A0A3Q0KMR1_SCHMA Loading...

Helicase, putative

AlphaFold DB , UniProt , Accession A0A3Q0KMR1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,314 aa.

						>A0A3Q0KMR1_SCHMA|A0A3Q0KMR1
MTGKVLDPDVNFKRSCATATSHGINTANVRVEPTIMKSIHEISKQALRSTKTEFNLWNCIRKSPDSSGDLPTVPSIIDELLRKASEDVVQSWCFPKGYFLRLTAQINEAGTFLLPKRETITFLKRRIRSCKSRDSYAKEEDTSTPLPTLTKLIQNPALNWDFELDTFQKRAILCLENNETVFVSAHTSSGKTVVAEYACAICLRRGSRVVYTSPVKALSNQKFHEFRERFGENVGLITGDIKLAQEASLLIMTTEILYNMLCNASEIIKNLEIVILDEVHYINNPDRGYVWEQIMIMLPKHILLVMLSATVPNSFEIADWLGRVRGCEIHVIATDKRPVPLEHYLYTSMTEQYTSHLHLIVDKDGRFIDSGYQTAALSNNSRRPYRSPACSGKDAFLIQTKNTWLGFVNLLKEQNLMPAIAFAFSRSSVETLAKNLSSVDLTSKSEKQQITKFFSTITGRLRKCDRKLASVKFLHDLTRRGLAVHHSGMLPILKETVELLFRDGLVKILFATETVSTGVNTPARCVVFTSLEKFDGQRRRPLDPSEFTQMAGRAGRRGIDAKGLVIILVSTIGKSLKSSVTGLPTESLLRNMILGRQTELISRFRVTYSMILNLHRSSSLTPQDIMKRSFMEAASHRWETKKRQHLSVLNKKLNETTTIISHNNNISNIITQVSNITMSTYIEVASDLFKSLIDSLYVQVKCPHNGVECCDSIGQYYQLCYKYRQLTNSIISTLDVKYAQHLQQIFCPGRLILLQFMINQSVWLVPAVIINYHWTKRNKDSGNQIMLNVIQWTLPINLPNSLTQEERQSSSSELVLVVSGSDTVTSEQINNNKNTNYYEYDEIEEKILRHSINEDSFMATSTVPVPPHLMPVFVPSSLDDGYSRLTRQSVSLSDSLVRICDQIVTFQDMKCNFIDDNNSKSHSSILELLLQSIKQINISRKDDPKLLPVNGDDHRFDIHLQVINLALFNCVNSIVPQESSLTSAVYYTTLRNAPKQMDFKKYLNLVMDEEDIYLFDEYSTLNEQLTIPLSKDTITAFDPTNLLKCPNLLQHLNLVHQTVRRKLAINSIENNLANYQLQLSNEYTGRLSVLKKLGFIDSATQSYCLSFKGFFACELTSKEVLLTQLLLDGFIDDLLAPDIAAVLSAFANELRAQDLTPEKTSGYYLKELFDSINNYTNNFNLHKDLECIPRHLLPVFKNVLICAYELEKLQRLHNLTDPYLESRLDLRIVPLVYKWANGYSFSATVSKCDIPEGSLIKSLLQLDELIRHISGACRQFGNHILSLKIDEARGLIHRDIVCSPSLYVSQDIKLAKDD
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.3	Very low	32.7	Very low	248 Å²	248	124.5 Å²	124.5	100%	1.222	70%	0.702	S	S	*	*				0	121.1	0	-75.4	-175.6	172.6	0	0	108
2	T	26.4	Very low	33.1	Very low	149 Å²	149	121.9 Å²	121.9	91%	0.914	68%	0.678	S	S	*	*			trans	-76	155.6	-166.7	39.7	0	0	0	0	113.9
3	G	28.3	Very low	33.7	Very low	72 Å²	72	124.8 Å²	124.8	74%	0.742	68%	0.679	S	S	*	*			trans	-65.6	161.6	-168.4	0	0	0	0	0	118
4	K	27.8	Very low	34	Very low	199 Å²	199	128.4 Å²	128.4	87%	0.865	68%	0.678	S	S	*	*			trans	-154.1	103.9	132.6	-101.5	176.8	-176.5	-179.6	0	107.6	L6	K4-L6 PolarHBondContact O-N 2.79Å
5	V	32.3	Very low	34.2	Very low	149 Å²	149	124.6 Å²	124.6	90%	0.903	67%	0.666	S	S	*	*			trans	-76.5	106.5	168.9	177.8	0	0	0	0	106.2
6	L	32.5	Very low	34.2	Very low	141 Å²	141	121.2 Å²	121.2	74%	0.738	65%	0.654	S	S	*	*			trans	-74	138.5	175.2	-81.2	155.2	0	0	0	109.9	K4	K4-L6 PolarHBondContact O-N 2.79Å
7	D	33.9	Very low	34.4	Very low	94 Å²	94	117.6 Å²	117.6	50%	0.503	65%	0.645	S	S	.	*			trans	-59.7	118.2	-177.3	-171.4	-10.9	0	0	0	111.9	D9 V10	D7-D9 PolarHBondContact O-N 3.07Å; D7-D9 PolarHBondContact OD1-N 3.02Å; D7-V10 HydrophobicContact CB-CG2 3.94Å; D7-V10 WeakPolarHBondContact O-CB 3.38Å; D7-V10 PolarHBondContact O-N 3.24Å; D7-V10 VanDerWaalsContact O-N 3.1Å
8	P	34.7	Very low	34.7	Very low	75 Å²	75	115.1 Å²	115.1	49%	0.487	63%	0.633	S	S	.	*	H	α-helix	trans	-63.1	-20.2	-177.3	22.5	-31.2	0	0	0	114	V10 F12	P8-V10 VanDerWaalsContact C-N 3.32Å; P8-F12 PolarHBondContact O-N 3.08Å
9	D	37.3	Very low	34.7	Very low	81 Å²	81	111.3 Å²	111.3	43%	0.433	62%	0.619	S	S	.	*	H	α-helix	trans	-75.2	-21.4	176.6	-77.8	-8.5	0	0	0	112.5	D7 K13 K44	D7-D9 PolarHBondContact O-N 3.07Å; D7-D9 PolarHBondContact OD1-N 3.02Å; D9-K13 PolarHBondContact O-N 2.99Å; D9-K44 IonicContact OD1-NZ 3.18Å; D9-K44 PolarHBondContact OD1-NZ 3.17Å
10	V	41.9	Very low	34.8	Very low	75 Å²	75	111.7 Å²	111.7	46%	0.455	62%	0.624	S	S	.	*	H	α-helix	trans	-76.9	-37.3	178.5	177.7	0	0	0	0	111.8	D7 P8 R14	D7-V10 HydrophobicContact CB-CG2 3.94Å; D7-V10 WeakPolarHBondContact O-CB 3.38Å; D7-V10 PolarHBondContact O-N 3.24Å; D7-V10 VanDerWaalsContact O-N 3.1Å; P8-V10 VanDerWaalsContact C-N 3.32Å; V10-R14 WeakPolarHBondContact O-CB 3.23Å; V10-R14 PolarHBondContact O-N 3.4Å
11	N	40.3	Very low	35	Very low	86 Å²	86	110.3 Å²	110.3	46%	0.46	62%	0.622	S	S	.	*	H	α-helix	trans	-72.8	-34.8	176.8	-88.2	-18.6	0	0	0	112.3	R14 S15	N11-R14 PolarHBondContact O-N 3.03Å; N11-S15 WeakPolarHBondContact O-CB 3.27Å; N11-S15 PolarHBondContact O-N 3.33Å; N11-S15 PolarHBondContact O-OG 2.97Å; N11-S15 VanDerWaalsContact O-OG 3.13Å
12	F	37.8	Very low	35.5	Very low	94 Å²	94	105 Å²	105	41%	0.412	59%	0.594	S	S	.	*	H	α-helix	trans	-65.3	-43.6	175.3	-170.3	-102.5	0	0	0	111.9	P8 S15 C16 H40	P8-F12 PolarHBondContact O-N 3.08Å; F12-S15 PolarHBondContact O-N 3.49Å; F12-C16 WeakPolarHBondContact O-CB 3.41Å; F12-C16 PolarHBondContact O-N 2.77Å; F12-C16 PolarHBondContact O-SG 3.35Å; F12-H40 AromaticContact CD2-CE1 3.85Å; F12-H40 AromaticContact CD2-ND1 3.85Å; F12-H40 AromaticContact CE2-CE1 4Å; F12-H40 AromaticContact CE2-ND1 3.6Å
13	K	40	Very low	35.8	Very low	160 Å²	160	101.5 Å²	101.5	70%	0.696	59%	0.588	S	S	*	*	H	α-helix	trans	-65.4	-37.4	173.9	-76.8	-179.1	178.4	175.5	0	112.7	D9 A17	D9-K13 PolarHBondContact O-N 2.99Å; K13-A17 VanDerWaalsContact O-CB 3.29Å; K13-A17 WeakPolarHBondContact O-CB 3.48Å; K13-A17 PolarHBondContact O-N 3.33Å
14	R	38.6	Very low	36.1	Very low	175 Å²	175	103.1 Å²	103.1	66%	0.66	58%	0.579	S	S	*	*	H	α-helix	trans	-65.2	-45.1	173.9	-93.6	-178.8	169.5	174.1	-2.9	112.3	V10 N11 A17 T18	V10-R14 WeakPolarHBondContact O-CB 3.23Å; V10-R14 PolarHBondContact O-N 3.4Å; N11-R14 PolarHBondContact O-N 3.03Å; R14-A17 PolarHBondContact O-N 3.25Å; R14-T18 PolarHBondContact O-N 3.15Å; R14-T18 PolarHBondContact O-OG1 3.13Å
15	S	36.9	Very low	36.4	Very low	71 Å²	71	100.8 Å²	100.8	50%	0.497	58%	0.576	S	S	.	*	H	α-helix	trans	-66.5	-35.5	177.5	-65.6	0	0	0	0	113	N11 F12 A19	N11-S15 WeakPolarHBondContact O-CB 3.27Å; N11-S15 PolarHBondContact O-N 3.33Å; N11-S15 PolarHBondContact O-OG 2.97Å; N11-S15 VanDerWaalsContact O-OG 3.13Å; F12-S15 PolarHBondContact O-N 3.49Å; S15-A19 PolarHBondContact O-N 2.56Å
16	C	35	Very low	36.6	Very low	70 Å²	70	99.4 Å²	99.4	47%	0.473	57%	0.567	S	S	.	*	H	α-helix	trans	-69.4	-35	171.5	-74.7	0	0	0	0	112.7	F12 A19 T20	F12-C16 WeakPolarHBondContact O-CB 3.41Å; F12-C16 PolarHBondContact O-N 2.77Å; F12-C16 PolarHBondContact O-SG 3.35Å; C16-A19 PolarHBondContact O-N 3.37Å; C16-T20 PolarHBondContact O-OG1 2.96Å
17	A	37.1	Very low	36.6	Very low	61 Å²	61	96.4 Å²	96.4	50%	0.504	56%	0.563	S	S	.	*	H	α-helix	trans	-75.4	-23.3	176	0	0	0	0	0	113.7	K13 R14 T20	K13-A17 VanDerWaalsContact O-CB 3.29Å; K13-A17 WeakPolarHBondContact O-CB 3.48Å; K13-A17 PolarHBondContact O-N 3.33Å; R14-A17 PolarHBondContact O-N 3.25Å; A17-T20 PolarHBondContact O-OG1 3.17Å; A17-T20 VanDerWaalsContact O-OG1 3.11Å
18	T	40.1	Very low	36.5	Very low	71 Å²	71	99.5 Å²	99.5	44%	0.436	58%	0.58	S	S	.	*	H	α-helix	trans	-79.3	-24	173.5	-5.3	0	0	0	0	112.4	R14 S21 H22	R14-T18 PolarHBondContact O-N 3.15Å; R14-T18 PolarHBondContact O-OG1 3.13Å; T18-S21 PolarHBondContact O-OG 2.73Å; T18-H22 PolarHBondContact O-ND1 3.32Å
19	A	34.8	Very low	36.5	Very low	44 Å²	44	100.7 Å²	100.7	36%	0.364	59%	0.585	S	S	.	*	H	α-helix	trans	-72.9	-30.7	176.8	0	0	0	0	0	112.6	S15 C16	S15-A19 PolarHBondContact O-N 2.56Å; C16-A19 PolarHBondContact O-N 3.37Å
20	T	36.8	Very low	36.2	Very low	118 Å²	118	109 Å²	109	72%	0.724	61%	0.611	S	S	*	*	H	α-helix	trans	-78	-21.1	174.7	32.5	0	0	0	0	113.7	C16 A17	C16-T20 PolarHBondContact O-OG1 2.96Å; A17-T20 PolarHBondContact O-OG1 3.17Å; A17-T20 VanDerWaalsContact O-OG1 3.11Å
21	S	37.7	Very low	36.1	Very low	83 Å²	83	109 Å²	109	58%	0.58	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-8.3	176.7	64.7	0	0	0	0	114.6	T18	T18-S21 PolarHBondContact O-OG 2.73Å
22	H	35.8	Very low	36	Very low	137 Å²	137	110.1 Å²	110.1	63%	0.634	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	20.5	-175.7	-74	71.1	0	0	0	114.4	T18 I24	T18-H22 PolarHBondContact O-ND1 3.32Å; H22-I24 VanDerWaalsContact C-N 3.3Å; H22-I24 PolarHBondContact O-N 2.93Å
23	G	31.8	Very low	36	Very low	76 Å²	76	110.6 Å²	110.6	78%	0.784	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	67.7	20.2	167	0	0	0	0	0	116.2	N25	G23-N25 PolarHBondContact O-N 3.44Å
24	I	34.5	Very low	36	Very low	106 Å²	106	106.7 Å²	106.7	54%	0.544	62%	0.615	S	S	.	*			trans	-80.4	110.2	178.9	-57.4	177	0	0	0	109.3	H22 T26	H22-I24 VanDerWaalsContact C-N 3.3Å; H22-I24 PolarHBondContact O-N 2.93Å; I24-T26 PolarHBondContact O-N 3.46Å; I24-T26 VanDerWaalsContact O-N 3.12Å
25	N	34.5	Very low	36.2	Very low	150 Å²	150	102.1 Å²	102.1	80%	0.802	60%	0.603	S	S	*	*			trans	-69.6	101.5	178.3	-156.7	-5.2	0	0	0	110.1	G23 A27	G23-N25 PolarHBondContact O-N 3.44Å; N25-A27 VanDerWaalsContact C-N 3.31Å; N25-A27 PolarHBondContact O-N 3.31Å
26	T	36.8	Very low	36.5	Very low	119 Å²	119	103.4 Å²	103.4	73%	0.73	60%	0.602	S	S	*	*			trans	-87.9	14.5	-172.8	42.5	0	0	0	0	114.3	I24 N28	I24-T26 PolarHBondContact O-N 3.46Å; I24-T26 VanDerWaalsContact O-N 3.12Å; T26-N28 VanDerWaalsContact C-N 3.33Å; T26-N28 PolarHBondContact O-N 3.23Å
27	A	31.6	Very low	37	Very low	79 Å²	79	107.8 Å²	107.8	65%	0.653	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-13.9	-170.3	0	0	0	0	0	116.2	N25	N25-A27 VanDerWaalsContact C-N 3.31Å; N25-A27 PolarHBondContact O-N 3.31Å
28	N	33.6	Very low	37.4	Very low	158 Å²	158	107.4 Å²	107.4	85%	0.845	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	11.3	-168	-82.9	-11.4	0	0	0	116.9	T26	T26-N28 VanDerWaalsContact C-N 3.33Å; T26-N28 PolarHBondContact O-N 3.23Å
29	V	32.9	Very low	37.6	Very low	100 Å²	100	106.6 Å²	106.6	61%	0.606	60%	0.599	S	S	*	*			trans	-122.6	89.2	-177.2	-166.5	0	0	0	0	111	V31	V29-V31 VanDerWaalsContact C-N 3.33Å; V29-V31 HydrophobicContact CG1-CG2 3.75Å; V29-V31 PolarHBondContact O-N 2.87Å
30	R	32.2	Very low	38.1	Very low	257 Å²	257	106.7 Å²	106.7	97%	0.97	59%	0.592	S	S	*	*			trans	-76	83.3	166.6	-85.6	-175.4	175.3	176.4	-0.7	109.4
31	V	39.5	Very low	38.7	Very low	74 Å²	74	105.5 Å²	105.5	45%	0.448	58%	0.578	S	S	.	*			trans	-77.4	122.3	159.1	-171.6	0	0	0	0	107.2	V29 I35 M36	V29-V31 VanDerWaalsContact C-N 3.33Å; V29-V31 HydrophobicContact CG1-CG2 3.75Å; V29-V31 PolarHBondContact O-N 2.87Å; V31-I35 HydrophobicContact CG1-CB 4.29Å; V31-I35 HydrophobicContact CG1-CG2 4.3Å; V31-M36 HydrophobicContact CB-CG 4.29Å; V31-M36 HydrophobicContact CG1-CG 3.79Å
32	E	38	Very low	39.1	Very low	109 Å²	109	104.1 Å²	104.1	51%	0.509	56%	0.564	S	S	.	*			trans	-57.9	130.1	179.9	-140	-169.3	-150.7	0	0	110	T34 I35 M36	E32-T34 VanDerWaalsContact CD-OG1 3.26Å; E32-T34 WeakPolarHBondContact CG-OG1 3.26Å; E32-T34 PolarHBondContact O-N 2.93Å; E32-T34 PolarHBondContact OE2-OG1 3.28Å; E32-I35 HydrophobicContact CB-CD1 4.2Å; E32-I35 HydrophobicContact CB-CG1 4.3Å; E32-I35 PolarHBondContact O-N 3.37Å; E32-M36 PolarHBondContact O-N 2.76Å
33	P	37.6	Very low	39.6	Very low	104 Å²	104	98.7 Å²	98.7	68%	0.675	54%	0.541	S	S	*	.	H	α-helix	trans	-54.1	-27.5	-176.2	-27.8	34.1	0	0	0	114.1	K37	P33-K37 WeakPolarHBondContact O-CB 3.47Å; P33-K37 PolarHBondContact O-N 2.76Å
34	T	41.4	Very low	40.3	Very low	78 Å²	78	97.5 Å²	97.5	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-42.6	173.5	21.8	0	0	0	0	113.1	E32 S38	E32-T34 VanDerWaalsContact CD-OG1 3.26Å; E32-T34 WeakPolarHBondContact CG-OG1 3.26Å; E32-T34 PolarHBondContact O-N 2.93Å; E32-T34 PolarHBondContact OE2-OG1 3.28Å; T34-S38 WeakPolarHBondContact O-CB 3.18Å; T34-S38 PolarHBondContact O-N 3.27Å; T34-S38 PolarHBondContact O-OG 3.47Å
35	I	42.2	Very low	40.8	Very low	79 Å²	79	96.7 Å²	96.7	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-72.9	-43.1	178.9	-62.5	175	0	0	0	110	V31 E32 K37 S38 I39	V31-I35 HydrophobicContact CG1-CB 4.29Å; V31-I35 HydrophobicContact CG1-CG2 4.3Å; E32-I35 HydrophobicContact CB-CD1 4.2Å; E32-I35 HydrophobicContact CB-CG1 4.3Å; E32-I35 PolarHBondContact O-N 3.37Å; I35-K37 PolarHBondContact O-N 3.03Å; I35-S38 PolarHBondContact O-N 3.29Å; I35-I39 HydrophobicContact CG2-CD1 3.88Å; I35-I39 WeakPolarHBondContact O-CG1 3.19Å; I35-I39 PolarHBondContact O-N 3.34Å
36	M	43.5	Very low	41.1	Very low	99 Å²	99	90.1 Å²	90.1	49%	0.488	48%	0.475	S	S	.	.	H	α-helix	trans	-63.9	-38.1	174.4	-91.3	-72.2	-83.2	0	0	112.6	V31 E32 S38 H40	V31-M36 HydrophobicContact CB-CG 4.29Å; V31-M36 HydrophobicContact CG1-CG 3.79Å; E32-M36 PolarHBondContact O-N 2.76Å; M36-S38 VanDerWaalsContact C-N 3.34Å; M36-H40 WeakPolarHBondContact O-CB 3.41Å; M36-H40 PolarHBondContact O-N 3.29Å
37	K	44.9	Very low	41.4	Very low	161 Å²	161	88.5 Å²	88.5	70%	0.7	46%	0.462	S	S	*	.	H	α-helix	trans	-60.2	-43.3	170.9	-109.2	-179.5	174	177.6	0	111.9	P33 I35 H40 E41	P33-K37 WeakPolarHBondContact O-CB 3.47Å; P33-K37 PolarHBondContact O-N 2.76Å; I35-K37 PolarHBondContact O-N 3.03Å; K37-H40 PolarHBondContact O-N 2.84Å; K37-E41 WeakPolarHBondContact O-CB 3.29Å; K37-E41 PolarHBondContact O-N 3.28Å
38	S	45	Very low	41.8	Very low	53 Å²	53	94.8 Å²	94.8	37%	0.371	47%	0.469	S	S	.	.	H	α-helix	trans	-67	-43.4	-178.8	-57.6	0	0	0	0	111.7	T34 I35 M36 E41 I42	T34-S38 WeakPolarHBondContact O-CB 3.18Å; T34-S38 PolarHBondContact O-N 3.27Å; T34-S38 PolarHBondContact O-OG 3.47Å; I35-S38 PolarHBondContact O-N 3.29Å; M36-S38 VanDerWaalsContact C-N 3.34Å; S38-E41 PolarHBondContact O-N 3.5Å; S38-I42 WeakPolarHBondContact O-CB 3.19Å; S38-I42 WeakPolarHBondContact O-CD1 3.47Å; S38-I42 WeakPolarHBondContact O-CG1 3.32Å; S38-I42 PolarHBondContact O-N 3.36Å
39	I	43.6	Very low	42.2	Very low	54 Å²	54	90 Å²	90	28%	0.277	45%	0.448	S	S	.	.	H	α-helix	trans	-66.8	-39.3	175.4	-65.4	169.6	0	0	0	110.9	I35 E41 I42 S43 L56	I35-I39 HydrophobicContact CG2-CD1 3.88Å; I35-I39 WeakPolarHBondContact O-CG1 3.19Å; I35-I39 PolarHBondContact O-N 3.34Å; I39-E41 VanDerWaalsContact C-N 3.34Å; I39-E41 PolarHBondContact O-N 3.11Å; I39-I42 PolarHBondContact O-N 3.36Å; I39-S43 WeakPolarHBondContact O-CB 3.29Å; I39-S43 PolarHBondContact O-N 3.31Å; I39-S43 PolarHBondContact O-OG 3.31Å; I39-S43 VanDerWaalsContact O-OG 3.04Å; I39-L56 HydrophobicContact CG2-CD2 3.77Å
40	H	46.8	Very low	42.5	Very low	46 Å²	46	86.8 Å²	86.8	21%	0.213	43%	0.428	C	S	.	.	H	α-helix	trans	-62.1	-41.1	174.6	-173.7	81.2	0	0	0	111.4	F12 M36 K37 S43 K44	F12-H40 AromaticContact CD2-CE1 3.85Å; F12-H40 AromaticContact CD2-ND1 3.85Å; F12-H40 AromaticContact CE2-CE1 4Å; F12-H40 AromaticContact CE2-ND1 3.6Å; M36-H40 WeakPolarHBondContact O-CB 3.41Å; M36-H40 PolarHBondContact O-N 3.29Å; K37-H40 PolarHBondContact O-N 2.84Å; H40-S43 WeakPolarHBondContact CA-OG 3.4Å; H40-S43 PolarHBondContact O-N 3.44Å; H40-S43 PolarHBondContact O-OG 3.14Å; H40-K44 PolarHBondContact NE2-NZ 2.97Å; H40-K44 WeakPolarHBondContact O-CB 3.31Å; H40-K44 PolarHBondContact O-N 3.22Å
41	E	49.9	Very low	42.9	Very low	93 Å²	93	85.3 Å²	85.3	44%	0.435	43%	0.429	S	S	.	.	H	α-helix	trans	-72.3	-38.2	179.5	-154.1	58.6	-162.7	0	0	112.7	K37 S38 I39 S43 K44 Q45	K37-E41 WeakPolarHBondContact O-CB 3.29Å; K37-E41 PolarHBondContact O-N 3.28Å; S38-E41 PolarHBondContact O-N 3.5Å; I39-E41 VanDerWaalsContact C-N 3.34Å; I39-E41 PolarHBondContact O-N 3.11Å; E41-S43 VanDerWaalsContact C-N 3.34Å; E41-S43 PolarHBondContact O-N 3.39Å; E41-K44 PolarHBondContact O-N 3Å; E41-Q45 WeakPolarHBondContact O-CG 3.3Å; E41-Q45 PolarHBondContact O-N 3.35Å
42	I	46	Very low	42.8	Very low	55 Å²	55	86.2 Å²	86.2	28%	0.282	44%	0.435	S	S	.	.	H	α-helix	trans	-61.6	-42.4	172.4	-69.2	164.7	0	0	0	110.8	S38 I39 Q45 A46 W92	S38-I42 WeakPolarHBondContact O-CB 3.19Å; S38-I42 WeakPolarHBondContact O-CD1 3.47Å; S38-I42 WeakPolarHBondContact O-CG1 3.32Å; S38-I42 PolarHBondContact O-N 3.36Å; I39-I42 PolarHBondContact O-N 3.36Å; I42-Q45 PolarHBondContact O-N 3.37Å; I42-A46 WeakPolarHBondContact O-CB 2.9Å; I42-A46 PolarHBondContact O-N 3.04Å; I42-W92 HydrophobicContact CG2-CH2 3.72Å; I42-W92 HydrophobicContact CG2-CZ2 3.64Å
43	S	45	Very low	42.8	Very low	22 Å²	22	90.2 Å²	90.2	15%	0.154	45%	0.453	C	S	.	.	H	α-helix	trans	-71	-37.5	177.1	61.8	0	0	0	0	113	I39 H40 E41 Q45 A46 L47	I39-S43 WeakPolarHBondContact O-CB 3.29Å; I39-S43 PolarHBondContact O-N 3.31Å; I39-S43 PolarHBondContact O-OG 3.31Å; I39-S43 VanDerWaalsContact O-OG 3.04Å; H40-S43 WeakPolarHBondContact CA-OG 3.4Å; H40-S43 PolarHBondContact O-N 3.44Å; H40-S43 PolarHBondContact O-OG 3.14Å; E41-S43 VanDerWaalsContact C-N 3.34Å; E41-S43 PolarHBondContact O-N 3.39Å; S43-Q45 VanDerWaalsContact C-N 3.29Å; S43-Q45 PolarHBondContact O-N 2.98Å; S43-A46 PolarHBondContact O-N 3.41Å; S43-L47 WeakPolarHBondContact O-CB 3.49Å; S43-L47 WeakPolarHBondContact O-CD1 3.11Å; S43-L47 WeakPolarHBondContact O-CG 3.29Å; S43-L47 PolarHBondContact O-N 2.9Å
44	K	47	Very low	42.9	Very low	51 Å²	51	87.8 Å²	87.8	22%	0.222	43%	0.432	C	S	.	.	H	α-helix	trans	-58.6	-40.3	170.7	-108.5	177.4	175.4	161.9	0	111.7	D9 H40 E41 R48	D9-K44 IonicContact OD1-NZ 3.18Å; D9-K44 PolarHBondContact OD1-NZ 3.17Å; H40-K44 PolarHBondContact NE2-NZ 2.97Å; H40-K44 WeakPolarHBondContact O-CB 3.31Å; H40-K44 PolarHBondContact O-N 3.22Å; E41-K44 PolarHBondContact O-N 3Å; K44-R48 WeakPolarHBondContact O-CG 3.12Å; K44-R48 PolarHBondContact O-N 3.41Å
45	Q	45.1	Very low	43.2	Very low	89 Å²	89	88.5 Å²	88.5	42%	0.416	43%	0.433	S	S	.	.	H	α-helix	trans	-74.3	-38.4	177.5	-73	-179.1	0.3	0	0	112.5	E41 I42 S43 R48 S49	E41-Q45 WeakPolarHBondContact O-CG 3.3Å; E41-Q45 PolarHBondContact O-N 3.35Å; I42-Q45 PolarHBondContact O-N 3.37Å; S43-Q45 VanDerWaalsContact C-N 3.29Å; S43-Q45 PolarHBondContact O-N 2.98Å; Q45-R48 PolarHBondContact O-N 3.42Å; Q45-S49 PolarHBondContact O-N 3.32Å
46	A	41.1	Very low	43.1	Very low	13 Å²	13	87.1 Å²	87.1	11%	0.107	43%	0.426	C	S	.	.	H	α-helix	trans	-63.1	-45.6	174.1	0	0	0	0	0	112.1	I42 S43 R48 S49 T50	I42-A46 WeakPolarHBondContact O-CB 2.9Å; I42-A46 PolarHBondContact O-N 3.04Å; S43-A46 PolarHBondContact O-N 3.41Å; A46-R48 VanDerWaalsContact C-N 3.28Å; A46-R48 PolarHBondContact O-N 2.9Å; A46-S49 PolarHBondContact O-N 3.44Å; A46-S49 PolarHBondContact O-OG 2.74Å; A46-T50 PolarHBondContact O-N 3.26Å; A46-T50 VanDerWaalsContact O-N 3.15Å; A46-T50 PolarHBondContact O-OG1 3.38Å
47	L	41.8	Very low	43	Very low	85 Å²	85	89.7 Å²	89.7	45%	0.445	43%	0.431	S	S	.	.	H	α-helix	trans	-63	-27.7	178.2	-83.7	156.4	0	0	0	113.9	S43 S49 F54	S43-L47 WeakPolarHBondContact O-CB 3.49Å; S43-L47 WeakPolarHBondContact O-CD1 3.11Å; S43-L47 WeakPolarHBondContact O-CG 3.29Å; S43-L47 PolarHBondContact O-N 2.9Å; L47-S49 VanDerWaalsContact C-N 3.31Å; L47-F54 HydrophobicContact CD2-CB 4.25Å; L47-F54 HydrophobicContact CG-CB 4.42Å
48	R	40.9	Very low	43	Very low	210 Å²	210	86.1 Å²	86.1	79%	0.792	42%	0.419	S	S	*	.	H	α-helix	trans	-73.8	-23.6	173.8	-76	175.7	178.5	-179.2	0.8	113	K44 Q45 A46	K44-R48 WeakPolarHBondContact O-CG 3.12Å; K44-R48 PolarHBondContact O-N 3.41Å; Q45-R48 PolarHBondContact O-N 3.42Å; A46-R48 VanDerWaalsContact C-N 3.28Å; A46-R48 PolarHBondContact O-N 2.9Å
49	S	42.2	Very low	42.8	Very low	58 Å²	58	85.4 Å²	85.4	41%	0.406	41%	0.414	S	S	.	.	H	α-helix	trans	-95.1	-30.9	-174.1	69.3	0	0	0	0	113.7	Q45 A46 L47	Q45-S49 PolarHBondContact O-N 3.32Å; A46-S49 PolarHBondContact O-N 3.44Å; A46-S49 PolarHBondContact O-OG 2.74Å; L47-S49 VanDerWaalsContact C-N 3.31Å
50	T	39	Very low	42.6	Very low	32 Å²	32	85.7 Å²	85.7	20%	0.196	42%	0.415	C	S	.	.			trans	-115	114.9	-176.6	60.3	0	0	0	0	109.1	A46 T52 V88	A46-T50 PolarHBondContact O-N 3.26Å; A46-T50 VanDerWaalsContact O-N 3.15Å; A46-T50 PolarHBondContact O-OG1 3.38Å; T50-T52 VanDerWaalsContact CB-OG1 3.32Å; T50-T52 WeakPolarHBondContact CB-OG1 3.46Å; T50-T52 PolarHBondContact O-N 2.84Å; T50-T52 PolarHBondContact OG1-OG1 3.32Å; T50-V88 HydrophobicContact CG2-CG2 3.36Å
51	K	39.4	Very low	42.3	Very low	226 Å²	226	93.2 Å²	93.2	98%	0.983	44%	0.442	S	S	*	.	S	Bend	trans	-63.9	25	172.5	-71.6	-178.8	175	176.6	0	113.8
52	T	37.3	Very low	41.8	Very low	93 Å²	93	96.9 Å²	96.9	57%	0.571	46%	0.456	S	S	*	.	S	Bend	trans	-117.1	133	-177.5	46.9	0	0	0	0	110	T50 F54	T50-T52 VanDerWaalsContact CB-OG1 3.32Å; T50-T52 WeakPolarHBondContact CB-OG1 3.46Å; T50-T52 PolarHBondContact O-N 2.84Å; T50-T52 PolarHBondContact OG1-OG1 3.32Å; T52-F54 PolarHBondContact O-N 3.3Å
53	E	40	Very low	41.2	Very low	193 Å²	193	97.4 Å²	97.4	90%	0.902	47%	0.465	S	S	*	.			trans	-57.2	104.2	174.4	-77.5	-171.2	148.8	0	0	111	N55	E53-N55 PolarHBondContact O-N 3.38Å
54	F	39.3	Very low	40.5	Very low	53 Å²	53	102 Å²	102	23%	0.232	49%	0.494	C	S	.	.			trans	-88.1	95.1	175.4	-161	-89.1	0	0	0	109.9	L47 T52 L56 L80	L47-F54 HydrophobicContact CD2-CB 4.25Å; L47-F54 HydrophobicContact CG-CB 4.42Å; T52-F54 PolarHBondContact O-N 3.3Å; F54-L56 HydrophobicContact CD1-CD1 4.34Å; F54-L56 HydrophobicContact CE1-CD1 3.76Å; F54-L56 PolarHBondContact O-N 3.36Å; F54-L80 HydrophobicContact CE1-CD2 3.79Å; F54-L80 HydrophobicContact CZ-CD2 3.58Å
55	N	47.9	Very low	39.9	Very low	94 Å²	94	106.3 Å²	106.3	50%	0.503	52%	0.519	S	S	.	.			trans	-89.4	88.9	178	-155.2	-17	0	0	0	110.6	E53 W57 N58	E53-N55 PolarHBondContact O-N 3.38Å; N55-W57 PolarHBondContact O-N 2.82Å; N55-W57 VanDerWaalsContact O-N 3.08Å; N55-N58 PolarHBondContact O-N 2.81Å
56	L	40.3	Very low	39.2	Very low	49 Å²	49	108.3 Å²	108.3	26%	0.257	54%	0.544	S	S	.	.	H	α-helix	trans	-50.1	-33.5	-178.6	-162.2	79	0	0	0	112.5	I39 F54 N58 C59 I60 L80	I39-L56 HydrophobicContact CG2-CD2 3.77Å; F54-L56 HydrophobicContact CD1-CD1 4.34Å; F54-L56 HydrophobicContact CE1-CD1 3.76Å; F54-L56 PolarHBondContact O-N 3.36Å; L56-N58 VanDerWaalsContact C-N 3.33Å; L56-N58 PolarHBondContact O-N 3.43Å; L56-C59 PolarHBondContact O-N 3.31Å; L56-I60 WeakPolarHBondContact O-CG1 3.37Å; L56-I60 PolarHBondContact O-N 3.36Å; L56-L80 HydrophobicContact CD1-CD2 4.36Å
57	W	41	Very low	38.8	Very low	153 Å²	153	111.3 Å²	111.3	58%	0.58	56%	0.564	S	S	*	*	H	α-helix	trans	-66.5	-28.8	178.8	-110.1	118	0	0	0	113.7	N55 C59 I60 R61	N55-W57 PolarHBondContact O-N 2.82Å; N55-W57 VanDerWaalsContact O-N 3.08Å; W57-C59 VanDerWaalsContact C-N 3.34Å; W57-I60 HydrophobicContact CE3-CB 4.09Å; W57-I60 HydrophobicContact CE3-CG2 4.11Å; W57-I60 HydrophobicContact CZ3-CB 4.32Å; W57-I60 HydrophobicContact CZ3-CG2 3.82Å; W57-I60 PolarHBondContact O-N 2.89Å; W57-R61 WeakPolarHBondContact O-CB 3.36Å; W57-R61 PolarHBondContact O-N 3.01Å; W57-R61 VanDerWaalsContact O-N 3.16Å
58	N	45.1	Very low	38.5	Very low	87 Å²	87	111.6 Å²	111.6	47%	0.465	59%	0.587	S	S	.	*	H	α-helix	trans	-74.8	-23.9	176.3	-82.1	-20.1	0	0	0	113.1	N55 L56	N55-N58 PolarHBondContact O-N 2.81Å; L56-N58 VanDerWaalsContact C-N 3.33Å; L56-N58 PolarHBondContact O-N 3.43Å
59	C	39.9	Very low	38.3	Very low	37 Å²	37	108.2 Å²	108.2	25%	0.25	59%	0.585	C	S	.	*	H	α-helix	trans	-76.1	-34.7	171.4	-70.4	0	0	0	0	111.6	L56 W57 R61 K83	L56-C59 PolarHBondContact O-N 3.31Å; W57-C59 VanDerWaalsContact C-N 3.34Å; C59-R61 VanDerWaalsContact C-N 3.29Å; C59-R61 PolarHBondContact O-N 2.88Å; C59-K83 PolarHBondContact SG-NZ 2.96Å
60	I	38.8	Very low	38.1	Very low	60 Å²	60	112.1 Å²	112.1	31%	0.308	60%	0.6	S	S	.	*	H	α-helix	trans	-69.6	-28.6	176.4	-62.8	168.1	0	0	0	111.4	L56 W57	L56-I60 WeakPolarHBondContact O-CG1 3.37Å; L56-I60 PolarHBondContact O-N 3.36Å; W57-I60 HydrophobicContact CE3-CB 4.09Å; W57-I60 HydrophobicContact CE3-CG2 4.11Å; W57-I60 HydrophobicContact CZ3-CB 4.32Å; W57-I60 HydrophobicContact CZ3-CG2 3.82Å; W57-I60 PolarHBondContact O-N 2.89Å
61	R	41.2	Very low	38.3	Very low	205 Å²	205	112.1 Å²	112.1	77%	0.774	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-3.2	-172.8	-145.7	175.7	-174.1	164.4	2.2	115.3	W57 C59	W57-R61 WeakPolarHBondContact O-CB 3.36Å; W57-R61 PolarHBondContact O-N 3.01Å; W57-R61 VanDerWaalsContact O-N 3.16Å; C59-R61 VanDerWaalsContact C-N 3.29Å; C59-R61 PolarHBondContact O-N 2.88Å
62	K	38.4	Very low	38.8	Very low	169 Å²	169	105.7 Å²	105.7	74%	0.735	58%	0.581	S	S	*	*			trans	-122.8	26.7	-170.5	-77.5	-167.6	175.3	-174.2	0	115.1	P64	K62-P64 WeakPolarHBondContact O-CD 3.26Å
63	S	35.3	Very low	39.1	Very low	67 Å²	67	105.5 Å²	105.5	47%	0.469	58%	0.579	S	S	.	*			trans	-77.9	117.5	164.6	62.9	0	0	0	0	109.5	D65	S63-D65 PolarHBondContact O-N 3.28Å
64	P	30.2	Very low	39.4	Very low	118 Å²	118	99.7 Å²	99.7	77%	0.766	56%	0.558	S	S	*	*			trans	-84.7	93.6	173	32.1	-23	0	0	0	107.5	K62	K62-P64 WeakPolarHBondContact O-CD 3.26Å
65	D	33.4	Very low	39.8	Very low	141 Å²	141	99.7 Å²	99.7	75%	0.754	57%	0.565	S	S	*	*			trans	-153.9	129.6	160	-86.2	-38.2	0	0	0	110	S63 S67	S63-D65 PolarHBondContact O-N 3.28Å; D65-S67 PolarHBondContact O-N 3.35Å
66	S	30.9	Very low	39.7	Very low	132 Å²	132	97.8 Å²	97.8	92%	0.923	55%	0.554	S	S	*	*	S	Bend	trans	-81	44	-169.6	47.8	0	0	0	0	114.3
67	S	32.2	Very low	40.1	Very low	76 Å²	76	99.4 Å²	99.4	53%	0.531	56%	0.562	S	S	.	*	S	Bend	trans	-146.4	128.2	174.4	51.5	0	0	0	0	108.6	D65 D69	D65-S67 PolarHBondContact O-N 3.35Å; S67-D69 PolarHBondContact O-N 3.38Å
68	G	34.9	Very low	40.4	Very low	91 Å²	91	96.6 Å²	96.6	94%	0.938	56%	0.558	S	S	*	*			trans	-65.8	37.8	-166.5	0	0	0	0	0	118.2
69	D	36.8	Very low	40.5	Very low	138 Å²	138	94.8 Å²	94.8	74%	0.738	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-97.5	130.5	177.1	-71.2	-36.1	0	0	0	111.4	S67	S67-D69 PolarHBondContact O-N 3.38Å
70	L	38.1	Very low	40.8	Very low	140 Å²	140	94.7 Å²	94.7	73%	0.733	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-59.7	145.8	173.9	-96.9	100.8	0	0	0	111	T72	L70-T72 PolarHBondContact O-N 3.31Å
71	P	43.6	Very low	41.2	Very low	32 Å²	32	94.4 Å²	94.4	21%	0.208	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-58.3	127.4	175.8	23.8	-32.1	0	0	0	110.3	I76	P71-I76 HydrophobicContact CB-CD1 4.49Å; P71-I76 HydrophobicContact CB-CG1 4.03Å; P71-I76 HydrophobicContact CG-CD1 4.23Å; P71-I76 HydrophobicContact CG-CG1 4.17Å
72	T	49.5	Very low	41.5	Very low	92 Å²	92	92.8 Å²	92.8	56%	0.564	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-63.8	150.7	176.8	59.3	0	0	0	0	110.2	L70 P74 S75 I76	L70-T72 PolarHBondContact O-N 3.31Å; T72-P74 VanDerWaalsContact O-N 3.13Å; T72-S75 WeakPolarHBondContact O-CA 3.2Å; T72-S75 WeakPolarHBondContact O-CB 3.02Å; T72-S75 PolarHBondContact O-N 2.92Å; T72-I76 PolarHBondContact O-N 3.49Å; T72-I76 VanDerWaalsContact O-N 3.13Å
73	V	44.9	Very low	41.8	Very low	89 Å²	89	89.6 Å²	89.6	54%	0.539	52%	0.523	S	S	.	.	H	α-helix	trans	-48.9	-38.8	176.7	174.2	0	0	0	0	112.8	I76 I77	V73-I76 PolarHBondContact O-N 3.04Å; V73-I77 HydrophobicContact CG1-CD1 3.7Å; V73-I77 HydrophobicContact CG1-CG1 4.31Å; V73-I77 WeakPolarHBondContact O-CB 3.4Å; V73-I77 VanDerWaalsContact O-CG1 3.26Å; V73-I77 WeakPolarHBondContact O-CG1 3.44Å; V73-I77 PolarHBondContact O-N 3.44Å
74	P	46.3	Very low	42	Very low	70 Å²	70	87.5 Å²	87.5	46%	0.455	51%	0.51	S	S	.	.	H	α-helix	trans	-59.4	-40.6	170.9	-26.3	36.5	0	0	0	114.8	T72 I77 D78	T72-P74 VanDerWaalsContact O-N 3.13Å; P74-I77 PolarHBondContact O-N 3.09Å; P74-D78 VanDerWaalsContact O-CB 3.31Å; P74-D78 WeakPolarHBondContact O-CB 3.36Å; P74-D78 PolarHBondContact O-N 3.45Å
75	S	47.5	Very low	42.5	Very low	53 Å²	53	84.5 Å²	84.5	37%	0.371	49%	0.491	S	S	.	.	H	α-helix	trans	-64.9	-40.3	176.9	161.4	0	0	0	0	111.8	T72 D78 E79	T72-S75 WeakPolarHBondContact O-CA 3.2Å; T72-S75 WeakPolarHBondContact O-CB 3.02Å; T72-S75 PolarHBondContact O-N 2.92Å; S75-D78 PolarHBondContact O-N 3.36Å; S75-E79 WeakPolarHBondContact O-CB 3.19Å; S75-E79 PolarHBondContact O-N 3.06Å
76	I	46.2	Very low	42.8	Very low	54 Å²	54	82.7 Å²	82.7	28%	0.277	48%	0.479	S	S	.	.	H	α-helix	trans	-67.5	-41.7	176.3	-59.9	174.4	0	0	0	110.7	P71 T72 V73 L80	P71-I76 HydrophobicContact CB-CD1 4.49Å; P71-I76 HydrophobicContact CB-CG1 4.03Å; P71-I76 HydrophobicContact CG-CD1 4.23Å; P71-I76 HydrophobicContact CG-CG1 4.17Å; T72-I76 PolarHBondContact O-N 3.49Å; T72-I76 VanDerWaalsContact O-N 3.13Å; V73-I76 PolarHBondContact O-N 3.04Å; I76-L80 HydrophobicContact CG2-CD1 3.92Å; I76-L80 HydrophobicContact CG2-CG 4.49Å; I76-L80 VanDerWaalsContact O-CB 3.31Å; I76-L80 WeakPolarHBondContact O-CB 3.36Å; I76-L80 WeakPolarHBondContact O-CD1 3.38Å; I76-L80 WeakPolarHBondContact O-CG 3.38Å; I76-L80 PolarHBondContact O-N 3.48Å
77	I	47.5	Very low	43.1	Very low	84 Å²	84	82.5 Å²	82.5	43%	0.431	47%	0.467	S	S	.	.	H	α-helix	trans	-65.9	-40.8	176	-70.4	171.2	0	0	0	110.9	V73 P74 L80 L81	V73-I77 HydrophobicContact CG1-CD1 3.7Å; V73-I77 HydrophobicContact CG1-CG1 4.31Å; V73-I77 WeakPolarHBondContact O-CB 3.4Å; V73-I77 VanDerWaalsContact O-CG1 3.26Å; V73-I77 WeakPolarHBondContact O-CG1 3.44Å; V73-I77 PolarHBondContact O-N 3.44Å; P74-I77 PolarHBondContact O-N 3.09Å; I77-L80 PolarHBondContact O-N 3.48Å; I77-L81 HydrophobicContact CG2-CD1 3.7Å; I77-L81 HydrophobicContact CG2-CG 4.22Å; I77-L81 WeakPolarHBondContact O-CB 3.46Å; I77-L81 WeakPolarHBondContact O-CG 3.39Å; I77-L81 PolarHBondContact O-N 3.49Å
78	D	48.7	Very low	43.4	Very low	93 Å²	93	79.3 Å²	79.3	50%	0.497	44%	0.444	S	S	.	.	H	α-helix	trans	-65.7	-41.9	179.1	-156.3	43.4	0	0	0	111.2	P74 S75 L81 R82	P74-D78 VanDerWaalsContact O-CB 3.31Å; P74-D78 WeakPolarHBondContact O-CB 3.36Å; P74-D78 PolarHBondContact O-N 3.45Å; S75-D78 PolarHBondContact O-N 3.36Å; D78-L81 PolarHBondContact O-N 2.99Å; D78-R82 VanDerWaalsContact O-CB 3.23Å; D78-R82 WeakPolarHBondContact O-CB 3.45Å; D78-R82 PolarHBondContact O-N 2.92Å
