0.902	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-73.8	120.8	162.7	-72.4	172.6	164.2	0	0	107.6
978	E	22.9	Very low	26.8	Very low	174 Å²	174	173.7 Å²	173.7	81%	0.813	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-70	119.7	170.1	168.4	-178.6	-159.8	0	0	108.7
979	W	25.1	Very low	27.1	Very low	244 Å²	244	170.3 Å²	170.3	92%	0.924	83%	0.825	S	S	*	*			trans	-168.8	141.7	142.1	-79.2	100.9	0	0	0	108.3
980	D	32	Very low	27.3	Very low	155 Å²	155	168 Å²	168	83%	0.829	83%	0.826	S	S	*	*			trans	88.5	68.3	-180	-59.5	-14.8	0	0	0	117.2	Y982	D980-Y982 PolarHBondContact O-N 3.31Å
981	S	25.4	Very low	27.7	Very low	99 Å²	99	165.6 Å²	165.6	69%	0.692	83%	0.828	S	S	*	*			trans	-67.8	105	160.4	57.4	0	0	0	0	111.5
982	Y	28.1	Very low	28	Very low	229 Å²	229	169.5 Å²	169.5	90%	0.898	83%	0.834	S	S	*	*			trans	-167	63.7	142.2	-74.1	-64.4	0	0	0	106.8	D980	D980-Y982 PolarHBondContact O-N 3.31Å
983	E	28.1	Very low	28.5	Very low	188 Å²	188	165.9 Å²	165.9	88%	0.879	84%	0.838	S	S	*	*			trans	-80.6	121.5	168.7	-94.7	-177.4	162.1	0	0	109	V985	E983-V985 PolarHBondContact O-N 3.49Å
984	N	29.7	Very low	28.7	Very low	156 Å²	156	163.9 Å²	163.9	83%	0.834	84%	0.837	S	S	*	*			trans	-51.8	120.7	166	-67.7	-49.5	0	0	0	108.6	A986	N984-A986 VanDerWaalsContact C-N 3.32Å; N984-A986 PolarHBondContact O-N 3.34Å
985	V	26.8	Very low	29.3	Very low	132 Å²	132	167.6 Å²	167.6	80%	0.8	86%	0.859	S	S	*	*			trans	-64.7	95.8	175.1	178.7	0	0	0	0	107.7	E983 L987	E983-V985 PolarHBondContact O-N 3.49Å; V985-L987 PolarHBondContact O-N 3.2Å
986	A	26.8	Very low	29.5	Very low	92 Å²	92	163.7 Å²	163.7	76%	0.76	86%	0.856	S	S	*	*			trans	-66.2	111.8	163.2	0	0	0	0	0	106.9	N984 A988	N984-A986 VanDerWaalsContact C-N 3.32Å; N984-A986 PolarHBondContact O-N 3.34Å; A986-A988 PolarHBondContact O-N 3.43Å
987	L	27.3	Very low	29.6	Very low	163 Å²	163	159.4 Å²	159.4	85%	0.853	85%	0.852	S	S	*	*			trans	-54.2	114	172.6	-72.6	163.3	0	0	0	108.2	V985	V985-L987 PolarHBondContact O-N 3.2Å
988	A	28.9	Very low	29.6	Very low	90 Å²	90	157.6 Å²	157.6	74%	0.744	85%	0.85	S	S	*	*			trans	-60.1	133.4	174.9	0	0	0	0	0	109	A986 S990	A986-A988 PolarHBondContact O-N 3.43Å; A988-S990 PolarHBondContact O-N 3.13Å
989	P	28.7	Very low	30	Very low	119 Å²	119	156.6 Å²	156.6	77%	0.773	85%	0.852	S	S	*	*			trans	-64.3	128.2	174.2	-4.1	14.9	0	0	0	109.2	N991	P989-N991 PolarHBondContact O-N 3.26Å
990	S	30.1	Very low	30.3	Very low	120 Å²	120	151.1 Å²	151.1	84%	0.839	85%	0.847	S	S	*	*			trans	-60.2	107.2	169.9	52.7	0	0	0	0	109.3	A988	A988-S990 PolarHBondContact O-N 3.13Å
991	N	31.1	Very low	30.2	Very low	150 Å²	150	150.9 Å²	150.9	80%	0.802	85%	0.848	S	S	*	*			trans	-70.4	150.3	158.2	-93.3	-14.9	0	0	0	109.1	P989	P989-N991 PolarHBondContact O-N 3.26Å
992	E	32.7	Very low	30.5	Very low	196 Å²	196	154.6 Å²	154.6	92%	0.916	86%	0.86	S	S	*	*			trans	94.5	94.7	168.2	-56	-173.9	174.2	0	0	116.8
993	G	38.3	Very low	30.7	Very low	77 Å²	77	148.8 Å²	148.8	79%	0.794	86%	0.857	S	S	*	*			trans	-147.3	73.8	151.2	0	0	0	0	0	108.7	F995	G993-F995 PolarHBondContact O-N 3.29Å
994	N	29.5	Very low	30.9	Very low	167 Å²	167	145.6 Å²	145.6	89%	0.893	86%	0.855	S	S	*	*			trans	-70.9	101	161.1	-94	-19	0	0	0	107.7
995	F	41.4	Very low	31.1	Very low	285 Å²	285	144.6 Å²	144.6	100%	1.25	86%	0.857	S	S	*	*			trans	-164.2	0	141	-103.6	-70.6	0	0	0	109.5	G993	G993-F995 PolarHBondContact O-N 3.29Å

Retrieved 995 of 995 residues in 960.3 ms (Link to these results)

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