79	E	47.1	Very low	43.6	Very low	49 Å²	49	77 Å²	77	23%	0.229	41%	0.412	C	S	.	.	H	α-helix	trans	-69.9	-34.4	175.2	-172.9	63.6	-171	0	0	112.7	S75 R82 K83	S75-E79 WeakPolarHBondContact O-CB 3.19Å; S75-E79 PolarHBondContact O-N 3.06Å; E79-R82 PolarHBondContact O-N 3.1Å; E79-R82 IonicContact OE1-CZ 3.66Å; E79-R82 IonicContact OE1-NE 2.7Å; E79-R82 IonicContact OE1-NH2 2.85Å; E79-R82 PolarHBondContact OE1-NH2 2.85Å; E79-R82 IonicContact OE2-CZ 3.58Å; E79-R82 IonicContact OE2-NE 3.16Å; E79-R82 PolarHBondContact OE2-NE 3.16Å; E79-R82 IonicContact OE2-NH2 3.57Å; E79-R82 PolarHBondContact OE2-NH2 3.26Å; E79-R82 VanDerWaalsContact OE2-NH2 3.08Å; E79-K83 WeakPolarHBondContact O-CB 3.45Å; E79-K83 PolarHBondContact O-N 3.26Å; E79-K83 VanDerWaalsContact O-N 3.13Å; E79-K83 WeakPolarHBondContact OE1-CE 3.33Å; E79-K83 IonicContact OE1-NZ 3.61Å; E79-K83 PolarHBondContact OE1-NZ 3.2Å
80	L	45	Very low	43.7	Very low	36 Å²	36	75.6 Å²	75.6	19%	0.188	40%	0.401	C	S	.	.	H	α-helix	trans	-64.3	-44.4	171.5	-80	165.4	0	0	0	111.5	F54 L56 I76 I77 R82 K83 A84	F54-L80 HydrophobicContact CE1-CD2 3.79Å; F54-L80 HydrophobicContact CZ-CD2 3.58Å; L56-L80 HydrophobicContact CD1-CD2 4.36Å; I76-L80 HydrophobicContact CG2-CD1 3.92Å; I76-L80 HydrophobicContact CG2-CG 4.49Å; I76-L80 VanDerWaalsContact O-CB 3.31Å; I76-L80 WeakPolarHBondContact O-CB 3.36Å; I76-L80 WeakPolarHBondContact O-CD1 3.38Å; I76-L80 WeakPolarHBondContact O-CG 3.38Å; I76-L80 PolarHBondContact O-N 3.48Å; I77-L80 PolarHBondContact O-N 3.48Å; L80-R82 VanDerWaalsContact C-N 3.33Å; L80-K83 PolarHBondContact O-N 2.93Å; L80-A84 VanDerWaalsContact O-CB 3.29Å; L80-A84 WeakPolarHBondContact O-CB 3.43Å; L80-A84 PolarHBondContact O-N 3.48Å
81	L	47.8	Very low	43.6	Very low	54 Å²	54	72.4 Å²	72.4	28%	0.283	39%	0.39	S	S	.	.	H	α-helix	trans	-70.5	-28.9	177.6	-71.8	171.4	0	0	0	112.5	I77 D78 V89	I77-L81 HydrophobicContact CG2-CD1 3.7Å; I77-L81 HydrophobicContact CG2-CG 4.22Å; I77-L81 WeakPolarHBondContact O-CB 3.46Å; I77-L81 WeakPolarHBondContact O-CG 3.39Å; I77-L81 PolarHBondContact O-N 3.49Å; D78-L81 PolarHBondContact O-N 2.99Å; L81-V89 HydrophobicContact CD2-CG2 4.41Å
82	R	47.5	Very low	43.2	Very low	171 Å²	171	74.2 Å²	74.2	65%	0.645	39%	0.393	S	S	*	.	H	α-helix	trans	-75	-30	176.7	-163.3	-178.9	74.1	97.3	2.5	112.8	D78 E79 L80	D78-R82 VanDerWaalsContact O-CB 3.23Å; D78-R82 WeakPolarHBondContact O-CB 3.45Å; D78-R82 PolarHBondContact O-N 2.92Å; E79-R82 PolarHBondContact O-N 3.1Å; E79-R82 IonicContact OE1-CZ 3.66Å; E79-R82 IonicContact OE1-NE 2.7Å; E79-R82 IonicContact OE1-NH2 2.85Å; E79-R82 PolarHBondContact OE1-NH2 2.85Å; E79-R82 IonicContact OE2-CZ 3.58Å; E79-R82 IonicContact OE2-NE 3.16Å; E79-R82 PolarHBondContact OE2-NE 3.16Å; E79-R82 IonicContact OE2-NH2 3.57Å; E79-R82 PolarHBondContact OE2-NH2 3.26Å; E79-R82 VanDerWaalsContact OE2-NH2 3.08Å; L80-R82 VanDerWaalsContact C-N 3.33Å
83	K	43.5	Very low	42.5	Very low	101 Å²	101	75.3 Å²	75.3	44%	0.439	40%	0.403	S	S	.	.	H	α-helix	trans	-95.8	-18.9	179.7	-75.8	-176.2	171.9	156.4	0	114.5	C59 E79 L80 S85	C59-K83 PolarHBondContact SG-NZ 2.96Å; E79-K83 WeakPolarHBondContact O-CB 3.45Å; E79-K83 PolarHBondContact O-N 3.26Å; E79-K83 VanDerWaalsContact O-N 3.13Å; E79-K83 WeakPolarHBondContact OE1-CE 3.33Å; E79-K83 IonicContact OE1-NZ 3.61Å; E79-K83 PolarHBondContact OE1-NZ 3.2Å; L80-K83 PolarHBondContact O-N 2.93Å; K83-S85 PolarHBondContact O-N 3.29Å
84	A	39.6	Very low	42.1	Very low	24 Å²	24	74.3 Å²	74.3	20%	0.198	39%	0.392	C	S	.	.	S	Bend	trans	-68.2	126.4	170.7	0	0	0	0	0	109.5	L80 V88 V89	L80-A84 VanDerWaalsContact O-CB 3.29Å; L80-A84 WeakPolarHBondContact O-CB 3.43Å; L80-A84 PolarHBondContact O-N 3.48Å; A84-V88 HydrophobicContact CB-CB 4Å; A84-V88 HydrophobicContact CB-CG1 3.91Å; A84-V89 HydrophobicContact CB-CG2 3.76Å
85	S	40.9	Very low	41.5	Very low	54 Å²	54	75.2 Å²	75.2	38%	0.378	40%	0.397	S	S	.	.			trans	-60.4	155	167.4	59.2	0	0	0	0	109.9	K83 D87 V88 V89	K83-S85 PolarHBondContact O-N 3.29Å; S85-D87 PolarHBondContact O-N 3.02Å; S85-V88 WeakPolarHBondContact O-CB 3.48Å; S85-V88 PolarHBondContact O-N 3.19Å; S85-V88 WeakPolarHBondContact OG-CG2 3.4Å; S85-V89 PolarHBondContact O-N 3.41Å
86	E	41	Very low	40.7	Very low	104 Å²	104	81.7 Å²	81.7	49%	0.486	42%	0.419	S	S	.	.	H	α-helix	trans	-51.3	-32.5	174.8	-86.4	171.4	-178.1	0	0	111.6	V88 V89 Q90 K300	E86-V88 PolarHBondContact O-N 3.08Å; E86-V89 PolarHBondContact O-N 3.37Å; E86-Q90 WeakPolarHBondContact O-CB 3.36Å; E86-Q90 WeakPolarHBondContact O-CG 3.19Å; E86-Q90 PolarHBondContact O-N 2.96Å; E86-K300 IonicContact OE1-NZ 3.36Å; E86-K300 PolarHBondContact OE1-NZ 3.43Å
87	D	37	Very low	40.2	Very low	128 Å²	128	81.1 Å²	81.1	68%	0.684	43%	0.427	S	S	*	.	H	α-helix	trans	-61.5	-37.9	174.6	-58.7	-37	0	0	0	113.4	S85 S91	S85-D87 PolarHBondContact O-N 3.02Å; D87-S91 PolarHBondContact O-N 2.97Å
88	V	38.3	Very low	39.7	Very low	8 Å²	8	83.6 Å²	83.6	5%	0.048	43%	0.431	C	S	.	.	H	α-helix	trans	-73.4	-40.7	178.9	175.4	0	0	0	0	110.3	T50 A84 S85 E86 S91 W92	T50-V88 HydrophobicContact CG2-CG2 3.36Å; A84-V88 HydrophobicContact CB-CB 4Å; A84-V88 HydrophobicContact CB-CG1 3.91Å; S85-V88 WeakPolarHBondContact O-CB 3.48Å; S85-V88 PolarHBondContact O-N 3.19Å; S85-V88 WeakPolarHBondContact OG-CG2 3.4Å; E86-V88 PolarHBondContact O-N 3.08Å; V88-S91 PolarHBondContact O-N 3.45Å; V88-S91 PolarHBondContact O-OG 2.83Å; V88-W92 PolarHBondContact O-N 3.03Å
89	V	39.6	Very low	39.2	Very low	44 Å²	44	83.8 Å²	83.8	27%	0.267	43%	0.428	S	S	.	.	H	α-helix	trans	-69.2	-35.9	178.9	-178.1	0	0	0	0	111.4	L81 A84 S85 E86 S91 W92	L81-V89 HydrophobicContact CD2-CG2 4.41Å; A84-V89 HydrophobicContact CB-CG2 3.76Å; S85-V89 PolarHBondContact O-N 3.41Å; E86-V89 PolarHBondContact O-N 3.37Å; V89-S91 VanDerWaalsContact C-N 3.32Å; V89-W92 PolarHBondContact O-N 3.3Å
90	Q	37.6	Very low	38.9	Very low	108 Å²	108	87 Å²	87	51%	0.505	45%	0.446	S	S	.	.	H	α-helix	trans	-69.8	-27.9	174.3	-73.3	-165.5	16.1	0	0	113.2	E86 W92	E86-Q90 WeakPolarHBondContact O-CB 3.36Å; E86-Q90 WeakPolarHBondContact O-CG 3.19Å; E86-Q90 PolarHBondContact O-N 2.96Å; Q90-W92 PolarHBondContact O-N 3.5Å
91	S	36.1	Very low	38.6	Very low	72 Å²	72	94.2 Å²	94.2	50%	0.503	47%	0.471	S	S	.	.	H	α-helix	trans	-70.8	-18.2	175	80.5	0	0	0	0	113.6	D87 V88 V89 C93	D87-S91 PolarHBondContact O-N 2.97Å; V88-S91 PolarHBondContact O-N 3.45Å; V88-S91 PolarHBondContact O-OG 2.83Å; V89-S91 VanDerWaalsContact C-N 3.32Å; S91-C93 PolarHBondContact O-N 3.47Å
92	W	35.6	Very low	38.2	Very low	71 Å²	71	94.5 Å²	94.5	27%	0.269	47%	0.472	S	S	.	.			trans	-79.8	62.3	176.9	-74.1	15.8	0	0	0	111.9	I42 V88 V89 Q90 F94	I42-W92 HydrophobicContact CG2-CH2 3.72Å; I42-W92 HydrophobicContact CG2-CZ2 3.64Å; V88-W92 PolarHBondContact O-N 3.03Å; V89-W92 PolarHBondContact O-N 3.3Å; Q90-W92 PolarHBondContact O-N 3.5Å; W92-F94 VanDerWaalsContact C-N 3.27Å; W92-F94 HydrophobicContact CB-CD2 4.34Å; W92-F94 HydrophobicContact CB-CE2 4.15Å; W92-F94 HydrophobicContact CD2-CE2 4.16Å; W92-F94 AromaticContact CE3-CE2 3.93Å; W92-F94 HydrophobicContact CE3-CE2 3.93Å; W92-F94 HydrophobicContact CG-CE2 4.3Å; W92-F94 PolarHBondContact O-N 2.95Å
93	C	34.9	Very low	37.9	Very low	115 Å²	115	89.1 Å²	89.1	78%	0.777	46%	0.459	S	S	*	.			trans	-78.5	77.5	166.7	-82.2	0	0	0	0	110.1	S91	S91-C93 PolarHBondContact O-N 3.47Å
94	F	35.6	Very low	37.9	Very low	68 Å²	68	86.7 Å²	86.7	30%	0.298	46%	0.457	S	S	.	.			trans	-64.1	128.9	165.1	-72.7	-80	0	0	0	109.1	W92 K96 Y98 F99	W92-F94 VanDerWaalsContact C-N 3.27Å; W92-F94 HydrophobicContact CB-CD2 4.34Å; W92-F94 HydrophobicContact CB-CE2 4.15Å; W92-F94 HydrophobicContact CD2-CE2 4.16Å; W92-F94 AromaticContact CE3-CE2 3.93Å; W92-F94 HydrophobicContact CE3-CE2 3.93Å; W92-F94 HydrophobicContact CG-CE2 4.3Å; W92-F94 PolarHBondContact O-N 2.95Å; F94-K96 PolarHBondContact O-N 3.4Å; F94-Y98 AromaticContact CD1-CD1 3.85Å; F94-Y98 HydrophobicContact CD1-CD1 3.85Å; F94-Y98 HydrophobicContact CE1-CD1 4.21Å; F94-Y98 HydrophobicContact CE1-CE1 4.47Å; F94-F99 HydrophobicContact CB-CD2 3.97Å; F94-F99 HydrophobicContact CD1-CD2 4.48Å; F94-F99 AromaticContact CD2-CD2 3.89Å; F94-F99 HydrophobicContact CD2-CD2 3.89Å; F94-F99 AromaticContact CD2-CE2 3.91Å; F94-F99 HydrophobicContact CD2-CE2 3.91Å; F94-F99 HydrophobicContact CE2-CE2 4.22Å; F94-F99 AromaticContact CG-CD2 3.86Å; F94-F99 HydrophobicContact CG-CD2 3.86Å; F94-F99 HydrophobicContact CG-CE2 4.33Å
95	P	34.4	Very low	38	Very low	88 Å²	88	91.6 Å²	91.6	57%	0.571	48%	0.476	S	S	*	.			trans	-53.6	134.8	167.3	-20.8	30.6	0	0	0	108.5	G97 Y98	P95-G97 PolarHBondContact O-N 3.07Å; P95-Y98 PolarHBondContact O-N 2.91Å
96	K	31.8	Very low	37.9	Very low	190 Å²	190	94 Å²	94	83%	0.826	48%	0.484	S	S	*	.	H	α-helix	trans	-46.5	-31.2	179.1	-128.7	176.8	-178.9	-178	0	112.8	F94 L100	F94-K96 PolarHBondContact O-N 3.4Å; K96-L100 WeakPolarHBondContact O-CD1 3.36Å; K96-L100 WeakPolarHBondContact O-CG 2.9Å
97	G	34.3	Very low	37.9	Very low	42 Å²	42	94 Å²	94	43%	0.433	49%	0.487	S	S	.	.	H	α-helix	trans	-76.6	-25.7	176	0	0	0	0	0	116.2	P95 R101	P95-G97 PolarHBondContact O-N 3.07Å; G97-R101 WeakPolarHBondContact O-CG 3.21Å; G97-R101 PolarHBondContact O-N 2.93Å
98	Y	37.7	Very low	38.1	Very low	136 Å²	136	96 Å²	96	53%	0.533	49%	0.492	S	S	.	.	H	α-helix	trans	-75.2	-41.8	-179.9	-156.9	-90	0	0	0	111.3	F94 P95 R101 L102	F94-Y98 AromaticContact CD1-CD1 3.85Å; F94-Y98 HydrophobicContact CD1-CD1 3.85Å; F94-Y98 HydrophobicContact CE1-CD1 4.21Å; F94-Y98 HydrophobicContact CE1-CE1 4.47Å; P95-Y98 PolarHBondContact O-N 2.91Å; Y98-R101 PolarHBondContact O-N 3.32Å; Y98-L102 HydrophobicContact CE1-CD1 4.36Å; Y98-L102 WeakPolarHBondContact O-CB 3.38Å; Y98-L102 PolarHBondContact O-N 3.12Å
99	F	38.5	Very low	38	Very low	96 Å²	96	98 Å²	98	42%	0.421	51%	0.509	S	S	.	.	H	α-helix	trans	-67.6	-37	175.9	-133.9	-88.5	0	0	0	111.8	F94 L102 T103	F94-F99 HydrophobicContact CB-CD2 3.97Å; F94-F99 HydrophobicContact CD1-CD2 4.48Å; F94-F99 AromaticContact CD2-CD2 3.89Å; F94-F99 HydrophobicContact CD2-CD2 3.89Å; F94-F99 AromaticContact CD2-CE2 3.91Å; F94-F99 HydrophobicContact CD2-CE2 3.91Å; F94-F99 HydrophobicContact CE2-CE2 4.22Å; F94-F99 AromaticContact CG-CD2 3.86Å; F94-F99 HydrophobicContact CG-CD2 3.86Å; F94-F99 HydrophobicContact CG-CE2 4.33Å; F99-L102 PolarHBondContact O-N 3.34Å; F99-T103 HydrophobicContact CD1-CG2 4.41Å; F99-T103 WeakPolarHBondContact O-CG2 2.99Å; F99-T103 PolarHBondContact O-N 3.37Å; F99-T103 PolarHBondContact O-OG1 2.82Å
100	L	39.8	Very low	37.6	Very low	118 Å²	118	99.5 Å²	99.5	62%	0.618	53%	0.534	S	S	*	.	H	α-helix	trans	-64.4	-41.2	173.5	-82.6	164.5	0	0	0	112.2	K96 T103 A104	K96-L100 WeakPolarHBondContact O-CD1 3.36Å; K96-L100 WeakPolarHBondContact O-CG 2.9Å; L100-T103 WeakPolarHBondContact CA-OG1 3.48Å; L100-T103 PolarHBondContact O-N 3.07Å; L100-T103 PolarHBondContact O-OG1 2.82Å; L100-A104 VanDerWaalsContact O-CB 3.3Å; L100-A104 WeakPolarHBondContact O-CB 3.48Å; L100-A104 PolarHBondContact O-N 2.88Å
101	R	38.8	Very low	37.4	Very low	186 Å²	186	99.9 Å²	99.9	70%	0.702	54%	0.544	S	S	*	.	H	α-helix	trans	-65.6	-40.5	172.7	-81.8	-177.7	-176.1	172.5	1.7	112.6	G97 Y98 A104 Q105	G97-R101 WeakPolarHBondContact O-CG 3.21Å; G97-R101 PolarHBondContact O-N 2.93Å; Y98-R101 PolarHBondContact O-N 3.32Å; R101-A104 PolarHBondContact O-N 2.67Å; R101-Q105 WeakPolarHBondContact O-CB 3.12Å; R101-Q105 WeakPolarHBondContact O-CG 3.14Å; R101-Q105 PolarHBondContact O-N 2.91Å
102	L	39.8	Very low	37.4	Very low	60 Å²	60	105.3 Å²	105.3	31%	0.314	56%	0.559	S	S	.	*	H	α-helix	trans	-64	-43.8	176.6	-148.6	90.1	0	0	0	110.9	Y98 F99 A104 Q105 I106	Y98-L102 HydrophobicContact CE1-CD1 4.36Å; Y98-L102 WeakPolarHBondContact O-CB 3.38Å; Y98-L102 PolarHBondContact O-N 3.12Å; F99-L102 PolarHBondContact O-N 3.34Å; L102-A104 VanDerWaalsContact C-N 3.3Å; L102-A104 PolarHBondContact O-N 3.12Å; L102-Q105 PolarHBondContact O-N 2.54Å; L102-I106 HydrophobicContact CD2-CD1 4.27Å; L102-I106 HydrophobicContact CG-CD1 4.26Å; L102-I106 WeakPolarHBondContact O-CB 3.41Å; L102-I106 WeakPolarHBondContact O-CD1 3.06Å; L102-I106 WeakPolarHBondContact O-CG1 3.35Å; L102-I106 PolarHBondContact O-N 3.16Å
103	T	41.9	Very low	37.3	Very low	59 Å²	59	110.9 Å²	110.9	36%	0.362	59%	0.593	S	S	.	*	H	α-helix	trans	-69.2	-25.4	174.4	50.4	0	0	0	0	113.6	F99 L100 N107	F99-T103 HydrophobicContact CD1-CG2 4.41Å; F99-T103 WeakPolarHBondContact O-CG2 2.99Å; F99-T103 PolarHBondContact O-N 3.37Å; F99-T103 PolarHBondContact O-OG1 2.82Å; L100-T103 WeakPolarHBondContact CA-OG1 3.48Å; L100-T103 PolarHBondContact O-N 3.07Å; L100-T103 PolarHBondContact O-OG1 2.82Å; T103-N107 WeakPolarHBondContact O-CB 3.33Å; T103-N107 PolarHBondContact O-N 2.93Å; T103-N107 PolarHBondContact O-ND2 3.08Å
104	A	43	Very low	37.3	Very low	49 Å²	49	110 Å²	110	41%	0.405	58%	0.58	S	S	.	*	H	α-helix	trans	-75.6	-44.4	173.7	0	0	0	0	0	111.2	L100 R101 L102 I106 N107 E108	L100-A104 VanDerWaalsContact O-CB 3.3Å; L100-A104 WeakPolarHBondContact O-CB 3.48Å; L100-A104 PolarHBondContact O-N 2.88Å; R101-A104 PolarHBondContact O-N 2.67Å; L102-A104 VanDerWaalsContact C-N 3.3Å; L102-A104 PolarHBondContact O-N 3.12Å; A104-I106 VanDerWaalsContact C-N 3.33Å; A104-I106 PolarHBondContact O-N 2.68Å; A104-N107 WeakPolarHBondContact O-CB 3.45Å; A104-N107 PolarHBondContact O-N 3.21Å; A104-E108 PolarHBondContact O-N 3Å
105	Q	40.6	Very low	37.3	Very low	128 Å²	128	110.9 Å²	110.9	60%	0.598	59%	0.592	S	S	*	*	H	α-helix	trans	-65.6	-34.4	175.9	-74.8	178.5	-27.2	0	0	112.5	R101 L102 N107 E108 A109	R101-Q105 WeakPolarHBondContact O-CB 3.12Å; R101-Q105 WeakPolarHBondContact O-CG 3.14Å; R101-Q105 PolarHBondContact O-N 2.91Å; L102-Q105 PolarHBondContact O-N 2.54Å; Q105-N107 VanDerWaalsContact C-N 3.3Å; Q105-E108 PolarHBondContact O-N 3.14Å; Q105-A109 PolarHBondContact O-N 3.2Å
106	I	40.4	Very low	37.8	Very low	104 Å²	104	113.9 Å²	113.9	53%	0.533	60%	0.597	S	S	.	*	H	α-helix	trans	-70.9	-26.3	172.7	-67.3	164.9	0	0	0	111.7	L102 A104	L102-I106 HydrophobicContact CD2-CD1 4.27Å; L102-I106 HydrophobicContact CG-CD1 4.26Å; L102-I106 WeakPolarHBondContact O-CB 3.41Å; L102-I106 WeakPolarHBondContact O-CD1 3.06Å; L102-I106 WeakPolarHBondContact O-CG1 3.35Å; L102-I106 PolarHBondContact O-N 3.16Å; A104-I106 VanDerWaalsContact C-N 3.33Å; A104-I106 PolarHBondContact O-N 2.68Å
107	N	39.8	Very low	38.1	Very low	105 Å²	105	115.1 Å²	115.1	56%	0.561	60%	0.596	S	S	*	*	H	α-helix	trans	-81.7	-22	174.1	-84.6	-51.9	0	0	0	113.2	T103 A104 Q105	T103-N107 WeakPolarHBondContact O-CB 3.33Å; T103-N107 PolarHBondContact O-N 2.93Å; T103-N107 PolarHBondContact O-ND2 3.08Å; A104-N107 WeakPolarHBondContact O-CB 3.45Å; A104-N107 PolarHBondContact O-N 3.21Å; Q105-N107 VanDerWaalsContact C-N 3.3Å
108	E	40.8	Very low	38.2	Very low	168 Å²	168	120.6 Å²	120.6	79%	0.785	61%	0.61	S	S	*	*	H	α-helix	trans	-81	-23	175.3	-77.7	177.8	164.7	0	0	112.9	A104 Q105 G110	A104-E108 PolarHBondContact O-N 3Å; Q105-E108 PolarHBondContact O-N 3.14Å; E108-G110 PolarHBondContact O-N 2.83Å
109	A	37.5	Very low	38.3	Very low	50 Å²	50	117 Å²	117	41%	0.413	60%	0.603	S	S	.	*	S	Bend	trans	-85	85	171.1	0	0	0	0	0	110.5	Q105 T111	Q105-A109 PolarHBondContact O-N 3.2Å; A109-T111 VanDerWaalsContact C-N 3.3Å; A109-T111 PolarHBondContact O-N 2.79Å
110	G	31.1	Very low	38.5	Very low	76 Å²	76	116.5 Å²	116.5	78%	0.784	60%	0.603	S	S	*	*			trans	-65.8	53.2	-167.2	0	0	0	0	0	119.1	E108	E108-G110 PolarHBondContact O-N 2.83Å
111	T	34	Very low	38.7	Very low	117 Å²	117	114.6 Å²	114.6	72%	0.718	60%	0.597	S	S	*	*			trans	-137.5	11.5	-177.7	37.9	0	0	0	0	117.9	A109	A109-T111 VanDerWaalsContact C-N 3.3Å; A109-T111 PolarHBondContact O-N 2.79Å
112	F	35	Very low	39	Very low	186 Å²	186	111 Å²	111	82%	0.816	59%	0.587	S	S	*	*			trans	-132.3	111.7	174.3	-80.7	-87.5	0	0	0	114.2	L114	F112-L114 PolarHBondContact O-N 3.37Å; F112-L114 VanDerWaalsContact O-N 3.15Å
113	L	32.8	Very low	39	Very low	187 Å²	187	111.7 Å²	111.7	98%	0.979	59%	0.59	S	S	*	*			trans	-71.1	93	168.8	-81.2	156.4	0	0	0	110.1
114	L	35.9	Very low	39.1	Very low	97 Å²	97	114.9 Å²	114.9	51%	0.508	60%	0.599	S	S	.	*			trans	-96.1	139.2	164.9	-80.1	163.5	0	0	0	110.2	F112 K116	F112-L114 PolarHBondContact O-N 3.37Å; F112-L114 VanDerWaalsContact O-N 3.15Å; L114-K116 WeakPolarHBondContact O-CG 3.24Å; L114-K116 PolarHBondContact O-N 2.89Å
115	P	34.8	Very low	39.2	Very low	86 Å²	86	122 Å²	122	56%	0.558	62%	0.615	S	S	*	*			trans	-67	102.6	173	-9.7	24.4	0	0	0	109.8	R117	P115-R117 VanDerWaalsContact C-N 3.28Å; P115-R117 PolarHBondContact O-N 2.98Å
116	K	45.7	Very low	39.3	Very low	152 Å²	152	121.7 Å²	121.7	66%	0.661	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-0.6	-162.3	-77.8	-178.2	174.6	178.9	0	117.2	L114 I120	L114-K116 WeakPolarHBondContact O-CG 3.24Å; L114-K116 PolarHBondContact O-N 2.89Å; K116-I120 VanDerWaalsContact O-CD1 3.27Å; K116-I120 WeakPolarHBondContact O-CD1 3.49Å
117	R	37.1	Very low	39.3	Very low	216 Å²	216	121.5 Å²	121.5	82%	0.815	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	-41.3	-176.3	-92.2	-177.8	170.5	176.1	-2.4	115.1	P115 T121	P115-R117 VanDerWaalsContact C-N 3.28Å; P115-R117 PolarHBondContact O-N 2.98Å; R117-T121 WeakPolarHBondContact O-CB 3.3Å; R117-T121 PolarHBondContact O-N 2.94Å; R117-T121 VanDerWaalsContact O-N 3.09Å; R117-T121 PolarHBondContact O-OG1 2.87Å
118	E	38.2	Very low	39.1	Very low	156 Å²	156	125.6 Å²	125.6	73%	0.729	62%	0.615	S	S	*	*	H	α-helix	trans	-75.8	-43.1	-174.4	-70.9	169	174.1	0	0	111.9	I120 T121 F122	E118-I120 PolarHBondContact O-N 2.88Å; E118-T121 PolarHBondContact O-N 2.92Å; E118-F122 VanDerWaalsContact O-CB 3.28Å; E118-F122 WeakPolarHBondContact O-CB 3.44Å; E118-F122 PolarHBondContact O-N 2.88Å
119	T	39.9	Very low	39.1	Very low	61 Å²	61	120.2 Å²	120.2	37%	0.374	60%	0.596	S	S	.	*	H	α-helix	trans	-65.6	-38.6	177.7	-41.8	0	0	0	0	112.2	L123	T119-L123 HydrophobicContact CG2-CD1 4.12Å; T119-L123 VanDerWaalsContact O-CB 3.28Å; T119-L123 WeakPolarHBondContact O-CB 3.48Å; T119-L123 VanDerWaalsContact O-CG 3.26Å; T119-L123 WeakPolarHBondContact O-CG 3.49Å; T119-L123 PolarHBondContact O-N 2.89Å
120	I	41.7	Very low	39	Very low	85 Å²	85	121.6 Å²	121.6	44%	0.436	60%	0.602	S	S	.	*	H	α-helix	trans	-69.2	-36.3	175.7	-61.9	-174.8	0	0	0	110.7	K116 E118 K124	K116-I120 VanDerWaalsContact O-CD1 3.27Å; K116-I120 WeakPolarHBondContact O-CD1 3.49Å; E118-I120 PolarHBondContact O-N 2.88Å; I120-K124 HydrophobicContact CG2-CD 3.99Å; I120-K124 HydrophobicContact CG2-CG 4.33Å; I120-K124 WeakPolarHBondContact O-CB 3.09Å; I120-K124 WeakPolarHBondContact O-CG 3.27Å; I120-K124 PolarHBondContact O-N 3.1Å
121	T	44.6	Very low	39.4	Very low	79 Å²	79	125.4 Å²	125.4	49%	0.485	60%	0.597	S	S	.	*	H	α-helix	trans	-72.2	-39.7	177.7	-53	0	0	0	0	111.3	R117 E118 K124 R125	R117-T121 WeakPolarHBondContact O-CB 3.3Å; R117-T121 PolarHBondContact O-N 2.94Å; R117-T121 VanDerWaalsContact O-N 3.09Å; R117-T121 PolarHBondContact O-OG1 2.87Å; E118-T121 PolarHBondContact O-N 2.92Å; T121-K124 PolarHBondContact O-N 2.78Å; T121-R125 WeakPolarHBondContact O-CB 3.39Å; T121-R125 PolarHBondContact O-N 2.9Å
122	F	44.8	Very low	40	Very low	111 Å²	111	123.6 Å²	123.6	49%	0.487	59%	0.589	S	S	.	*	H	α-helix	trans	-61	-49.9	172.2	178.1	-99.3	0	0	0	111.6	E118 R125 R126	E118-F122 VanDerWaalsContact O-CB 3.28Å; E118-F122 WeakPolarHBondContact O-CB 3.44Å; E118-F122 PolarHBondContact O-N 2.88Å; F122-R125 WeakPolarHBondContact O-CB 3.14Å; F122-R125 PolarHBondContact O-N 3.02Å; F122-R126 WeakPolarHBondContact O-CB 3.48Å; F122-R126 PolarHBondContact O-N 2.99Å
123	L	40	Very low	41	Very low	73 Å²	73	118.9 Å²	118.9	38%	0.382	57%	0.566	S	S	.	*	H	α-helix	trans	-65.5	-38.4	175.7	-73.1	167.8	0	0	0	111.9	T119 R125 R126 I127	T119-L123 HydrophobicContact CG2-CD1 4.12Å; T119-L123 VanDerWaalsContact O-CB 3.28Å; T119-L123 WeakPolarHBondContact O-CB 3.48Å; T119-L123 VanDerWaalsContact O-CG 3.26Å; T119-L123 WeakPolarHBondContact O-CG 3.49Å; T119-L123 PolarHBondContact O-N 2.89Å; L123-R125 PolarHBondContact O-N 3.21Å; L123-R126 PolarHBondContact O-N 2.82Å; L123-I127 HydrophobicContact CB-CD1 4.42Å; L123-I127 WeakPolarHBondContact O-CB 3.43Å; L123-I127 WeakPolarHBondContact O-CD1 3.3Å; L123-I127 WeakPolarHBondContact O-CG1 3.27Å; L123-I127 PolarHBondContact O-N 2.88Å
124	K	43.7	Very low	42.6	Very low	127 Å²	127	117.1 Å²	117.1	55%	0.552	56%	0.558	S	S	*	*	H	α-helix	trans	-64.8	-36.5	173.4	-80	176.4	-180	178.1	0	112.2	I120 T121 R128	I120-K124 HydrophobicContact CG2-CD 3.99Å; I120-K124 HydrophobicContact CG2-CG 4.33Å; I120-K124 WeakPolarHBondContact O-CB 3.09Å; I120-K124 WeakPolarHBondContact O-CG 3.27Å; I120-K124 PolarHBondContact O-N 3.1Å; T121-K124 PolarHBondContact O-N 2.78Å; K124-R128 VanDerWaalsContact O-CB 3.22Å; K124-R128 WeakPolarHBondContact O-CB 3.44Å; K124-R128 WeakPolarHBondContact O-CG 3.48Å; K124-R128 PolarHBondContact O-N 3.37Å
125	R	43.9	Very low	44.7	Very low	197 Å²	197	114.3 Å²	114.3	74%	0.743	55%	0.546	S	S	*	.	H	α-helix	trans	-65.5	-44	172.7	-99.5	179.9	169.1	156.8	-3.9	111.3	T121 F122 L123 R128 S129	T121-R125 WeakPolarHBondContact O-CB 3.39Å; T121-R125 PolarHBondContact O-N 2.9Å; F122-R125 WeakPolarHBondContact O-CB 3.14Å; F122-R125 PolarHBondContact O-N 3.02Å; L123-R125 PolarHBondContact O-N 3.21Å; R125-R128 PolarHBondContact O-N 3.14Å; R125-S129 PolarHBondContact O-N 3.47Å
126	R	43.6	Very low	47.2	Very low	122 Å²	122	112.1 Å²	112.1	46%	0.46	53%	0.527	S	S	.	.	H	α-helix	trans	-73.1	-34.7	-179.3	-146	165.3	171.6	132.1	-8.6	112.8	F122 L123 S129 C130	F122-R126 WeakPolarHBondContact O-CB 3.48Å; F122-R126 PolarHBondContact O-N 2.99Å; L123-R126 PolarHBondContact O-N 2.82Å; R126-S129 WeakPolarHBondContact CA-OG 3.29Å; R126-S129 PolarHBondContact O-N 3.28Å; R126-S129 PolarHBondContact O-OG 2.59Å; R126-C130 WeakPolarHBondContact O-CB 3.41Å; R126-C130 PolarHBondContact O-N 2.69Å; R126-C130 PolarHBondContact O-SG 2.72Å
127	I	40.5	Very low	49.3	Very low	101 Å²	101	105.3 Å²	105.3	52%	0.518	50%	0.499	S	S	.	.	H	α-helix	trans	-72.1	-33.7	171.6	-66.9	164.3	0	0	0	110.9	L123 S129 C130 K131	L123-I127 HydrophobicContact CB-CD1 4.42Å; L123-I127 WeakPolarHBondContact O-CB 3.43Å; L123-I127 WeakPolarHBondContact O-CD1 3.3Å; L123-I127 WeakPolarHBondContact O-CG1 3.27Å; L123-I127 PolarHBondContact O-N 2.88Å; I127-S129 VanDerWaalsContact C-N 3.35Å; I127-C130 PolarHBondContact O-N 2.89Å; I127-K131 PolarHBondContact O-N 3.42Å
128	R	36.6	Very low	52	Low	190 Å²	190	99.5 Å²	99.5	72%	0.717	48%	0.48	S	S	*	.	H	α-helix	trans	-68.5	-32	170.3	-79.3	175.7	-179.2	-177.3	-0.4	112.2	K124 R125	K124-R128 VanDerWaalsContact O-CB 3.22Å; K124-R128 WeakPolarHBondContact O-CB 3.44Å; K124-R128 WeakPolarHBondContact O-CG 3.48Å; K124-R128 PolarHBondContact O-N 3.37Å; R125-R128 PolarHBondContact O-N 3.14Å
129	S	38.8	Very low	54.5	Low	55 Å²	55	98.5 Å²	98.5	39%	0.385	48%	0.475	S	S	.	.	H	α-helix	trans	-76	-23	171.6	70	0	0	0	0	113.3	R125 R126 I127	R125-S129 PolarHBondContact O-N 3.47Å; R126-S129 WeakPolarHBondContact CA-OG 3.29Å; R126-S129 PolarHBondContact O-N 3.28Å; R126-S129 PolarHBondContact O-OG 2.59Å; I127-S129 VanDerWaalsContact C-N 3.35Å
130	C	36.9	Very low	56.9	Low	80 Å²	80	97.2 Å²	97.2	54%	0.541	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	2.9	177.1	-70.6	0	0	0	0	115.1	R126 I127	R126-C130 WeakPolarHBondContact O-CB 3.41Å; R126-C130 PolarHBondContact O-N 2.69Å; R126-C130 PolarHBondContact O-SG 2.72Å; I127-C130 PolarHBondContact O-N 2.89Å
131	K	38.5	Very low	59.1	Low	156 Å²	156	96.8 Å²	96.8	68%	0.678	46%	0.463	S	S	*	.	S	Bend	trans	-63.8	137	160.4	-76.5	-172.1	174	-170.6	0	107.3	I127 R133	I127-K131 PolarHBondContact O-N 3.42Å; K131-R133 VanDerWaalsContact C-N 3.33Å; K131-R133 PolarHBondContact O-N 3.34Å
132	S	46.6	Very low	61	Low	78 Å²	78	94.7 Å²	94.7	55%	0.545	45%	0.451	S	S	.	.			trans	-54.6	102.8	171.8	62.3	0	0	0	0	107.7	D134	S132-D134 PolarHBondContact O-N 3.23Å
133	R	56.8	Low	62.8	Low	87 Å²	87	93.9 Å²	93.9	33%	0.328	46%	0.459	S	S	.	.			trans	-71	124.6	175	-69.4	-177.3	175.9	-156.9	-7.5	106	K131 S135 Y136 E328	K131-R133 VanDerWaalsContact C-N 3.33Å; K131-R133 PolarHBondContact O-N 3.34Å; R133-S135 PolarHBondContact O-N 2.93Å; R133-Y136 HydrophobicContact CB-CE2 4.35Å; R133-E328 IonicContact CZ-OE2 3.6Å; R133-E328 IonicContact NH1-OE2 2.65Å; R133-E328 PolarHBondContact NH1-OE2 2.98Å; R133-E328 IonicContact NH2-OE2 2.92Å
134	D	65.9	Low	65	Low	151 Å²	151	93.3 Å²	93.3	81%	0.807	46%	0.458	S	S	*	.	S	Bend	trans	-60.3	-32.1	175.1	-67.1	-33.1	0	0	0	110.3	S132 R323	S132-D134 PolarHBondContact O-N 3.23Å; D134-R323 PolarHBondContact O-NH2 2.94Å
135	S	79.9	Confident	66.9	Low	37 Å²	37	92.7 Å²	92.7	26%	0.259	47%	0.467	S	S	.	.			trans	-143.3	148	173.7	-173.2	0	0	0	0	113.3	R133 A137 F315 D319	R133-S135 PolarHBondContact O-N 2.93Å; S135-A137 PolarHBondContact OG-N 2.79Å; S135-A137 VanDerWaalsContact OG-N 3.1Å; S135-A137 PolarHBondContact OG-O 2.72Å; S135-F315 WeakPolarHBondContact OG-CZ 3.43Å; S135-D319 WeakPolarHBondContact CA-OD1 3.4Å; S135-D319 WeakPolarHBondContact CB-OD1 3.48Å; S135-D319 PolarHBondContact OG-OD1 3.04Å
136	Y	87	Confident	69	Low	40 Å²	40	85 Å²	85	16%	0.157	44%	0.441	C	S	.	.	S	Bend	trans	-97.6	-3.6	170	-74.8	-105.3	0	0	0	112.6	R133 D319 G322 R323 C327 E328 I329	R133-Y136 HydrophobicContact CB-CE2 4.35Å; Y136-D319 PolarHBondContact N-OD1 3.03Å; Y136-G322 VanDerWaalsContact CD1-O 3.23Å; Y136-G322 WeakPolarHBondContact CD1-O 3.19Å; Y136-R323 HydrophobicContact CD2-CB 4.27Å; Y136-R323 HydrophobicContact CD2-CG 3.36Å; Y136-R323 HydrophobicContact CE2-CG 3.75Å; Y136-R323 HydrophobicContact CG-CG 4.1Å; Y136-C327 WeakPolarHBondContact CD1-O 3.44Å; Y136-E328 CarbonylContact O-C 3.57Å; Y136-E328 WeakPolarHBondContact O-CA 3.37Å; Y136-I329 PolarHBondContact O-N 3.4Å
137	A	90.9	Very high	71.1	Confident	10 Å²	10	82.5 Å²	82.5	8%	0.083	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140.6	173.5	0	0	0	0	0	110.8	S135 F315 A318 D319 I329 V331	S135-A137 PolarHBondContact OG-N 2.79Å; S135-A137 VanDerWaalsContact OG-N 3.1Å; S135-A137 PolarHBondContact OG-O 2.72Å; A137-F315 HydrophobicContact CB-CD1 4.49Å; A137-F315 HydrophobicContact CB-CD2 3.8Å; A137-F315 HydrophobicContact CB-CE1 4.28Å; A137-F315 HydrophobicContact CB-CE2 3.55Å; A137-F315 HydrophobicContact CB-CG 4.27Å; A137-F315 HydrophobicContact CB-CZ 3.81Å; A137-F315 WeakPolarHBondContact O-CE2 3.43Å; A137-A318 HydrophobicContact CB-CB 3.83Å; A137-D319 HydrophobicContact CB-CB 3.93Å; A137-I329 WeakPolarHBondContact CA-O 3.44Å; A137-V331 HydrophobicContact CB-CG2 4.36Å
138	K	92.4	Very high	73.2	Confident	93 Å²	93	80.3 Å²	80.3	40%	0.404	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	118.7	173.3	-174.8	177.8	173.2	-128.7	0	109	E140 E328 I329 H330 V331	K138-E140 WeakPolarHBondContact CE-OE1 3.34Å; K138-E140 IonicContact NZ-OE1 3.47Å; K138-E140 PolarHBondContact NZ-OE1 2.89Å; K138-E140 IonicContact NZ-OE2 2.86Å; K138-E328 HydrophobicContact CB-CG 4.45Å; K138-E328 WeakPolarHBondContact CD-OE1 3.48Å; K138-I329 PolarHBondContact N-O 2.9Å; K138-H330 CarbonylContact O-C 3.52Å; K138-H330 WeakPolarHBondContact O-CA 3.37Å; K138-V331 PolarHBondContact O-N 3.43Å
139	E	91.6	Very high	75.5	Confident	135 Å²	135	71.9 Å²	71.9	63%	0.631	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	124.8	174.9	-168.4	168.7	-165.3	0	0	109.6	F315	E139-F315 HydrophobicContact CB-CD2 4.33Å; E139-F315 HydrophobicContact CB-CE2 4.5Å
140	E	91.1	Very high	77.7	Confident	35 Å²	35	73.6 Å²	73.6	16%	0.164	41%	0.409	C	S	.	.			trans	-94.9	130.3	179.1	-68.6	-64.1	155.6	0	0	110.3	K138 T142 H330 V331 I332	K138-E140 WeakPolarHBondContact CE-OE1 3.34Å; K138-E140 IonicContact NZ-OE1 3.47Å; K138-E140 PolarHBondContact NZ-OE1 2.89Å; K138-E140 IonicContact NZ-OE2 2.86Å; E140-T142 PolarHBondContact O-N 2.92Å; E140-H330 HydrophobicContact CG-CB 4.05Å; E140-H330 IonicContact OE1-CE1 3.15Å; E140-H330 IonicContact OE1-CG 3.22Å; E140-H330 IonicContact OE1-ND1 3.13Å; E140-H330 PolarHBondContact OE1-ND1 3.29Å; E140-V331 PolarHBondContact N-O 2.9Å; E140-I332 HydrophobicContact CB-CG1 4Å; E140-I332 HydrophobicContact CG-CG1 4.17Å
141	D	86.9	Confident	80	Confident	75 Å²	75	77.9 Å²	77.9	40%	0.401	42%	0.418	S	S	.	.			trans	-71.8	115.8	177.7	174.5	32.5	0	0	0	111.2	S143 T144 R170	D141-S143 VanDerWaalsContact CG-OG 3.31Å; D141-S143 VanDerWaalsContact OD1-CB 3.27Å; D141-S143 WeakPolarHBondContact OD1-CB 3.47Å; D141-S143 PolarHBondContact OD1-N 3.29Å; D141-S143 PolarHBondContact OD1-OG 3.21Å; D141-S143 PolarHBondContact OD2-OG 2.91Å; D141-T144 WeakPolarHBondContact OD2-CB 3.34Å; D141-T144 WeakPolarHBondContact OD2-CG2 3.4Å; D141-T144 PolarHBondContact OD2-N 3.14Å; D141-T144 PolarHBondContact OD2-OG1 3.45Å; D141-R170 PolarHBondContact O-NE 2.79Å
142	T	85.2	Confident	82.1	Confident	36 Å²	36	73 Å²	73	22%	0.221	40%	0.399	C	S	.	.			trans	-95.8	-5	177	60.2	0	0	0	0	113.3	E140 T166 F167 I332 A333	E140-T142 PolarHBondContact O-N 2.92Å; T142-T166 WeakPolarHBondContact O-CG2 3.47Å; T142-F167 HydrophobicContact CG2-CB 3.85Å; T142-I332 HydrophobicContact CG2-CG2 3.76Å; T142-A333 VanDerWaalsContact CG2-O 3.29Å; T142-A333 WeakPolarHBondContact CG2-O 3.27Å; T142-A333 PolarHBondContact OG1-O 3.17Å
143	S	82.7	Confident	84.1	Confident	94 Å²	94	70.2 Å²	70.2	66%	0.657	38%	0.378	S	S	*	.	S	Bend	trans	-77.6	-33.1	-179.2	73.1	0	0	0	0	112.7	D141	D141-S143 VanDerWaalsContact CG-OG 3.31Å; D141-S143 VanDerWaalsContact OD1-CB 3.27Å; D141-S143 WeakPolarHBondContact OD1-CB 3.47Å; D141-S143 PolarHBondContact OD1-N 3.29Å; D141-S143 PolarHBondContact OD1-OG 3.21Å; D141-S143 PolarHBondContact OD2-OG 2.91Å
144	T	84.8	Confident	85.2	Confident	61 Å²	61	74.8 Å²	74.8	37%	0.374	40%	0.403	S	S	.	.	S	Bend	trans	-76.7	119.8	-179.1	41.8	0	0	0	0	111.6	D141 T166 R170	D141-T144 WeakPolarHBondContact OD2-CB 3.34Å; D141-T144 WeakPolarHBondContact OD2-CG2 3.4Å; D141-T144 PolarHBondContact OD2-N 3.14Å; D141-T144 PolarHBondContact OD2-OG1 3.45Å; T144-T166 WeakPolarHBondContact O-CG2 3.3Å; T144-R170 PolarHBondContact O-NH1 2.87Å; T144-R170 PolarHBondContact O-NH2 3.22Å; T144-R170 PolarHBondContact OG1-NH2 2.87Å
145	P	84.3	Confident	86.2	Confident	113 Å²	113	73.8 Å²	73.8	73%	0.734	40%	0.398	S	S	*	.			trans	-64.1	144.6	-179.9	26.1	-33.4	0	0	0	111.5
146	L	87.4	Confident	86.6	Confident	36 Å²	36	73.1 Å²	73.1	19%	0.188	39%	0.393	C	S	.	.			trans	-112.7	146.4	-179.5	-125.6	169.5	0	0	0	110.2	L152 K169 R170 L173	L146-L152 HydrophobicContact CB-CD1 4.15Å; L146-L152 HydrophobicContact CD1-CD1 3.84Å; L146-L152 HydrophobicContact CG-CD1 3.8Å; L146-L152 HydrophobicContact CG-CD2 4.15Å; L146-K169 HydrophobicContact CB-CB 4.48Å; L146-K169 HydrophobicContact CB-CD 4.03Å; L146-K169 HydrophobicContact CD1-CB 3.82Å; L146-K169 PolarHBondContact O-NZ 3.22Å; L146-R170 VanDerWaalsContact CD1-CD 3.41Å; L146-R170 VanDerWaalsContact CD1-CZ 3.48Å; L146-L173 HydrophobicContact CD1-CD1 3.61Å
147	P	88.3	Confident	86.7	Confident	69 Å²	69	72.5 Å²	72.5	45%	0.448	40%	0.396	S	S	.	.			trans	-51.1	167.4	169.4	-25.3	31.9	0	0	0	113.6	K151 L152 K169	P147-K151 HydrophobicContact CB-CB 4.03Å; P147-K151 HydrophobicContact CB-CD 4.43Å; P147-L152 HydrophobicContact CB-CD2 4.32Å; P147-L152 HydrophobicContact CB-CG 4.21Å; P147-L152 HydrophobicContact CG-CD2 4.22Å; P147-L152 VanDerWaalsContact O-CD1 3.29Å; P147-L152 WeakPolarHBondContact O-CD1 3.44Å; P147-K169 WeakPolarHBondContact O-CD 3.33Å; P147-K169 WeakPolarHBondContact O-CE 3.49Å; P147-K169 PolarHBondContact O-NZ 3.38Å
148	T	84.3	Confident	86.7	Confident	56 Å²	56	73.6 Å²	73.6	34%	0.344	40%	0.4	S	S	.	.			trans	-58.2	150.2	173.7	54	0	0	0	0	111	T150 K151 L152	T148-T150 PolarHBondContact O-N 3.28Å; T148-T150 PolarHBondContact OG1-OG1 3.11Å; T148-K151 WeakPolarHBondContact O-CB 3.44Å; T148-K151 PolarHBondContact O-N 2.88Å; T148-K151 WeakPolarHBondContact OG1-CG 3.47Å; T148-L152 PolarHBondContact O-N 3.06Å
149	L	86.1	Confident	86.5	Confident	13 Å²	13	73.8 Å²	73.8	7%	0.068	41%	0.406	C	S	.	.	H	α-helix	trans	-54.5	-40.5	-175.7	-171.4	69.5	0	0	0	112.4	K151 L152 I153 P156 W160 L164 I172 Y197	L149-K151 PolarHBondContact O-N 3.43Å; L149-L152 WeakPolarHBondContact O-CB 3.49Å; L149-L152 PolarHBondContact O-N 3.46Å; L149-I153 HydrophobicContact CD1-CD1 3.88Å; L149-I153 PolarHBondContact O-N 2.98Å; L149-P156 HydrophobicContact CD2-CB 3.92Å; L149-P156 HydrophobicContact CG-CB 4.24Å; L149-W160 HydrophobicContact CD2-CZ3 4.28Å; L149-L164 HydrophobicContact CD2-CD1 3.97Å; L149-I172 HydrophobicContact CD1-CB 4.46Å; L149-I172 HydrophobicContact CD1-CD1 4.35Å; L149-I172 HydrophobicContact CD1-CG2 3.81Å; L149-Y197 HydrophobicContact CD2-CE2 4.42Å
150	T	83.4	Confident	86.4	Confident	90 Å²	90	69.1 Å²	69.1	55%	0.552	38%	0.382	S	S	*	.	H	α-helix	trans	-64	-23.3	177.7	51.3	0	0	0	0	114.5	T148	T148-T150 PolarHBondContact O-N 3.28Å; T148-T150 PolarHBondContact OG1-OG1 3.11Å
151	K	85.9	Confident	86.3	Confident	171 Å²	171	76.1 Å²	76.1	74%	0.743	42%	0.421	S	S	*	.	H	α-helix	trans	-86.3	-25.8	173.4	-71.1	-178.3	179.3	-177.9	0	112.1	P147 T148 L149	P147-K151 HydrophobicContact CB-CB 4.03Å; P147-K151 HydrophobicContact CB-CD 4.43Å; T148-K151 WeakPolarHBondContact O-CB 3.44Å; T148-K151 PolarHBondContact O-N 2.88Å; T148-K151 WeakPolarHBondContact OG1-CG 3.47Å; L149-K151 PolarHBondContact O-N 3.43Å
152	L	83.8	Confident	86.3	Confident	53 Å²	53	77.6 Å²	77.6	28%	0.277	42%	0.424	S	S	.	.	H	α-helix	trans	-82.7	-41.3	-179.6	-71.9	170.9	0	0	0	112.1	L146 P147 T148 L149 K169 L173	L146-L152 HydrophobicContact CB-CD1 4.15Å; L146-L152 HydrophobicContact CD1-CD1 3.84Å; L146-L152 HydrophobicContact CG-CD1 3.8Å; L146-L152 HydrophobicContact CG-CD2 4.15Å; P147-L152 HydrophobicContact CB-CD2 4.32Å; P147-L152 HydrophobicContact CB-CG 4.21Å; P147-L152 HydrophobicContact CG-CD2 4.22Å; P147-L152 VanDerWaalsContact O-CD1 3.29Å; P147-L152 WeakPolarHBondContact O-CD1 3.44Å; T148-L152 PolarHBondContact O-N 3.06Å; L149-L152 WeakPolarHBondContact O-CB 3.49Å; L149-L152 PolarHBondContact O-N 3.46Å; L152-K169 HydrophobicContact CD1-CB 4.26Å; L152-K169 HydrophobicContact CD1-CD 4.37Å; L152-L173 HydrophobicContact CB-CD2 4.24Å; L152-L173 HydrophobicContact CD1-CD1 4.27Å; L152-L173 HydrophobicContact CD2-CD1 4.38Å
153	I	86.8	Confident	86.6	Confident	19 Å²	19	82 Å²	82	10%	0.097	44%	0.442	C	S	.	.			trans	-126.2	122.8	-177.4	-61.8	161.4	0	0	0	107.1	L149 N155 P156 I172 L173 E176	L149-I153 HydrophobicContact CD1-CD1 3.88Å; L149-I153 PolarHBondContact O-N 2.98Å; I153-N155 VanDerWaalsContact C-N 3.34Å; I153-N155 PolarHBondContact O-N 2.89Å; I153-P156 HydrophobicContact CG2-CB 4.43Å; I153-I172 HydrophobicContact CD1-CG2 3.51Å; I153-L173 HydrophobicContact CD1-CD2 4.3Å; I153-L173 HydrophobicContact CG1-CD2 4.08Å; I153-E176 HydrophobicContact CD1-CG 3.72Å; I153-E176 HydrophobicContact CG1-CG 4.3Å
154	Q	81.1	Confident	87	Confident	183 Å²	183	78 Å²	78	86%	0.855	41%	0.413	S	S	*	.	S	Bend	trans	-61.9	-42.3	-176.5	-68	178.5	-8.3	0	0	112
155	N	86.9	Confident	87.3	Confident	130 Å²	130	77.2 Å²	77.2	70%	0.695	41%	0.407	S	S	*	.	S	Bend	trans	-128.6	79.4	-179.7	-70.5	-23.3	0	0	0	110.3	I153 R204	I153-N155 VanDerWaalsContact C-N 3.34Å; I153-N155 PolarHBondContact O-N 2.89Å; N155-R204 PolarHBondContact O-NH1 2.64Å
156	P	87.7	Confident	87.6	Confident	24 Å²	24	73.8 Å²	73.8	16%	0.156	38%	0.384	C	S	.	.			trans	-63.8	140.8	178.9	27.1	-33.5	0	0	0	110.6	L149 I153 L158 N159 Y197	L149-P156 HydrophobicContact CD2-CB 3.92Å; L149-P156 HydrophobicContact CG-CB 4.24Å; I153-P156 HydrophobicContact CG2-CB 4.43Å; P156-L158 PolarHBondContact O-N 3.06Å; P156-N159 WeakPolarHBondContact CG-OD1 3.23Å; P156-Y197 WeakPolarHBondContact CA-OH 3.45Å; P156-Y197 HydrophobicContact CB-CE2 4.26Å
157	A	89.1	Confident	87.9	Confident	27 Å²	27	72.5 Å²	72.5	22%	0.223	38%	0.377	C	S	.	.	S	Bend	trans	-66.9	-24.3	-178.4	0	0	0	0	0	112.9	Y197 A200 I201	A157-Y197 HydrophobicContact CB-CE1 4.37Å; A157-Y197 HydrophobicContact CB-CE2 4.14Å; A157-Y197 PolarHBondContact N-OH 3.38Å; A157-Y197 VanDerWaalsContact N-OH 3.07Å; A157-A200 HydrophobicContact CB-CB 3.77Å; A157-I201 HydrophobicContact CB-CG1 4.16Å
158	L	91.2	Very high	88.1	Confident	33 Å²	33	69.2 Å²	69.2	17%	0.173	36%	0.355	C	S	.	.			trans	-151.2	142.1	-178.1	-165.6	61.5	0	0	0	109.8	P156 W160 E196 Y197 A200 F230	P156-L158 PolarHBondContact O-N 3.06Å; L158-W160 HydrophobicContact CB-CH2 4.19Å; L158-W160 HydrophobicContact CB-CZ3 4.37Å; L158-W160 HydrophobicContact CD2-CH2 4.04Å; L158-W160 HydrophobicContact CD2-CZ2 3.72Å; L158-W160 HydrophobicContact CG-CH2 4.27Å; L158-W160 HydrophobicContact CG-CZ2 4.23Å; L158-W160 WeakPolarHBondContact O-CZ3 3.4Å; L158-E196 HydrophobicContact CD2-CB 3.83Å; L158-Y197 HydrophobicContact CB-CD2 4.14Å; L158-A200 HydrophobicContact CB-CB 3.95Å; L158-A200 HydrophobicContact CD2-CB 4.36Å; L158-F230 HydrophobicContact CD2-CZ 4.29Å
159	N	88.7	Confident	88.6	Confident	97 Å²	97	66.8 Å²	66.8	52%	0.519	34%	0.34	S	S	.	.			trans	-119	157.8	175	-68.8	-50.8	0	0	0	110.2	P156	P156-N159 WeakPolarHBondContact CG-OD1 3.23Å
160	W	89	Confident	89	Confident	37 Å²	37	67.5 Å²	67.5	14%	0.14	34%	0.342	C	S	.	.			trans	-130.7	154.7	176.3	-65.6	-101.3	0	0	0	109.6	L149 L158 F162 L164 I172 V193 E196 Y197 R229	L149-W160 HydrophobicContact CD2-CZ3 4.28Å; L158-W160 HydrophobicContact CB-CH2 4.19Å; L158-W160 HydrophobicContact CB-CZ3 4.37Å; L158-W160 HydrophobicContact CD2-CH2 4.04Å; L158-W160 HydrophobicContact CD2-CZ2 3.72Å; L158-W160 HydrophobicContact CG-CH2 4.27Å; L158-W160 HydrophobicContact CG-CZ2 4.23Å; L158-W160 WeakPolarHBondContact O-CZ3 3.4Å; W160-F162 HydrophobicContact CB-CD1 4.09Å; W160-F162 HydrophobicContact CB-CD2 4.44Å; W160-F162 HydrophobicContact CB-CE1 3.87Å; W160-F162 HydrophobicContact CB-CE2 4.23Å; W160-F162 HydrophobicContact CB-CG 4.37Å; W160-F162 HydrophobicContact CB-CZ 3.94Å; W160-F162 AromaticContact CD1-CE1 3.6Å; W160-F162 AromaticContact CD1-CZ 3.38Å; W160-F162 HydrophobicContact CG-CE1 4.04Å; W160-F162 HydrophobicContact CG-CE2 4.28Å; W160-F162 AromaticContact CG-CZ 3.79Å; W160-F162 HydrophobicContact CG-CZ 3.79Å; W160-F162 PolarHBondContact O-N 3.04Å; W160-L164 HydrophobicContact CB-CD2 4.49Å; W160-L164 HydrophobicContact CD2-CD2 3.94Å; W160-L164 HydrophobicContact CE3-CD1 3.84Å; W160-L164 HydrophobicContact CE3-CD2 3.79Å; W160-L164 HydrophobicContact CE3-CG 4.17Å; W160-L164 HydrophobicContact CG-CD2 4.28Å; W160-L164 HydrophobicContact CH2-CD1 4.46Å; W160-L164 HydrophobicContact CZ3-CD1 3.68Å; W160-L164 HydrophobicContact CZ3-CD2 4.32Å; W160-L164 HydrophobicContact CZ3-CG 4.49Å; W160-I172 HydrophobicContact CH2-CD1 4.28Å; W160-I172 HydrophobicContact CZ3-CD1 4.25Å; W160-V193 HydrophobicContact CD2-CG1 4.42Å; W160-V193 HydrophobicContact CH2-CG1 3.61Å; W160-V193 HydrophobicContact CZ2-CB 4.11Å; W160-V193 HydrophobicContact CZ2-CG1 3.45Å; W160-V193 VanDerWaalsContact CZ2-CG1 3.45Å; W160-V193 HydrophobicContact CZ2-CG2 4.46Å; W160-V193 HydrophobicContact CZ3-CG1 4.18Å; W160-E196 HydrophobicContact CZ2-CB 4.22Å; W160-E196 PolarHBondContact NE1-OE2 3.34Å; W160-E196 VanDerWaalsContact NE1-OE2 3.17Å; W160-Y197 AromaticContact CH2-CD2 3.79Å; W160-Y197 HydrophobicContact CH2-CD2 3.79Å; W160-Y197 HydrophobicContact CH2-CG 4.43Å; W160-Y197 HydrophobicContact CZ3-CD2 4.01Å; W160-R229 VanDerWaalsContact CE2-NH2 3.27Å
161	D	87.9	Confident	89.5	Confident	182 Å²	182	63.2 Å²	63.2	97%	0.973	32%	0.315	S	S	*	.	S	Bend	trans	-73.7	-8.2	178.4	-56.4	-31.4	0	0	0	113.3
162	F	88.6	Confident	90	Very high	105 Å²	105	55 Å²	55	46%	0.461	28%	0.28	S	S	.	.	S	Bend	trans	-116.1	153.5	178	58.1	-95.3	0	0	0	111.2	W160 L164 V193	W160-F162 HydrophobicContact CB-CD1 4.09Å; W160-F162 HydrophobicContact CB-CD2 4.44Å; W160-F162 HydrophobicContact CB-CE1 3.87Å; W160-F162 HydrophobicContact CB-CE2 4.23Å; W160-F162 HydrophobicContact CB-CG 4.37Å; W160-F162 HydrophobicContact CB-CZ 3.94Å; W160-F162 AromaticContact CD1-CE1 3.6Å; W160-F162 AromaticContact CD1-CZ 3.38Å; W160-F162 HydrophobicContact CG-CE1 4.04Å; W160-F162 HydrophobicContact CG-CE2 4.28Å; W160-F162 AromaticContact CG-CZ 3.79Å; W160-F162 HydrophobicContact CG-CZ 3.79Å; W160-F162 PolarHBondContact O-N 3.04Å; F162-L164 HydrophobicContact CD2-CD2 4.17Å; F162-L164 HydrophobicContact CE2-CD2 3.65Å; F162-L164 HydrophobicContact CZ-CD2 4.5Å; F162-V193 HydrophobicContact CE2-CG2 4.39Å; F162-V193 HydrophobicContact CZ-CG2 4.23Å
163	E	90.1	Very high	90.4	Very high	129 Å²	129	54.8 Å²	54.8	60%	0.603	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-71.2	132.5	174.1	-172.8	175.5	-175.5	0	0	111.2	K169	E163-K169 IonicContact OE1-NZ 3.53Å; E163-K169 PolarHBondContact OE1-NZ 2.72Å
164	L	91.5	Very high	90.8	Very high	10 Å²	10	54.2 Å²	54.2	5%	0.052	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-73.9	144.1	176.7	-58.7	-171.6	0	0	0	112.3	L149 W160 F162 Q168 K169 I172 V193	L149-L164 HydrophobicContact CD2-CD1 3.97Å; W160-L164 HydrophobicContact CB-CD2 4.49Å; W160-L164 HydrophobicContact CD2-CD2 3.94Å; W160-L164 HydrophobicContact CE3-CD1 3.84Å; W160-L164 HydrophobicContact CE3-CD2 3.79Å; W160-L164 HydrophobicContact CE3-CG 4.17Å; W160-L164 HydrophobicContact CG-CD2 4.28Å; W160-L164 HydrophobicContact CH2-CD1 4.46Å; W160-L164 HydrophobicContact CZ3-CD1 3.68Å; W160-L164 HydrophobicContact CZ3-CD2 4.32Å; W160-L164 HydrophobicContact CZ3-CG 4.49Å; F162-L164 HydrophobicContact CD2-CD2 4.17Å; F162-L164 HydrophobicContact CE2-CD2 3.65Å; F162-L164 HydrophobicContact CZ-CD2 4.5Å; L164-Q168 HydrophobicContact CB-CB 4.23Å; L164-K169 HydrophobicContact CB-CG 3.92Å; L164-K169 WeakPolarHBondContact O-CE 3.23Å; L164-K169 PolarHBondContact O-NZ 2.81Å; L164-I172 HydrophobicContact CD1-CD1 3.48Å; L164-I172 VanDerWaalsContact CD1-CD1 3.48Å; L164-V193 HydrophobicContact CD1-CG1 4.09Å; L164-V193 HydrophobicContact CD2-CG1 3.65Å; L164-V193 HydrophobicContact CG-CG1 4.49Å
165	D	90.5	Very high	91.4	Very high	45 Å²	45	45.6 Å²	45.6	24%	0.241	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-67.1	155.4	174.7	-62.2	-25	0	0	0	110.9	F167 Q168 K169 R557	D165-F167 VanDerWaalsContact C-N 3.27Å; D165-F167 HydrophobicContact CB-CD1 3.63Å; D165-F167 HydrophobicContact CB-CE1 3.59Å; D165-F167 PolarHBondContact O-N 3.26Å; D165-Q168 HydrophobicContact CB-CG 4.24Å; D165-Q168 WeakPolarHBondContact O-CB 3.35Å; D165-Q168 PolarHBondContact O-N 3.44Å; D165-K169 PolarHBondContact O-N 3.21Å; D165-R557 IonicContact OD1-CZ 3.62Å; D165-R557 IonicContact OD1-NH2 3.41Å; D165-R557 PolarHBondContact OD1-NH2 2.91Å; D165-R557 IonicContact OD2-CZ 2.79Å; D165-R557 VanDerWaalsContact OD2-CZ 3.29Å; D165-R557 IonicContact OD2-NH1 2.65Å; D165-R557 PolarHBondContact OD2-NH1 3.38Å; D165-R557 IonicContact OD2-NH2 2.75Å; D165-R557 PolarHBondContact OD2-NH2 2.88Å
166	T	91.8	Very high	91.6	Very high	41 Å²	41	41.4 Å²	41.4	25%	0.252	21%	0.212	S	C	.	.	H	α-helix	trans	-51.8	-42.9	-179.2	-53.1	0	0	0	0	113.4	T142 T144 K169 R170	T142-T166 WeakPolarHBondContact O-CG2 3.47Å; T144-T166 WeakPolarHBondContact O-CG2 3.3Å; T166-K169 PolarHBondContact O-N 2.91Å; T166-R170 VanDerWaalsContact O-CD 3.3Å; T166-R170 WeakPolarHBondContact O-CD 3.5Å; T166-R170 PolarHBondContact O-N 2.83Å
167	F	92.7	Very high	91.8	Very high	9 Å²	9	45.3 Å²	45.3	4%	0.039	23%	0.232	C	C	.	.	H	α-helix	trans	-69.5	-34.1	179.3	83	-89.6	0	0	0	112.2	T142 D165 R170 A171 V183 A185 I332 T334	T142-F167 HydrophobicContact CG2-CB 3.85Å; D165-F167 VanDerWaalsContact C-N 3.27Å; D165-F167 HydrophobicContact CB-CD1 3.63Å; D165-F167 HydrophobicContact CB-CE1 3.59Å; D165-F167 PolarHBondContact O-N 3.26Å; F167-R170 PolarHBondContact O-N 2.85Å; F167-A171 PolarHBondContact O-N 3.49Å; F167-V183 HydrophobicContact CD2-CG1 4.05Å; F167-V183 HydrophobicContact CE2-CG1 4.03Å; F167-A185 HydrophobicContact CE2-CB 4.12Å; F167-A185 HydrophobicContact CZ-CB 4.38Å; F167-I332 HydrophobicContact CB-CG2 3.78Å; F167-I332 HydrophobicContact CD2-CG2 4.44Å; F167-T334 HydrophobicContact CD1-CG2 4.2Å; F167-T334 HydrophobicContact CE1-CG2 4.43Å; F167-T334 HydrophobicContact CG-CG2 4.29Å
168	Q	93.9	Very high	91.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-67.7	-44.7	176.1	-63.7	172.3	-34.2	0	0	110.3	L164 D165 R170 A171 I172 G190 V193	L164-Q168 HydrophobicContact CB-CB 4.23Å; D165-Q168 HydrophobicContact CB-CG 4.24Å; D165-Q168 WeakPolarHBondContact O-CB 3.35Å; D165-Q168 PolarHBondContact O-N 3.44Å; Q168-R170 VanDerWaalsContact C-N 3.35Å; Q168-R170 PolarHBondContact O-N 3.46Å; Q168-A171 PolarHBondContact O-N 2.98Å; Q168-I172 WeakPolarHBondContact O-CG1 3.25Å; Q168-I172 PolarHBondContact O-N 3.06Å; Q168-G190 PolarHBondContact NE2-O 3.02Å; Q168-V193 HydrophobicContact CB-CG1 4.38Å; Q168-V193 HydrophobicContact CG-CG1 4.47Å
169	K	94	Very high	92	Very high	5 Å²	5	49.1 Å²	49.1	2%	0.022	25%	0.247	C	C	.	.	H	α-helix	trans	-59.5	-42.5	175.2	-66.4	171.4	175.6	165.2	0	111.7	L146 P147 L152 E163 L164 D165 T166 I172 L173	L146-K169 HydrophobicContact CB-CB 4.48Å; L146-K169 HydrophobicContact CB-CD 4.03Å; L146-K169 HydrophobicContact CD1-CB 3.82Å; L146-K169 PolarHBondContact O-NZ 3.22Å; P147-K169 WeakPolarHBondContact O-CD 3.33Å; P147-K169 WeakPolarHBondContact O-CE 3.49Å; P147-K169 PolarHBondContact O-NZ 3.38Å; L152-K169 HydrophobicContact CD1-CB 4.26Å; L152-K169 HydrophobicContact CD1-CD 4.37Å; E163-K169 IonicContact OE1-NZ 3.53Å; E163-K169 PolarHBondContact OE1-NZ 2.72Å; L164-K169 HydrophobicContact CB-CG 3.92Å; L164-K169 WeakPolarHBondContact O-CE 3.23Å; L164-K169 PolarHBondContact O-NZ 2.81Å; D165-K169 PolarHBondContact O-N 3.21Å; T166-K169 PolarHBondContact O-N 2.91Å; K169-I172 PolarHBondContact O-N 3.39Å; K169-L173 WeakPolarHBondContact O-CG 3.32Å; K169-L173 PolarHBondContact O-N 3.44Å
170	R	93.7	Very high	92.3	Very high	27 Å²	27	44.7 Å²	44.7	10%	0.102	22%	0.223	C	C	.	.	H	α-helix	trans	-58.8	-49.9	173.8	-102.3	71.2	-176.1	-167.5	-8.6	111.9	D141 T144 L146 T166 F167 Q168 I172 L173 C174 I332	D141-R170 PolarHBondContact O-NE 2.79Å; T144-R170 PolarHBondContact O-NH1 2.87Å; T144-R170 PolarHBondContact O-NH2 3.22Å; T144-R170 PolarHBondContact OG1-NH2 2.87Å; L146-R170 VanDerWaalsContact CD1-CD 3.41Å; L146-R170 VanDerWaalsContact CD1-CZ 3.48Å; T166-R170 VanDerWaalsContact O-CD 3.3Å; T166-R170 WeakPolarHBondContact O-CD 3.5Å; T166-R170 PolarHBondContact O-N 2.83Å; F167-R170 PolarHBondContact O-N 2.85Å; Q168-R170 VanDerWaalsContact C-N 3.35Å; Q168-R170 PolarHBondContact O-N 3.46Å; R170-I172 VanDerWaalsContact C-N 3.28Å; R170-I172 PolarHBondContact O-N 2.92Å; R170-L173 WeakPolarHBondContact O-CB 3.41Å; R170-L173 PolarHBondContact O-N 3.19Å; R170-L173 VanDerWaalsContact O-N 3.15Å; R170-C174 PolarHBondContact O-N 2.64Å; R170-I332 HydrophobicContact CB-CD1 4.15Å
171	A	95	Very high	92.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60	-43.3	-178.6	0	0	0	0	0	111.2	F167 Q168 L173 C174 L175 V183 V194 I332	F167-A171 PolarHBondContact O-N 3.49Å; Q168-A171 PolarHBondContact O-N 2.98Å; A171-L173 PolarHBondContact O-N 3.14Å; A171-C174 PolarHBondContact O-N 3.08Å; A171-L175 VanDerWaalsContact O-CG 3.28Å; A171-L175 WeakPolarHBondContact O-CG 3.43Å; A171-L175 PolarHBondContact O-N 2.86Å; A171-V183 HydrophobicContact CB-CG2 4.07Å; A171-V194 HydrophobicContact CB-CB 4.46Å; A171-V194 HydrophobicContact CB-CG1 3.8Å; A171-V194 HydrophobicContact CB-CG2 3.74Å; A171-I332 HydrophobicContact CB-CD1 3.55Å
172	I	95.2	Very high	93.1	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.5	-41.4	176.8	-71.6	169.8	0	0	0	111.9	L149 I153 W160 L164 Q168 K169 R170 L175 E176 V193 Y197	L149-I172 HydrophobicContact CD1-CB 4.46Å; L149-I172 HydrophobicContact CD1-CD1 4.35Å; L149-I172 HydrophobicContact CD1-CG2 3.81Å; I153-I172 HydrophobicContact CD1-CG2 3.51Å; W160-I172 HydrophobicContact CH2-CD1 4.28Å; W160-I172 HydrophobicContact CZ3-CD1 4.25Å; L164-I172 HydrophobicContact CD1-CD1 3.48Å; L164-I172 VanDerWaalsContact CD1-CD1 3.48Å; Q168-I172 WeakPolarHBondContact O-CG1 3.25Å; Q168-I172 PolarHBondContact O-N 3.06Å; K169-I172 PolarHBondContact O-N 3.39Å; R170-I172 VanDerWaalsContact C-N 3.28Å; R170-I172 PolarHBondContact O-N 2.92Å; I172-L175 PolarHBondContact O-N 3.22Å; I172-E176 PolarHBondContact O-N 2.92Å; I172-V193 HydrophobicContact CD1-CG1 4.44Å; I172-Y197 HydrophobicContact CB-CD1 4.22Å; I172-Y197 HydrophobicContact CB-CE1 4.38Å; I172-Y197 HydrophobicContact CB-CG 4.43Å; I172-Y197 HydrophobicContact CD1-CD2 3.9Å; I172-Y197 HydrophobicContact CD1-CE2 4.45Å; I172-Y197 HydrophobicContact CD1-CG 3.98Å; I172-Y197 HydrophobicContact CG1-CD1 3.91Å; I172-Y197 HydrophobicContact CG1-CD2 4.1Å; I172-Y197 HydrophobicContact CG1-CE1 4.5Å; I172-Y197 HydrophobicContact CG1-CG 3.7Å; I172-Y197 HydrophobicContact CG2-CD1 3.68Å; I172-Y197 HydrophobicContact CG2-CD2 4.11Å; I172-Y197 HydrophobicContact CG2-CE1 3.38Å; I172-Y197 HydrophobicContact CG2-CE2 3.82Å; I172-Y197 HydrophobicContact CG2-CG 4.04Å; I172-Y197 VanDerWaalsContact CG2-CZ 3.45Å
173	L	93.6	Very high	93.5	Very high	47 Å²	47	29.2 Å²	29.2	25%	0.246	15%	0.148	C	C	.	.	H	α-helix	trans	-60.6	-45.9	175.8	-77.3	169	0	0	0	112.5	L146 L152 I153 K169 R170 A171 L175 E176 N177	L146-L173 HydrophobicContact CD1-CD1 3.61Å; L152-L173 HydrophobicContact CB-CD2 4.24Å; L152-L173 HydrophobicContact CD1-CD1 4.27Å; L152-L173 HydrophobicContact CD2-CD1 4.38Å; I153-L173 HydrophobicContact CD1-CD2 4.3Å; I153-L173 HydrophobicContact CG1-CD2 4.08Å; K169-L173 WeakPolarHBondContact O-CG 3.32Å; K169-L173 PolarHBondContact O-N 3.44Å; R170-L173 WeakPolarHBondContact O-CB 3.41Å; R170-L173 PolarHBondContact O-N 3.19Å; R170-L173 VanDerWaalsContact O-N 3.15Å; A171-L173 PolarHBondContact O-N 3.14Å; L173-L175 VanDerWaalsContact C-N 3.3Å; L173-L175 PolarHBondContact O-N 3.44Å; L173-E176 PolarHBondContact O-N 3.18Å; L173-N177 PolarHBondContact O-N 3.34Å; L173-N177 VanDerWaalsContact O-N 3.16Å; L173-N177 PolarHBondContact O-ND2 3.42Å
174	C	93.4	Very high	93.7	Very high	8 Å²	8	23.2 Å²	23.2	5%	0.054	12%	0.12	C	C	.	.	H	α-helix	trans	-61.2	-39.1	175.2	-67.3	0	0	0	0	111.8	R170 A171 N177 N178 E179 V181	R170-C174 PolarHBondContact O-N 2.64Å; A171-C174 PolarHBondContact O-N 3.08Å; C174-N177 CarbonylContact O-C 3.51Å; C174-N177 PolarHBondContact O-N 2.82Å; C174-N178 PolarHBondContact O-N 3.01Å; C174-E179 HydrophobicContact CB-CB 4.32Å; C174-E179 WeakPolarHBondContact O-CB 3.43Å; C174-E179 PolarHBondContact O-N 2.97Å; C174-V181 HydrophobicContact CB-CG1 3.42Å; C174-V181 VanDerWaalsContact CB-CG1 3.42Å
175	L	93.8	Very high	93.7	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-66.3	-39.2	177.2	-69.1	173.6	0	0	0	112.9	A171 I172 L173 N177 N178 V181 V194 A198 I201 V305	A171-L175 VanDerWaalsContact O-CG 3.28Å; A171-L175 WeakPolarHBondContact O-CG 3.43Å; A171-L175 PolarHBondContact O-N 2.86Å; I172-L175 PolarHBondContact O-N 3.22Å; L173-L175 VanDerWaalsContact C-N 3.3Å; L173-L175 PolarHBondContact O-N 3.44Å; L175-N177 PolarHBondContact O-N 3.21Å; L175-N178 PolarHBondContact O-N 3.48Å; L175-N178 VanDerWaalsContact O-N 3.08Å; L175-V181 HydrophobicContact CD2-CG1 4.39Å; L175-V181 HydrophobicContact CD2-CG2 3.92Å; L175-V181 HydrophobicContact CG-CG1 4.44Å; L175-V181 HydrophobicContact CG-CG2 4.3Å; L175-V194 HydrophobicContact CD1-CG1 3.85Å; L175-A198 HydrophobicContact CD1-CB 4.07Å; L175-I201 HydrophobicContact CB-CD1 3.78Å; L175-V305 HydrophobicContact CD2-CG2 3.64Å
176	E	92.6	Very high	93.4	Very high	41 Å²	41	22 Å²	22	19%	0.192	11%	0.113	C	C	.	.	H	α-helix	trans	-63.8	-30.1	172.9	-74.2	-68.8	177.3	0	0	112.3	I153 I172 L173 N178 Y197 R204	I153-E176 HydrophobicContact CD1-CG 3.72Å; I153-E176 HydrophobicContact CG1-CG 4.3Å; I172-E176 PolarHBondContact O-N 2.92Å; L173-E176 PolarHBondContact O-N 3.18Å; E176-N178 PolarHBondContact O-N 3.48Å; E176-Y197 HydrophobicContact CG-CE1 4.08Å; E176-Y197 WeakPolarHBondContact OE1-CE1 3.4Å; E176-Y197 PolarHBondContact OE1-OH 3.45Å; E176-R204 IonicContact OE1-CZ 3.46Å; E176-R204 IonicContact OE1-NH1 2.85Å; E176-R204 IonicContact OE1-NH2 3.23Å; E176-R204 PolarHBondContact OE1-NH2 3.16Å; E176-R204 IonicContact OE2-NH2 3.74Å; E176-R204 PolarHBondContact OE2-NH2 3.49Å
177	N	91.1	Very high	92.9	Very high	106 Å²	106	20.6 Å²	20.6	57%	0.567	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	2.2	174	-67.7	-23.2	0	0	0	113.9	L173 C174 L175 E179	L173-N177 PolarHBondContact O-N 3.34Å; L173-N177 VanDerWaalsContact O-N 3.16Å; L173-N177 PolarHBondContact O-ND2 3.42Å; C174-N177 CarbonylContact O-C 3.51Å; C174-N177 PolarHBondContact O-N 2.82Å; L175-N177 PolarHBondContact O-N 3.21Å; N177-E179 VanDerWaalsContact C-N 3.33Å; N177-E179 HydrophobicContact CB-CG 4.01Å
178	N	91.9	Very high	92.2	Very high	80 Å²	80	22 Å²	22	43%	0.428	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	39.7	-174.3	-58.3	-31.1	0	0	0	113.3	C174 L175 E176 R205 L303	C174-N178 PolarHBondContact O-N 3.01Å; L175-N178 PolarHBondContact O-N 3.48Å; L175-N178 VanDerWaalsContact O-N 3.08Å; E176-N178 PolarHBondContact O-N 3.48Å; N178-R205 PolarHBondContact OD1-NH1 3.42Å; N178-R205 PolarHBondContact OD1-NH2 3.31Å; N178-L303 HydrophobicContact CB-CD1 4.03Å; N178-L303 WeakPolarHBondContact O-CD2 3.36Å
179	E	93.2	Very high	91.7	Very high	60 Å²	60	22 Å²	22	28%	0.28	12%	0.115	S	C	.	.			trans	-104.4	151.1	178.3	-63.7	167.6	158.7	0	0	111	C174 N177 H330	C174-E179 HydrophobicContact CB-CB 4.32Å; C174-E179 WeakPolarHBondContact O-CB 3.43Å; C174-E179 PolarHBondContact O-N 2.97Å; N177-E179 VanDerWaalsContact C-N 3.33Å; N177-E179 HydrophobicContact CB-CG 4.01Å; E179-H330 IonicContact OE1-CE1 3.77Å; E179-H330 IonicContact OE1-NE2 2.77Å; E179-H330 IonicContact OE2-CD2 2.91Å; E179-H330 IonicContact OE2-CE1 3.64Å; E179-H330 PolarHBondContact OE2-CE1 3.49Å; E179-H330 IonicContact OE2-NE2 3.43Å; E179-H330 PolarHBondContact OE2-NE2 2.69Å
180	T	95.7	Very high	91.2	Very high	4 Å²	4	22.8 Å²	22.8	3%	0.025	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	135.6	177.7	-72.9	0	0	0	0	110.1	L304 M306 I329 H330	T180-L304 HydrophobicContact CG2-CB 3.71Å; T180-L304 HydrophobicContact CG2-CG 4.46Å; T180-L304 WeakPolarHBondContact CG2-O 3.46Å; T180-L304 PolarHBondContact OG1-N 3.26Å; T180-M306 HydrophobicContact CG2-CE 4.1Å; T180-I329 HydrophobicContact CG2-CB 4.37Å; T180-I329 HydrophobicContact CG2-CD1 4.01Å; T180-I329 HydrophobicContact CG2-CG1 3.78Å; T180-I329 HydrophobicContact CG2-CG2 4.1Å; T180-H330 PolarHBondContact O-N 3.1Å
181	V	96.7	Very high	91	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138.9	-173.7	-60.6	0	0	0	0	112.4	C174 L175 L304 V305 M306 H330	C174-V181 HydrophobicContact CB-CG1 3.42Å; C174-V181 VanDerWaalsContact CB-CG1 3.42Å; L175-V181 HydrophobicContact CD2-CG1 4.39Å; L175-V181 HydrophobicContact CD2-CG2 3.92Å; L175-V181 HydrophobicContact CG-CG1 4.44Å; L175-V181 HydrophobicContact CG-CG2 4.3Å; V181-L304 PolarHBondContact N-O 2.86Å; V181-V305 HydrophobicContact CG2-CB 4.28Å; V181-V305 HydrophobicContact CG2-CG1 3.93Å; V181-V305 HydrophobicContact CG2-CG2 4.19Å; V181-M306 PolarHBondContact O-N 2.94Å; V181-H330 WeakPolarHBondContact CA-O 3.39Å
182	F	96.7	Very high	90.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	108.5	168.9	-166.6	-60.7	0	0	0	109.1	V279 M306 V311 I317 I329 H330 V331 I332	F182-V279 HydrophobicContact CE2-CG1 4.2Å; F182-V279 HydrophobicContact CZ-CG1 4.28Å; F182-M306 HydrophobicContact CB-CB 4.4Å; F182-M306 HydrophobicContact CB-CE 3.94Å; F182-M306 HydrophobicContact CD2-CB 3.94Å; F182-M306 HydrophobicContact CD2-CE 3.7Å; F182-M306 HydrophobicContact CD2-CG 4.47Å; F182-M306 HydrophobicContact CD2-SD 3.68Å; F182-M306 HydrophobicContact CE2-CB 4.43Å; F182-M306 HydrophobicContact CE2-SD 4.16Å; F182-M306 HydrophobicContact CG-CB 4.16Å; F182-M306 HydrophobicContact CG-CE 4.26Å; F182-V311 HydrophobicContact CE1-CG2 4.29Å; F182-V311 HydrophobicContact CZ-CG2 4.35Å; F182-I317 HydrophobicContact CE2-CG2 4.13Å; F182-I329 HydrophobicContact CB-CG2 4.2Å; F182-H330 PolarHBondContact N-O 2.96Å; F182-V331 HydrophobicContact CB-CG2 4.45Å; F182-I332 PolarHBondContact O-N 3.49Å
183	V	96.2	Very high	90.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.9	179.5	-176	0	0	0	0	109.9	F167 A171 A185 V194 M306 L307 S308 I332	F167-V183 HydrophobicContact CD2-CG1 4.05Å; F167-V183 HydrophobicContact CE2-CG1 4.03Å; A171-V183 HydrophobicContact CB-CG2 4.07Å; V183-A185 HydrophobicContact CG1-CB 4.34Å; V183-V194 HydrophobicContact CG2-CG1 4.33Å; V183-V194 HydrophobicContact CG2-CG2 4.5Å; V183-M306 PolarHBondContact N-O 3.25Å; V183-L307 HydrophobicContact CB-CD2 3.92Å; V183-L307 HydrophobicContact CG2-CD2 4.11Å; V183-S308 PolarHBondContact O-N 3.02Å; V183-I332 WeakPolarHBondContact CA-O 3.32Å
184	S	94.1	Very high	90.7	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.021	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	103.8	174.7	-170.3	0	0	0	0	109.8	A309 T310 V311 I332 A333 T334	S184-A309 PolarHBondContact OG-O 3.44Å; S184-T310 VanDerWaalsContact OG-CA 3.27Å; S184-T310 WeakPolarHBondContact OG-CA 3.37Å; S184-V311 PolarHBondContact OG-N 3.24Å; S184-V311 VanDerWaalsContact OG-N 3.07Å; S184-I332 PolarHBondContact N-O 3.38Å; S184-A333 WeakPolarHBondContact O-CA 3.46Å; S184-T334 PolarHBondContact O-N 3.46Å
185	A	91.2	Very high	90.8	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.123	C	C	.	.			trans	-146.1	152.5	-174.8	0	0	0	0	0	112.3	F167 V183 S189 K191 S308 A309 T334	F167-A185 HydrophobicContact CE2-CB 4.12Å; F167-A185 HydrophobicContact CZ-CB 4.38Å; V183-A185 HydrophobicContact CG1-CB 4.34Å; A185-S189 VanDerWaalsContact CB-OG 3.25Å; A185-S189 WeakPolarHBondContact CB-OG 3.29Å; A185-K191 HydrophobicContact CB-CD 4.18Å; A185-K191 HydrophobicContact CB-CG 3.97Å; A185-K191 PolarHBondContact O-NZ 3.04Å; A185-S308 PolarHBondContact N-O 2.82Å; A185-S308 VanDerWaalsContact N-O 3.07Å; A185-S308 VanDerWaalsContact O-O 3.1Å; A185-A309 WeakPolarHBondContact O-CA 3.26Å; A185-T334 HydrophobicContact CB-CG2 3.46Å; A185-T334 VanDerWaalsContact CB-CG2 3.46Å
186	H	85.6	Confident	90.9	Very high	29 Å²	29	23.1 Å²	23.1	13%	0.134	13%	0.129	C	C	.	.			trans	-52.9	155.7	179.9	-73.1	-79.9	0	0	0	113.7	S189 K191 D335 R337	H186-S189 VanDerWaalsContact O-CB 3.25Å; H186-S189 WeakPolarHBondContact O-CB 2.94Å; H186-S189 PolarHBondContact O-N 3.28Å; H186-S189 PolarHBondContact O-OG 3.2Å; H186-K191 PolarHBondContact O-NZ 2.69Å; H186-D335 PolarHBondContact NE2-O 3.33Å; H186-R337 HydrophobicContact CB-CG 4.17Å
187	T	80.5	Confident	91	Very high	11 Å²	11	21.1 Å²	21.1	7%	0.067	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	142.6	167.9	49.4	0	0	0	0	109.5	S189 G552	T187-S189 PolarHBondContact O-N 3.48Å; T187-G552 WeakPolarHBondContact OG1-CA 3.41Å; T187-G552 PolarHBondContact OG1-O 2.9Å
188	S	77.7	Confident	91.2	Very high	38 Å²	38	16.1 Å²	16.1	27%	0.266	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	12.3	-173.1	-48	0	0	0	0	115.9	G190	S188-G190 VanDerWaalsContact C-N 3.26Å; S188-G190 PolarHBondContact O-N 2.99Å
189	S	82.7	Confident	91.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.072	C	C	.	.	S	Bend	trans	-75.6	-9.2	174.5	71.6	0	0	0	0	114.5	A185 H186 T187 R557	A185-S189 VanDerWaalsContact CB-OG 3.25Å; A185-S189 WeakPolarHBondContact CB-OG 3.29Å; H186-S189 VanDerWaalsContact O-CB 3.25Å; H186-S189 WeakPolarHBondContact O-CB 2.94Å; H186-S189 PolarHBondContact O-N 3.28Å; H186-S189 PolarHBondContact O-OG 3.2Å; T187-S189 PolarHBondContact O-N 3.48Å; S189-R557 PolarHBondContact O-NH1 2.94Å
190	G	84.6	Confident	91.4	Very high	23 Å²	23	9.8 Å²	9.8	24%	0.237	6%	0.062	C	C	.	.			trans	89.1	30.7	-177.2	0	0	0	0	0	114.7	Q168 S188 T192 V193	Q168-G190 PolarHBondContact NE2-O 3.02Å; S188-G190 VanDerWaalsContact C-N 3.26Å; S188-G190 PolarHBondContact O-N 2.99Å; G190-T192 PolarHBondContact O-N 3Å; G190-T192 VanDerWaalsContact O-N 3.17Å; G190-V193 WeakPolarHBondContact O-CB 2.88Å; G190-V193 WeakPolarHBondContact O-CG2 3.35Å; G190-V193 PolarHBondContact O-N 2.98Å; G190-V193 VanDerWaalsContact O-N 3.13Å
191	K	90	Very high	91.3	Very high	16 Å²	16	9.6 Å²	9.6	7%	0.07	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-32.6	172.8	-65.2	-172.8	-73.1	-84.2	0	113.6	A185 H186 V193 V194 L307 S308	A185-K191 HydrophobicContact CB-CD 4.18Å; A185-K191 HydrophobicContact CB-CG 3.97Å; A185-K191 PolarHBondContact O-NZ 3.04Å; H186-K191 PolarHBondContact O-NZ 2.69Å; K191-V193 PolarHBondContact O-N 2.89Å; K191-V194 WeakPolarHBondContact O-CB 3.34Å; K191-V194 PolarHBondContact O-N 3.43Å; K191-L307 HydrophobicContact CB-CD1 4.43Å; K191-L307 HydrophobicContact CB-CD2 4.49Å; K191-L307 HydrophobicContact CD-CB 4.45Å; K191-S308 VanDerWaalsContact CD-O 3.24Å; K191-S308 WeakPolarHBondContact CD-O 3.42Å
192	T	89.9	Confident	91.1	Very high	41 Å²	41	9.6 Å²	9.6	25%	0.252	6%	0.061	S	C	.	.	H	α-helix	trans	-58.4	-28.7	179.3	-52.2	0	0	0	0	113	G190 V194 A195 E196	G190-T192 PolarHBondContact O-N 3Å; G190-T192 VanDerWaalsContact O-N 3.17Å; T192-V194 PolarHBondContact O-N 3.07Å; T192-A195 WeakPolarHBondContact O-CB 3.19Å; T192-A195 PolarHBondContact O-N 3.47Å; T192-A195 VanDerWaalsContact O-N 3.11Å; T192-E196 HydrophobicContact CG2-CG 4.14Å; T192-E196 WeakPolarHBondContact O-CG 3.32Å; T192-E196 PolarHBondContact O-N 3.17Å
193	V	93.1	Very high	90.9	Very high	7 Å²	7	12.1 Å²	12.1	4%	0.042	7%	0.074	C	C	.	.	H	α-helix	trans	-55.6	-40.5	174.6	170.8	0	0	0	0	111.4	W160 F162 L164 Q168 I172 G190 K191 E196 Y197	W160-V193 HydrophobicContact CD2-CG1 4.42Å; W160-V193 HydrophobicContact CH2-CG1 3.61Å; W160-V193 HydrophobicContact CZ2-CB 4.11Å; W160-V193 HydrophobicContact CZ2-CG1 3.45Å; W160-V193 VanDerWaalsContact CZ2-CG1 3.45Å; W160-V193 HydrophobicContact CZ2-CG2 4.46Å; W160-V193 HydrophobicContact CZ3-CG1 4.18Å; F162-V193 HydrophobicContact CE2-CG2 4.39Å; F162-V193 HydrophobicContact CZ-CG2 4.23Å; L164-V193 HydrophobicContact CD1-CG1 4.09Å; L164-V193 HydrophobicContact CD2-CG1 3.65Å; L164-V193 HydrophobicContact CG-CG1 4.49Å; Q168-V193 HydrophobicContact CB-CG1 4.38Å; Q168-V193 HydrophobicContact CG-CG1 4.47Å; I172-V193 HydrophobicContact CD1-CG1 4.44Å; G190-V193 WeakPolarHBondContact O-CB 2.88Å; G190-V193 WeakPolarHBondContact O-CG2 3.35Å; G190-V193 PolarHBondContact O-N 2.98Å; G190-V193 VanDerWaalsContact O-N 3.13Å; K191-V193 PolarHBondContact O-N 2.89Å; V193-E196 PolarHBondContact O-N 2.99Å; V193-Y197 PolarHBondContact O-N 2.84Å
194	V	95	Very high	90.6	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-68.9	-40.5	179.5	-176.8	0	0	0	0	110.8	A171 L175 V183 K191 T192 Y197 A198 V305 L307	A171-V194 HydrophobicContact CB-CB 4.46Å; A171-V194 HydrophobicContact CB-CG1 3.8Å; A171-V194 HydrophobicContact CB-CG2 3.74Å; L175-V194 HydrophobicContact CD1-CG1 3.85Å; V183-V194 HydrophobicContact CG2-CG1 4.33Å; V183-V194 HydrophobicContact CG2-CG2 4.5Å; K191-V194 WeakPolarHBondContact O-CB 3.34Å; K191-V194 PolarHBondContact O-N 3.43Å; T192-V194 PolarHBondContact O-N 3.07Å; V194-Y197 PolarHBondContact O-N 3.12Å; V194-A198 WeakPolarHBondContact O-CB 3.5Å; V194-A198 PolarHBondContact O-N 3.44Å; V194-V305 HydrophobicContact CG1-CG1 3.99Å; V194-L307 HydrophobicContact CB-CD2 4.28Å; V194-L307 HydrophobicContact CG1-CD2 4.42Å
195	A	94.9	Very high	90.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.1	-46.2	174.7	0	0	0	0	0	112.1	T192 Y197 A198 C199 Y211 F226 I275 L307	T192-A195 WeakPolarHBondContact O-CB 3.19Å; T192-A195 PolarHBondContact O-N 3.47Å; T192-A195 VanDerWaalsContact O-N 3.11Å; A195-Y197 VanDerWaalsContact C-N 3.31Å; A195-Y197 PolarHBondContact O-N 3.41Å; A195-A198 PolarHBondContact O-N 2.89Å; A195-C199 PolarHBondContact O-N 3.25Å; A195-C199 PolarHBondContact O-SG 3.11Å; A195-C199 VanDerWaalsContact O-SG 3.33Å; A195-Y211 HydrophobicContact CB-CD2 4.27Å; A195-Y211 HydrophobicContact CB-CE2 3.87Å; A195-F226 HydrophobicContact CB-CZ 4.38Å; A195-I275 HydrophobicContact CB-CD1 4.06Å; A195-I275 HydrophobicContact CB-CG2 4.02Å; A195-L307 HydrophobicContact CB-CD1 3.95Å
196	E	94.9	Very high	90.3	Very high	26 Å²	26	24.8 Å²	24.8	12%	0.121	14%	0.142	C	C	.	.	H	α-helix	trans	-60.9	-41.3	178.1	-69.3	170.8	153.7	0	0	111.5	L158 W160 T192 V193 C199 A200 F226 R229 F230	L158-E196 HydrophobicContact CD2-CB 3.83Å; W160-E196 HydrophobicContact CZ2-CB 4.22Å; W160-E196 PolarHBondContact NE1-OE2 3.34Å; W160-E196 VanDerWaalsContact NE1-OE2 3.17Å; T192-E196 HydrophobicContact CG2-CG 4.14Å; T192-E196 WeakPolarHBondContact O-CG 3.32Å; T192-E196 PolarHBondContact O-N 3.17Å; V193-E196 PolarHBondContact O-N 2.99Å; E196-C199 WeakPolarHBondContact O-CB 3.39Å; E196-C199 PolarHBondContact O-N 3.19Å; E196-A200 PolarHBondContact O-N 3.33Å; E196-F226 HydrophobicContact CG-CE1 4.42Å; E196-F226 HydrophobicContact CG-CZ 4.35Å; E196-R229 VanDerWaalsContact CD-CZ 3.44Å; E196-R229 WeakPolarHBondContact OE1-CD 3.47Å; E196-R229 IonicContact OE1-CZ 3.5Å; E196-R229 IonicContact OE1-NE 3.74Å; E196-R229 IonicContact OE1-NH1 3.67Å; E196-R229 PolarHBondContact OE1-NH1 3.11Å; E196-R229 IonicContact OE2-CZ 3.24Å; E196-R229 IonicContact OE2-NE 2.72Å; E196-R229 IonicContact OE2-NH1 3.56Å; E196-R229 PolarHBondContact OE2-NH1 2.94Å; E196-R229 IonicContact OE2-NH2 3.81Å; E196-F230 HydrophobicContact CB-CZ 4.39Å; E196-F230 WeakPolarHBondContact O-CZ 3.28Å
197	Y	95.4	Very high	90.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.6	-45.4	176.2	-159.4	-92.2	0	0	0	111.9	L149 P156 A157 L158 W160 I172 E176 V193 V194 A195 C199 A200 I201	L149-Y197 HydrophobicContact CD2-CE2 4.42Å; P156-Y197 WeakPolarHBondContact CA-OH 3.45Å; P156-Y197 HydrophobicContact CB-CE2 4.26Å; A157-Y197 HydrophobicContact CB-CE1 4.37Å; A157-Y197 HydrophobicContact CB-CE2 4.14Å; A157-Y197 PolarHBondContact N-OH 3.38Å; A157-Y197 VanDerWaalsContact N-OH 3.07Å; L158-Y197 HydrophobicContact CB-CD2 4.14Å; W160-Y197 AromaticContact CH2-CD2 3.79Å; W160-Y197 HydrophobicContact CH2-CD2 3.79Å; W160-Y197 HydrophobicContact CH2-CG 4.43Å; W160-Y197 HydrophobicContact CZ3-CD2 4.01Å; I172-Y197 HydrophobicContact CB-CD1 4.22Å; I172-Y197 HydrophobicContact CB-CE1 4.38Å; I172-Y197 HydrophobicContact CB-CG 4.43Å; I172-Y197 HydrophobicContact CD1-CD2 3.9Å; I172-Y197 HydrophobicContact CD1-CE2 4.45Å; I172-Y197 HydrophobicContact CD1-CG 3.98Å; I172-Y197 HydrophobicContact CG1-CD1 3.91Å; I172-Y197 HydrophobicContact CG1-CD2 4.1Å; I172-Y197 HydrophobicContact CG1-CE1 4.5Å; I172-Y197 HydrophobicContact CG1-CG 3.7Å; I172-Y197 HydrophobicContact CG2-CD1 3.68Å; I172-Y197 HydrophobicContact CG2-CD2 4.11Å; I172-Y197 HydrophobicContact CG2-CE1 3.38Å; I172-Y197 HydrophobicContact CG2-CE2 3.82Å; I172-Y197 HydrophobicContact CG2-CG 4.04Å; I172-Y197 VanDerWaalsContact CG2-CZ 3.45Å; E176-Y197 HydrophobicContact CG-CE1 4.08Å; E176-Y197 WeakPolarHBondContact OE1-CE1 3.4Å; E176-Y197 PolarHBondContact OE1-OH 3.45Å; V193-Y197 PolarHBondContact O-N 2.84Å; V194-Y197 PolarHBondContact O-N 3.12Å; A195-Y197 VanDerWaalsContact C-N 3.31Å; A195-Y197 PolarHBondContact O-N 3.41Å; Y197-C199 VanDerWaalsContact C-N 3.27Å; Y197-C199 PolarHBondContact O-N 2.96Å; Y197-A200 PolarHBondContact O-N 3.45Å; Y197-A200 VanDerWaalsContact O-N 3.1Å; Y197-I201 HydrophobicContact CD1-CD1 3.6Å; Y197-I201 HydrophobicContact CD1-CG1 3.81Å; Y197-I201 HydrophobicContact CE1-CD1 3.54Å; Y197-I201 HydrophobicContact CE1-CG1 3.63Å; Y197-I201 WeakPolarHBondContact O-CG1 3.08Å; Y197-I201 PolarHBondContact O-N 3.39Å
198	A	95.7	Very high	91.1	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-57.9	-41.7	176.6	0	0	0	0	0	111.7	L175 V194 A195 I201 C202 I273 I275 V305	L175-A198 HydrophobicContact CD1-CB 4.07Å; V194-A198 WeakPolarHBondContact O-CB 3.5Å; V194-A198 PolarHBondContact O-N 3.44Å; A195-A198 PolarHBondContact O-N 2.89Å; A198-I201 PolarHBondContact O-N 2.79Å; A198-C202 PolarHBondContact O-N 3.01Å; A198-I273 HydrophobicContact CB-CD1 4.41Å; A198-I273 HydrophobicContact CB-CG2 4.37Å; A198-I275 HydrophobicContact CB-CD1 4.08Å; A198-I275 HydrophobicContact CB-CG1 4.36Å; A198-V305 HydrophobicContact CB-CG2 4.06Å
199	C	95	Very high	92	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61.9	-45.5	173.3	-71.6	0	0	0	0	112.6	A195 E196 Y197 I201 C202 L203 V209 F226 F230 L249 I275	A195-C199 PolarHBondContact O-N 3.25Å; A195-C199 PolarHBondContact O-SG 3.11Å; A195-C199 VanDerWaalsContact O-SG 3.33Å; E196-C199 WeakPolarHBondContact O-CB 3.39Å; E196-C199 PolarHBondContact O-N 3.19Å; Y197-C199 VanDerWaalsContact C-N 3.27Å; Y197-C199 PolarHBondContact O-N 2.96Å; C199-I201 VanDerWaalsContact C-N 3.34Å; C199-I201 PolarHBondContact O-N 2.75Å; C199-C202 PolarHBondContact O-N 3.06Å; C199-L203 WeakPolarHBondContact O-CG 3.38Å; C199-L203 PolarHBondContact O-N 3.28Å; C199-V209 HydrophobicContact CB-CG1 4.41Å; C199-F226 HydrophobicContact CB-CE1 4.31Å; C199-F230 HydrophobicContact CB-CE2 4.22Å; C199-F230 HydrophobicContact CB-CZ 4.03Å; C199-L249 HydrophobicContact CB-CD1 3.56Å; C199-L249 WeakPolarHBondContact SG-CD1 3.39Å; C199-I275 VanDerWaalsContact SG-CD1 3.52Å
200	A	94.2	Very high	92.6	Very high	8 Å²	8	24.2 Å²	24.2	7%	0.066	14%	0.135	C	C	.	.	H	α-helix	trans	-63.1	-37	178.4	0	0	0	0	0	112.7	A157 L158 E196 Y197 L203 R204 F230	A157-A200 HydrophobicContact CB-CB 3.77Å; L158-A200 HydrophobicContact CB-CB 3.95Å; L158-A200 HydrophobicContact CD2-CB 4.36Å; E196-A200 PolarHBondContact O-N 3.33Å; Y197-A200 PolarHBondContact O-N 3.45Å; Y197-A200 VanDerWaalsContact O-N 3.1Å; A200-L203 PolarHBondContact O-N 3.44Å; A200-R204 WeakPolarHBondContact O-CB 3.3Å; A200-R204 PolarHBondContact O-N 3.01Å; A200-F230 HydrophobicContact CB-CE1 4.18Å
201	I	93.2	Very high	93.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-49.8	174.3	-67.5	173.4	0	0	0	110.6	A157 L175 Y197 A198 C199 R204 R205	A157-I201 HydrophobicContact CB-CG1 4.16Å; L175-I201 HydrophobicContact CB-CD1 3.78Å; Y197-I201 HydrophobicContact CD1-CD1 3.6Å; Y197-I201 HydrophobicContact CD1-CG1 3.81Å; Y197-I201 HydrophobicContact CE1-CD1 3.54Å; Y197-I201 HydrophobicContact CE1-CG1 3.63Å; Y197-I201 WeakPolarHBondContact O-CG1 3.08Å; Y197-I201 PolarHBondContact O-N 3.39Å; A198-I201 PolarHBondContact O-N 2.79Å; C199-I201 VanDerWaalsContact C-N 3.34Å; C199-I201 PolarHBondContact O-N 2.75Å; I201-R204 WeakPolarHBondContact O-CB 3.31Å; I201-R204 PolarHBondContact O-N 2.65Å; I201-R205 WeakPolarHBondContact O-CG 3.44Å; I201-R205 PolarHBondContact O-N 2.67Å
202	C	92.5	Very high	93.5	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-63.6	-43.6	-179.6	-73.4	0	0	0	0	112	A198 C199 R204 R205 G206 S207 V209 I273	A198-C202 PolarHBondContact O-N 3.01Å; C199-C202 PolarHBondContact O-N 3.06Å; C202-R204 VanDerWaalsContact C-N 3.3Å; C202-R204 PolarHBondContact O-N 3.43Å; C202-R205 CarbonylContact O-C 3.53Å; C202-R205 PolarHBondContact O-N 3Å; C202-R205 VanDerWaalsContact O-N 3.08Å; C202-G206 PolarHBondContact O-N 2.72Å; C202-S207 WeakPolarHBondContact CA-OG 3.44Å; C202-S207 WeakPolarHBondContact CB-OG 3.43Å; C202-S207 PolarHBondContact O-N 2.86Å; C202-S207 PolarHBondContact O-OG 3.35Å; C202-V209 HydrophobicContact CB-CB 3.86Å; C202-V209 HydrophobicContact CB-CG1 4.11Å; C202-I273 WeakPolarHBondContact SG-CD1 3.47Å; C202-I273 WeakPolarHBondContact SG-CG1 3.5Å
203	L	91.9	Very high	93.5	Very high	52 Å²	52	20.5 Å²	20.5	27%	0.272	11%	0.109	S	C	.	.	H	α-helix	trans	-59.9	-40.9	176	-70.1	173.6	0	0	0	111.7	C199 A200 R205 G206 F230	C199-L203 WeakPolarHBondContact O-CG 3.38Å; C199-L203 PolarHBondContact O-N 3.28Å; A200-L203 PolarHBondContact O-N 3.44Å; L203-R205 VanDerWaalsContact C-N 3.32Å; L203-R205 PolarHBondContact O-N 3.37Å; L203-G206 PolarHBondContact O-N 3.33Å; L203-F230 HydrophobicContact CD1-CB 4.31Å; L203-F230 HydrophobicContact CD1-CD1 3.5Å; L203-F230 HydrophobicContact CD1-CE1 4.03Å; L203-F230 HydrophobicContact CD1-CG 4.05Å
204	R	90.3	Very high	93.2	Very high	111 Å²	111	20.2 Å²	20.2	42%	0.419	11%	0.107	S	C	.	.	H	α-helix	trans	-64.4	-34.1	174.8	-178.7	178.1	64.3	-179.1	-1.1	112.7	N155 E176 A200 I201 C202	N155-R204 PolarHBondContact O-NH1 2.64Å; E176-R204 IonicContact OE1-CZ 3.46Å; E176-R204 IonicContact OE1-NH1 2.85Å; E176-R204 IonicContact OE1-NH2 3.23Å; E176-R204 PolarHBondContact OE1-NH2 3.16Å; E176-R204 IonicContact OE2-NH2 3.74Å; E176-R204 PolarHBondContact OE2-NH2 3.49Å; A200-R204 WeakPolarHBondContact O-CB 3.3Å; A200-R204 PolarHBondContact O-N 3.01Å; I201-R204 WeakPolarHBondContact O-CB 3.31Å; I201-R204 PolarHBondContact O-N 2.65Å; C202-R204 VanDerWaalsContact C-N 3.3Å; C202-R204 PolarHBondContact O-N 3.43Å
205	R	90	Very high	92.6	Very high	92 Å²	92	22.5 Å²	22.5	35%	0.347	12%	0.121	S	C	.	.	H	α-helix	trans	-85.3	-11.2	179.7	-69.5	175.1	-178.8	169.1	1.5	113.6	N178 I201 C202 L203 S207 E272	N178-R205 PolarHBondContact OD1-NH1 3.42Å; N178-R205 PolarHBondContact OD1-NH2 3.31Å; I201-R205 WeakPolarHBondContact O-CG 3.44Å; I201-R205 PolarHBondContact O-N 2.67Å; C202-R205 CarbonylContact O-C 3.53Å; C202-R205 PolarHBondContact O-N 3Å; C202-R205 VanDerWaalsContact O-N 3.08Å; L203-R205 VanDerWaalsContact C-N 3.32Å; L203-R205 PolarHBondContact O-N 3.37Å; R205-S207 VanDerWaalsContact C-N 3.29Å; R205-E272 IonicContact CZ-OE1 3.93Å; R205-E272 IonicContact NH1-OE1 3.75Å; R205-E272 PolarHBondContact NH1-OE1 3.48Å
206	G	88.2	Confident	92.1	Very high	67 Å²	67	26.1 Å²	26.1	69%	0.691	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.5	20.3	-173.6	0	0	0	0	0	113.8	C202 L203	C202-G206 PolarHBondContact O-N 2.72Å; L203-G206 PolarHBondContact O-N 3.33Å
207	S	90.6	Very high	91.3	Very high	20 Å²	20	26.3 Å²	26.3	14%	0.14	14%	0.143	C	C	.	.			trans	-98.6	170.3	178.5	63.7	0	0	0	0	112	C202 R205 E272	C202-S207 WeakPolarHBondContact CA-OG 3.44Å; C202-S207 WeakPolarHBondContact CB-OG 3.43Å; C202-S207 PolarHBondContact O-N 2.86Å; C202-S207 PolarHBondContact O-OG 3.35Å; R205-S207 VanDerWaalsContact C-N 3.29Å; S207-E272 WeakPolarHBondContact CB-OE2 3.42Å; S207-E272 PolarHBondContact OG-OE2 2.94Å
208	R	93.7	Very high	90.8	Very high	44 Å²	44	26.7 Å²	26.7	17%	0.166	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	144.4	177	-62.9	-171.1	171.3	-174.2	-6.8	111.7	E246 S248 N270 L271 E272	R208-E246 IonicContact NH2-OE2 3.62Å; R208-E246 PolarHBondContact NH2-OE2 3.49Å; R208-S248 CarbonylContact C-O 3.56Å; R208-S248 VanDerWaalsContact CA-O 3.28Å; R208-S248 WeakPolarHBondContact CA-O 3.21Å; R208-N270 WeakPolarHBondContact CB-O 3.47Å; R208-N270 HydrophobicContact CG-CB 4.41Å; R208-N270 PolarHBondContact N-O 3.5Å; R208-L271 WeakPolarHBondContact O-CD1 3.47Å; R208-E272 PolarHBondContact O-N 3.23Å
209	V	96	Very high	90.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.1	173.9	59.9	0	0	0	0	109.8	C199 C202 S248 L249 L250 I273 I275	C199-V209 HydrophobicContact CB-CG1 4.41Å; C202-V209 HydrophobicContact CB-CB 3.86Å; C202-V209 HydrophobicContact CB-CG1 4.11Å; V209-S248 PolarHBondContact N-O 3.12Å; V209-L249 HydrophobicContact CG1-CB 3.96Å; V209-L249 HydrophobicContact CG1-CD1 4.22Å; V209-L249 HydrophobicContact CG1-CG 3.86Å; V209-L250 PolarHBondContact O-N 3.47Å; V209-I273 WeakPolarHBondContact CA-O 3.07Å; V209-I273 HydrophobicContact CG2-CB 4.09Å; V209-I273 HydrophobicContact CG2-CG2 4.32Å; V209-I275 HydrophobicContact CG2-CD1 3.98Å; V209-I275 HydrophobicContact CG2-CG1 4.33Å
210	V	96.4	Very high	90.1	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.7	175.2	168.4	0	0	0	0	109.5	T212 L250 M252 L271 I273 V274 I275	V210-T212 HydrophobicContact CG1-CG2 3.81Å; V210-L250 CarbonylContact C-O 3.54Å; V210-L250 WeakPolarHBondContact CA-O 3.41Å; V210-L250 HydrophobicContact CG2-CB 4.26Å; V210-M252 HydrophobicContact CB-CE 4.37Å; V210-M252 HydrophobicContact CG1-CE 3.67Å; V210-M252 HydrophobicContact CG1-CG 3.75Å; V210-M252 HydrophobicContact CG1-SD 3.59Å; V210-M252 VanDerWaalsContact CG1-SD 3.59Å; V210-M252 HydrophobicContact CG2-CE 3.75Å; V210-L271 HydrophobicContact CB-CD1 3.96Å; V210-L271 HydrophobicContact CB-CD2 4.45Å; V210-L271 HydrophobicContact CG2-CD1 3.55Å; V210-L271 HydrophobicContact CG2-CD2 3.97Å; V210-L271 HydrophobicContact CG2-CG 4.44Å; V210-I273 PolarHBondContact N-O 3.23Å; V210-V274 HydrophobicContact CB-CG2 4.39Å; V210-V274 WeakPolarHBondContact O-CA 3.21Å; V210-I275 PolarHBondContact O-N 2.88Å
211	Y	96.6	Very high	89.6	Confident	1 Å²	1	27.2 Å²	27.2	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120	168.5	-174.7	-76.9	0	0	0	109.5	A195 K222 F226 L250 I251 M252 I275 D277	A195-Y211 HydrophobicContact CB-CD2 4.27Å; A195-Y211 HydrophobicContact CB-CE2 3.87Å; Y211-K222 HydrophobicContact CE1-CB 4.23Å; Y211-K222 HydrophobicContact CE1-CD 4.25Å; Y211-K222 HydrophobicContact CE1-CG 3.88Å; Y211-K222 WeakPolarHBondContact OH-CD 3.28Å; Y211-K222 WeakPolarHBondContact OH-CE 3.28Å; Y211-F226 HydrophobicContact CD2-CE2 4.35Å; Y211-F226 AromaticContact CD2-CZ 3.98Å; Y211-F226 HydrophobicContact CD2-CZ 3.98Å; Y211-F226 HydrophobicContact CE2-CE2 4.17Å; Y211-F226 HydrophobicContact CE2-CZ 4Å; Y211-L250 PolarHBondContact N-O 2.82Å; Y211-I251 HydrophobicContact CD1-CG1 4.49Å; Y211-I251 HydrophobicContact CD1-CG2 4.4Å; Y211-I251 HydrophobicContact CG-CG1 4.47Å; Y211-I251 WeakPolarHBondContact O-CA 3.12Å; Y211-M252 PolarHBondContact O-N 3.41Å; Y211-I275 HydrophobicContact CD2-CB 3.99Å; Y211-I275 HydrophobicContact CD2-CD1 4.02Å; Y211-I275 HydrophobicContact CD2-CG2 3.74Å; Y211-I275 HydrophobicContact CE2-CG2 3.93Å; Y211-D277 HydrophobicContact CE1-CB 4.08Å; Y211-D277 PolarHBondContact OH-OD2 3.24Å
212	T	95.4	Very high	89.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	139.7	176.1	65.5	0	0	0	0	110.9	V210 M252 L257 V274 I275 L276 D277	V210-T212 HydrophobicContact CG1-CG2 3.81Å; T212-M252 WeakPolarHBondContact CA-O 3.47Å; T212-M252 HydrophobicContact CG2-CG 4.2Å; T212-L257 HydrophobicContact CG2-CB 4.2Å; T212-L257 HydrophobicContact CG2-CD2 3.57Å; T212-L257 HydrophobicContact CG2-CG 4.5Å; T212-V274 HydrophobicContact CG2-CG1 4.44Å; T212-I275 PolarHBondContact N-O 2.75Å; T212-I275 PolarHBondContact OG1-O 2.76Å; T212-L276 HydrophobicContact CG2-CD2 4.33Å; T212-L276 WeakPolarHBondContact OG1-CA 3.41Å; T212-L276 WeakPolarHBondContact OG1-CD2 3.37Å; T212-D277 WeakPolarHBondContact O-CB 3.44Å; T212-D277 PolarHBondContact O-N 3.05Å
213	S	91.6	Very high	89.3	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	149.8	171.2	101	0	0	0	0	110.8	V215 S219 M252 T253 T254	S213-V215 VanDerWaalsContact C-N 3.27Å; S213-V215 PolarHBondContact O-N 3.46Å; S213-V215 PolarHBondContact OG-N 3.2Å; S213-V215 PolarHBondContact OG-O 3.32Å; S213-S219 PolarHBondContact OG-N 3.45Å; S213-S219 PolarHBondContact OG-OG 2.77Å; S213-M252 PolarHBondContact N-O 3.05Å; S213-M252 VanDerWaalsContact N-O 3.08Å; S213-T253 WeakPolarHBondContact O-CA 3.4Å; S213-T254 PolarHBondContact O-N 3.31Å
214	P	85.7	Confident	89.1	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.006	15%	0.146	C	C	.	.	S	Bend	trans	-71.1	-18.3	179.4	26.5	-35.3	0	0	0	113.3	E278 Y281 R287 W291	P214-E278 HydrophobicContact CG-CB 4.01Å; P214-E278 HydrophobicContact CG-CG 4.38Å; P214-Y281 HydrophobicContact CB-CD1 4.08Å; P214-Y281 HydrophobicContact CB-CD2 4.32Å; P214-Y281 HydrophobicContact CB-CE1 4.31Å; P214-Y281 HydrophobicContact CB-CG 4.07Å; P214-Y281 HydrophobicContact CG-CD2 4.07Å; P214-Y281 HydrophobicContact CG-CE2 4.05Å; P214-Y281 HydrophobicContact CG-CG 4.32Å; P214-R287 PolarHBondContact O-NH1 3.4Å; P214-R287 PolarHBondContact O-NH2 2.81Å; P214-W291 HydrophobicContact CB-CZ2 4.06Å
215	V	83.1	Confident	88.9	Confident	48 Å²	48	24.1 Å²	24.1	29%	0.291	14%	0.135	S	C	.	.	S	Bend	trans	-133.8	133.3	-169.8	-175.4	0	0	0	0	110.7	S213 A217 L218 S219	S213-V215 VanDerWaalsContact C-N 3.27Å; S213-V215 PolarHBondContact O-N 3.46Å; S213-V215 PolarHBondContact OG-N 3.2Å; S213-V215 PolarHBondContact OG-O 3.32Å; V215-A217 VanDerWaalsContact C-N 3.26Å; V215-A217 HydrophobicContact CG1-CB 4.15Å; V215-A217 PolarHBondContact O-N 2.91Å; V215-L218 HydrophobicContact CB-CB 4.4Å; V215-L218 WeakPolarHBondContact O-CA 3.17Å; V215-L218 WeakPolarHBondContact O-CB 3.22Å; V215-L218 PolarHBondContact O-N 3.37Å; V215-S219 PolarHBondContact O-N 3.34Å
216	K	83.1	Confident	89	Confident	76 Å²	76	19.9 Å²	19.9	33%	0.33	12%	0.119	S	C	.	.	H	α-helix	trans	-52.7	-41.6	178.6	-64.8	-171.4	-178.3	-167.6	0	113	L218 S219 N220 D240 T253 E1264	K216-L218 VanDerWaalsContact C-N 3.32Å; K216-L218 PolarHBondContact O-N 2.9Å; K216-S219 WeakPolarHBondContact O-CB 3Å; K216-S219 PolarHBondContact O-N 3.15Å; K216-N220 VanDerWaalsContact O-CG 3.3Å; K216-N220 PolarHBondContact O-N 2.87Å; K216-N220 PolarHBondContact O-OD1 3.09Å; K216-D240 IonicContact NZ-OD1 3.78Å; K216-D240 PolarHBondContact NZ-OD1 3.19Å; K216-T253 HydrophobicContact CG-CG2 3.99Å; K216-E1264 IonicContact NZ-OE2 3.89Å
217	A	78.8	Confident	89.1	Confident	30 Å²	30	19.2 Å²	19.2	25%	0.248	10%	0.095	C	C	.	.	H	α-helix	trans	-59	-41.7	176.6	0	0	0	0	0	112.4	V215 N220 Q221	V215-A217 VanDerWaalsContact C-N 3.26Å; V215-A217 HydrophobicContact CG1-CB 4.15Å; V215-A217 PolarHBondContact O-N 2.91Å; A217-N220 PolarHBondContact O-N 2.94Å; A217-Q221 WeakPolarHBondContact O-CB 3.5Å; A217-Q221 PolarHBondContact O-N 2.79Å
218	L	84.9	Confident	89	Confident	8 Å²	8	23.2 Å²	23.2	4%	0.042	11%	0.112	C	C	.	.	H	α-helix	trans	-68.1	-41.8	175	-179.5	55.7	0	0	0	111.2	V215 K216 N220 Q221 K222 G518	V215-L218 HydrophobicContact CB-CB 4.4Å; V215-L218 WeakPolarHBondContact O-CA 3.17Å; V215-L218 WeakPolarHBondContact O-CB 3.22Å; V215-L218 PolarHBondContact O-N 3.37Å; K216-L218 VanDerWaalsContact C-N 3.32Å; K216-L218 PolarHBondContact O-N 2.9Å; L218-N220 VanDerWaalsContact C-N 3.31Å; L218-N220 PolarHBondContact O-N 2.95Å; L218-Q221 PolarHBondContact O-N 3.36Å; L218-K222 HydrophobicContact CD1-CD 4.34Å; L218-K222 HydrophobicContact CD1-CG 3.7Å; L218-K222 HydrophobicContact CG-CG 4.13Å; L218-K222 VanDerWaalsContact O-CB 3.29Å; L218-K222 WeakPolarHBondContact O-CB 3.47Å; L218-K222 WeakPolarHBondContact O-CG 3.22Å; L218-K222 PolarHBondContact O-N 3.47Å; L218-G518 VanDerWaalsContact CB-O 3.31Å; L218-G518 WeakPolarHBondContact CB-O 3.4Å; L218-G518 VanDerWaalsContact CD1-O 3.26Å; L218-G518 WeakPolarHBondContact CD1-O 3.48Å
219	S	89.2	Confident	88.7	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.5	-42.6	174.1	-67.4	0	0	0	0	111.8	S213 V215 K216 K222 F223 I251 M252	S213-S219 PolarHBondContact OG-N 3.45Å; S213-S219 PolarHBondContact OG-OG 2.77Å; V215-S219 PolarHBondContact O-N 3.34Å; K216-S219 WeakPolarHBondContact O-CB 3Å; K216-S219 PolarHBondContact O-N 3.15Å; S219-K222 PolarHBondContact O-N 2.82Å; S219-F223 VanDerWaalsContact O-CB 3.26Å; S219-F223 WeakPolarHBondContact O-CB 3.26Å; S219-F223 PolarHBondContact O-N 3.28Å; S219-I251 WeakPolarHBondContact O-CG2 3.47Å; S219-M252 PolarHBondContact OG-O 2.56Å
220	N	86.4	Confident	88.5	Confident	11 Å²	11	27.3 Å²	27.3	6%	0.059	13%	0.128	C	C	.	.	H	α-helix	trans	-66.4	-43.1	177.3	-67.8	-6.3	0	0	0	111.8	K216 A217 L218 F223 H224 S1301 Y1303	K216-N220 VanDerWaalsContact O-CG 3.3Å; K216-N220 PolarHBondContact O-N 2.87Å; K216-N220 PolarHBondContact O-OD1 3.09Å; A217-N220 PolarHBondContact O-N 2.94Å; L218-N220 VanDerWaalsContact C-N 3.31Å; L218-N220 PolarHBondContact O-N 2.95Å; N220-F223 WeakPolarHBondContact O-CB 3.48Å; N220-F223 PolarHBondContact O-N 2.61Å; N220-H224 PolarHBondContact O-N 3.18Å; N220-H224 VanDerWaalsContact O-N 3.11Å; N220-S1301 PolarHBondContact ND2-OG 3.15Å; N220-Y1303 HydrophobicContact CB-CD2 4.33Å; N220-Y1303 HydrophobicContact CB-CG 4.49Å
221	Q	84.2	Confident	88.1	Confident	8 Å²	8	28.7 Å²	28.7	4%	0.037	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-46.2	176.2	-170.9	-163.3	-39	0	0	111.4	A217 L218 F223 H224 E225 Y1303	A217-Q221 WeakPolarHBondContact O-CB 3.5Å; A217-Q221 PolarHBondContact O-N 2.79Å; L218-Q221 PolarHBondContact O-N 3.36Å; Q221-F223 VanDerWaalsContact C-N 3.33Å; Q221-F223 PolarHBondContact O-N 3.09Å; Q221-H224 WeakPolarHBondContact O-CB 3.2Å; Q221-H224 PolarHBondContact O-N 3.15Å; Q221-E225 PolarHBondContact NE2-OE1 3.44Å; Q221-E225 WeakPolarHBondContact O-CG 3.38Å; Q221-E225 PolarHBondContact O-N 3.33Å; Q221-Y1303 HydrophobicContact CB-CD1 4.45Å; Q221-Y1303 HydrophobicContact CB-CE1 4.27Å; Q221-Y1303 HydrophobicContact CG-CD1 4.49Å; Q221-Y1303 HydrophobicContact CG-CE1 4.03Å
222	K	89.1	Confident	87.5	Confident	12 Å²	12	35.1 Å²	35.1	5%	0.052	17%	0.173	C	C	.	.	H	α-helix	trans	-64.4	-39.2	177.3	-69.9	-73.4	165	-156.6	0	110.9	Y211 L218 S219 H224 E225 F226 I251	Y211-K222 HydrophobicContact CE1-CB 4.23Å; Y211-K222 HydrophobicContact CE1-CD 4.25Å; Y211-K222 HydrophobicContact CE1-CG 3.88Å; Y211-K222 WeakPolarHBondContact OH-CD 3.28Å; Y211-K222 WeakPolarHBondContact OH-CE 3.28Å; L218-K222 HydrophobicContact CD1-CD 4.34Å; L218-K222 HydrophobicContact CD1-CG 3.7Å; L218-K222 HydrophobicContact CG-CG 4.13Å; L218-K222 VanDerWaalsContact O-CB 3.29Å; L218-K222 WeakPolarHBondContact O-CB 3.47Å; L218-K222 WeakPolarHBondContact O-CG 3.22Å; L218-K222 PolarHBondContact O-N 3.47Å; S219-K222 PolarHBondContact O-N 2.82Å; K222-H224 VanDerWaalsContact C-N 3.27Å; K222-H224 PolarHBondContact O-N 3.39Å; K222-E225 WeakPolarHBondContact CE-OE2 3.27Å; K222-E225 IonicContact NZ-OE2 3.09Å; K222-E225 PolarHBondContact NZ-OE2 2.76Å; K222-E225 PolarHBondContact O-N 2.82Å; K222-F226 HydrophobicContact CB-CD2 4.26Å; K222-F226 HydrophobicContact CB-CE2 4.43Å; K222-F226 HydrophobicContact CD-CD2 4.35Å; K222-F226 HydrophobicContact CD-CE2 3.9Å; K222-F226 WeakPolarHBondContact O-CB 3.11Å; K222-F226 WeakPolarHBondContact O-CD2 3.39Å; K222-F226 PolarHBondContact O-N 2.69Å; K222-I251 HydrophobicContact CB-CD1 4.43Å
223	F	90.9	Very high	87.2	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.018	19%	0.19	C	C	.	.	H	α-helix	trans	-56	-45.8	173.4	173	-102.6	0	0	0	111.9	S219 N220 Q221 R227 V234 L236 L243 I251	S219-F223 VanDerWaalsContact O-CB 3.26Å; S219-F223 WeakPolarHBondContact O-CB 3.26Å; S219-F223 PolarHBondContact O-N 3.28Å; N220-F223 WeakPolarHBondContact O-CB 3.48Å; N220-F223 PolarHBondContact O-N 2.61Å; Q221-F223 VanDerWaalsContact C-N 3.33Å; Q221-F223 PolarHBondContact O-N 3.09Å; F223-R227 WeakPolarHBondContact O-CB 3.48Å; F223-R227 PolarHBondContact O-N 2.91Å; F223-V234 HydrophobicContact CD2-CG1 3.74Å; F223-V234 HydrophobicContact CE2-CG1 4Å; F223-V234 WeakPolarHBondContact CE2-O 3.35Å; F223-L236 HydrophobicContact CB-CB 4.45Å; F223-L236 HydrophobicContact CB-CD1 4.19Å; F223-L236 HydrophobicContact CB-CD2 4.35Å; F223-L236 HydrophobicContact CD1-CD2 4.3Å; F223-L236 HydrophobicContact CD2-CB 3.58Å; F223-L236 HydrophobicContact CE2-CB 3.85Å; F223-L236 HydrophobicContact CG-CB 3.97Å; F223-L236 HydrophobicContact CG-CD2 4.18Å; F223-L236 HydrophobicContact CG-CG 4.47Å; F223-L236 HydrophobicContact CZ-CB 4.47Å; F223-L243 HydrophobicContact CE1-CD1 4.43Å; F223-L243 HydrophobicContact CZ-CD1 4.28Å; F223-I251 VanDerWaalsContact CA-CD1 3.43Å; F223-I251 HydrophobicContact CB-CD1 4.15Å
224	H	86.3	Confident	87.3	Confident	46 Å²	46	38.4 Å²	38.4	21%	0.213	19%	0.191	C	C	.	.	H	α-helix	trans	-61.7	-50.4	175.6	-172.6	83.5	0	0	0	112.2	N220 Q221 K222 F226 R227 E228 Y1303	N220-H224 PolarHBondContact O-N 3.18Å; N220-H224 VanDerWaalsContact O-N 3.11Å; Q221-H224 WeakPolarHBondContact O-CB 3.2Å; Q221-H224 PolarHBondContact O-N 3.15Å; K222-H224 VanDerWaalsContact C-N 3.27Å; K222-H224 PolarHBondContact O-N 3.39Å; H224-F226 PolarHBondContact O-N 2.9Å; H224-R227 PolarHBondContact O-N 3.43Å; H224-E228 IonicContact CE1-OE1 3.72Å; H224-E228 IonicContact NE2-OE1 3.89Å; H224-E228 PolarHBondContact NE2-OE1 3.03Å; H224-E228 WeakPolarHBondContact O-CG 3.24Å; H224-E228 PolarHBondContact O-N 2.69Å; H224-Y1303 PolarHBondContact ND1-O 3.23Å
225	E	87.7	Confident	87.6	Confident	36 Å²	36	38.4 Å²	38.4	17%	0.168	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-44.5	179.4	-70.3	174.4	-179.5	0	0	112.7	Q221 K222 E228 R229	Q221-E225 PolarHBondContact NE2-OE1 3.44Å; Q221-E225 WeakPolarHBondContact O-CG 3.38Å; Q221-E225 PolarHBondContact O-N 3.33Å; K222-E225 WeakPolarHBondContact CE-OE2 3.27Å; K222-E225 IonicContact NZ-OE2 3.09Å; K222-E225 PolarHBondContact NZ-OE2 2.76Å; K222-E225 PolarHBondContact O-N 2.82Å; E225-E228 PolarHBondContact O-N 3.32Å; E225-R229 WeakPolarHBondContact O-CB 3.14Å; E225-R229 PolarHBondContact O-N 2.8Å
226	F	91.3	Very high	88.1	Confident	3 Å²	3	36.1 Å²	36.1	1%	0.013	18%	0.177	C	C	.	.	H	α-helix	trans	-73.3	-33.5	-179.5	-82.3	-102.4	0	0	0	112	A195 E196 C199 Y211 K222 H224 R229 F230 V234 L249 I251	A195-F226 HydrophobicContact CB-CZ 4.38Å; E196-F226 HydrophobicContact CG-CE1 4.42Å; E196-F226 HydrophobicContact CG-CZ 4.35Å; C199-F226 HydrophobicContact CB-CE1 4.31Å; Y211-F226 HydrophobicContact CD2-CE2 4.35Å; Y211-F226 AromaticContact CD2-CZ 3.98Å; Y211-F226 HydrophobicContact CD2-CZ 3.98Å; Y211-F226 HydrophobicContact CE2-CE2 4.17Å; Y211-F226 HydrophobicContact CE2-CZ 4Å; K222-F226 HydrophobicContact CB-CD2 4.26Å; K222-F226 HydrophobicContact CB-CE2 4.43Å; K222-F226 HydrophobicContact CD-CD2 4.35Å; K222-F226 HydrophobicContact CD-CE2 3.9Å; K222-F226 WeakPolarHBondContact O-CB 3.11Å; K222-F226 WeakPolarHBondContact O-CD2 3.39Å; K222-F226 PolarHBondContact O-N 2.69Å; H224-F226 PolarHBondContact O-N 2.9Å; F226-R229 PolarHBondContact O-N 2.96Å; F226-F230 HydrophobicContact CB-CD2 4.33Å; F226-F230 AromaticContact CD1-CD2 3.67Å; F226-F230 HydrophobicContact CD1-CD2 3.67Å; F226-F230 AromaticContact CD1-CE2 3.49Å; F226-F230 HydrophobicContact CD1-CE2 3.49Å; F226-F230 VanDerWaalsContact CD1-CE2 3.49Å; F226-F230 HydrophobicContact CE1-CD2 4.47Å; F226-F230 AromaticContact CE1-CE2 3.85Å; F226-F230 HydrophobicContact CE1-CE2 3.85Å; F226-F230 HydrophobicContact CG-CD2 4.4Å; F226-F230 HydrophobicContact CG-CE2 4.46Å; F226-F230 WeakPolarHBondContact O-CB 3.32Å; F226-F230 PolarHBondContact O-N 2.95Å; F226-V234 HydrophobicContact CB-CG1 4.21Å; F226-V234 HydrophobicContact CB-CG2 4.41Å; F226-L249 HydrophobicContact CB-CD2 4.43Å; F226-L249 HydrophobicContact CD1-CD1 3.81Å; F226-L249 HydrophobicContact CD1-CD2 4.17Å; F226-L249 HydrophobicContact CE1-CD1 4.34Å; F226-I251 HydrophobicContact CB-CD1 3.87Å; F226-I251 HydrophobicContact CD2-CD1 4.21Å; F226-I251 HydrophobicContact CG-CD1 4.08Å
227	R	90.6	Very high	88.5	Confident	54 Å²	54	32.6 Å²	32.6	20%	0.204	16%	0.162	C	C	.	.	H	α-helix	trans	-69.6	-35.8	174.7	-169.6	176.6	-177.1	165.2	2.9	111.9	F223 H224 R229 G231 E232 V234	F223-R227 WeakPolarHBondContact O-CB 3.48Å; F223-R227 PolarHBondContact O-N 2.91Å; H224-R227 PolarHBondContact O-N 3.43Å; R227-R229 VanDerWaalsContact C-N 3.25Å; R227-R229 PolarHBondContact O-N 2.86Å; R227-G231 WeakPolarHBondContact CG-O 3.35Å; R227-G231 VanDerWaalsContact O-CA 3.25Å; R227-G231 WeakPolarHBondContact O-CA 3.35Å; R227-G231 PolarHBondContact O-N 2.85Å; R227-E232 IonicContact CZ-OE1 3.63Å; R227-E232 IonicContact CZ-OE2 3.81Å; R227-E232 IonicContact NE-OE1 3.21Å; R227-E232 PolarHBondContact NE-OE1 2.58Å; R227-E232 IonicContact NE-OE2 3.55Å; R227-E232 VanDerWaalsContact NH2-CD 3.29Å; R227-E232 IonicContact NH2-OE1 2.83Å; R227-E232 PolarHBondContact NH2-OE1 3.22Å; R227-E232 VanDerWaalsContact NH2-OE1 3.11Å; R227-E232 IonicContact NH2-OE2 3.84Å; R227-E232 PolarHBondContact NH2-OE2 3.11Å; R227-V234 HydrophobicContact CB-CB 4.48Å
228	E	87.6	Confident	88.8	Confident	103 Å²	103	31.2 Å²	31.2	48%	0.481	15%	0.15	S	C	.	.	H	α-helix	trans	-61.9	-35.7	170.5	-73.8	-173	147.3	0	0	111.8	H224 E225	H224-E228 IonicContact CE1-OE1 3.72Å; H224-E228 IonicContact NE2-OE1 3.89Å; H224-E228 PolarHBondContact NE2-OE1 3.03Å; H224-E228 WeakPolarHBondContact O-CG 3.24Å; H224-E228 PolarHBondContact O-N 2.69Å; E225-E228 PolarHBondContact O-N 3.32Å
229	R	88.8	Confident	88.3	Confident	88 Å²	88	31.1 Å²	31.1	33%	0.332	15%	0.151	S	C	.	.	H	α-helix	trans	-87.8	-41.6	-174.6	-170.8	167.6	-172.4	143.4	0.1	115.3	W160 E196 E225 F226 R227	W160-R229 VanDerWaalsContact CE2-NH2 3.27Å; E196-R229 VanDerWaalsContact CD-CZ 3.44Å; E196-R229 WeakPolarHBondContact OE1-CD 3.47Å; E196-R229 IonicContact OE1-CZ 3.5Å; E196-R229 IonicContact OE1-NE 3.74Å; E196-R229 IonicContact OE1-NH1 3.67Å; E196-R229 PolarHBondContact OE1-NH1 3.11Å; E196-R229 IonicContact OE2-CZ 3.24Å; E196-R229 IonicContact OE2-NE 2.72Å; E196-R229 IonicContact OE2-NH1 3.56Å; E196-R229 PolarHBondContact OE2-NH1 2.94Å; E196-R229 IonicContact OE2-NH2 3.81Å; E225-R229 WeakPolarHBondContact O-CB 3.14Å; E225-R229 PolarHBondContact O-N 2.8Å; F226-R229 PolarHBondContact O-N 2.96Å; R227-R229 VanDerWaalsContact C-N 3.25Å; R227-R229 PolarHBondContact O-N 2.86Å
230	F	90.5	Very high	87.4	Confident	43 Å²	43	34.9 Å²	34.9	19%	0.189	17%	0.171	C	C	.	.	H	α-helix	trans	-109	-0.1	-174.3	-62.6	-75	0	0	0	113.3	L158 E196 C199 A200 L203 F226 V234 L249	L158-F230 HydrophobicContact CD2-CZ 4.29Å; E196-F230 HydrophobicContact CB-CZ 4.39Å; E196-F230 WeakPolarHBondContact O-CZ 3.28Å; C199-F230 HydrophobicContact CB-CE2 4.22Å; C199-F230 HydrophobicContact CB-CZ 4.03Å; A200-F230 HydrophobicContact CB-CE1 4.18Å; L203-F230 HydrophobicContact CD1-CB 4.31Å; L203-F230 HydrophobicContact CD1-CD1 3.5Å; L203-F230 HydrophobicContact CD1-CE1 4.03Å; L203-F230 HydrophobicContact CD1-CG 4.05Å; F226-F230 HydrophobicContact CB-CD2 4.33Å; F226-F230 AromaticContact CD1-CD2 3.67Å; F226-F230 HydrophobicContact CD1-CD2 3.67Å; F226-F230 AromaticContact CD1-CE2 3.49Å; F226-F230 HydrophobicContact CD1-CE2 3.49Å; F226-F230 VanDerWaalsContact CD1-CE2 3.49Å; F226-F230 HydrophobicContact CE1-CD2 4.47Å; F226-F230 AromaticContact CE1-CE2 3.85Å; F226-F230 HydrophobicContact CE1-CE2 3.85Å; F226-F230 HydrophobicContact CG-CD2 4.4Å; F226-F230 HydrophobicContact CG-CE2 4.46Å; F226-F230 WeakPolarHBondContact O-CB 3.32Å; F226-F230 PolarHBondContact O-N 2.95Å; F230-V234 HydrophobicContact CB-CG2 4.07Å; F230-L249 HydrophobicContact CD2-CD1 4.15Å; F230-L249 HydrophobicContact CE2-CD1 4.44Å
231	G	88.3	Confident	87	Confident	31 Å²	31	36.1 Å²	36.1	32%	0.32	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	-152.8	-179.8	0	0	0	0	0	113.4	R227 N233	R227-G231 WeakPolarHBondContact CG-O 3.35Å; R227-G231 VanDerWaalsContact O-CA 3.25Å; R227-G231 WeakPolarHBondContact O-CA 3.35Å; R227-G231 PolarHBondContact O-N 2.85Å; G231-N233 VanDerWaalsContact C-N 3.29Å; G231-N233 PolarHBondContact O-N 2.66Å
232	E	84.4	Confident	87.1	Confident	135 Å²	135	41.3 Å²	41.3	63%	0.631	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-12.8	-170.3	-66.8	-66.1	121.2	0	0	114.7	R227 V234	R227-E232 IonicContact CZ-OE1 3.63Å; R227-E232 IonicContact CZ-OE2 3.81Å; R227-E232 IonicContact NE-OE1 3.21Å; R227-E232 PolarHBondContact NE-OE1 2.58Å; R227-E232 IonicContact NE-OE2 3.55Å; R227-E232 VanDerWaalsContact NH2-CD 3.29Å; R227-E232 IonicContact NH2-OE1 2.83Å; R227-E232 PolarHBondContact NH2-OE1 3.22Å; R227-E232 VanDerWaalsContact NH2-OE1 3.11Å; R227-E232 IonicContact NH2-OE2 3.84Å; R227-E232 PolarHBondContact NH2-OE2 3.11Å; E232-V234 PolarHBondContact O-N 3.15Å
233	N	88.6	Confident	87.1	Confident	67 Å²	67	43.7 Å²	43.7	36%	0.358	21%	0.213	S	C	.	.			trans	-80.5	45.1	179.3	-167.1	20.8	0	0	0	112.8	G231 A247 S248	G231-N233 VanDerWaalsContact C-N 3.29Å; G231-N233 PolarHBondContact O-N 2.66Å; N233-A247 WeakPolarHBondContact OD1-CA 3.5Å; N233-S248 WeakPolarHBondContact ND2-CB 3.39Å; N233-S248 PolarHBondContact ND2-OG 3.3Å; N233-S248 VanDerWaalsContact ND2-OG 3.08Å; N233-S248 PolarHBondContact OD1-N 3.47Å
234	V	93	Very high	86.9	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	122.8	179.3	175.9	0	0	0	0	108.5	F223 F226 R227 F230 E232 L249 I251	F223-V234 HydrophobicContact CD2-CG1 3.74Å; F223-V234 HydrophobicContact CE2-CG1 4Å; F223-V234 WeakPolarHBondContact CE2-O 3.35Å; F226-V234 HydrophobicContact CB-CG1 4.21Å; F226-V234 HydrophobicContact CB-CG2 4.41Å; R227-V234 HydrophobicContact CB-CB 4.48Å; F230-V234 HydrophobicContact CB-CG2 4.07Å; E232-V234 PolarHBondContact O-N 3.15Å; V234-L249 WeakPolarHBondContact CA-O 3.39Å; V234-L249 HydrophobicContact CB-CD2 4.31Å; V234-L249 HydrophobicContact CG1-CD2 3.68Å; V234-L249 HydrophobicContact CG2-CB 4.43Å; V234-L249 HydrophobicContact CG2-CD2 4.06Å; V234-I251 HydrophobicContact CG1-CD1 3.86Å
235	G	93	Very high	87	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	156.5	177.2	0	0	0	0	0	112.8	L243 A244 L249 I251	G235-L243 CarbonylContact C-O 3.52Å; G235-L243 VanDerWaalsContact CA-O 3.26Å; G235-L243 WeakPolarHBondContact CA-O 3.31Å; G235-A244 WeakPolarHBondContact CA-O 3.43Å; G235-L249 PolarHBondContact N-O 2.92Å; G235-I251 PolarHBondContact O-N 2.69Å
236	L	93.1	Very high	87	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	122.9	174.8	177.3	64.1	0	0	0	109.1	F223 T238 I241 K242 L243 I251 V1304	F223-L236 HydrophobicContact CB-CB 4.45Å; F223-L236 HydrophobicContact CB-CD1 4.19Å; F223-L236 HydrophobicContact CB-CD2 4.35Å; F223-L236 HydrophobicContact CD1-CD2 4.3Å; F223-L236 HydrophobicContact CD2-CB 3.58Å; F223-L236 HydrophobicContact CE2-CB 3.85Å; F223-L236 HydrophobicContact CG-CB 3.97Å; F223-L236 HydrophobicContact CG-CD2 4.18Å; F223-L236 HydrophobicContact CG-CG 4.47Å; F223-L236 HydrophobicContact CZ-CB 4.47Å; L236-T238 HydrophobicContact CD1-CG2 3.8Å; L236-T238 HydrophobicContact CG-CG2 4.15Å; L236-I241 HydrophobicContact CD2-CG2 4.25Å; L236-K242 CarbonylContact O-C 3.55Å; L236-K242 WeakPolarHBondContact O-CA 3.39Å; L236-L243 HydrophobicContact CB-CB 4.39Å; L236-L243 PolarHBondContact N-O 3.42Å; L236-L243 PolarHBondContact O-N 2.97Å; L236-I251 CarbonylContact C-O 3.42Å; L236-I251 WeakPolarHBondContact CA-O 3.41Å; L236-I251 HydrophobicContact CD1-CB 4.38Å; L236-I251 HydrophobicContact CD1-CG2 4.05Å; L236-V1304 HydrophobicContact CD2-CG2 4.03Å
237	I	91.4	Very high	87.1	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	103.4	176.8	-48.5	-179.2	0	0	0	108.8	K242 Q245 L250 I251 M252 I256 M260	I237-K242 HydrophobicContact CG2-CG 4.18Å; I237-Q245 HydrophobicContact CD1-CB 4.49Å; I237-Q245 HydrophobicContact CD1-CG 4.09Å; I237-Q245 HydrophobicContact CG1-CG 4.27Å; I237-L250 HydrophobicContact CD1-CD1 4.13Å; I237-L250 HydrophobicContact CD1-CD2 4.15Å; I237-I251 PolarHBondContact N-O 2.85Å; I237-M252 HydrophobicContact CB-CB 4.21Å; I237-M252 HydrophobicContact CD1-CE 4.31Å; I237-M252 WeakPolarHBondContact O-CA 3.31Å; I237-M252 WeakPolarHBondContact O-CB 3.32Å; I237-I256 HydrophobicContact CB-CG2 4.29Å; I237-I256 HydrophobicContact CG2-CG2 3.66Å; I237-M260 HydrophobicContact CD1-CE 3.77Å; I237-M260 HydrophobicContact CG2-CE 4.09Å
238	T	85.1	Confident	87.2	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.006	27%	0.272	C	S	.	.			trans	-118.2	172.8	171.9	60.6	0	0	0	0	108.8	L236 D240 I241 T253	L236-T238 HydrophobicContact CD1-CG2 3.8Å; L236-T238 HydrophobicContact CG-CG2 4.15Å; T238-D240 PolarHBondContact O-N 3.49Å; T238-D240 PolarHBondContact OG1-OD1 3.23Å; T238-I241 PolarHBondContact N-O 3Å; T238-I241 WeakPolarHBondContact OG1-CA 3.24Å; T238-I241 WeakPolarHBondContact OG1-CB 3.31Å; T238-I241 PolarHBondContact OG1-N 2.95Å; T238-I241 PolarHBondContact OG1-O 2.71Å; T238-T253 HydrophobicContact CG2-CG2 4.49Å
239	G	74.1	Confident	87.5	Confident	7 Å²	7	47.8 Å²	47.8	7%	0.072	25%	0.249	C	C	.	.	S	Bend	trans	-62	-22.5	179.2	0	0	0	0	0	114	R1267	G239-R1267 PolarHBondContact O-NE 2.89Å; G239-R1267 PolarHBondContact O-NH2 3.33Å
240	D	70.6	Confident	87.8	Confident	78 Å²	78	43.6 Å²	43.6	42%	0.417	23%	0.234	S	C	.	.	S	Bend	trans	-111.3	-38.3	-174.6	44.9	-48.5	0	0	0	112.9	K216 T238	K216-D240 IonicContact NZ-OD1 3.78Å; K216-D240 PolarHBondContact NZ-OD1 3.19Å; T238-D240 PolarHBondContact O-N 3.49Å; T238-D240 PolarHBondContact OG1-OD1 3.23Å
241	I	78.5	Confident	88.1	Confident	38 Å²	38	41.6 Å²	41.6	20%	0.195	23%	0.225	C	C	.	.			trans	-118.4	124.9	-175.5	-59	170.8	0	0	0	109.9	L236 T238 L243	L236-I241 HydrophobicContact CD2-CG2 4.25Å; T238-I241 PolarHBondContact N-O 3Å; T238-I241 WeakPolarHBondContact OG1-CA 3.24Å; T238-I241 WeakPolarHBondContact OG1-CB 3.31Å; T238-I241 PolarHBondContact OG1-N 2.95Å; T238-I241 PolarHBondContact OG1-O 2.71Å; I241-L243 HydrophobicContact CG2-CD1 3.74Å; I241-L243 HydrophobicContact CG2-CD2 4.38Å; I241-L243 HydrophobicContact CG2-CG 3.63Å
242	K	86.3	Confident	88.4	Confident	117 Å²	117	40.1 Å²	40.1	51%	0.509	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	108	172	-58.7	-174	-178.3	-178.5	0	109.7	L236 I237 Q245	L236-K242 CarbonylContact O-C 3.55Å; L236-K242 WeakPolarHBondContact O-CA 3.39Å; I237-K242 HydrophobicContact CG2-CG 4.18Å; K242-Q245 HydrophobicContact CB-CG 4.28Å
243	L	88	Confident	88.8	Confident	61 Å²	61	34 Å²	34	32%	0.319	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.6	-179	-62.4	172.8	0	0	0	110	F223 G235 L236 I241 Q245 V1304	F223-L243 HydrophobicContact CE1-CD1 4.43Å; F223-L243 HydrophobicContact CZ-CD1 4.28Å; G235-L243 CarbonylContact C-O 3.52Å; G235-L243 VanDerWaalsContact CA-O 3.26Å; G235-L243 WeakPolarHBondContact CA-O 3.31Å; L236-L243 HydrophobicContact CB-CB 4.39Å; L236-L243 PolarHBondContact N-O 3.42Å; L236-L243 PolarHBondContact O-N 2.97Å; I241-L243 HydrophobicContact CG2-CD1 3.74Å; I241-L243 HydrophobicContact CG2-CD2 4.38Å; I241-L243 HydrophobicContact CG2-CG 3.63Å; L243-Q245 PolarHBondContact O-N 3.49Å; L243-V1304 HydrophobicContact CD1-CG1 3.5Å
244	A	87.2	Confident	88.9	Confident	58 Å²	58	30.8 Å²	30.8	48%	0.479	16%	0.164	S	C	.	.			trans	44	56.2	175.7	0	0	0	0	0	113.7	G235 E246 A247	G235-A244 WeakPolarHBondContact CA-O 3.43Å; A244-E246 PolarHBondContact O-N 3.34Å; A244-E246 VanDerWaalsContact O-N 3.13Å; A244-A247 HydrophobicContact CB-CB 4.35Å; A244-A247 WeakPolarHBondContact O-CB 3.48Å; A244-A247 PolarHBondContact O-N 3.02Å
245	Q	89	Confident	88.7	Confident	84 Å²	84	33.1 Å²	33.1	39%	0.393	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.4	-177.7	-67.7	177.6	76.5	0	0	113.8	I237 K242 L243 A247	I237-Q245 HydrophobicContact CD1-CB 4.49Å; I237-Q245 HydrophobicContact CD1-CG 4.09Å; I237-Q245 HydrophobicContact CG1-CG 4.27Å; K242-Q245 HydrophobicContact CB-CG 4.28Å; L243-Q245 PolarHBondContact O-N 3.49Å; Q245-A247 VanDerWaalsContact C-N 3.33Å
246	E	88.6	Confident	88.5	Confident	152 Å²	152	34.2 Å²	34.2	71%	0.71	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.7	176.9	-61.5	-57.4	163.5	0	0	114.2	R208 A244	R208-E246 IonicContact NH2-OE2 3.62Å; R208-E246 PolarHBondContact NH2-OE2 3.49Å; A244-E246 PolarHBondContact O-N 3.34Å; A244-E246 VanDerWaalsContact O-N 3.13Å
247	A	91.7	Very high	88.5	Confident	7 Å²	7	34.3 Å²	34.3	6%	0.058	18%	0.181	C	C	.	.			trans	-59.4	146.8	-180	0	0	0	0	0	111.8	N233 A244 Q245 L249 L250	N233-A247 WeakPolarHBondContact OD1-CA 3.5Å; A244-A247 HydrophobicContact CB-CB 4.35Å; A244-A247 WeakPolarHBondContact O-CB 3.48Å; A244-A247 PolarHBondContact O-N 3.02Å; Q245-A247 VanDerWaalsContact C-N 3.33Å; A247-L249 VanDerWaalsContact C-N 3.26Å; A247-L249 PolarHBondContact O-N 2.73Å; A247-L250 HydrophobicContact CB-CD2 4.2Å
248	S	92.6	Very high	88.5	Confident	31 Å²	31	34.9 Å²	34.9	22%	0.217	18%	0.183	C	C	.	.	S	Bend	trans	-66.4	-32.6	176	-52.4	0	0	0	0	111.8	R208 V209 N233	R208-S248 CarbonylContact C-O 3.56Å; R208-S248 VanDerWaalsContact CA-O 3.28Å; R208-S248 WeakPolarHBondContact CA-O 3.21Å; V209-S248 PolarHBondContact N-O 3.12Å; N233-S248 WeakPolarHBondContact ND2-CB 3.39Å; N233-S248 PolarHBondContact ND2-OG 3.3Å; N233-S248 VanDerWaalsContact ND2-OG 3.08Å; N233-S248 PolarHBondContact OD1-N 3.47Å
249	L	95.4	Very high	88.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.8	177.3	-170.7	153.9	0	0	0	109.6	C199 V209 F226 F230 V234 G235 A247 I251	C199-L249 HydrophobicContact CB-CD1 3.56Å; C199-L249 WeakPolarHBondContact SG-CD1 3.39Å; V209-L249 HydrophobicContact CG1-CB 3.96Å; V209-L249 HydrophobicContact CG1-CD1 4.22Å; V209-L249 HydrophobicContact CG1-CG 3.86Å; F226-L249 HydrophobicContact CB-CD2 4.43Å; F226-L249 HydrophobicContact CD1-CD1 3.81Å; F226-L249 HydrophobicContact CD1-CD2 4.17Å; F226-L249 HydrophobicContact CE1-CD1 4.34Å; F230-L249 HydrophobicContact CD2-CD1 4.15Å; F230-L249 HydrophobicContact CE2-CD1 4.44Å; V234-L249 WeakPolarHBondContact CA-O 3.39Å; V234-L249 HydrophobicContact CB-CD2 4.31Å; V234-L249 HydrophobicContact CG1-CD2 3.68Å; V234-L249 HydrophobicContact CG2-CB 4.43Å; V234-L249 HydrophobicContact CG2-CD2 4.06Å; G235-L249 PolarHBondContact N-O 2.92Å; A247-L249 VanDerWaalsContact C-N 3.26Å; A247-L249 PolarHBondContact O-N 2.73Å; L249-I251 HydrophobicContact CD2-CD1 3.92Å; L249-I251 HydrophobicContact CD2-CG1 3.83Å
250	L	95.3	Very high	89.2	Confident	1 Å²	1	38 Å²	38	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122	179.9	-64	176.4	0	0	0	110.7	V209 V210 Y211 I237 A247 M252 I267	V209-L250 PolarHBondContact O-N 3.47Å; V210-L250 CarbonylContact C-O 3.54Å; V210-L250 WeakPolarHBondContact CA-O 3.41Å; V210-L250 HydrophobicContact CG2-CB 4.26Å; Y211-L250 PolarHBondContact N-O 2.82Å; I237-L250 HydrophobicContact CD1-CD1 4.13Å; I237-L250 HydrophobicContact CD1-CD2 4.15Å; A247-L250 HydrophobicContact CB-CD2 4.2Å; L250-M252 HydrophobicContact CB-CE 3.83Å; L250-M252 HydrophobicContact CD1-CE 4.29Å; L250-I267 HydrophobicContact CD1-CG2 3.68Å
251	I	95.5	Very high	90.1	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.4	171.7	-67.4	160.8	0	0	0	108.5	Y211 S219 K222 F223 F226 V234 G235 L236 I237 L249	Y211-I251 HydrophobicContact CD1-CG1 4.49Å; Y211-I251 HydrophobicContact CD1-CG2 4.4Å; Y211-I251 HydrophobicContact CG-CG1 4.47Å; Y211-I251 WeakPolarHBondContact O-CA 3.12Å; S219-I251 WeakPolarHBondContact O-CG2 3.47Å; K222-I251 HydrophobicContact CB-CD1 4.43Å; F223-I251 VanDerWaalsContact CA-CD1 3.43Å; F223-I251 HydrophobicContact CB-CD1 4.15Å; F226-I251 HydrophobicContact CB-CD1 3.87Å; F226-I251 HydrophobicContact CD2-CD1 4.21Å; F226-I251 HydrophobicContact CG-CD1 4.08Å; V234-I251 HydrophobicContact CG1-CD1 3.86Å; G235-I251 PolarHBondContact O-N 2.69Å; L236-I251 CarbonylContact C-O 3.42Å; L236-I251 WeakPolarHBondContact CA-O 3.41Å; L236-I251 HydrophobicContact CD1-CB 4.38Å; L236-I251 HydrophobicContact CD1-CG2 4.05Å; I237-I251 PolarHBondContact N-O 2.85Å; L249-I251 HydrophobicContact CD2-CD1 3.92Å; L249-I251 HydrophobicContact CD2-CG1 3.83Å
252	M	94.5	Very high	90.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	173.7	-179.2	63.7	-174.3	69.3	0	0	112.4	V210 Y211 T212 S213 S219 I237 L250 I256 L257 M260	V210-M252 HydrophobicContact CB-CE 4.37Å; V210-M252 HydrophobicContact CG1-CE 3.67Å; V210-M252 HydrophobicContact CG1-CG 3.75Å; V210-M252 HydrophobicContact CG1-SD 3.59Å; V210-M252 VanDerWaalsContact CG1-SD 3.59Å; V210-M252 HydrophobicContact CG2-CE 3.75Å; Y211-M252 PolarHBondContact O-N 3.41Å; T212-M252 WeakPolarHBondContact CA-O 3.47Å; T212-M252 HydrophobicContact CG2-CG 4.2Å; S213-M252 PolarHBondContact N-O 3.05Å; S213-M252 VanDerWaalsContact N-O 3.08Å; S219-M252 PolarHBondContact OG-O 2.56Å; I237-M252 HydrophobicContact CB-CB 4.21Å; I237-M252 HydrophobicContact CD1-CE 4.31Å; I237-M252 WeakPolarHBondContact O-CA 3.31Å; I237-M252 WeakPolarHBondContact O-CB 3.32Å; L250-M252 HydrophobicContact CB-CE 3.83Å; L250-M252 HydrophobicContact CD1-CE 4.29Å; M252-I256 HydrophobicContact CB-CB 4.29Å; M252-I256 HydrophobicContact CB-CG2 4.13Å; M252-I256 HydrophobicContact SD-CG2 4.13Å; M252-L257 HydrophobicContact SD-CB 3.85Å; M252-L257 HydrophobicContact SD-CD1 4.26Å; M252-M260 HydrophobicContact CE-CE 4.23Å; M252-M260 HydrophobicContact CE-SD 4.07Å; M252-M260 HydrophobicContact SD-SD 4.09Å
253	T	92.5	Very high	90.1	Very high	7 Å²	7	32.2 Å²	32.2	4%	0.043	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	161	167.9	63.9	0	0	0	0	110.6	S213 K216 T238 E255 I256 L257	S213-T253 WeakPolarHBondContact O-CA 3.4Å; K216-T253 HydrophobicContact CG-CG2 3.99Å; T238-T253 HydrophobicContact CG2-CG2 4.49Å; T253-E255 VanDerWaalsContact C-N 3.31Å; T253-E255 PolarHBondContact O-N 3.31Å; T253-I256 PolarHBondContact O-N 3.34Å; T253-I256 WeakPolarHBondContact OG1-CG1 3.28Å; T253-L257 PolarHBondContact O-N 3.36Å
254	T	91.7	Very high	89.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.9	-41.3	177.9	39.4	0	0	0	0	113.6	S213 I256 L257 Y258 W291 I294	S213-T254 PolarHBondContact O-N 3.31Å; T254-I256 VanDerWaalsContact C-N 3.29Å; T254-I256 PolarHBondContact O-N 3.36Å; T254-L257 PolarHBondContact O-N 2.96Å; T254-Y258 PolarHBondContact O-N 3.03Å; T254-W291 HydrophobicContact CG2-CD2 4.13Å; T254-W291 HydrophobicContact CG2-CH2 3.75Å; T254-W291 HydrophobicContact CG2-CZ2 3.29Å; T254-W291 HydrophobicContact CG2-CZ3 4.41Å; T254-I294 HydrophobicContact CG2-CD1 4.42Å; T254-I294 WeakPolarHBondContact O-CD1 3.41Å
255	E	88	Confident	89.4	Confident	51 Å²	51	31.8 Å²	31.8	24%	0.238	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-33.8	-179.4	-67.2	79	-179.4	0	0	112.3	T253 Y258 N259 R287	T253-E255 VanDerWaalsContact C-N 3.31Å; T253-E255 PolarHBondContact O-N 3.31Å; E255-Y258 PolarHBondContact O-N 3.48Å; E255-N259 WeakPolarHBondContact O-CB 3.23Å; E255-N259 PolarHBondContact O-N 3.4Å; E255-N259 PolarHBondContact O-ND2 3.07Å; E255-R287 IonicContact OE1-CZ 3.96Å; E255-R287 IonicContact OE1-NE 2.71Å; E255-R287 PolarHBondContact OE1-NE 2.94Å; E255-R287 IonicContact OE1-NH2 3.72Å; E255-R287 PolarHBondContact OE1-NH2 2.99Å; E255-R287 IonicContact OE2-NH2 2.66Å; E255-R287 PolarHBondContact OE2-NH2 3.41Å
256	I	90.6	Very high	89.2	Confident	24 Å²	24	34.6 Å²	34.6	12%	0.123	19%	0.19	C	C	.	.	H	α-helix	trans	-67.4	-43.1	175.8	-64.9	-63.3	0	0	0	110.3	I237 M252 T253 T254 N259 M260	I237-I256 HydrophobicContact CB-CG2 4.29Å; I237-I256 HydrophobicContact CG2-CG2 3.66Å; M252-I256 HydrophobicContact CB-CB 4.29Å; M252-I256 HydrophobicContact CB-CG2 4.13Å; M252-I256 HydrophobicContact SD-CG2 4.13Å; T253-I256 PolarHBondContact O-N 3.34Å; T253-I256 WeakPolarHBondContact OG1-CG1 3.28Å; T254-I256 VanDerWaalsContact C-N 3.29Å; T254-I256 PolarHBondContact O-N 3.36Å; I256-N259 PolarHBondContact O-N 2.85Å; I256-M260 HydrophobicContact CG2-CE 3.83Å; I256-M260 HydrophobicContact CG2-SD 4.44Å; I256-M260 WeakPolarHBondContact O-CG 3.33Å; I256-M260 PolarHBondContact O-N 2.91Å
257	L	93	Very high	89	Confident	2 Å²	2	28.5 Å²	28.5	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-43.3	175.3	-179.5	59.9	0	0	0	111.6	T212 M252 T253 T254 M260 L261 V274 I294	T212-L257 HydrophobicContact CG2-CB 4.2Å; T212-L257 HydrophobicContact CG2-CD2 3.57Å; T212-L257 HydrophobicContact CG2-CG 4.5Å; M252-L257 HydrophobicContact SD-CB 3.85Å; M252-L257 HydrophobicContact SD-CD1 4.26Å; T253-L257 PolarHBondContact O-N 3.36Å; T254-L257 PolarHBondContact O-N 2.96Å; L257-M260 WeakPolarHBondContact O-CB 3.22Å; L257-M260 PolarHBondContact O-N 3.15Å; L257-L261 HydrophobicContact CG-CD1 4.35Å; L257-L261 WeakPolarHBondContact O-CG 3.13Å; L257-L261 PolarHBondContact O-N 3.08Å; L257-V274 HydrophobicContact CD2-CG1 3.82Å; L257-I294 HydrophobicContact CD2-CG2 3.75Å; L257-I294 HydrophobicContact CG-CG2 4.29Å
258	Y	90.1	Very high	88.6	Confident	14 Å²	14	29 Å²	29	6%	0.055	16%	0.163	C	C	.	.	H	α-helix	trans	-57.8	-49.3	174.7	173.7	-103.2	0	0	0	111.8	T254 E255 M260 L261 C262 V290 Q293 I294 M297	T254-Y258 PolarHBondContact O-N 3.03Å; E255-Y258 PolarHBondContact O-N 3.48Å; Y258-M260 VanDerWaalsContact C-N 3.28Å; Y258-M260 PolarHBondContact O-N 2.85Å; Y258-L261 WeakPolarHBondContact O-CB 3.25Å; Y258-L261 PolarHBondContact O-N 2.7Å; Y258-C262 PolarHBondContact O-N 2.85Å; Y258-V290 HydrophobicContact CG-CG1 4.11Å; Y258-Q293 HydrophobicContact CD2-CB 4.17Å; Y258-Q293 HydrophobicContact CE2-CB 3.96Å; Y258-I294 HydrophobicContact CD2-CG1 4.37Å; Y258-M297 HydrophobicContact CD2-SD 4.32Å; Y258-M297 HydrophobicContact CE2-SD 3.91Å
259	N	85.9	Confident	88.2	Confident	51 Å²	51	34.3 Å²	34.3	27%	0.273	18%	0.182	S	C	.	.	H	α-helix	trans	-61.1	-38	178.1	-70	-14.6	0	0	0	111.9	E255 I256 L261 C262 N263	E255-N259 WeakPolarHBondContact O-CB 3.23Å; E255-N259 PolarHBondContact O-N 3.4Å; E255-N259 PolarHBondContact O-ND2 3.07Å; I256-N259 PolarHBondContact O-N 2.85Å; N259-L261 VanDerWaalsContact C-N 3.31Å; N259-L261 PolarHBondContact O-N 3.45Å; N259-C262 PolarHBondContact O-N 2.96Å; N259-N263 VanDerWaalsContact O-CB 3.27Å; N259-N263 WeakPolarHBondContact O-CB 2.93Å; N259-N263 PolarHBondContact O-N 3.39Å; N259-N263 PolarHBondContact O-ND2 2.95Å
260	M	88.6	Confident	87.7	Confident	23 Å²	23	39.4 Å²	39.4	11%	0.113	21%	0.21	C	C	.	.	H	α-helix	trans	-62	-38.1	173.9	-73.8	-179.9	178	0	0	112.2	I237 M252 I256 L257 Y258 N263 A264 S265 I267 I268	I237-M260 HydrophobicContact CD1-CE 3.77Å; I237-M260 HydrophobicContact CG2-CE 4.09Å; M252-M260 HydrophobicContact CE-CE 4.23Å; M252-M260 HydrophobicContact CE-SD 4.07Å; M252-M260 HydrophobicContact SD-SD 4.09Å; I256-M260 HydrophobicContact CG2-CE 3.83Å; I256-M260 HydrophobicContact CG2-SD 4.44Å; I256-M260 WeakPolarHBondContact O-CG 3.33Å; I256-M260 PolarHBondContact O-N 2.91Å; L257-M260 WeakPolarHBondContact O-CB 3.22Å; L257-M260 PolarHBondContact O-N 3.15Å; Y258-M260 VanDerWaalsContact C-N 3.28Å; Y258-M260 PolarHBondContact O-N 2.85Å; M260-N263 PolarHBondContact O-N 3.49Å; M260-A264 PolarHBondContact O-N 2.77Å; M260-A264 VanDerWaalsContact O-N 3.11Å; M260-S265 PolarHBondContact O-N 3.19Å; M260-I267 HydrophobicContact CE-CD1 3.87Å; M260-I267 HydrophobicContact SD-CD1 4.34Å; M260-I268 VanDerWaalsContact C-CD1 3.45Å; M260-I268 HydrophobicContact CB-CD1 4.01Å; M260-I268 VanDerWaalsContact O-CD1 3.24Å; M260-I268 WeakPolarHBondContact O-CD1 3.5Å
261	L	89.1	Confident	87.5	Confident	21 Å²	21	39.6 Å²	39.6	11%	0.11	21%	0.211	C	C	.	.	H	α-helix	trans	-67.8	-46.1	176.9	-70	162.5	0	0	0	111.5	L257 Y258 N259 N263 A264 I268 I294 M297 L298	L257-L261 HydrophobicContact CG-CD1 4.35Å; L257-L261 WeakPolarHBondContact O-CG 3.13Å; L257-L261 PolarHBondContact O-N 3.08Å; Y258-L261 WeakPolarHBondContact O-CB 3.25Å; Y258-L261 PolarHBondContact O-N 2.7Å; N259-L261 VanDerWaalsContact C-N 3.31Å; N259-L261 PolarHBondContact O-N 3.45Å; L261-N263 PolarHBondContact O-N 3.37Å; L261-A264 PolarHBondContact O-N 2.76Å; L261-I268 HydrophobicContact CB-CD1 4.48Å; L261-I268 HydrophobicContact CD2-CD1 3.75Å; L261-I268 HydrophobicContact CD2-CG2 4.47Å; L261-I268 HydrophobicContact CG-CD1 4.07Å; L261-I294 HydrophobicContact CD1-CB 4.45Å; L261-I294 HydrophobicContact CD1-CG1 4.33Å; L261-I294 HydrophobicContact CD1-CG2 4.18Å; L261-M297 HydrophobicContact CB-CE 4.14Å; L261-M297 HydrophobicContact CD1-CB 4.29Å; L261-L298 HydrophobicContact CD1-CD2 4.12Å; L261-L298 HydrophobicContact CD1-CG 4.14Å; L261-L298 HydrophobicContact CD2-CD2 3.93Å; L261-L298 HydrophobicContact CD2-CG 4.49Å
262	C	84.1	Confident	87.4	Confident	5 Å²	5	41.7 Å²	41.7	3%	0.034	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-31	175.6	-66.1	0	0	0	0	113.1	Y258 N259 N613 R616	Y258-C262 PolarHBondContact O-N 2.85Å; N259-C262 PolarHBondContact O-N 2.96Å; C262-N613 HydrophobicContact CB-CB 4.18Å; C262-R616 PolarHBondContact O-NH2 2.73Å
263	N	81.4	Confident	87.5	Confident	84 Å²	84	41.8 Å²	41.8	45%	0.449	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	1.8	179.3	-63.5	-10	0	0	0	113.7	N259 M260 L261 S265 R616	N259-N263 VanDerWaalsContact O-CB 3.27Å; N259-N263 WeakPolarHBondContact O-CB 2.93Å; N259-N263 PolarHBondContact O-N 3.39Å; N259-N263 PolarHBondContact O-ND2 2.95Å; M260-N263 PolarHBondContact O-N 3.49Å; L261-N263 PolarHBondContact O-N 3.37Å; N263-S265 PolarHBondContact O-N 3.01Å; N263-R616 PolarHBondContact OD1-NH2 3.23Å
264	A	78.8	Confident	87.7	Confident	80 Å²	80	41.4 Å²	41.4	66%	0.661	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	44	-175	0	0	0	0	0	112.9	M260 L261	M260-A264 PolarHBondContact O-N 2.77Å; M260-A264 VanDerWaalsContact O-N 3.11Å; L261-A264 PolarHBondContact O-N 2.76Å
265	S	82.1	Confident	88	Confident	31 Å²	31	41.4 Å²	41.4	22%	0.217	22%	0.219	C	C	.	.			trans	-54.6	139.3	-176	-178	0	0	0	0	112.1	M260 N263 I267 I268	M260-S265 PolarHBondContact O-N 3.19Å; N263-S265 PolarHBondContact O-N 3.01Å; S265-I267 PolarHBondContact O-N 2.96Å; S265-I267 VanDerWaalsContact O-N 3.15Å; S265-I268 WeakPolarHBondContact O-CB 3.37Å; S265-I268 PolarHBondContact O-N 2.72Å; S265-I268 VanDerWaalsContact O-N 3.1Å
266	E	83.9	Confident	88.4	Confident	143 Å²	143	39 Å²	39	67%	0.668	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-61	-25.7	179	-57.8	-158.7	131.4	0	0	113.2	I268 K269	E266-I268 PolarHBondContact O-N 3.37Å; E266-I268 VanDerWaalsContact O-N 3.16Å; E266-K269 WeakPolarHBondContact O-CB 3.12Å; E266-K269 PolarHBondContact O-N 2.99Å; E266-K269 IonicContact OE1-NZ 2.87Å
267	I	83.8	Confident	88.5	Confident	24 Å²	24	38.3 Å²	38.3	12%	0.123	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-56.2	-32.7	176.8	-61.5	173.7	0	0	0	111.2	L250 M260 S265 K269	L250-I267 HydrophobicContact CD1-CG2 3.68Å; M260-I267 HydrophobicContact CE-CD1 3.87Å; M260-I267 HydrophobicContact SD-CD1 4.34Å; S265-I267 PolarHBondContact O-N 2.96Å; S265-I267 VanDerWaalsContact O-N 3.15Å; I267-K269 VanDerWaalsContact C-N 3.31Å; I267-K269 PolarHBondContact O-N 3.2Å
268	I	84.7	Confident	88.4	Confident	16 Å²	16	39 Å²	39	8%	0.082	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-71.2	-25.6	-177.5	-62.6	161.4	0	0	0	111.8	M260 L261 S265 E266 N270 L271 P299 I302	M260-I268 VanDerWaalsContact C-CD1 3.45Å; M260-I268 HydrophobicContact CB-CD1 4.01Å; M260-I268 VanDerWaalsContact O-CD1 3.24Å; M260-I268 WeakPolarHBondContact O-CD1 3.5Å; L261-I268 HydrophobicContact CB-CD1 4.48Å; L261-I268 HydrophobicContact CD2-CD1 3.75Å; L261-I268 HydrophobicContact CD2-CG2 4.47Å; L261-I268 HydrophobicContact CG-CD1 4.07Å; S265-I268 WeakPolarHBondContact O-CB 3.37Å; S265-I268 PolarHBondContact O-N 2.72Å; S265-I268 VanDerWaalsContact O-N 3.1Å; E266-I268 PolarHBondContact O-N 3.37Å; E266-I268 VanDerWaalsContact O-N 3.16Å; I268-N270 VanDerWaalsContact C-N 3.29Å; I268-N270 PolarHBondContact O-N 3.5Å; I268-L271 WeakPolarHBondContact O-CB 3.3Å; I268-L271 PolarHBondContact O-N 3.08Å; I268-P299 HydrophobicContact CG2-CG 4.22Å; I268-I302 HydrophobicContact CG2-CD1 4.21Å
269	K	82.8	Confident	88.4	Confident	144 Å²	144	38.3 Å²	38.3	63%	0.626	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-64.5	-32.1	-176.6	-65.8	176.9	-177.6	167.2	0	113	E266 I267	E266-K269 WeakPolarHBondContact O-CB 3.12Å; E266-K269 PolarHBondContact O-N 2.99Å; E266-K269 IonicContact OE1-NZ 2.87Å; I267-K269 VanDerWaalsContact C-N 3.31Å; I267-K269 PolarHBondContact O-N 3.2Å
270	N	84.6	Confident	88.6	Confident	107 Å²	107	37.4 Å²	37.4	57%	0.572	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-104.5	11.6	-177.2	-64	-16.1	0	0	0	113	R208 I268	R208-N270 WeakPolarHBondContact CB-O 3.47Å; R208-N270 HydrophobicContact CG-CB 4.41Å; R208-N270 PolarHBondContact N-O 3.5Å; I268-N270 VanDerWaalsContact C-N 3.29Å; I268-N270 PolarHBondContact O-N 3.5Å
271	L	92.2	Very high	88.5	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.026	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.1	-175.4	-176.9	54.7	0	0	0	110.4	R208 V210 I268 I273 V274 I302	R208-L271 WeakPolarHBondContact O-CD1 3.47Å; V210-L271 HydrophobicContact CB-CD1 3.96Å; V210-L271 HydrophobicContact CB-CD2 4.45Å; V210-L271 HydrophobicContact CG2-CD1 3.55Å; V210-L271 HydrophobicContact CG2-CD2 3.97Å; V210-L271 HydrophobicContact CG2-CG 4.44Å; I268-L271 WeakPolarHBondContact O-CB 3.3Å; I268-L271 PolarHBondContact O-N 3.08Å; L271-I273 WeakPolarHBondContact CD1-O 3.38Å; L271-V274 HydrophobicContact CD1-CG2 4.32Å; L271-V274 HydrophobicContact CD2-CG2 3.61Å; L271-V274 HydrophobicContact CG-CG2 4.04Å; L271-I302 HydrophobicContact CB-CD1 4.39Å; L271-I302 HydrophobicContact CD2-CD1 4.09Å; L271-I302 HydrophobicContact CG-CD1 4.22Å
272	E	94.1	Very high	88.5	Confident	43 Å²	43	37.1 Å²	37.1	20%	0.201	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-44.6	179.1	-172.5	-178.2	166.7	0	0	111.7	R205 S207 R208 I302 L303	R205-E272 IonicContact CZ-OE1 3.93Å; R205-E272 IonicContact NH1-OE1 3.75Å; R205-E272 PolarHBondContact NH1-OE1 3.48Å; S207-E272 WeakPolarHBondContact CB-OE2 3.42Å; S207-E272 PolarHBondContact OG-OE2 2.94Å; R208-E272 PolarHBondContact O-N 3.23Å; E272-I302 WeakPolarHBondContact O-CA 3.31Å; E272-L303 PolarHBondContact O-N 2.85Å
273	I	96.4	Very high	88.7	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.8	-174.3	-56	-174.3	0	0	0	111	A198 C202 V209 V210 L271 I275 L303 V305	A198-I273 HydrophobicContact CB-CD1 4.41Å; A198-I273 HydrophobicContact CB-CG2 4.37Å; C202-I273 WeakPolarHBondContact SG-CD1 3.47Å; C202-I273 WeakPolarHBondContact SG-CG1 3.5Å; V209-I273 WeakPolarHBondContact CA-O 3.07Å; V209-I273 HydrophobicContact CG2-CB 4.09Å; V209-I273 HydrophobicContact CG2-CG2 4.32Å; V210-I273 PolarHBondContact N-O 3.23Å; L271-I273 WeakPolarHBondContact CD1-O 3.38Å; I273-I275 HydrophobicContact CG2-CG1 4.26Å; I273-L303 WeakPolarHBondContact CA-O 3.37Å; I273-L303 HydrophobicContact CG1-CB 4.22Å; I273-L303 HydrophobicContact CG1-CD1 4.44Å; I273-V305 HydrophobicContact CG2-CG2 3.71Å
274	V	96.9	Very high	88.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.2	167.4	174.9	0	0	0	0	109.7	V210 T212 L257 L271 L276 L298 I302 L303 L304 V305	V210-V274 HydrophobicContact CB-CG2 4.39Å; V210-V274 WeakPolarHBondContact O-CA 3.21Å; T212-V274 HydrophobicContact CG2-CG1 4.44Å; L257-V274 HydrophobicContact CD2-CG1 3.82Å; L271-V274 HydrophobicContact CD1-CG2 4.32Å; L271-V274 HydrophobicContact CD2-CG2 3.61Å; L271-V274 HydrophobicContact CG-CG2 4.04Å; V274-L276 HydrophobicContact CG1-CD2 3.68Å; V274-L276 HydrophobicContact CG1-CG 4.08Å; V274-L298 HydrophobicContact CB-CD1 4.41Å; V274-L298 HydrophobicContact CG1-CD1 4.28Å; V274-L298 HydrophobicContact CG2-CD1 4.38Å; V274-L298 HydrophobicContact CG2-CD2 4.14Å; V274-I302 HydrophobicContact CB-CG2 4.16Å; V274-I302 HydrophobicContact CG2-CG2 3.63Å; V274-L303 PolarHBondContact N-O 3.14Å; V274-L304 HydrophobicContact CB-CD2 4.1Å; V274-V305 PolarHBondContact O-N 3.22Å
275	I	97.3	Very high	88.9	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.5	174	-54	165.5	0	0	0	108.2	A195 A198 C199 V209 V210 Y211 T212 I273 V305 L307	A195-I275 HydrophobicContact CB-CD1 4.06Å; A195-I275 HydrophobicContact CB-CG2 4.02Å; A198-I275 HydrophobicContact CB-CD1 4.08Å; A198-I275 HydrophobicContact CB-CG1 4.36Å; C199-I275 VanDerWaalsContact SG-CD1 3.52Å; V209-I275 HydrophobicContact CG2-CD1 3.98Å; V209-I275 HydrophobicContact CG2-CG1 4.33Å; V210-I275 PolarHBondContact O-N 2.88Å; Y211-I275 HydrophobicContact CD2-CB 3.99Å; Y211-I275 HydrophobicContact CD2-CD1 4.02Å; Y211-I275 HydrophobicContact CD2-CG2 3.74Å; Y211-I275 HydrophobicContact CE2-CG2 3.93Å; T212-I275 PolarHBondContact N-O 2.75Å; T212-I275 PolarHBondContact OG1-O 2.76Å; I273-I275 HydrophobicContact CG2-CG1 4.26Å; I275-V305 WeakPolarHBondContact CA-O 3.09Å; I275-V305 HydrophobicContact CB-CB 4.42Å; I275-V305 HydrophobicContact CG1-CB 4.05Å; I275-V305 HydrophobicContact CG1-CG2 4.39Å; I275-V305 HydrophobicContact CG2-CB 4.38Å; I275-V305 HydrophobicContact CG2-CG1 4.4Å; I275-L307 HydrophobicContact CG2-CD1 4.19Å
276	L	95.4	Very high	88.6	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	99.4	179.8	-68.1	-172.4	0	0	0	107.8	T212 V274 V279 W291 M295 V305 M306 L307	T212-L276 HydrophobicContact CG2-CD2 4.33Å; T212-L276 WeakPolarHBondContact OG1-CA 3.41Å; T212-L276 WeakPolarHBondContact OG1-CD2 3.37Å; V274-L276 HydrophobicContact CG1-CD2 3.68Å; V274-L276 HydrophobicContact CG1-CG 4.08Å; L276-V279 HydrophobicContact CB-CG2 3.84Å; L276-V279 VanDerWaalsContact O-CG2 3.3Å; L276-V279 WeakPolarHBondContact O-CG2 3.36Å; L276-W291 HydrophobicContact CB-CZ3 3.94Å; L276-W291 HydrophobicContact CD2-CZ3 4.35Å; L276-M295 HydrophobicContact CD1-CE 3.59Å; L276-M295 HydrophobicContact CD1-CG 3.98Å; L276-V305 PolarHBondContact N-O 2.66Å; L276-M306 HydrophobicContact CB-CG 4.31Å; L276-M306 HydrophobicContact CD1-CG 4.15Å; L276-L307 PolarHBondContact O-N 3.24Å
277	D	93.1	Very high	88.6	Confident	9 Å²	9	35.4 Å²	35.4	5%	0.048	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	141.9	-178.1	-167.5	25	0	0	0	112.5	Y211 T212 W291	Y211-D277 HydrophobicContact CE1-CB 4.08Å; Y211-D277 PolarHBondContact OH-OD2 3.24Å; T212-D277 WeakPolarHBondContact O-CB 3.44Å; T212-D277 PolarHBondContact O-N 3.05Å; D277-W291 WeakPolarHBondContact O-CH2 3.39Å
278	E	90.1	Very high	88.7	Confident	16 Å²	16	34.3 Å²	34.3	8%	0.075	17%	0.169	C	C	.	.	S	Bend	trans	58.2	46.4	-177	-54	-79.4	114.4	0	0	114.1	P214 H280 Y281 L307	P214-E278 HydrophobicContact CG-CB 4.01Å; P214-E278 HydrophobicContact CG-CG 4.38Å; E278-H280 VanDerWaalsContact CD-CE1 3.5Å; E278-H280 PolarHBondContact O-N 3.47Å; E278-H280 IonicContact OE1-CE1 2.67Å; E278-H280 IonicContact OE2-CE1 2.75Å; E278-H280 PolarHBondContact OE2-CE1 3.2Å; E278-H280 IonicContact OE2-NE2 2.81Å; E278-H280 PolarHBondContact OE2-NE2 3.24Å; E278-Y281 HydrophobicContact CB-CD2 3.68Å; E278-Y281 HydrophobicContact CB-CE2 3.95Å; E278-Y281 WeakPolarHBondContact O-CB 3.37Å; E278-Y281 VanDerWaalsContact O-CD2 3.29Å; E278-Y281 WeakPolarHBondContact O-CD2 3.37Å; E278-Y281 PolarHBondContact O-N 2.85Å; E278-L307 CarbonylContact C-O 3.55Å; E278-L307 WeakPolarHBondContact CA-O 3.27Å; E278-L307 PolarHBondContact N-O 3.11Å
279	V	92.1	Very high	88.9	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-54.6	-24.7	-177	172.5	0	0	0	0	114.6	F182 L276 Y281 I282 W291 M295 M306 L307	F182-V279 HydrophobicContact CE2-CG1 4.2Å; F182-V279 HydrophobicContact CZ-CG1 4.28Å; L276-V279 HydrophobicContact CB-CG2 3.84Å; L276-V279 VanDerWaalsContact O-CG2 3.3Å; L276-V279 WeakPolarHBondContact O-CG2 3.36Å; V279-Y281 PolarHBondContact O-N 3.04Å; V279-I282 HydrophobicContact CG1-CD1 3.64Å; V279-I282 HydrophobicContact CG1-CG1 4.44Å; V279-I282 WeakPolarHBondContact O-CB 3.49Å; V279-I282 VanDerWaalsContact O-CG1 3.25Å; V279-I282 WeakPolarHBondContact O-CG1 3.37Å; V279-I282 PolarHBondContact O-N 3.44Å; V279-W291 HydrophobicContact CB-CZ3 4.47Å; V279-W291 HydrophobicContact CG2-CE3 4.47Å; V279-W291 HydrophobicContact CG2-CZ3 3.93Å; V279-M295 HydrophobicContact CG1-CE 3.81Å; V279-M295 HydrophobicContact CG2-CE 4.41Å; V279-M306 HydrophobicContact CG2-CB 3.88Å; V279-M306 HydrophobicContact CG2-CG 4.14Å; V279-L307 PolarHBondContact N-O 3.3Å
280	H	89.8	Confident	89.2	Confident	31 Å²	31	29 Å²	29	14%	0.144	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-59.5	-11.9	172.8	59.6	-81.8	0	0	0	114.1	E278 I282 N283 S308 A309 V311 Q549 L600	E278-H280 VanDerWaalsContact CD-CE1 3.5Å; E278-H280 PolarHBondContact O-N 3.47Å; E278-H280 IonicContact OE1-CE1 2.67Å; E278-H280 IonicContact OE2-CE1 2.75Å; E278-H280 PolarHBondContact OE2-CE1 3.2Å; E278-H280 IonicContact OE2-NE2 2.81Å; E278-H280 PolarHBondContact OE2-NE2 3.24Å; H280-I282 PolarHBondContact O-N 3.18Å; H280-N283 PolarHBondContact O-N 2.88Å; H280-S308 WeakPolarHBondContact CB-OG 3.27Å; H280-S308 PolarHBondContact N-OG 2.57Å; H280-A309 PolarHBondContact ND1-N 3.07Å; H280-V311 HydrophobicContact CB-CG1 4.14Å; H280-Q549 PolarHBondContact NE2-NE2 3.07Å; H280-L600 HydrophobicContact CB-CD2 3.99Å
281	Y	87	Confident	89.6	Confident	32 Å²	32	24.1 Å²	24.1	13%	0.125	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-63.1	-9.4	167.4	-88.9	-98.6	0	0	0	114.6	P214 E278 V279 N283 N284 T517	P214-Y281 HydrophobicContact CB-CD1 4.08Å; P214-Y281 HydrophobicContact CB-CD2 4.32Å; P214-Y281 HydrophobicContact CB-CE1 4.31Å; P214-Y281 HydrophobicContact CB-CG 4.07Å; P214-Y281 HydrophobicContact CG-CD2 4.07Å; P214-Y281 HydrophobicContact CG-CE2 4.05Å; P214-Y281 HydrophobicContact CG-CG 4.32Å; E278-Y281 HydrophobicContact CB-CD2 3.68Å; E278-Y281 HydrophobicContact CB-CE2 3.95Å; E278-Y281 WeakPolarHBondContact O-CB 3.37Å; E278-Y281 VanDerWaalsContact O-CD2 3.29Å; E278-Y281 WeakPolarHBondContact O-CD2 3.37Å; E278-Y281 PolarHBondContact O-N 2.85Å; V279-Y281 PolarHBondContact O-N 3.04Å; Y281-N283 PolarHBondContact O-N 3.46Å; Y281-N283 VanDerWaalsContact O-N 3.16Å; Y281-N284 HydrophobicContact CD1-CB 4.39Å; Y281-N284 WeakPolarHBondContact O-CB 3.47Å; Y281-N284 PolarHBondContact O-N 2.8Å; Y281-T517 WeakPolarHBondContact OH-CB 3.24Å; Y281-T517 WeakPolarHBondContact OH-CG2 3.43Å
282	I	88.8	Confident	89.6	Confident	7 Å²	7	24 Å²	24	4%	0.036	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-52.1	-32.2	166.8	-72.6	169	0	0	0	111.4	V279 H280 N284 G288 W291 M295 R603	V279-I282 HydrophobicContact CG1-CD1 3.64Å; V279-I282 HydrophobicContact CG1-CG1 4.44Å; V279-I282 WeakPolarHBondContact O-CB 3.49Å; V279-I282 VanDerWaalsContact O-CG1 3.25Å; V279-I282 WeakPolarHBondContact O-CG1 3.37Å; V279-I282 PolarHBondContact O-N 3.44Å; H280-I282 PolarHBondContact O-N 3.18Å; I282-N284 PolarHBondContact O-N 3.1Å; I282-G288 WeakPolarHBondContact O-CA 3.44Å; I282-W291 HydrophobicContact CG1-CB 3.7Å; I282-W291 HydrophobicContact CG1-CG 4.23Å; I282-M295 HydrophobicContact CD1-CE 3.83Å; I282-M295 HydrophobicContact CD1-SD 4.1Å; I282-R603 WeakPolarHBondContact O-CG 3.5Å
283	N	87.4	Confident	89.4	Confident	34 Å²	34	22 Å²	22	18%	0.182	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-71.4	-11.6	177	-91.8	-0.2	0	0	0	115	H280 Y281 E599 L600 I601 R603	H280-N283 PolarHBondContact O-N 2.88Å; Y281-N283 PolarHBondContact O-N 3.46Å; Y281-N283 VanDerWaalsContact O-N 3.16Å; N283-E599 PolarHBondContact ND2-O 2.93Å; N283-L600 HydrophobicContact CB-CD2 4.32Å; N283-L600 VanDerWaalsContact OD1-CA 3.25Å; N283-L600 WeakPolarHBondContact OD1-CA 3.44Å; N283-I601 PolarHBondContact OD1-N 3.22Å; N283-I601 PolarHBondContact OD1-O 2.92Å; N283-I601 VanDerWaalsContact OD1-O 3.12Å; N283-R603 PolarHBondContact O-NE 2.81Å; N283-R603 VanDerWaalsContact O-NE 3.13Å
284	N	84.9	Confident	89.3	Confident	48 Å²	48	22 Å²	22	26%	0.257	11%	0.109	S	C	.	.			trans	-66	121.4	-177.6	-173.9	-76.8	0	0	0	110	Y281 I282 D286 R287 G288	Y281-N284 HydrophobicContact CD1-CB 4.39Å; Y281-N284 WeakPolarHBondContact O-CB 3.47Å; Y281-N284 PolarHBondContact O-N 2.8Å; I282-N284 PolarHBondContact O-N 3.1Å; N284-D286 PolarHBondContact O-N 3.38Å; N284-D286 PolarHBondContact OD1-N 2.63Å; N284-R287 PolarHBondContact OD1-N 2.69Å; N284-G288 WeakPolarHBondContact O-CA 3.37Å; N284-G288 PolarHBondContact O-N 2.86Å
285	P	80.1	Confident	89	Confident	74 Å²	74	22 Å²	22	48%	0.481	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-27.7	-174.2	25.8	-34.9	0	0	0	113.3
286	D	76.1	Confident	88.8	Confident	73 Å²	73	22.4 Å²	22.4	39%	0.39	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-31.6	-174.5	-59.2	-32.8	0	0	0	112.7	N284 Y289 R605	N284-D286 PolarHBondContact O-N 3.38Å; N284-D286 PolarHBondContact OD1-N 2.63Å; D286-Y289 WeakPolarHBondContact O-CE1 3.46Å; D286-R605 PolarHBondContact O-NH2 2.82Å
287	R	83	Confident	88.5	Confident	78 Å²	78	23.6 Å²	23.6	29%	0.294	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124	-11.8	-170.7	-64.7	176.4	71	-160.7	2.3	114.6	P214 E255 N284 Y289 V290	P214-R287 PolarHBondContact O-NH1 3.4Å; P214-R287 PolarHBondContact O-NH2 2.81Å; E255-R287 IonicContact OE1-CZ 3.96Å; E255-R287 IonicContact OE1-NE 2.71Å; E255-R287 PolarHBondContact OE1-NE 2.94Å; E255-R287 IonicContact OE1-NH2 3.72Å; E255-R287 PolarHBondContact OE1-NH2 2.99Å; E255-R287 IonicContact OE2-NH2 2.66Å; E255-R287 PolarHBondContact OE2-NH2 3.41Å; N284-R287 PolarHBondContact OD1-N 2.69Å; R287-Y289 VanDerWaalsContact C-N 3.27Å; R287-Y289 PolarHBondContact O-N 3.45Å; R287-V290 PolarHBondContact O-N 3.11Å
288	G	86.5	Confident	88.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.1	-31.2	-174.2	0	0	0	0	0	114.1	I282 N284 V290 W291	I282-G288 WeakPolarHBondContact O-CA 3.44Å; N284-G288 WeakPolarHBondContact O-CA 3.37Å; N284-G288 PolarHBondContact O-N 2.86Å; G288-V290 VanDerWaalsContact C-N 3.27Å; G288-V290 PolarHBondContact O-N 3.27Å; G288-W291 WeakPolarHBondContact O-CB 3.37Å; G288-W291 PolarHBondContact O-N 3.27Å
289	Y	88.4	Confident	88.4	Confident	42 Å²	42	24.7 Å²	24.7	17%	0.165	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-30.2	178.9	71.9	-87.7	0	0	0	113.6	D286 R287 W291 E292 Q293 R603 R605 T607	D286-Y289 WeakPolarHBondContact O-CE1 3.46Å; R287-Y289 VanDerWaalsContact C-N 3.27Å; R287-Y289 PolarHBondContact O-N 3.45Å; Y289-W291 VanDerWaalsContact C-N 3.34Å; Y289-E292 PolarHBondContact O-N 3.37Å; Y289-Q293 WeakPolarHBondContact O-CG 3.18Å; Y289-Q293 PolarHBondContact O-N 2.97Å; Y289-Q293 VanDerWaalsContact O-N 3.13Å; Y289-R603 WeakPolarHBondContact CB-O 3.44Å; Y289-R605 HydrophobicContact CD1-CG 3.95Å; Y289-R605 HydrophobicContact CD2-CG 4.5Å; Y289-R605 HydrophobicContact CE1-CG 4.48Å; Y289-R605 HydrophobicContact CG-CG 3.97Å; Y289-T607 HydrophobicContact CE2-CG2 4.17Å
290	V	90.2	Very high	88.2	Confident	7 Å²	7	30.4 Å²	30.4	4%	0.042	15%	0.151	C	C	.	.	H	α-helix	trans	-67.4	-37.8	179.8	-178.9	0	0	0	0	110.7	Y258 R287 G288 E292 Q293 I294	Y258-V290 HydrophobicContact CG-CG1 4.11Å; R287-V290 PolarHBondContact O-N 3.11Å; G288-V290 VanDerWaalsContact C-N 3.27Å; G288-V290 PolarHBondContact O-N 3.27Å; V290-E292 PolarHBondContact O-N 3.03Å; V290-Q293 PolarHBondContact O-N 2.98Å; V290-I294 HydrophobicContact CG1-CD1 3.96Å; V290-I294 HydrophobicContact CG1-CG1 4.47Å; V290-I294 VanDerWaalsContact O-CG1 3.28Å; V290-I294 WeakPolarHBondContact O-CG1 3.28Å; V290-I294 PolarHBondContact O-N 2.98Å
291	W	91.5	Very high	88.1	Confident	4 Å²	4	34.5 Å²	34.5	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-47.3	177.2	-75.2	73.5	0	0	0	111.5	P214 T254 L276 D277 V279 I282 G288 Y289 Q293 I294 M295	P214-W291 HydrophobicContact CB-CZ2 4.06Å; T254-W291 HydrophobicContact CG2-CD2 4.13Å; T254-W291 HydrophobicContact CG2-CH2 3.75Å; T254-W291 HydrophobicContact CG2-CZ2 3.29Å; T254-W291 HydrophobicContact CG2-CZ3 4.41Å; L276-W291 HydrophobicContact CB-CZ3 3.94Å; L276-W291 HydrophobicContact CD2-CZ3 4.35Å; D277-W291 WeakPolarHBondContact O-CH2 3.39Å; V279-W291 HydrophobicContact CB-CZ3 4.47Å; V279-W291 HydrophobicContact CG2-CE3 4.47Å; V279-W291 HydrophobicContact CG2-CZ3 3.93Å; I282-W291 HydrophobicContact CG1-CB 3.7Å; I282-W291 HydrophobicContact CG1-CG 4.23Å; G288-W291 WeakPolarHBondContact O-CB 3.37Å; G288-W291 PolarHBondContact O-N 3.27Å; Y289-W291 VanDerWaalsContact C-N 3.34Å; W291-Q293 PolarHBondContact O-N 3.36Å; W291-I294 PolarHBondContact O-N 3.07Å; W291-M295 HydrophobicContact CE3-CE 4.41Å; W291-M295 WeakPolarHBondContact O-CG 3.32Å; W291-M295 PolarHBondContact O-N 3.15Å
292	E	91.9	Very high	88.4	Confident	2 Å²	2	33 Å²	33	1%	0.009	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-42.6	180	-157.4	178.5	131.7	0	0	111.4	Y289 V290 M295 I296 W320 S602 F604 S629 F630	Y289-E292 PolarHBondContact O-N 3.37Å; V290-E292 PolarHBondContact O-N 3.03Å; E292-M295 PolarHBondContact O-N 3.38Å; E292-I296 HydrophobicContact CG-CD1 4.27Å; E292-I296 WeakPolarHBondContact O-CD1 3.34Å; E292-I296 VanDerWaalsContact O-CG1 3.26Å; E292-I296 WeakPolarHBondContact O-CG1 3.4Å; E292-I296 PolarHBondContact O-N 3.28Å; E292-I296 VanDerWaalsContact O-N 3.12Å; E292-W320 HydrophobicContact CG-CH2 3.56Å; E292-W320 HydrophobicContact CG-CZ2 3.92Å; E292-S602 WeakPolarHBondContact OE2-CB 3.23Å; E292-S602 PolarHBondContact OE2-OG 3.5Å; E292-F604 HydrophobicContact CB-CD2 4.26Å; E292-F604 HydrophobicContact CG-CD2 4.3Å; E292-S629 WeakPolarHBondContact OE1-CA 3.47Å; E292-S629 WeakPolarHBondContact OE1-CB 3.39Å; E292-F630 HydrophobicContact CG-CB 4.49Å; E292-F630 PolarHBondContact OE1-N 3.43Å
293	Q	91.3	Very high	88.7	Confident	1 Å²	1	34 Å²	34	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-60	-46.6	175.1	-72.2	171.2	-4.9	0	0	112.1	Y258 Y289 V290 W291 M295 I296 M297 F604 M610	Y258-Q293 HydrophobicContact CD2-CB 4.17Å; Y258-Q293 HydrophobicContact CE2-CB 3.96Å; Y289-Q293 WeakPolarHBondContact O-CG 3.18Å; Y289-Q293 PolarHBondContact O-N 2.97Å; Y289-Q293 VanDerWaalsContact O-N 3.13Å; V290-Q293 PolarHBondContact O-N 2.98Å; W291-Q293 PolarHBondContact O-N 3.36Å; Q293-M295 PolarHBondContact O-N 2.92Å; Q293-I296 PolarHBondContact O-N 3.36Å; Q293-M297 HydrophobicContact CB-SD 4.49Å; Q293-M297 VanDerWaalsContact O-CB 3.28Å; Q293-M297 WeakPolarHBondContact O-CB 3.28Å; Q293-M297 WeakPolarHBondContact O-CG 3.46Å; Q293-M297 PolarHBondContact O-N 3.07Å; Q293-F604 HydrophobicContact CG-CE2 3.78Å; Q293-M610 PolarHBondContact NE2-SD 3.49Å
294	I	92.6	Very high	89.1	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-58.7	-48	177.4	-69.2	165.3	0	0	0	110.6	T254 L257 Y258 L261 V290 W291 I296 M297 L298	T254-I294 HydrophobicContact CG2-CD1 4.42Å; T254-I294 WeakPolarHBondContact O-CD1 3.41Å; L257-I294 HydrophobicContact CD2-CG2 3.75Å; L257-I294 HydrophobicContact CG-CG2 4.29Å; Y258-I294 HydrophobicContact CD2-CG1 4.37Å; L261-I294 HydrophobicContact CD1-CB 4.45Å; L261-I294 HydrophobicContact CD1-CG1 4.33Å; L261-I294 HydrophobicContact CD1-CG2 4.18Å; V290-I294 HydrophobicContact CG1-CD1 3.96Å; V290-I294 HydrophobicContact CG1-CG1 4.47Å; V290-I294 VanDerWaalsContact O-CG1 3.28Å; V290-I294 WeakPolarHBondContact O-CG1 3.28Å; V290-I294 PolarHBondContact O-N 2.98Å; W291-I294 PolarHBondContact O-N 3.07Å; I294-I296 VanDerWaalsContact C-N 3.28Å; I294-I296 PolarHBondContact O-N 3.39Å; I294-M297 PolarHBondContact O-N 3.01Å; I294-L298 HydrophobicContact CG2-CD1 3.62Å; I294-L298 HydrophobicContact CG2-CG 4.04Å; I294-L298 WeakPolarHBondContact O-CB 3.39Å; I294-L298 WeakPolarHBondContact O-CG 3.44Å; I294-L298 PolarHBondContact O-N 2.73Å
295	M	92.6	Very high	89.7	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.4	-38.4	-178.8	-73	178.8	175.2	0	0	112.7	L276 V279 I282 W291 E292 Q293 M306 W320 L321 R325	L276-M295 HydrophobicContact CD1-CE 3.59Å; L276-M295 HydrophobicContact CD1-CG 3.98Å; V279-M295 HydrophobicContact CG1-CE 3.81Å; V279-M295 HydrophobicContact CG2-CE 4.41Å; I282-M295 HydrophobicContact CD1-CE 3.83Å; I282-M295 HydrophobicContact CD1-SD 4.1Å; W291-M295 HydrophobicContact CE3-CE 4.41Å; W291-M295 WeakPolarHBondContact O-CG 3.32Å; W291-M295 PolarHBondContact O-N 3.15Å; E292-M295 PolarHBondContact O-N 3.38Å; Q293-M295 PolarHBondContact O-N 2.92Å; M295-M306 HydrophobicContact CE-CG 4.39Å; M295-M306 HydrophobicContact CE-SD 4Å; M295-W320 HydrophobicContact SD-CZ3 4.31Å; M295-L321 HydrophobicContact CB-CD1 3.78Å; M295-L321 HydrophobicContact CB-CD2 4.37Å; M295-L321 HydrophobicContact CG-CD2 4.32Å; M295-L321 HydrophobicContact SD-CD2 4.14Å; M295-R325 PolarHBondContact O-NH1 2.92Å
296	I	91.4	Very high	90.5	Very high	9 Å²	9	26.5 Å²	26.5	5%	0.046	13%	0.125	C	C	.	.	H	α-helix	trans	-74.7	-41.9	177.4	-62.9	164.4	0	0	0	111.8	E292 Q293 I294 W320 V324 I625 R628	E292-I296 HydrophobicContact CG-CD1 4.27Å; E292-I296 WeakPolarHBondContact O-CD1 3.34Å; E292-I296 VanDerWaalsContact O-CG1 3.26Å; E292-I296 WeakPolarHBondContact O-CG1 3.4Å; E292-I296 PolarHBondContact O-N 3.28Å; E292-I296 VanDerWaalsContact O-N 3.12Å; Q293-I296 PolarHBondContact O-N 3.36Å; I294-I296 VanDerWaalsContact C-N 3.28Å; I294-I296 PolarHBondContact O-N 3.39Å; I296-W320 HydrophobicContact CD1-CZ2 4.06Å; I296-W320 HydrophobicContact CG1-CH2 4.28Å; I296-W320 HydrophobicContact CG1-CZ2 3.95Å; I296-V324 HydrophobicContact CG1-CG1 4.3Å; I296-V324 HydrophobicContact CG2-CG1 4.26Å; I296-I625 HydrophobicContact CD1-CG2 4.23Å; I296-I625 HydrophobicContact CG2-CG1 4.16Å; I296-R628 HydrophobicContact CD1-CB 4.25Å; I296-R628 HydrophobicContact CG1-CB 4.35Å; I296-R628 HydrophobicContact CG2-CB 3.84Å
297	M	90.4	Very high	91.4	Very high	26 Å²	26	23 Å²	23	13%	0.128	11%	0.106	C	C	.	.	H	α-helix	trans	-79.6	-25.3	-172.8	-71.3	176.8	72.4	0	0	113.8	Y258 L261 Q293 I294 L614 L620 I625	Y258-M297 HydrophobicContact CD2-SD 4.32Å; Y258-M297 HydrophobicContact CE2-SD 3.91Å; L261-M297 HydrophobicContact CB-CE 4.14Å; L261-M297 HydrophobicContact CD1-CB 4.29Å; Q293-M297 HydrophobicContact CB-SD 4.49Å; Q293-M297 VanDerWaalsContact O-CB 3.28Å; Q293-M297 WeakPolarHBondContact O-CB 3.28Å; Q293-M297 WeakPolarHBondContact O-CG 3.46Å; Q293-M297 PolarHBondContact O-N 3.07Å; I294-M297 PolarHBondContact O-N 3.01Å; M297-L614 HydrophobicContact CE-CD2 4.07Å; M297-L614 HydrophobicContact SD-CD2 4.42Å; M297-L620 HydrophobicContact CG-CD1 4.29Å; M297-I625 HydrophobicContact CG-CD1 3.79Å; M297-I625 HydrophobicContact SD-CD1 4.08Å
298	L	91.4	Very high	91.8	Very high	5 Å²	5	19.3 Å²	19.3	3%	0.026	9%	0.092	C	C	.	.	S	Bend	trans	-58.9	129	-179	-82.3	167.4	0	0	0	111	L261 V274 I294 I302 L304 R325	L261-L298 HydrophobicContact CD1-CD2 4.12Å; L261-L298 HydrophobicContact CD1-CG 4.14Å; L261-L298 HydrophobicContact CD2-CD2 3.93Å; L261-L298 HydrophobicContact CD2-CG 4.49Å; V274-L298 HydrophobicContact CB-CD1 4.41Å; V274-L298 HydrophobicContact CG1-CD1 4.28Å; V274-L298 HydrophobicContact CG2-CD1 4.38Å; V274-L298 HydrophobicContact CG2-CD2 4.14Å; I294-L298 HydrophobicContact CG2-CD1 3.62Å; I294-L298 HydrophobicContact CG2-CG 4.04Å; I294-L298 WeakPolarHBondContact O-CB 3.39Å; I294-L298 WeakPolarHBondContact O-CG 3.44Å; I294-L298 PolarHBondContact O-N 2.73Å; L298-I302 HydrophobicContact CD2-CD1 3.78Å; L298-L304 HydrophobicContact CD1-CD2 3.61Å; L298-R325 PolarHBondContact O-NH1 3.02Å
299	P	89	Confident	91.9	Very high	43 Å²	43	20.1 Å²	20.1	28%	0.279	10%	0.099	S	C	.	.			trans	-51.1	144.5	176.1	-29.8	33.2	0	0	0	113.9	I268 H301 I302 R325	I268-P299 HydrophobicContact CG2-CG 4.22Å; P299-H301 WeakPolarHBondContact CB-CE1 3.18Å; P299-H301 WeakPolarHBondContact CB-ND1 3.46Å; P299-H301 PolarHBondContact O-N 3.16Å; P299-H301 VanDerWaalsContact O-N 3.13Å; P299-I302 HydrophobicContact CB-CD1 4.27Å; P299-I302 HydrophobicContact CB-CG1 4.33Å; P299-I302 HydrophobicContact CG-CD1 4.12Å; P299-I302 PolarHBondContact O-N 3.42Å; P299-I302 VanDerWaalsContact O-N 3.11Å; P299-R325 PolarHBondContact O-NH2 2.79Å
300	K	87.2	Confident	91.9	Very high	121 Å²	121	18.9 Å²	18.9	53%	0.526	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-25.2	-175.7	-66.1	-172.3	171.9	-167.3	0	114.5	E86 I302 R325	E86-K300 IonicContact OE1-NZ 3.36Å; E86-K300 PolarHBondContact OE1-NZ 3.43Å; K300-I302 VanDerWaalsContact C-N 3.29Å; K300-I302 PolarHBondContact O-N 3.09Å; K300-R325 WeakPolarHBondContact CD-O 3.44Å; K300-R325 WeakPolarHBondContact CE-O 3.29Å; K300-R325 WeakPolarHBondContact CG-O 3.42Å
301	H	88.6	Confident	91.9	Very high	117 Å²	117	19.2 Å²	19.2	54%	0.542	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-17.1	179.7	65.1	-96.9	0	0	0	113.7	P299	P299-H301 WeakPolarHBondContact CB-CE1 3.18Å; P299-H301 WeakPolarHBondContact CB-ND1 3.46Å; P299-H301 PolarHBondContact O-N 3.16Å; P299-H301 VanDerWaalsContact O-N 3.13Å
302	I	93.3	Very high	91.8	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	11%	0.112	C	C	.	.	S	Bend	trans	-80	127.1	-179.4	-58.2	-179.5	0	0	0	109.3	I268 L271 E272 V274 L298 P299 K300 R325	I268-I302 HydrophobicContact CG2-CD1 4.21Å; L271-I302 HydrophobicContact CB-CD1 4.39Å; L271-I302 HydrophobicContact CD2-CD1 4.09Å; L271-I302 HydrophobicContact CG-CD1 4.22Å; E272-I302 WeakPolarHBondContact O-CA 3.31Å; V274-I302 HydrophobicContact CB-CG2 4.16Å; V274-I302 HydrophobicContact CG2-CG2 3.63Å; L298-I302 HydrophobicContact CD2-CD1 3.78Å; P299-I302 HydrophobicContact CB-CD1 4.27Å; P299-I302 HydrophobicContact CB-CG1 4.33Å; P299-I302 HydrophobicContact CG-CD1 4.12Å; P299-I302 PolarHBondContact O-N 3.42Å; P299-I302 VanDerWaalsContact O-N 3.11Å; K300-I302 VanDerWaalsContact C-N 3.29Å; K300-I302 PolarHBondContact O-N 3.09Å; I302-R325 PolarHBondContact O-NH2 2.9Å
303	L	94.7	Very high	91.9	Very high	26 Å²	26	22 Å²	22	14%	0.136	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	140.3	173.3	-59.9	175.6	0	0	0	110.4	N178 E272 I273 V274	N178-L303 HydrophobicContact CB-CD1 4.03Å; N178-L303 WeakPolarHBondContact O-CD2 3.36Å; E272-L303 PolarHBondContact O-N 2.85Å; I273-L303 WeakPolarHBondContact CA-O 3.37Å; I273-L303 HydrophobicContact CG1-CB 4.22Å; I273-L303 HydrophobicContact CG1-CD1 4.44Å; V274-L303 PolarHBondContact N-O 3.14Å
304	L	96.4	Very high	91.9	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137.4	178.1	-53	175.9	0	0	0	110.8	T180 V181 V274 L298 M306 L321	T180-L304 HydrophobicContact CG2-CB 3.71Å; T180-L304 HydrophobicContact CG2-CG 4.46Å; T180-L304 WeakPolarHBondContact CG2-O 3.46Å; T180-L304 PolarHBondContact OG1-N 3.26Å; V181-L304 PolarHBondContact N-O 2.86Å; V274-L304 HydrophobicContact CB-CD2 4.1Å; L298-L304 HydrophobicContact CD1-CD2 3.61Å; L304-M306 HydrophobicContact CB-CG 4.49Å; L304-L321 HydrophobicContact CD1-CD2 3.76Å; L304-L321 HydrophobicContact CD1-CG 4.5Å
305	V	97.1	Very high	92	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	99.3	168.5	-177.3	0	0	0	0	107.6	L175 V181 V194 A198 I273 V274 I275 L276 L307	L175-V305 HydrophobicContact CD2-CG2 3.64Å; V181-V305 HydrophobicContact CG2-CB 4.28Å; V181-V305 HydrophobicContact CG2-CG1 3.93Å; V181-V305 HydrophobicContact CG2-CG2 4.19Å; V194-V305 HydrophobicContact CG1-CG1 3.99Å; A198-V305 HydrophobicContact CB-CG2 4.06Å; I273-V305 HydrophobicContact CG2-CG2 3.71Å; V274-V305 PolarHBondContact O-N 3.22Å; I275-V305 WeakPolarHBondContact CA-O 3.09Å; I275-V305 HydrophobicContact CB-CB 4.42Å; I275-V305 HydrophobicContact CG1-CB 4.05Å; I275-V305 HydrophobicContact CG1-CG2 4.39Å; I275-V305 HydrophobicContact CG2-CB 4.38Å; I275-V305 HydrophobicContact CG2-CG1 4.4Å; L276-V305 PolarHBondContact N-O 2.66Å; V305-L307 HydrophobicContact CG1-CD2 4.04Å; V305-L307 HydrophobicContact CG1-CG 4.39Å
306	M	96.7	Very high	91.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.4	-176.8	-72	174.4	-72.5	0	0	109.8	T180 V181 F182 V183 L276 V279 M295 L304 L321 I329	T180-M306 HydrophobicContact CG2-CE 4.1Å; V181-M306 PolarHBondContact O-N 2.94Å; F182-M306 HydrophobicContact CB-CB 4.4Å; F182-M306 HydrophobicContact CB-CE 3.94Å; F182-M306 HydrophobicContact CD2-CB 3.94Å; F182-M306 HydrophobicContact CD2-CE 3.7Å; F182-M306 HydrophobicContact CD2-CG 4.47Å; F182-M306 HydrophobicContact CD2-SD 3.68Å; F182-M306 HydrophobicContact CE2-CB 4.43Å; F182-M306 HydrophobicContact CE2-SD 4.16Å; F182-M306 HydrophobicContact CG-CB 4.16Å; F182-M306 HydrophobicContact CG-CE 4.26Å; V183-M306 PolarHBondContact N-O 3.25Å; L276-M306 HydrophobicContact CB-CG 4.31Å; L276-M306 HydrophobicContact CD1-CG 4.15Å; V279-M306 HydrophobicContact CG2-CB 3.88Å; V279-M306 HydrophobicContact CG2-CG 4.14Å; M295-M306 HydrophobicContact CE-CG 4.39Å; M295-M306 HydrophobicContact CE-SD 4Å; L304-M306 HydrophobicContact CB-CG 4.49Å; M306-L321 HydrophobicContact CE-CD2 3.97Å; M306-L321 HydrophobicContact SD-CD2 3.68Å; M306-I329 HydrophobicContact CE-CD1 4.21Å; M306-I329 HydrophobicContact CE-CG2 3.87Å
307	L	94.8	Very high	92	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.9	178.2	-54.3	-178.8	0	0	0	109.2	V183 K191 V194 A195 I275 L276 E278 V279 V305	V183-L307 HydrophobicContact CB-CD2 3.92Å; V183-L307 HydrophobicContact CG2-CD2 4.11Å; K191-L307 HydrophobicContact CB-CD1 4.43Å; K191-L307 HydrophobicContact CB-CD2 4.49Å; K191-L307 HydrophobicContact CD-CB 4.45Å; V194-L307 HydrophobicContact CB-CD2 4.28Å; V194-L307 HydrophobicContact CG1-CD2 4.42Å; A195-L307 HydrophobicContact CB-CD1 3.95Å; I275-L307 HydrophobicContact CG2-CD1 4.19Å; L276-L307 PolarHBondContact O-N 3.24Å; E278-L307 CarbonylContact C-O 3.55Å; E278-L307 WeakPolarHBondContact CA-O 3.27Å; E278-L307 PolarHBondContact N-O 3.11Å; V279-L307 PolarHBondContact N-O 3.3Å; V305-L307 HydrophobicContact CG1-CD2 4.04Å; V305-L307 HydrophobicContact CG1-CG 4.39Å
308	S	92.4	Very high	92.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	159.6	-178.4	-161.7	0	0	0	0	112.2	V183 A185 K191 H280	V183-S308 PolarHBondContact O-N 3.02Å; A185-S308 PolarHBondContact N-O 2.82Å; A185-S308 VanDerWaalsContact N-O 3.07Å; A185-S308 VanDerWaalsContact O-O 3.1Å; K191-S308 VanDerWaalsContact CD-O 3.24Å; K191-S308 WeakPolarHBondContact CD-O 3.42Å; H280-S308 WeakPolarHBondContact CB-OG 3.27Å; H280-S308 PolarHBondContact N-OG 2.57Å
309	A	87.9	Confident	92.2	Very high	17 Å²	17	28 Å²	28	14%	0.14	14%	0.143	C	C	.	.	S	Bend	trans	-61.1	171.2	159	0	0	0	0	0	109.7	S184 A185 H280 V311	S184-A309 PolarHBondContact OG-O 3.44Å; A185-A309 WeakPolarHBondContact O-CA 3.26Å; H280-A309 PolarHBondContact ND1-N 3.07Å; A309-V311 PolarHBondContact O-N 3.24Å
310	T	88.7	Confident	92.3	Very high	15 Å²	15	26.5 Å²	26.5	9%	0.092	13%	0.132	C	C	.	.			trans	-57.1	127.5	170.3	48.6	0	0	0	0	108.9	S184 Q597	S184-T310 VanDerWaalsContact OG-CA 3.27Å; S184-T310 WeakPolarHBondContact OG-CA 3.37Å; T310-Q597 PolarHBondContact O-OE1 2.5Å; T310-Q597 PolarHBondContact OG1-NE2 3.4Å; T310-Q597 PolarHBondContact OG1-OE1 2.97Å
311	V	89.8	Confident	92.6	Very high	14 Å²	14	20.8 Å²	20.8	9%	0.085	11%	0.107	C	C	.	.			trans	-140.7	133.8	177.4	-66.6	0	0	0	0	109.1	F182 S184 H280 A309 N313 L600	F182-V311 HydrophobicContact CE1-CG2 4.29Å; F182-V311 HydrophobicContact CZ-CG2 4.35Å; S184-V311 PolarHBondContact OG-N 3.24Å; S184-V311 VanDerWaalsContact OG-N 3.07Å; H280-V311 HydrophobicContact CB-CG1 4.14Å; A309-V311 PolarHBondContact O-N 3.24Å; V311-N313 PolarHBondContact O-N 2.98Å; V311-L600 HydrophobicContact CB-CD1 4.12Å; V311-L600 HydrophobicContact CB-CG 4.12Å; V311-L600 HydrophobicContact CG1-CD1 3.91Å; V311-L600 HydrophobicContact CG1-CD2 4Å; V311-L600 HydrophobicContact CG1-CG 3.86Å; V311-L600 HydrophobicContact CG2-CD1 3.94Å; V311-L600 HydrophobicContact CG2-CG 4.46Å
312	P	90.2	Very high	92.7	Very high	51 Å²	51	15.2 Å²	15.2	33%	0.331	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-21.8	-171.3	27.8	-36.3	0	0	0	114.5	E599	P312-E599 HydrophobicContact CB-CG 4.48Å; P312-E599 HydrophobicContact CG-CB 4.4Å; P312-E599 HydrophobicContact CG-CG 3.57Å
313	N	92.2	Very high	92.5	Very high	14 Å²	14	18.7 Å²	18.7	8%	0.075	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	31.8	-177.5	67	-33.1	0	0	0	113.3	V311 F315 E316 I317 E599 L600	V311-N313 PolarHBondContact O-N 2.98Å; N313-F315 VanDerWaalsContact C-N 3.28Å; N313-F315 PolarHBondContact O-N 3.05Å; N313-E316 HydrophobicContact CB-CB 4.33Å; N313-E316 PolarHBondContact O-N 3.19Å; N313-I317 PolarHBondContact O-N 3.34Å; N313-E599 HydrophobicContact CB-CG 4.39Å; N313-L600 PolarHBondContact ND2-O 3.18Å; N313-L600 PolarHBondContact OD1-N 2.72Å
314	S	92.6	Very high	92.2	Very high	11 Å²	11	18.6 Å²	18.6	8%	0.077	10%	0.095	C	C	.	.	H	α-helix	trans	-56.3	-40.3	176.2	53.2	0	0	0	0	112.8	E316 I317 A318	S314-E316 PolarHBondContact O-N 3.32Å; S314-I317 PolarHBondContact O-N 2.77Å; S314-A318 WeakPolarHBondContact O-CB 3.24Å; S314-A318 PolarHBondContact O-N 3.34Å
315	F	93.5	Very high	91.8	Very high	80 Å²	80	18.9 Å²	18.9	35%	0.351	10%	0.096	S	C	.	.	H	α-helix	trans	-62.2	-41.2	177.7	-173.2	-89.2	0	0	0	112.6	S135 A137 E139 N313 I317 A318 D319	S135-F315 WeakPolarHBondContact OG-CZ 3.43Å; A137-F315 HydrophobicContact CB-CD1 4.49Å; A137-F315 HydrophobicContact CB-CD2 3.8Å; A137-F315 HydrophobicContact CB-CE1 4.28Å; A137-F315 HydrophobicContact CB-CE2 3.55Å; A137-F315 HydrophobicContact CB-CG 4.27Å; A137-F315 HydrophobicContact CB-CZ 3.81Å; A137-F315 WeakPolarHBondContact O-CE2 3.43Å; E139-F315 HydrophobicContact CB-CD2 4.33Å; E139-F315 HydrophobicContact CB-CE2 4.5Å; N313-F315 VanDerWaalsContact C-N 3.28Å; N313-F315 PolarHBondContact O-N 3.05Å; F315-I317 PolarHBondContact O-N 3.32Å; F315-A318 PolarHBondContact O-N 2.98Å; F315-D319 WeakPolarHBondContact O-CB 3.38Å; F315-D319 PolarHBondContact O-N 2.99Å
316	E	91.9	Very high	91.3	Very high	72 Å²	72	20.6 Å²	20.6	34%	0.336	11%	0.113	S	C	.	.	H	α-helix	trans	-64.7	-42.9	-179.5	-173.3	-178.2	-166.9	0	0	111.8	N313 S314 D319 W320 F630 R637	N313-E316 HydrophobicContact CB-CB 4.33Å; N313-E316 PolarHBondContact O-N 3.19Å; S314-E316 PolarHBondContact O-N 3.32Å; E316-D319 PolarHBondContact O-N 3.05Å; E316-W320 WeakPolarHBondContact O-CB 3.42Å; E316-W320 PolarHBondContact O-N 3.25Å; E316-F630 HydrophobicContact CG-CE2 4.12Å; E316-F630 HydrophobicContact CG-CZ 4.25Å; E316-R637 IonicContact OE1-NH1 2.71Å
317	I	92.2	Very high	90.8	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.015	12%	0.124	C	C	.	.	H	α-helix	trans	-67.8	-43	177.6	-67.1	165.8	0	0	0	110.8	F182 N313 S314 F315 D319 W320 L321 L600 F630	F182-I317 HydrophobicContact CE2-CG2 4.13Å; N313-I317 PolarHBondContact O-N 3.34Å; S314-I317 PolarHBondContact O-N 2.77Å; F315-I317 PolarHBondContact O-N 3.32Å; I317-D319 VanDerWaalsContact C-N 3.3Å; I317-D319 PolarHBondContact O-N 2.83Å; I317-W320 HydrophobicContact CG2-CE3 4.17Å; I317-W320 HydrophobicContact CG2-CZ3 4.44Å; I317-W320 PolarHBondContact O-N 2.95Å; I317-L321 WeakPolarHBondContact O-CB 3.37Å; I317-L321 PolarHBondContact O-N 3.48Å; I317-L600 HydrophobicContact CD1-CB 3.4Å; I317-L600 HydrophobicContact CD1-CD1 3.26Å; I317-L600 HydrophobicContact CD1-CG 3.89Å; I317-F630 HydrophobicContact CG1-CE1 4.29Å; I317-F630 HydrophobicContact CG1-CE2 4.05Å; I317-F630 HydrophobicContact CG1-CZ 3.87Å
318	A	94	Very high	90.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.7	-39.3	175.6	0	0	0	0	0	111.6	A137 S314 F315 G322 I329 V331	A137-A318 HydrophobicContact CB-CB 3.83Å; S314-A318 WeakPolarHBondContact O-CB 3.24Å; S314-A318 PolarHBondContact O-N 3.34Å; F315-A318 PolarHBondContact O-N 2.98Å; A318-G322 PolarHBondContact O-N 3.04Å; A318-I329 HydrophobicContact CB-CB 4.15Å; A318-I329 HydrophobicContact CB-CG2 3.72Å; A318-V331 HydrophobicContact CB-CG2 3.31Å
319	D	92.4	Very high	90.8	Very high	4 Å²	4	25.2 Å²	25.2	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-68.9	-42.8	177.9	-177	68.3	0	0	0	111.4	S135 Y136 A137 F315 E316 I317 R323 R637	S135-D319 WeakPolarHBondContact CA-OD1 3.4Å; S135-D319 WeakPolarHBondContact CB-OD1 3.48Å; S135-D319 PolarHBondContact OG-OD1 3.04Å; Y136-D319 PolarHBondContact N-OD1 3.03Å; A137-D319 HydrophobicContact CB-CB 3.93Å; F315-D319 WeakPolarHBondContact O-CB 3.38Å; F315-D319 PolarHBondContact O-N 2.99Å; E316-D319 PolarHBondContact O-N 3.05Å; I317-D319 VanDerWaalsContact C-N 3.3Å; I317-D319 PolarHBondContact O-N 2.83Å; D319-R323 VanDerWaalsContact O-CG 3.29Å; D319-R323 WeakPolarHBondContact O-CG 3.41Å; D319-R323 PolarHBondContact O-N 3.39Å; D319-R323 IonicContact OD1-CZ 3.87Å; D319-R323 IonicContact OD1-NE 2.79Å; D319-R323 IonicContact OD1-NH2 3.89Å; D319-R323 PolarHBondContact OD1-NH2 3.33Å; D319-R323 IonicContact OD2-CZ 2.92Å; D319-R323 VanDerWaalsContact OD2-CZ 3.31Å; D319-R323 IonicContact OD2-NE 3.69Å; D319-R323 PolarHBondContact OD2-NE 3.3Å; D319-R323 IonicContact OD2-NH2 3.38Å; D319-R323 PolarHBondContact OD2-NH2 2.8Å; D319-R637 IonicContact OD2-CZ 2.98Å; D319-R637 IonicContact OD2-NE 2.8Å; D319-R637 IonicContact OD2-NH2 2.68Å; D319-R637 PolarHBondContact OD2-NH2 3.2Å
320	W	92.3	Very high	91.2	Very high	11 Å²	11	24.6 Å²	24.6	4%	0.042	13%	0.132	C	C	.	.	H	α-helix	trans	-58.7	-52.9	173.7	160.3	71.8	0	0	0	111.3	E292 M295 I296 E316 I317 G322 R323 V324 R628 S629 F630 A633	E292-W320 HydrophobicContact CG-CH2 3.56Å; E292-W320 HydrophobicContact CG-CZ2 3.92Å; M295-W320 HydrophobicContact SD-CZ3 4.31Å; I296-W320 HydrophobicContact CD1-CZ2 4.06Å; I296-W320 HydrophobicContact CG1-CH2 4.28Å; I296-W320 HydrophobicContact CG1-CZ2 3.95Å; E316-W320 WeakPolarHBondContact O-CB 3.42Å; E316-W320 PolarHBondContact O-N 3.25Å; I317-W320 HydrophobicContact CG2-CE3 4.17Å; I317-W320 HydrophobicContact CG2-CZ3 4.44Å; I317-W320 PolarHBondContact O-N 2.95Å; W320-G322 VanDerWaalsContact C-N 3.32Å; W320-G322 PolarHBondContact O-N 2.84Å; W320-R323 WeakPolarHBondContact O-CB 3.29Å; W320-R323 PolarHBondContact O-N 3.36Å; W320-V324 WeakPolarHBondContact O-CG2 3.43Å; W320-V324 PolarHBondContact O-N 3.32Å; W320-R628 VanDerWaalsContact CZ2-O 3.27Å; W320-R628 WeakPolarHBondContact CZ2-O 3.28Å; W320-R628 PolarHBondContact NE1-O 3.05Å; W320-S629 PolarHBondContact NE1-O 3.04Å; W320-F630 HydrophobicContact CB-CD2 3.86Å; W320-F630 HydrophobicContact CB-CE2 4.17Å; W320-F630 HydrophobicContact CD2-CB 3.9Å; W320-F630 AromaticContact CD2-CD2 3.68Å; W320-F630 HydrophobicContact CD2-CD2 3.68Å; W320-F630 HydrophobicContact CD2-CG 4.22Å; W320-F630 HydrophobicContact CE3-CB 4.16Å; W320-F630 AromaticContact CE3-CD2 3.96Å; W320-F630 HydrophobicContact CE3-CD2 3.96Å; W320-F630 HydrophobicContact CE3-CG 4.36Å; W320-F630 HydrophobicContact CG-CB 4.48Å; W320-F630 AromaticContact CG-CD2 3.62Å; W320-F630 HydrophobicContact CG-CD2 3.62Å; W320-F630 HydrophobicContact CG-CE2 4.41Å; W320-F630 HydrophobicContact CH2-CB 4.18Å; W320-F630 HydrophobicContact CZ2-CB 3.89Å; W320-F630 HydrophobicContact CZ3-CB 4.3Å; W320-A633 HydrophobicContact CB-CB 4.37Å; W320-A633 HydrophobicContact CG-CB 4.13Å
321	L	92.3	Very high	91.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.1	-38.3	-177.3	-175.6	57.3	0	0	0	111.5	M295 L304 M306 I317 R323 V324 R325 I329	M295-L321 HydrophobicContact CB-CD1 3.78Å; M295-L321 HydrophobicContact CB-CD2 4.37Å; M295-L321 HydrophobicContact CG-CD2 4.32Å; M295-L321 HydrophobicContact SD-CD2 4.14Å; L304-L321 HydrophobicContact CD1-CD2 3.76Å; L304-L321 HydrophobicContact CD1-CG 4.5Å; M306-L321 HydrophobicContact CE-CD2 3.97Å; M306-L321 HydrophobicContact SD-CD2 3.68Å; I317-L321 WeakPolarHBondContact O-CB 3.37Å; I317-L321 PolarHBondContact O-N 3.48Å; L321-R323 VanDerWaalsContact C-N 3.34Å; L321-R323 PolarHBondContact O-N 3.08Å; L321-V324 PolarHBondContact O-N 2.92Å; L321-R325 HydrophobicContact CD1-CG 3.91Å; L321-R325 HydrophobicContact CG-CG 4.36Å; L321-R325 WeakPolarHBondContact O-CB 3.41Å; L321-R325 WeakPolarHBondContact O-CG 3.3Å; L321-R325 PolarHBondContact O-N 2.94Å; L321-I329 HydrophobicContact CB-CD1 3.82Å; L321-I329 HydrophobicContact CD2-CD1 3.97Å; L321-I329 HydrophobicContact CG-CD1 3.79Å
322	G	91.8	Very high	91.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.2	-40.1	174.4	0	0	0	0	0	112.5	Y136 A318 W320 G326 C327	Y136-G322 VanDerWaalsContact CD1-O 3.23Å; Y136-G322 WeakPolarHBondContact CD1-O 3.19Å; A318-G322 PolarHBondContact O-N 3.04Å; W320-G322 VanDerWaalsContact C-N 3.32Å; W320-G322 PolarHBondContact O-N 2.84Å; G322-G326 CarbonylContact O-C 3.52Å; G322-G326 VanDerWaalsContact O-CA 3.24Å; G322-G326 WeakPolarHBondContact O-CA 3.17Å; G322-G326 PolarHBondContact O-N 3.05Å; G322-C327 CarbonylContact C-O 2.96Å; G322-C327 WeakPolarHBondContact CA-O 3.4Å; G322-C327 PolarHBondContact O-N 3Å; G322-C327 VanDerWaalsContact O-N 3.09Å
323	R	88.6	Confident	91.8	Very high	74 Å²	74	22 Å²	22	28%	0.279	12%	0.118	S	C	.	.	H	α-helix	trans	-64.9	-45.6	172.4	-73.3	174.9	-160	-85.5	-4.4	112.4	D134 Y136 D319 W320 L321 R325 G326	D134-R323 PolarHBondContact O-NH2 2.94Å; Y136-R323 HydrophobicContact CD2-CB 4.27Å; Y136-R323 HydrophobicContact CD2-CG 3.36Å; Y136-R323 HydrophobicContact CE2-CG 3.75Å; Y136-R323 HydrophobicContact CG-CG 4.1Å; D319-R323 VanDerWaalsContact O-CG 3.29Å; D319-R323 WeakPolarHBondContact O-CG 3.41Å; D319-R323 PolarHBondContact O-N 3.39Å; D319-R323 IonicContact OD1-CZ 3.87Å; D319-R323 IonicContact OD1-NE 2.79Å; D319-R323 IonicContact OD1-NH2 3.89Å; D319-R323 PolarHBondContact OD1-NH2 3.33Å; D319-R323 IonicContact OD2-CZ 2.92Å; D319-R323 VanDerWaalsContact OD2-CZ 3.31Å; D319-R323 IonicContact OD2-NE 3.69Å; D319-R323 PolarHBondContact OD2-NE 3.3Å; D319-R323 IonicContact OD2-NH2 3.38Å; D319-R323 PolarHBondContact OD2-NH2 2.8Å; W320-R323 WeakPolarHBondContact O-CB 3.29Å; W320-R323 PolarHBondContact O-N 3.36Å; L321-R323 VanDerWaalsContact C-N 3.34Å; L321-R323 PolarHBondContact O-N 3.08Å; R323-R325 PolarHBondContact O-N 3.3Å; R323-G326 PolarHBondContact O-N 2.68Å
324	V	88.2	Confident	91.7	Very high	25 Å²	25	22.2 Å²	22.2	15%	0.152	12%	0.12	C	C	.	.	H	α-helix	trans	-63.4	-42	-179.3	170.6	0	0	0	0	111.5	I296 W320 L321 R628	I296-V324 HydrophobicContact CG1-CG1 4.3Å; I296-V324 HydrophobicContact CG2-CG1 4.26Å; W320-V324 WeakPolarHBondContact O-CG2 3.43Å; W320-V324 PolarHBondContact O-N 3.32Å; L321-V324 PolarHBondContact O-N 2.92Å; V324-R628 HydrophobicContact CG1-CB 4.04Å; V324-R628 HydrophobicContact CG1-CG 4.22Å; V324-R628 HydrophobicContact CG2-CB 4.09Å; V324-R628 HydrophobicContact CG2-CG 4.48Å
325	R	88.1	Confident	91.2	Very high	6 Å²	6	28.7 Å²	28.7	2%	0.023	15%	0.154	C	C	.	.	H	α-helix	trans	-85.1	-21.6	-179.2	-64.1	-179.7	70	72.2	4.7	112.8	M295 L298 P299 K300 I302 L321 R323	M295-R325 PolarHBondContact O-NH1 2.92Å; L298-R325 PolarHBondContact O-NH1 3.02Å; P299-R325 PolarHBondContact O-NH2 2.79Å; K300-R325 WeakPolarHBondContact CD-O 3.44Å; K300-R325 WeakPolarHBondContact CE-O 3.29Å; K300-R325 WeakPolarHBondContact CG-O 3.42Å; I302-R325 PolarHBondContact O-NH2 2.9Å; L321-R325 HydrophobicContact CD1-CG 3.91Å; L321-R325 HydrophobicContact CG-CG 4.36Å; L321-R325 WeakPolarHBondContact O-CB 3.41Å; L321-R325 WeakPolarHBondContact O-CG 3.3Å; L321-R325 PolarHBondContact O-N 2.94Å; R323-R325 PolarHBondContact O-N 3.3Å
326	G	85.8	Confident	90.5	Very high	35 Å²	35	33.1 Å²	33.1	36%	0.361	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	28.6	-172.7	0	0	0	0	0	113.4	G322 R323	G322-G326 CarbonylContact O-C 3.52Å; G322-G326 VanDerWaalsContact O-CA 3.24Å; G322-G326 WeakPolarHBondContact O-CA 3.17Å; G322-G326 PolarHBondContact O-N 3.05Å; R323-G326 PolarHBondContact O-N 2.68Å
327	C	87.7	Confident	90.2	Very high	33 Å²	33	31 Å²	31	22%	0.223	16%	0.162	C	C	.	.	S	Bend	trans	-126.3	155.6	179.7	65.6	0	0	0	0	112	Y136 G322	Y136-C327 WeakPolarHBondContact CD1-O 3.44Å; G322-C327 CarbonylContact C-O 2.96Å; G322-C327 WeakPolarHBondContact CA-O 3.4Å; G322-C327 PolarHBondContact O-N 3Å; G322-C327 VanDerWaalsContact O-N 3.09Å
328	E	90.9	Very high	89.8	Confident	65 Å²	65	33.2 Å²	33.2	30%	0.304	18%	0.177	S	C	.	.			trans	-79	136.5	174.8	-166.2	166.2	128.4	0	0	110.4	R133 Y136 K138 H330	R133-E328 IonicContact CZ-OE2 3.6Å; R133-E328 IonicContact NH1-OE2 2.65Å; R133-E328 PolarHBondContact NH1-OE2 2.98Å; R133-E328 IonicContact NH2-OE2 2.92Å; Y136-E328 CarbonylContact O-C 3.57Å; Y136-E328 WeakPolarHBondContact O-CA 3.37Å; K138-E328 HydrophobicContact CB-CG 4.45Å; K138-E328 WeakPolarHBondContact CD-OE1 3.48Å; E328-H330 IonicContact OE1-CE1 2.85Å; E328-H330 IonicContact OE1-NE2 2.95Å
329	I	94.7	Very high	89.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	123.5	179.5	-58.6	-171.7	0	0	0	109.6	Y136 A137 K138 T180 F182 M306 A318 L321	Y136-I329 PolarHBondContact O-N 3.4Å; A137-I329 WeakPolarHBondContact CA-O 3.44Å; K138-I329 PolarHBondContact N-O 2.9Å; T180-I329 HydrophobicContact CG2-CB 4.37Å; T180-I329 HydrophobicContact CG2-CD1 4.01Å; T180-I329 HydrophobicContact CG2-CG1 3.78Å; T180-I329 HydrophobicContact CG2-CG2 4.1Å; F182-I329 HydrophobicContact CB-CG2 4.2Å; M306-I329 HydrophobicContact CE-CD1 4.21Å; M306-I329 HydrophobicContact CE-CG2 3.87Å; A318-I329 HydrophobicContact CB-CB 4.15Å; A318-I329 HydrophobicContact CB-CG2 3.72Å; L321-I329 HydrophobicContact CB-CD1 3.82Å; L321-I329 HydrophobicContact CD2-CD1 3.97Å; L321-I329 HydrophobicContact CG-CD1 3.79Å
330	H	96.5	Very high	89.5	Confident	3 Å²	3	35.6 Å²	35.6	1%	0.014	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	118.8	-179.8	-62.8	-104.3	0	0	0	110.2	K138 E140 E179 T180 V181 F182 E328	K138-H330 CarbonylContact O-C 3.52Å; K138-H330 WeakPolarHBondContact O-CA 3.37Å; E140-H330 HydrophobicContact CG-CB 4.05Å; E140-H330 IonicContact OE1-CE1 3.15Å; E140-H330 IonicContact OE1-CG 3.22Å; E140-H330 IonicContact OE1-ND1 3.13Å; E140-H330 PolarHBondContact OE1-ND1 3.29Å; E179-H330 IonicContact OE1-CE1 3.77Å; E179-H330 IonicContact OE1-NE2 2.77Å; E179-H330 IonicContact OE2-CD2 2.91Å; E179-H330 IonicContact OE2-CE1 3.64Å; E179-H330 PolarHBondContact OE2-CE1 3.49Å; E179-H330 IonicContact OE2-NE2 3.43Å; E179-H330 PolarHBondContact OE2-NE2 2.69Å; T180-H330 PolarHBondContact O-N 3.1Å; V181-H330 WeakPolarHBondContact CA-O 3.39Å; F182-H330 PolarHBondContact N-O 2.96Å; E328-H330 IonicContact OE1-CE1 2.85Å; E328-H330 IonicContact OE1-NE2 2.95Å
331	V	96.1	Very high	89.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	118.1	179.7	-176.4	0	0	0	0	108.9	A137 K138 E140 F182 A318	A137-V331 HydrophobicContact CB-CG2 4.36Å; K138-V331 PolarHBondContact O-N 3.43Å; E140-V331 PolarHBondContact N-O 2.9Å; F182-V331 HydrophobicContact CB-CG2 4.45Å; A318-V331 HydrophobicContact CB-CG2 3.31Å
332	I	95.1	Very high	89.7	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	97.5	-177.8	-59	169.6	0	0	0	107.2	E140 T142 F167 R170 A171 F182 V183 S184	E140-I332 HydrophobicContact CB-CG1 4Å; E140-I332 HydrophobicContact CG-CG1 4.17Å; T142-I332 HydrophobicContact CG2-CG2 3.76Å; F167-I332 HydrophobicContact CB-CG2 3.78Å; F167-I332 HydrophobicContact CD2-CG2 4.44Å; R170-I332 HydrophobicContact CB-CD1 4.15Å; A171-I332 HydrophobicContact CB-CD1 3.55Å; F182-I332 PolarHBondContact O-N 3.49Å; V183-I332 WeakPolarHBondContact CA-O 3.32Å; S184-I332 PolarHBondContact N-O 3.38Å
333	A	92	Very high	89.9	Confident	26 Å²	26	38.1 Å²	38.1	22%	0.215	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	147.2	179.6	0	0	0	0	0	111.5	T142 S184	T142-A333 VanDerWaalsContact CG2-O 3.29Å; T142-A333 WeakPolarHBondContact CG2-O 3.27Å; T142-A333 PolarHBondContact OG1-O 3.17Å; S184-A333 WeakPolarHBondContact O-CA 3.46Å
334	T	89.3	Confident	90.2	Very high	19 Å²	19	36.1 Å²	36.1	12%	0.117	20%	0.198	C	C	.	.			trans	-140.3	121.7	170.4	-173	0	0	0	0	111.8	F167 S184 A185	F167-T334 HydrophobicContact CD1-CG2 4.2Å; F167-T334 HydrophobicContact CE1-CG2 4.43Å; F167-T334 HydrophobicContact CG-CG2 4.29Å; S184-T334 PolarHBondContact O-N 3.46Å; A185-T334 HydrophobicContact CB-CG2 3.46Å; A185-T334 VanDerWaalsContact CB-CG2 3.46Å
335	D	80.9	Confident	90.3	Very high	147 Å²	147	35 Å²	35	79%	0.786	19%	0.191	S	C	*	.			trans	-85	-19.4	177.3	-61.5	-36	0	0	0	112.3	H186	H186-D335 PolarHBondContact NE2-O 3.33Å
336	K	79.7	Confident	90.4	Very high	172 Å²	172	34.7 Å²	34.7	75%	0.748	19%	0.19	S	C	*	.			trans	-86.9	123.2	-176.7	-170.3	175.8	-179.2	179.2	0	110.9
337	R	84.8	Confident	90.4	Very high	27 Å²	27	33.4 Å²	33.4	10%	0.102	18%	0.175	C	C	.	.			trans	-80.7	133.9	171.9	-165.8	175.6	-178.8	-108.1	0.8	110.5	H186 V339 G552 A554	H186-R337 HydrophobicContact CB-CG 4.17Å; R337-V339 VanDerWaalsContact C-N 3.32Å; R337-V339 WeakPolarHBondContact CD-O 3.22Å; R337-V339 VanDerWaalsContact CG-O 3.25Å; R337-V339 WeakPolarHBondContact CG-O 3.23Å; R337-V339 PolarHBondContact NH1-O 3.12Å; R337-V339 PolarHBondContact O-N 2.93Å; R337-G552 PolarHBondContact NH2-O 3.12Å; R337-A554 PolarHBondContact NH1-O 3.35Å; R337-A554 PolarHBondContact NH2-O 2.9Å
338	P	84.4	Confident	89.8	Confident	51 Å²	51	31.9 Å²	31.9	33%	0.331	17%	0.165	S	C	.	.	S	Bend	trans	-61.2	-36.3	179.4	-30	38.9	0	0	0	114.5
339	V	88.8	Confident	88.4	Confident	11 Å²	11	31.3 Å²	31.3	7%	0.067	16%	0.162	C	C	.	.	S	Bend	trans	-107.5	115.7	171.2	-177.1	0	0	0	0	107.5	R337 R557	R337-V339 VanDerWaalsContact C-N 3.32Å; R337-V339 WeakPolarHBondContact CD-O 3.22Å; R337-V339 VanDerWaalsContact CG-O 3.25Å; R337-V339 WeakPolarHBondContact CG-O 3.23Å; R337-V339 PolarHBondContact NH1-O 3.12Å; R337-V339 PolarHBondContact O-N 2.93Å; V339-R557 HydrophobicContact CG2-CB 4.37Å
340	P	92.2	Very high	86.8	Confident	42 Å²	42	34.1 Å²	34.1	27%	0.273	18%	0.18	S	C	.	.			trans	-67.7	153.8	179.4	27.9	-34	0	0	0	111.3	K363 G563	P340-K363 HydrophobicContact CB-CB 3.95Å; P340-K363 WeakPolarHBondContact CB-O 3.37Å; P340-K363 HydrophobicContact CG-CB 4.31Å; P340-G563 PolarHBondContact O-N 3.5Å
341	L	93.8	Very high	85	Confident	30 Å²	30	39.7 Å²	39.7	16%	0.157	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	139.4	178.1	-68.2	178.2	0	0	0	110.5	A551 A554 G563 V565	L341-A551 HydrophobicContact CD1-CB 4.29Å; L341-A554 HydrophobicContact CD2-CB 3.82Å; L341-A554 WeakPolarHBondContact CD2-O 3.31Å; L341-G563 WeakPolarHBondContact CA-O 3.42Å; L341-V565 HydrophobicContact CD1-CG2 4.4Å; L341-V565 HydrophobicContact CD2-CG2 4.14Å
342	E	95.1	Very high	83.2	Confident	20 Å²	20	46 Å²	46	9%	0.093	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.7	166.1	-71.8	176.8	-177.5	0	0	109.3	Y344 L359 V361 K363 K562 G563 V565	E342-Y344 HydrophobicContact CB-CD2 4.29Å; E342-Y344 HydrophobicContact CB-CE2 3.54Å; E342-Y344 WeakPolarHBondContact OE2-CE2 3.4Å; E342-Y344 PolarHBondContact OE2-OH 3.47Å; E342-L359 HydrophobicContact CB-CD1 3.95Å; E342-L359 HydrophobicContact CG-CD1 4.3Å; E342-V361 WeakPolarHBondContact CA-O 3.4Å; E342-K363 HydrophobicContact CG-CB 4.34Å; E342-K562 HydrophobicContact CG-CD 4.27Å; E342-K562 WeakPolarHBondContact OE1-CD 3.38Å; E342-K562 IonicContact OE1-NZ 3.9Å; E342-K562 PolarHBondContact OE1-NZ 3.24Å; E342-K562 WeakPolarHBondContact OE2-CD 3.35Å; E342-K562 WeakPolarHBondContact OE2-CE 2.88Å; E342-K562 IonicContact OE2-NZ 2.86Å; E342-K562 PolarHBondContact OE2-NZ 3.34Å; E342-G563 PolarHBondContact N-O 2.93Å; E342-V565 PolarHBondContact O-N 3.45Å
343	H	95.4	Very high	81.4	Confident	15 Å²	15	49 Å²	49	7%	0.069	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	129.3	-177.9	-56.2	73.2	0	0	0	110.8	I360 V361 F547 V565 I593	H343-I360 HydrophobicContact CB-CD1 4.39Å; H343-I360 HydrophobicContact CB-CG1 4.01Å; H343-I360 WeakPolarHBondContact O-CG1 3.44Å; H343-I360 PolarHBondContact O-N 3.19Å; H343-V361 HydrophobicContact CB-CB 3.88Å; H343-V361 HydrophobicContact CB-CG2 4.23Å; H343-V361 PolarHBondContact N-O 3.06Å; H343-V361 PolarHBondContact O-N 2.94Å; H343-F547 AromaticContact CD2-CE1 3.84Å; H343-F547 AromaticContact CD2-CZ 3.85Å; H343-F547 AromaticContact NE2-CE1 3.71Å; H343-V565 CarbonylContact C-O 3.55Å; H343-V565 WeakPolarHBondContact CA-O 3.26Å; H343-I593 HydrophobicContact CB-CD1 4.43Å
344	Y	94.2	Very high	79.8	Confident	32 Å²	32	52.7 Å²	52.7	13%	0.125	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	146	-176.5	-66.2	-95.7	0	0	0	112.3	E342 L357 H358 L359 L564 V565 I566 I567	E342-Y344 HydrophobicContact CB-CD2 4.29Å; E342-Y344 HydrophobicContact CB-CE2 3.54Å; E342-Y344 WeakPolarHBondContact OE2-CE2 3.4Å; E342-Y344 PolarHBondContact OE2-OH 3.47Å; Y344-L357 HydrophobicContact CD1-CD1 4.33Å; Y344-L357 HydrophobicContact CD1-CD2 3.77Å; Y344-L357 HydrophobicContact CD1-CG 3.57Å; Y344-L357 HydrophobicContact CE1-CD2 4.09Å; Y344-L357 HydrophobicContact CE1-CG 4.31Å; Y344-L357 HydrophobicContact CG-CD1 4.16Å; Y344-L357 HydrophobicContact CG-CD2 4.06Å; Y344-L357 HydrophobicContact CG-CG 3.89Å; Y344-H358 CarbonylContact C-O 3.56Å; Y344-H358 VanDerWaalsContact CA-O 3.23Å; Y344-H358 WeakPolarHBondContact CA-O 3.46Å; Y344-L359 HydrophobicContact CD1-CB 3.91Å; Y344-L359 HydrophobicContact CD1-CD1 4.14Å; Y344-L359 HydrophobicContact CD2-CD1 4.25Å; Y344-L359 HydrophobicContact CE1-CB 3.65Å; Y344-L359 HydrophobicContact CE1-CD1 3.71Å; Y344-L359 HydrophobicContact CE1-CG 4.25Å; Y344-L359 HydrophobicContact CE2-CD1 3.8Å; Y344-L359 HydrophobicContact CG-CD1 4.41Å; Y344-L564 HydrophobicContact CE2-CD2 4.07Å; Y344-L564 HydrophobicContact CE2-CG 4.25Å; Y344-V565 PolarHBondContact N-O 3.04Å; Y344-I566 WeakPolarHBondContact O-CA 3.14Å; Y344-I567 PolarHBondContact O-N 3.41Å
345	L	92.1	Very high	78.4	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.9	166.2	-62.8	-179.3	0	0	0	109.8	H358 I360 Y372 A375 I567 V569 L583 L589	L345-H358 PolarHBondContact N-O 2.84Å; L345-H358 PolarHBondContact O-N 3.44Å; L345-I360 HydrophobicContact CD1-CD1 4.49Å; L345-I360 HydrophobicContact CD1-CG2 3.65Å; L345-I360 HydrophobicContact CD2-CD1 3.89Å; L345-I360 HydrophobicContact CG-CD1 3.91Å; L345-I360 HydrophobicContact CG-CG1 4.27Å; L345-I360 HydrophobicContact CG-CG2 3.69Å; L345-Y372 HydrophobicContact CD1-CD2 4.12Å; L345-A375 HydrophobicContact CB-CB 4.3Å; L345-A375 HydrophobicContact CD1-CB 3.88Å; L345-I567 HydrophobicContact CD2-CB 3.92Å; L345-I567 HydrophobicContact CD2-CD1 4.17Å; L345-I567 HydrophobicContact CD2-CG2 4.28Å; L345-V569 HydrophobicContact CB-CG2 4.17Å; L345-V569 HydrophobicContact CD2-CG2 4.4Å; L345-L583 HydrophobicContact CD1-CD2 4.25Å; L345-L589 HydrophobicContact CD1-CD1 4.35Å; L345-L589 HydrophobicContact CD2-CD1 4.38Å
346	Y	90	Very high	78.2	Confident	1 Å²	1	48.7 Å²	48.7	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.7	173.3	-175.9	-106	0	0	0	110.6	S348 H356 L357 T403 F407 L410 I567 L568 V569	Y346-S348 VanDerWaalsContact CZ-CB 3.46Å; Y346-S348 WeakPolarHBondContact OH-CB 3.22Å; Y346-H356 WeakPolarHBondContact CA-O 3.43Å; Y346-H356 HydrophobicContact CE2-CB 4.37Å; Y346-L357 HydrophobicContact CD2-CD1 4.22Å; Y346-T403 HydrophobicContact CD1-CG2 4.42Å; Y346-T403 HydrophobicContact CE1-CG2 3.93Å; Y346-F407 HydrophobicContact CD1-CD2 4.03Å; Y346-F407 HydrophobicContact CD2-CD2 4.18Å; Y346-F407 HydrophobicContact CE1-CB 3.98Å; Y346-F407 AromaticContact CE1-CD2 3.99Å; Y346-F407 HydrophobicContact CE1-CD2 3.99Å; Y346-F407 HydrophobicContact CE1-CG 4.37Å; Y346-F407 HydrophobicContact CE2-CD2 4.17Å; Y346-F407 HydrophobicContact CG-CD2 4.09Å; Y346-F407 HydrophobicContact CG-CE2 4.49Å; Y346-L410 HydrophobicContact CD2-CD2 4.09Å; Y346-L410 HydrophobicContact CE2-CD2 3.85Å; Y346-I567 PolarHBondContact N-O 2.91Å; Y346-L568 HydrophobicContact CD1-CD2 3.56Å; Y346-L568 HydrophobicContact CE1-CD2 4.4Å; Y346-L568 HydrophobicContact CG-CD2 4.08Å; Y346-V569 WeakPolarHBondContact O-CB 3.12Å; Y346-V569 WeakPolarHBondContact O-CG2 3.1Å; Y346-V569 PolarHBondContact O-N 3.26Å
347	T	84.4	Confident	78.6	Confident	7 Å²	7	42.5 Å²	42.5	4%	0.043	23%	0.226	C	C	.	.			trans	-108.7	-3.4	-170.6	52.8	0	0	0	0	114.3	H356 H358 A375 S378 V569	T347-H356 PolarHBondContact N-O 3.3Å; T347-H356 PolarHBondContact OG1-O 3.44Å; T347-H358 PolarHBondContact OG1-CD2 2.91Å; T347-H358 PolarHBondContact OG1-NE2 3.14Å; T347-A375 HydrophobicContact CG2-CB 4.03Å; T347-S378 WeakPolarHBondContact CB-OG 3.4Å; T347-S378 PolarHBondContact OG1-OG 2.82Å; T347-V569 HydrophobicContact CG2-CG2 4.13Å
348	S	75.1	Confident	78.8	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.007	23%	0.226	C	C	.	.			trans	-70.8	138.2	-175.3	-163.9	0	0	0	0	111.9	Y346 T350 Q352 H356 T403	Y346-S348 VanDerWaalsContact CZ-CB 3.46Å; Y346-S348 WeakPolarHBondContact OH-CB 3.22Å; S348-T350 PolarHBondContact OG-N 2.71Å; S348-T350 PolarHBondContact OG-O 3.18Å; S348-Q352 PolarHBondContact OG-O 2.91Å; S348-H356 PolarHBondContact OG-CD2 2.83Å; S348-T403 WeakPolarHBondContact O-CG2 3.27Å
349	M	63	Low	79.2	Confident	53 Å²	53	42.3 Å²	42.3	26%	0.261	22%	0.223	S	C	.	.			trans	-112.8	1.9	174.1	-70	-65.2	-131.3	0	0	112.4	Q399 S570	M349-Q399 HydrophobicContact CE-CG 4.45Å; M349-Q399 HydrophobicContact SD-CG 4.15Å; M349-Q399 PolarHBondContact SD-NE2 2.86Å; M349-Q399 VanDerWaalsContact SD-NE2 3.45Å; M349-S570 WeakPolarHBondContact SD-CB 3.38Å
350	T	60.6	Low	79.5	Confident	60 Å²	60	41.8 Å²	41.8	37%	0.368	22%	0.219	S	C	.	.	S	Bend	trans	-131.9	168	-171.9	50.3	0	0	0	0	110	S348 Q352	S348-T350 PolarHBondContact OG-N 2.71Å; S348-T350 PolarHBondContact OG-O 3.18Å; T350-Q352 PolarHBondContact O-N 3.37Å; T350-Q352 VanDerWaalsContact O-N 3.14Å
351	E	57.8	Low	79.5	Confident	119 Å²	119	39.8 Å²	39.8	56%	0.556	21%	0.207	S	C	*	.	S	Bend	trans	-63.4	-16.3	176.2	-65.8	-177.3	170.1	0	0	113.3	Y353	E351-Y353 WeakPolarHBondContact O-CD1 3.37Å; E351-Y353 PolarHBondContact O-N 3.15Å
352	Q	59	Low	79.5	Confident	133 Å²	133	39.7 Å²	39.7	62%	0.621	21%	0.206	S	C	*	.			trans	-69.9	116.5	171.2	-66	179.9	-7.1	0	0	110.6	S348 T350	S348-Q352 PolarHBondContact OG-O 2.91Å; T350-Q352 PolarHBondContact O-N 3.37Å; T350-Q352 VanDerWaalsContact O-N 3.14Å
353	Y	57.5	Low	79.2	Confident	62 Å²	62	44.7 Å²	44.7	24%	0.243	23%	0.228	C	C	.	.			trans	-111.5	-23.5	-162.4	51.3	-96.2	0	0	0	115.4	E351 G406 N409 L410 E413	E351-Y353 WeakPolarHBondContact O-CD1 3.37Å; E351-Y353 PolarHBondContact O-N 3.15Å; Y353-G406 VanDerWaalsContact CB-O 3.32Å; Y353-G406 WeakPolarHBondContact CB-O 3.35Å; Y353-N409 HydrophobicContact CD1-CB 4.21Å; Y353-L410 HydrophobicContact CD2-CD1 4.28Å; Y353-E413 VanDerWaalsContact CE2-CD 3.42Å; Y353-E413 WeakPolarHBondContact CE2-OE1 3.38Å; Y353-E413 WeakPolarHBondContact CE2-OE2 3.4Å; Y353-E413 VanDerWaalsContact OH-CD 3.31Å; Y353-E413 PolarHBondContact OH-OE1 2.77Å; Y353-E413 PolarHBondContact OH-OE2 3.21Å
354	T	57	Low	78.8	Confident	104 Å²	104	49 Å²	49	64%	0.638	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-34	-166.5	51.4	0	0	0	0	115.1	H356	T354-H356 PolarHBondContact O-N 3.36Å
355	S	60.2	Low	78.4	Confident	75 Å²	75	49.1 Å²	49.1	52%	0.524	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	18.5	-168.5	53.6	0	0	0	0	115.3
356	H	77.9	Confident	78.4	Confident	8 Å²	8	57.2 Å²	57.2	4%	0.037	29%	0.293	C	S	.	.			trans	-129.6	8.9	-164.7	-67.1	-54.5	0	0	0	116.1	Y346 T347 S348 T354 H358 R382	Y346-H356 WeakPolarHBondContact CA-O 3.43Å; Y346-H356 HydrophobicContact CE2-CB 4.37Å; T347-H356 PolarHBondContact N-O 3.3Å; T347-H356 PolarHBondContact OG1-O 3.44Å; S348-H356 PolarHBondContact OG-CD2 2.83Å; T354-H356 PolarHBondContact O-N 3.36Å; H356-H358 PolarHBondContact O-CD2 3.42Å; H356-R382 PolarHBondContact CE1-NH1 3.49Å; H356-R382 PolarHBondContact CE1-NH2 2.94Å; H356-R382 VanDerWaalsContact CE1-NH2 3.29Å; H356-R382 PolarHBondContact NE2-NH1 3.49Å; H356-R382 PolarHBondContact NE2-NH2 2.95Å; H356-R382 VanDerWaalsContact NE2-NH2 3.15Å
357	L	86.6	Confident	78.5	Confident	42 Å²	42	58.1 Å²	58.1	22%	0.22	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	110	176.2	-166.5	74.9	0	0	0	109.6	Y344 Y346 L410 I566	Y344-L357 HydrophobicContact CD1-CD1 4.33Å; Y344-L357 HydrophobicContact CD1-CD2 3.77Å; Y344-L357 HydrophobicContact CD1-CG 3.57Å; Y344-L357 HydrophobicContact CE1-CD2 4.09Å; Y344-L357 HydrophobicContact CE1-CG 4.31Å; Y344-L357 HydrophobicContact CG-CD1 4.16Å; Y344-L357 HydrophobicContact CG-CD2 4.06Å; Y344-L357 HydrophobicContact CG-CG 3.89Å; Y346-L357 HydrophobicContact CD2-CD1 4.22Å; L357-L410 HydrophobicContact CD1-CD2 4.43Å; L357-I566 HydrophobicContact CD1-CD1 4.08Å; L357-I566 HydrophobicContact CD1-CG1 4.27Å; L357-I566 HydrophobicContact CD1-CG2 3.97Å
358	H	90.4	Very high	78.8	Confident	25 Å²	25	60 Å²	60	12%	0.116	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.5	-173.8	-54	-81.5	0	0	0	110.7	Y344 L345 T347 H356 I360 A375 S378	Y344-H358 CarbonylContact C-O 3.56Å; Y344-H358 VanDerWaalsContact CA-O 3.23Å; Y344-H358 WeakPolarHBondContact CA-O 3.46Å; L345-H358 PolarHBondContact N-O 2.84Å; L345-H358 PolarHBondContact O-N 3.44Å; T347-H358 PolarHBondContact OG1-CD2 2.91Å; T347-H358 PolarHBondContact OG1-NE2 3.14Å; H356-H358 PolarHBondContact O-CD2 3.42Å; H358-I360 PolarHBondContact O-N 2.76Å; H358-A375 HydrophobicContact CB-CB 3.93Å; H358-S378 PolarHBondContact NE2-OG 2.7Å; H358-S378 VanDerWaalsContact NE2-OG 3.14Å
359	L	92.9	Very high	79.5	Confident	48 Å²	48	63.1 Å²	63.1	25%	0.251	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.2	179.5	-179.2	70.3	0	0	0	110.1	E342 Y344 V361 I368 G371	E342-L359 HydrophobicContact CB-CD1 3.95Å; E342-L359 HydrophobicContact CG-CD1 4.3Å; Y344-L359 HydrophobicContact CD1-CB 3.91Å; Y344-L359 HydrophobicContact CD1-CD1 4.14Å; Y344-L359 HydrophobicContact CD2-CD1 4.25Å; Y344-L359 HydrophobicContact CE1-CB 3.65Å; Y344-L359 HydrophobicContact CE1-CD1 3.71Å; Y344-L359 HydrophobicContact CE1-CG 4.25Å; Y344-L359 HydrophobicContact CE2-CD1 3.8Å; Y344-L359 HydrophobicContact CG-CD1 4.41Å; L359-V361 VanDerWaalsContact CD1-O 3.31Å; L359-V361 WeakPolarHBondContact CD1-O 3.24Å; L359-I368 HydrophobicContact CD2-CD1 3.48Å; L359-I368 VanDerWaalsContact CD2-CD1 3.48Å; L359-I368 HydrophobicContact CG-CD1 3.82Å; L359-G371 WeakPolarHBondContact O-CA 3.44Å
360	I	93.9	Very high	80.8	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	-23.2	178.9	55.9	161	0	0	0	113.7	H343 L345 H358 F367 I368 L589 I593	H343-I360 HydrophobicContact CB-CD1 4.39Å; H343-I360 HydrophobicContact CB-CG1 4.01Å; H343-I360 WeakPolarHBondContact O-CG1 3.44Å; H343-I360 PolarHBondContact O-N 3.19Å; L345-I360 HydrophobicContact CD1-CD1 4.49Å; L345-I360 HydrophobicContact CD1-CG2 3.65Å; L345-I360 HydrophobicContact CD2-CD1 3.89Å; L345-I360 HydrophobicContact CG-CD1 3.91Å; L345-I360 HydrophobicContact CG-CG1 4.27Å; L345-I360 HydrophobicContact CG-CG2 3.69Å; H358-I360 PolarHBondContact O-N 2.76Å; I360-F367 HydrophobicContact CB-CE2 4.41Å; I360-F367 CarbonylContact O-C 3.5Å; I360-F367 VanDerWaalsContact O-CA 3.31Å; I360-F367 WeakPolarHBondContact O-CA 3.27Å; I360-I368 PolarHBondContact O-N 2.81Å; I360-L589 HydrophobicContact CD1-CD1 4.39Å; I360-I593 HydrophobicContact CD1-CD1 3.77Å
361	V	93.2	Very high	82	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	124	172.6	-177.1	0	0	0	0	108.9	E342 H343 L359 R366 F367 I593 L594	E342-V361 WeakPolarHBondContact CA-O 3.4Å; H343-V361 HydrophobicContact CB-CB 3.88Å; H343-V361 HydrophobicContact CB-CG2 4.23Å; H343-V361 PolarHBondContact N-O 3.06Å; H343-V361 PolarHBondContact O-N 2.94Å; L359-V361 VanDerWaalsContact CD1-O 3.31Å; L359-V361 WeakPolarHBondContact CD1-O 3.24Å; V361-R366 VanDerWaalsContact CA-O 3.31Å; V361-R366 WeakPolarHBondContact CA-O 3.33Å; V361-F367 HydrophobicContact CG2-CD2 3.81Å; V361-F367 HydrophobicContact CG2-CE2 4.46Å; V361-I593 HydrophobicContact CG2-CD1 4.29Å; V361-I593 HydrophobicContact CG2-CG2 3.98Å; V361-L594 HydrophobicContact CG1-CD2 4.22Å
362	D	92.6	Very high	83.5	Confident	28 Å²	28	56.9 Å²	56.9	15%	0.15	30%	0.299	C	S	.	.			trans	-78.5	176.7	179.3	68.5	18.3	0	0	0	113.3	D364 G365 R366 I368	D362-D364 PolarHBondContact O-N 3.05Å; D362-D364 WeakPolarHBondContact OD1-CA 3.48Å; D362-D364 PolarHBondContact OD1-N 3.42Å; D362-G365 PolarHBondContact O-N 3.27Å; D362-G365 VanDerWaalsContact O-N 3.11Å; D362-G365 PolarHBondContact OD1-N 3.34Å; D362-R366 PolarHBondContact N-O 3.18Å; D362-R366 VanDerWaalsContact N-O 3.11Å; D362-R366 PolarHBondContact OD1-N 3.32Å; D362-I368 HydrophobicContact CB-CD1 3.96Å
363	K	89.1	Confident	84.8	Confident	124 Å²	124	56 Å²	56	54%	0.539	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.7	177.9	66.3	179.2	-176.2	178	0	114.3	P340 E342	P340-K363 HydrophobicContact CB-CB 3.95Å; P340-K363 WeakPolarHBondContact CB-O 3.37Å; P340-K363 HydrophobicContact CG-CB 4.31Å; E342-K363 HydrophobicContact CG-CB 4.34Å
364	D	87.4	Confident	86.2	Confident	105 Å²	105	56.1 Å²	56.1	56%	0.561	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	1.9	-178	-60.4	-49.2	0	0	0	111.4	D362	D362-D364 PolarHBondContact O-N 3.05Å; D362-D364 WeakPolarHBondContact OD1-CA 3.48Å; D362-D364 PolarHBondContact OD1-N 3.42Å
365	G	86.6	Confident	87.5	Confident	36 Å²	36	51.2 Å²	51.2	37%	0.371	27%	0.271	S	S	.	.	S	Bend	trans	82.1	16	178.2	0	0	0	0	0	114.3	D362 L594	D362-G365 PolarHBondContact O-N 3.27Å; D362-G365 VanDerWaalsContact O-N 3.11Å; D362-G365 PolarHBondContact OD1-N 3.34Å; G365-L594 WeakPolarHBondContact O-CD2 3.42Å
366	R	91.5	Very high	88.6	Confident	169 Å²	169	48.1 Å²	48.1	64%	0.638	25%	0.251	S	S	*	.			trans	-90.6	133	179.5	-55.8	176.1	-174.7	169.4	3.1	110.4	V361 D362	V361-R366 VanDerWaalsContact CA-O 3.31Å; V361-R366 WeakPolarHBondContact CA-O 3.33Å; D362-R366 PolarHBondContact N-O 3.18Å; D362-R366 VanDerWaalsContact N-O 3.11Å; D362-R366 PolarHBondContact OD1-N 3.32Å
367	F	91.6	Very high	88.8	Confident	21 Å²	21	53.1 Å²	53.1	9%	0.092	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-76.9	128	174	-164.3	-86	0	0	0	110.3	I360 V361 D369 Y372 E586 L589 R590 L594	I360-F367 HydrophobicContact CB-CE2 4.41Å; I360-F367 CarbonylContact O-C 3.5Å; I360-F367 VanDerWaalsContact O-CA 3.31Å; I360-F367 WeakPolarHBondContact O-CA 3.27Å; V361-F367 HydrophobicContact CG2-CD2 3.81Å; V361-F367 HydrophobicContact CG2-CE2 4.46Å; F367-D369 WeakPolarHBondContact CD1-OD1 3.5Å; F367-Y372 HydrophobicContact CZ-CD2 4.35Å; F367-Y372 HydrophobicContact CZ-CG 4.45Å; F367-E586 HydrophobicContact CE1-CG 3.71Å; F367-E586 HydrophobicContact CZ-CG 3.82Å; F367-L589 HydrophobicContact CE2-CB 4.26Å; F367-R590 HydrophobicContact CD1-CG 4.31Å; F367-R590 VanDerWaalsContact CD1-NH2 3.27Å; F367-R590 HydrophobicContact CD2-CG 3.67Å; F367-R590 HydrophobicContact CE1-CG 4.4Å; F367-R590 HydrophobicContact CE2-CG 3.8Å; F367-R590 HydrophobicContact CG-CG 3.93Å; F367-R590 HydrophobicContact CZ-CG 4.17Å; F367-L594 HydrophobicContact CB-CD1 3.95Å
368	I	91.8	Very high	88.4	Confident	46 Å²	46	52.3 Å²	52.3	24%	0.236	28%	0.275	C	S	.	.			trans	-101.2	101.5	-177.7	-60.4	169.5	0	0	0	109.2	L359 I360 D362 S370 G371 Y372	L359-I368 HydrophobicContact CD2-CD1 3.48Å; L359-I368 VanDerWaalsContact CD2-CD1 3.48Å; L359-I368 HydrophobicContact CG-CD1 3.82Å; I360-I368 PolarHBondContact O-N 2.81Å; D362-I368 HydrophobicContact CB-CD1 3.96Å; I368-S370 VanDerWaalsContact C-N 3.33Å; I368-S370 VanDerWaalsContact CG2-OG 3.24Å; I368-S370 WeakPolarHBondContact CG2-OG 3.47Å; I368-S370 PolarHBondContact O-N 2.87Å; I368-G371 PolarHBondContact O-N 3.06Å; I368-G371 VanDerWaalsContact O-N 3.15Å; I368-Y372 PolarHBondContact O-N 3.04Å
369	D	89.8	Confident	87.7	Confident	66 Å²	66	52.5 Å²	52.5	35%	0.353	28%	0.277	S	S	.	.	H	α-helix	trans	-61.7	-38.6	-178.5	-66.3	-46.6	0	0	0	113.1	F367 G371 Y372 Q373 R590	F367-D369 WeakPolarHBondContact CD1-OD1 3.5Å; D369-G371 VanDerWaalsContact C-N 3.26Å; D369-G371 PolarHBondContact O-N 3.16Å; D369-Y372 PolarHBondContact O-N 3.28Å; D369-Q373 VanDerWaalsContact O-CG 3.29Å; D369-Q373 WeakPolarHBondContact O-CG 3.25Å; D369-Q373 PolarHBondContact O-N 2.85Å; D369-R590 VanDerWaalsContact CG-NH2 3.3Å; D369-R590 IonicContact OD1-CZ 3.75Å; D369-R590 IonicContact OD1-NH2 3.39Å; D369-R590 PolarHBondContact OD1-NH2 3.48Å; D369-R590 IonicContact OD2-NH2 2.82Å; D369-R590 PolarHBondContact OD2-NH2 3.3Å
370	S	88.6	Confident	86.5	Confident	75 Å²	75	53.1 Å²	53.1	52%	0.524	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-34.3	177.2	59.7	0	0	0	0	112.3	I368 Q373 T374	I368-S370 VanDerWaalsContact C-N 3.33Å; I368-S370 VanDerWaalsContact CG2-OG 3.24Å; I368-S370 WeakPolarHBondContact CG2-OG 3.47Å; I368-S370 PolarHBondContact O-N 2.87Å; S370-Q373 PolarHBondContact O-N 3.3Å; S370-T374 WeakPolarHBondContact O-CB 3.5Å; S370-T374 VanDerWaalsContact O-CG2 3.27Å; S370-T374 WeakPolarHBondContact O-CG2 3.25Å; S370-T374 PolarHBondContact O-N 3.23Å; S370-T374 PolarHBondContact O-OG1 2.87Å
371	G	87.2	Confident	84.8	Confident	7 Å²	7	58 Å²	58	7%	0.072	32%	0.315	C	S	.	.	H	α-helix	trans	-68.5	-39.4	175.4	0	0	0	0	0	112.6	L359 I368 D369 T374 A375	L359-G371 WeakPolarHBondContact O-CA 3.44Å; I368-G371 PolarHBondContact O-N 3.06Å; I368-G371 VanDerWaalsContact O-N 3.15Å; D369-G371 VanDerWaalsContact C-N 3.26Å; D369-G371 PolarHBondContact O-N 3.16Å; G371-T374 WeakPolarHBondContact CA-OG1 3.28Å; G371-T374 PolarHBondContact O-OG1 3.39Å; G371-A375 WeakPolarHBondContact O-CB 3.38Å; G371-A375 PolarHBondContact O-N 3.29Å; G371-A375 VanDerWaalsContact O-N 3.12Å
372	Y	89	Confident	83.1	Confident	19 Å²	19	63 Å²	63	8%	0.075	33%	0.333	C	S	.	.	H	α-helix	trans	-67.3	-43	173.3	-178.8	-95.4	0	0	0	111.8	L345 F367 I368 D369 A375 A376 L583 P584 E586 L589	L345-Y372 HydrophobicContact CD1-CD2 4.12Å; F367-Y372 HydrophobicContact CZ-CD2 4.35Å; F367-Y372 HydrophobicContact CZ-CG 4.45Å; I368-Y372 PolarHBondContact O-N 3.04Å; D369-Y372 PolarHBondContact O-N 3.28Å; Y372-A375 WeakPolarHBondContact O-CB 3.27Å; Y372-A375 PolarHBondContact O-N 3.46Å; Y372-A376 PolarHBondContact O-N 2.85Å; Y372-L583 HydrophobicContact CE2-CB 4.43Å; Y372-L583 HydrophobicContact CE2-CD1 4.31Å; Y372-P584 WeakPolarHBondContact CE2-O 3.4Å; Y372-P584 PolarHBondContact OH-O 3.37Å; Y372-E586 HydrophobicContact CD1-CB 4.38Å; Y372-E586 HydrophobicContact CD1-CG 4.39Å; Y372-E586 HydrophobicContact CE1-CB 4.03Å; Y372-E586 HydrophobicContact CE2-CB 4.46Å; Y372-E586 PolarHBondContact OH-N 2.98Å; Y372-L589 HydrophobicContact CD2-CD1 3.99Å; Y372-L589 HydrophobicContact CE2-CD1 3.76Å
373	Q	86.1	Confident	81.1	Confident	116 Å²	116	69.4 Å²	69.4	54%	0.542	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-43.8	179.1	-70.3	172.1	9.8	0	0	112.1	D369 S370 A375 A376 L377	D369-Q373 VanDerWaalsContact O-CG 3.29Å; D369-Q373 WeakPolarHBondContact O-CG 3.25Å; D369-Q373 PolarHBondContact O-N 2.85Å; S370-Q373 PolarHBondContact O-N 3.3Å; Q373-A375 VanDerWaalsContact C-N 3.33Å; Q373-A375 PolarHBondContact O-N 2.82Å; Q373-A376 WeakPolarHBondContact O-CB 3.27Å; Q373-A376 PolarHBondContact O-N 3.2Å; Q373-A376 VanDerWaalsContact O-N 3.12Å; Q373-L377 VanDerWaalsContact O-CG 3.3Å; Q373-L377 WeakPolarHBondContact O-CG 3.25Å; Q373-L377 PolarHBondContact O-N 2.83Å
374	T	86.1	Confident	78.9	Confident	64 Å²	64	68.6 Å²	68.6	39%	0.393	36%	0.363	S	S	.	.	H	α-helix	trans	-62.5	-39.7	175.3	47.2	0	0	0	0	111.9	S370 G371 A376 L377 S378	S370-T374 WeakPolarHBondContact O-CB 3.5Å; S370-T374 VanDerWaalsContact O-CG2 3.27Å; S370-T374 WeakPolarHBondContact O-CG2 3.25Å; S370-T374 PolarHBondContact O-N 3.23Å; S370-T374 PolarHBondContact O-OG1 2.87Å; G371-T374 WeakPolarHBondContact CA-OG1 3.28Å; G371-T374 PolarHBondContact O-OG1 3.39Å; T374-A376 PolarHBondContact O-N 2.89Å; T374-L377 PolarHBondContact O-N 2.96Å; T374-S378 WeakPolarHBondContact O-CB 3.46Å; T374-S378 PolarHBondContact O-N 3.43Å; T374-S378 PolarHBondContact O-OG 3.07Å
375	A	85.1	Confident	76.4	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-59.6	-45.4	170.8	0	0	0	0	0	111.7	L345 T347 H358 G371 Y372 Q373 L377 S378 N379 L583	L345-A375 HydrophobicContact CB-CB 4.3Å; L345-A375 HydrophobicContact CD1-CB 3.88Å; T347-A375 HydrophobicContact CG2-CB 4.03Å; H358-A375 HydrophobicContact CB-CB 3.93Å; G371-A375 WeakPolarHBondContact O-CB 3.38Å; G371-A375 PolarHBondContact O-N 3.29Å; G371-A375 VanDerWaalsContact O-N 3.12Å; Y372-A375 WeakPolarHBondContact O-CB 3.27Å; Y372-A375 PolarHBondContact O-N 3.46Å; Q373-A375 VanDerWaalsContact C-N 3.33Å; Q373-A375 PolarHBondContact O-N 2.82Å; A375-L377 PolarHBondContact O-N 2.71Å; A375-S378 PolarHBondContact O-N 2.75Å; A375-S378 PolarHBondContact O-OG 3.23Å; A375-N379 WeakPolarHBondContact O-CB 3.49Å; A375-N379 PolarHBondContact O-N 3.43Å; A375-L583 HydrophobicContact CB-CD1 4.08Å
376	A	83.6	Confident	74	Confident	11 Å²	11	83.4 Å²	83.4	9%	0.091	40%	0.401	C	S	.	.	H	α-helix	trans	-62.8	-43.1	179.6	0	0	0	0	0	112.4	Y372 Q373 T374 N379 N380 T581 L583	Y372-A376 PolarHBondContact O-N 2.85Å; Q373-A376 WeakPolarHBondContact O-CB 3.27Å; Q373-A376 PolarHBondContact O-N 3.2Å; Q373-A376 VanDerWaalsContact O-N 3.12Å; T374-A376 PolarHBondContact O-N 2.89Å; A376-N379 PolarHBondContact O-N 3.12Å; A376-N380 WeakPolarHBondContact O-CB 3.4Å; A376-N380 PolarHBondContact O-N 2.79Å; A376-T581 HydrophobicContact CB-CG2 4.09Å; A376-L583 HydrophobicContact CB-CD1 3.7Å
377	L	81.4	Confident	71.2	Confident	113 Å²	113	80 Å²	80	59%	0.592	40%	0.404	S	S	*	.	H	α-helix	trans	-63.7	-43.9	176.1	-68.1	170.6	0	0	0	111.6	Q373 T374 A375 N379 N380 S381	Q373-L377 VanDerWaalsContact O-CG 3.3Å; Q373-L377 WeakPolarHBondContact O-CG 3.25Å; Q373-L377 PolarHBondContact O-N 2.83Å; T374-L377 PolarHBondContact O-N 2.96Å; A375-L377 PolarHBondContact O-N 2.71Å; L377-N379 VanDerWaalsContact C-N 3.29Å; L377-N379 PolarHBondContact O-N 2.64Å; L377-N380 PolarHBondContact O-N 2.83Å; L377-S381 WeakPolarHBondContact O-CB 3.36Å; L377-S381 PolarHBondContact O-N 3.36Å; L377-S381 PolarHBondContact O-OG 3.4Å
378	S	79.1	Confident	68.8	Low	24 Å²	24	85 Å²	85	17%	0.168	44%	0.438	C	S	.	.	H	α-helix	trans	-64.3	-33.6	179.6	74.2	0	0	0	0	112.9	T347 H358 T374 A375	T347-S378 WeakPolarHBondContact CB-OG 3.4Å; T347-S378 PolarHBondContact OG1-OG 2.82Å; H358-S378 PolarHBondContact NE2-OG 2.7Å; H358-S378 VanDerWaalsContact NE2-OG 3.14Å; T374-S378 WeakPolarHBondContact O-CB 3.46Å; T374-S378 PolarHBondContact O-N 3.43Å; T374-S378 PolarHBondContact O-OG 3.07Å; A375-S378 PolarHBondContact O-N 2.75Å; A375-S378 PolarHBondContact O-OG 3.23Å
379	N	75.4	Confident	66.5	Low	30 Å²	30	87 Å²	87	16%	0.16	46%	0.462	C	S	.	.	H	α-helix	trans	-79.2	-39.3	178.5	-162.2	44.5	0	0	0	112	A375 A376 L377 R382 T581 G582	A375-N379 WeakPolarHBondContact O-CB 3.49Å; A375-N379 PolarHBondContact O-N 3.43Å; A376-N379 PolarHBondContact O-N 3.12Å; L377-N379 VanDerWaalsContact C-N 3.29Å; L377-N379 PolarHBondContact O-N 2.64Å; N379-R382 PolarHBondContact O-N 2.8Å; N379-T581 PolarHBondContact ND2-O 3.38Å; N379-G582 WeakPolarHBondContact ND2-CA 3.47Å; N379-G582 PolarHBondContact ND2-O 3.11Å
380	N	67.5	Low	64	Low	61 Å²	61	88.7 Å²	88.7	33%	0.326	48%	0.478	S	S	.	.	H	α-helix	trans	-67.6	-38.2	178.4	-82.8	-12.3	0	0	0	113	A376 L377 R382 R383 V580 T581	A376-N380 WeakPolarHBondContact O-CB 3.4Å; A376-N380 PolarHBondContact O-N 2.79Å; L377-N380 PolarHBondContact O-N 2.83Å; N380-R382 PolarHBondContact O-N 3.47Å; N380-R383 PolarHBondContact O-N 2.9Å; N380-V580 PolarHBondContact OD1-O 3.43Å; N380-V580 VanDerWaalsContact OD1-O 3.05Å; N380-T581 WeakPolarHBondContact OD1-CA 3.35Å; N380-T581 PolarHBondContact OD1-O 2.97Å
381	S	59	Low	61.4	Low	103 Å²	103	90.9 Å²	90.9	72%	0.72	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-10.8	-179.6	-55.4	0	0	0	0	113.6	L377	L377-S381 WeakPolarHBondContact O-CB 3.36Å; L377-S381 PolarHBondContact O-N 3.36Å; L377-S381 PolarHBondContact O-OG 3.4Å
382	R	56.5	Low	59.7	Low	104 Å²	104	92.5 Å²	92.5	39%	0.392	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	22.7	-172.6	-69.6	-174.7	172.6	176.1	0.8	114.1	H356 N379 N380 P384	H356-R382 PolarHBondContact CE1-NH1 3.49Å; H356-R382 PolarHBondContact CE1-NH2 2.94Å; H356-R382 VanDerWaalsContact CE1-NH2 3.29Å; H356-R382 PolarHBondContact NE2-NH1 3.49Å; H356-R382 PolarHBondContact NE2-NH2 2.95Å; H356-R382 VanDerWaalsContact NE2-NH2 3.15Å; N379-R382 PolarHBondContact O-N 2.8Å; N380-R382 PolarHBondContact O-N 3.47Å; R382-P384 WeakPolarHBondContact O-CD 3.31Å
383	R	50.7	Low	58.1	Low	163 Å²	163	100.4 Å²	100.4	62%	0.615	54%	0.544	S	S	*	.			trans	-57.2	113.8	165.4	-76.8	-169.6	-178.5	-166.3	0.7	107.6	N380 Y385 S579 V580	N380-R383 PolarHBondContact O-N 2.9Å; R383-Y385 PolarHBondContact O-N 3.29Å; R383-Y385 VanDerWaalsContact O-N 3.13Å; R383-S579 PolarHBondContact NH2-O 3.49Å; R383-V580 PolarHBondContact NH2-O 2.96Å; R383-V580 VanDerWaalsContact NH2-O 3.16Å
384	P	42.6	Very low	56.7	Low	107 Å²	107	100.2 Å²	100.2	70%	0.695	55%	0.547	S	S	*	.			trans	-62.5	125.2	-178	-3.4	13.1	0	0	0	107.1	R382 R386	R382-P384 WeakPolarHBondContact O-CD 3.31Å; P384-R386 PolarHBondContact O-N 3.24Å
385	Y	35.1	Very low	55.4	Low	224 Å²	224	99 Å²	99	88%	0.878	54%	0.544	S	S	*	.			trans	-49.5	116.7	156.5	-158.2	-94.2	0	0	0	105.6	R383 S387	R383-Y385 PolarHBondContact O-N 3.29Å; R383-Y385 VanDerWaalsContact O-N 3.13Å; Y385-S387 PolarHBondContact O-N 2.68Å
386	R	36.9	Very low	54.5	Low	228 Å²	228	104.2 Å²	104.2	86%	0.86	57%	0.567	S	S	*	*			trans	-59.8	98.1	-173.8	-80.5	179.5	173	172.9	-2.1	108.3	P384 P388	P384-R386 PolarHBondContact O-N 3.24Å; R386-P388 VanDerWaalsContact O-CD 3.24Å; R386-P388 WeakPolarHBondContact O-CD 3.44Å
387	S	33	Very low	53.6	Low	99 Å²	99	107.3 Å²	107.3	69%	0.692	58%	0.581	S	S	*	*			trans	-67.2	116.7	156.6	-66	0	0	0	0	106.7	Y385 A389	Y385-S387 PolarHBondContact O-N 2.68Å; S387-A389 PolarHBondContact O-N 3.41Å
388	P	41.2	Very low	52.9	Low	124 Å²	124	106.7 Å²	106.7	81%	0.805	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-2.6	-176.5	-18.3	32	0	0	0	114.3	R386 C390	R386-P388 VanDerWaalsContact O-CD 3.24Å; R386-P388 WeakPolarHBondContact O-CD 3.44Å; P388-C390 PolarHBondContact O-N 3.47Å
389	A	43.1	Very low	52.5	Low	90 Å²	90	108.8 Å²	108.8	74%	0.744	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-1.1	-160.7	0	0	0	0	0	116.3	S387	S387-A389 PolarHBondContact O-N 3.41Å
390	C	36.3	Very low	52.4	Low	101 Å²	101	107.9 Å²	107.9	68%	0.682	58%	0.58	S	S	*	*			trans	-144.8	69.4	174.2	-85.4	0	0	0	0	110.9	P388 G392 A395	P388-C390 PolarHBondContact O-N 3.47Å; C390-G392 PolarHBondContact O-N 3.26Å; C390-A395 HydrophobicContact CB-CB 4.33Å
391	S	35.4	Very low	52.9	Low	120 Å²	120	109 Å²	109	84%	0.839	58%	0.582	S	S	*	*			trans	-80.6	106.7	165.1	57.5	0	0	0	0	109.3
392	G	51.2	Low	53.9	Low	42 Å²	42	106.7 Å²	106.7	43%	0.433	56%	0.562	S	S	.	*	S	Bend	trans	172.5	158.2	177.6	0	0	0	0	0	112.7	C390 D394 A395	C390-G392 PolarHBondContact O-N 3.26Å; G392-D394 PolarHBondContact O-N 2.86Å; G392-A395 PolarHBondContact O-N 3.2Å; G392-A395 VanDerWaalsContact O-N 3.08Å
393	K	55.4	Low	55.1	Low	184 Å²	184	101.8 Å²	101.8	80%	0.8	54%	0.543	S	S	*	.	H	α-helix	trans	-48	-28	172.4	-69.7	175.1	177.9	173.2	0	112	F396 L397	K393-F396 PolarHBondContact O-N 3.17Å; K393-L397 WeakPolarHBondContact O-CG 3.35Å; K393-L397 PolarHBondContact O-N 3.44Å
394	D	56.4	Low	56.8	Low	113 Å²	113	94.1 Å²	94.1	60%	0.604	51%	0.514	S	S	*	.	H	α-helix	trans	-65.4	-38.8	-179.7	-55.5	-33.6	0	0	0	113.7	G392 F396 L397 I398	G392-D394 PolarHBondContact O-N 2.86Å; D394-F396 VanDerWaalsContact C-N 3.3Å; D394-F396 PolarHBondContact O-N 3.41Å; D394-L397 PolarHBondContact O-N 2.98Å; D394-I398 WeakPolarHBondContact O-CG1 3.48Å; D394-I398 PolarHBondContact O-N 2.92Å
395	A	58.6	Low	58.8	Low	39 Å²	39	90.5 Å²	90.5	32%	0.322	49%	0.489	S	S	.	.	H	α-helix	trans	-63.2	-39.2	178.8	0	0	0	0	0	111.7	C390 G392 Q399	C390-A395 HydrophobicContact CB-CB 4.33Å; G392-A395 PolarHBondContact O-N 3.2Å; G392-A395 VanDerWaalsContact O-N 3.08Å; A395-Q399 WeakPolarHBondContact O-CB 3.41Å; A395-Q399 PolarHBondContact O-N 3.17Å
396	F	65.1	Low	61.1	Low	109 Å²	109	79.9 Å²	79.9	48%	0.478	45%	0.447	S	S	.	.	H	α-helix	trans	-68	-37.9	176.8	-177	-99.2	0	0	0	111.9	K393 D394 T400	K393-F396 PolarHBondContact O-N 3.17Å; D394-F396 VanDerWaalsContact C-N 3.3Å; D394-F396 PolarHBondContact O-N 3.41Å; F396-T400 VanDerWaalsContact O-CB 3.32Å; F396-T400 WeakPolarHBondContact O-CB 3.38Å; F396-T400 PolarHBondContact O-N 3.32Å; F396-T400 PolarHBondContact O-OG1 3.4Å
397	L	64.9	Low	63.5	Low	76 Å²	76	69 Å²	69	40%	0.398	41%	0.406	S	S	.	.	H	α-helix	trans	-65.4	-45.3	176.3	-72	168.3	0	0	0	111.6	K393 D394 T400 K401	K393-L397 WeakPolarHBondContact O-CG 3.35Å; K393-L397 PolarHBondContact O-N 3.44Å; D394-L397 PolarHBondContact O-N 2.98Å; L397-T400 PolarHBondContact O-N 3.46Å; L397-K401 WeakPolarHBondContact O-CB 3.36Å; L397-K401 PolarHBondContact O-N 3.22Å
398	I	67.1	Low	66.2	Low	100 Å²	100	64.4 Å²	64.4	51%	0.513	37%	0.374	S	S	.	.	H	α-helix	trans	-62.5	-46.4	177	-65.7	165.3	0	0	0	110.3	D394 T400 K401 N402	D394-I398 WeakPolarHBondContact O-CG1 3.48Å; D394-I398 PolarHBondContact O-N 2.92Å; I398-T400 PolarHBondContact O-N 3.5Å; I398-K401 WeakPolarHBondContact O-CB 3.15Å; I398-K401 PolarHBondContact O-N 2.9Å; I398-N402 PolarHBondContact O-N 3.07Å
399	Q	70.3	Confident	68.3	Low	67 Å²	67	61.9 Å²	61.9	31%	0.313	35%	0.354	S	S	.	.	H	α-helix	trans	-60.2	-45.8	177.4	-176.7	170.7	34.7	0	0	111.7	M349 A395 K401 N402 T403	M349-Q399 HydrophobicContact CE-CG 4.45Å; M349-Q399 HydrophobicContact SD-CG 4.15Å; M349-Q399 PolarHBondContact SD-NE2 2.86Å; M349-Q399 VanDerWaalsContact SD-NE2 3.45Å; A395-Q399 WeakPolarHBondContact O-CB 3.41Å; A395-Q399 PolarHBondContact O-N 3.17Å; Q399-K401 VanDerWaalsContact C-N 3.31Å; Q399-K401 PolarHBondContact O-N 2.92Å; Q399-N402 PolarHBondContact O-N 2.89Å; Q399-T403 PolarHBondContact O-N 3.22Å; Q399-T403 PolarHBondContact O-OG1 3.25Å; Q399-T403 VanDerWaalsContact O-OG1 3.11Å
400	T	74.7	Confident	70.5	Confident	11 Å²	11	57.8 Å²	57.8	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-59.6	-44.3	177.2	-57.7	0	0	0	0	110.6	F396 L397 I398 T403 W404 L432 T571	F396-T400 VanDerWaalsContact O-CB 3.32Å; F396-T400 WeakPolarHBondContact O-CB 3.38Å; F396-T400 PolarHBondContact O-N 3.32Å; F396-T400 PolarHBondContact O-OG1 3.4Å; L397-T400 PolarHBondContact O-N 3.46Å; I398-T400 PolarHBondContact O-N 3.5Å; T400-T403 PolarHBondContact O-N 3.49Å; T400-W404 PolarHBondContact O-N 3.38Å; T400-L432 HydrophobicContact CG2-CD2 4.16Å; T400-T571 HydrophobicContact CG2-CG2 4.19Å
401	K	78.1	Confident	73	Confident	84 Å²	84	53 Å²	53	37%	0.365	29%	0.287	S	S	.	.	H	α-helix	trans	-59.1	-48.4	176.8	-173.5	-179.1	179.2	-175.5	0	111.8	L397 I398 Q399 T403 W404 L405	L397-K401 WeakPolarHBondContact O-CB 3.36Å; L397-K401 PolarHBondContact O-N 3.22Å; I398-K401 WeakPolarHBondContact O-CB 3.15Å; I398-K401 PolarHBondContact O-N 2.9Å; Q399-K401 VanDerWaalsContact C-N 3.31Å; Q399-K401 PolarHBondContact O-N 2.92Å; K401-T403 PolarHBondContact O-N 3.14Å; K401-W404 PolarHBondContact O-N 2.88Å; K401-L405 HydrophobicContact CG-CD1 4.26Å; K401-L405 WeakPolarHBondContact O-CG 3.49Å; K401-L405 PolarHBondContact O-N 2.82Å
402	N	79.1	Confident	75.6	Confident	55 Å²	55	53.4 Å²	53.4	29%	0.294	27%	0.274	S	S	.	.	H	α-helix	trans	-65.1	-39.9	-179.2	-67.1	-7.6	0	0	0	112.2	I398 Q399 W404 L405 G406	I398-N402 PolarHBondContact O-N 3.07Å; Q399-N402 PolarHBondContact O-N 2.89Å; N402-W404 VanDerWaalsContact C-N 3.33Å; N402-W404 PolarHBondContact O-N 2.84Å; N402-L405 PolarHBondContact O-N 3.35Å; N402-G406 PolarHBondContact O-N 2.83Å
403	T	82	Confident	77.3	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-58.5	-45.7	173.4	-62.6	0	0	0	0	111.4	Y346 S348 Q399 T400 K401 F407	Y346-T403 HydrophobicContact CD1-CG2 4.42Å; Y346-T403 HydrophobicContact CE1-CG2 3.93Å; S348-T403 WeakPolarHBondContact O-CG2 3.27Å; Q399-T403 PolarHBondContact O-N 3.22Å; Q399-T403 PolarHBondContact O-OG1 3.25Å; Q399-T403 VanDerWaalsContact O-OG1 3.11Å; T400-T403 PolarHBondContact O-N 3.49Å; K401-T403 PolarHBondContact O-N 3.14Å; T403-F407 VanDerWaalsContact O-CB 3.23Å; T403-F407 WeakPolarHBondContact O-CB 3.49Å; T403-F407 PolarHBondContact O-N 2.69Å
404	W	85.7	Confident	78.8	Confident	2 Å²	2	53.2 Å²	53.2	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-68	-38.4	179.1	-85.8	102.3	0	0	0	112.9	T400 K401 N402 F407 V408 A421 L432 L436 F510 V527 T529 L568	T400-W404 PolarHBondContact O-N 3.38Å; K401-W404 PolarHBondContact O-N 2.88Å; N402-W404 VanDerWaalsContact C-N 3.33Å; N402-W404 PolarHBondContact O-N 2.84Å; W404-F407 AromaticContact CE3-CD1 3.89Å; W404-F407 HydrophobicContact CE3-CD1 3.89Å; W404-F407 AromaticContact CZ3-CD1 3.76Å; W404-F407 HydrophobicContact CZ3-CD1 3.76Å; W404-F407 HydrophobicContact CZ3-CE1 4.03Å; W404-F407 PolarHBondContact O-N 3.41Å; W404-V408 VanDerWaalsContact O-CG2 3.25Å; W404-V408 WeakPolarHBondContact O-CG2 3.29Å; W404-V408 PolarHBondContact O-N 3.34Å; W404-A421 HydrophobicContact CH2-CB 3.7Å; W404-A421 HydrophobicContact CZ3-CB 4.35Å; W404-L432 HydrophobicContact CZ2-CD1 4.37Å; W404-L432 HydrophobicContact CZ2-CD2 4.46Å; W404-L436 HydrophobicContact CB-CD1 4.12Å; W404-L436 HydrophobicContact CB-CD2 3.93Å; W404-L436 HydrophobicContact CB-CG 4.17Å; W404-L436 HydrophobicContact CD2-CD1 4.21Å; W404-L436 HydrophobicContact CE3-CD1 3.91Å; W404-L436 HydrophobicContact CG-CD1 4.33Å; W404-F510 HydrophobicContact CE3-CE1 4.28Å; W404-F510 HydrophobicContact CE3-CZ 4.41Å; W404-F510 AromaticContact CH2-CE1 3.7Å; W404-F510 HydrophobicContact CH2-CE1 3.7Å; W404-F510 HydrophobicContact CZ2-CE1 4.09Å; W404-F510 AromaticContact CZ3-CE1 3.79Å; W404-F510 HydrophobicContact CZ3-CE1 3.79Å; W404-F510 HydrophobicContact CZ3-CZ 4.16Å; W404-V527 HydrophobicContact CH2-CG1 4.24Å; W404-T529 HydrophobicContact CH2-CG2 3.9Å; W404-T529 HydrophobicContact CZ2-CG2 3.51Å; W404-L568 HydrophobicContact CD2-CD1 4.44Å; W404-L568 HydrophobicContact CH2-CD1 3.62Å; W404-L568 HydrophobicContact CZ2-CD1 3.32Å; W404-L568 HydrophobicContact CZ3-CD1 4.31Å
405	L	84.9	Confident	80.4	Confident	32 Å²	32	53.4 Å²	53.4	17%	0.168	27%	0.265	C	S	.	.	H	α-helix	trans	-61.5	-48.4	175.1	-71.2	172.4	0	0	0	111.6	K401 N402 F407 V408 N409 L436 V439	K401-L405 HydrophobicContact CG-CD1 4.26Å; K401-L405 WeakPolarHBondContact O-CG 3.49Å; K401-L405 PolarHBondContact O-N 2.82Å; N402-L405 PolarHBondContact O-N 3.35Å; L405-F407 VanDerWaalsContact C-N 3.29Å; L405-F407 PolarHBondContact O-N 3.43Å; L405-V408 PolarHBondContact O-N 3.05Å; L405-N409 PolarHBondContact O-N 3.01Å; L405-N409 VanDerWaalsContact O-N 3.13Å; L405-N409 PolarHBondContact O-ND2 3.4Å; L405-L436 HydrophobicContact CD2-CD2 4Å; L405-L436 HydrophobicContact CG-CD2 4.49Å; L405-V439 HydrophobicContact CD2-CG2 3.49Å; L405-V439 VanDerWaalsContact CD2-CG2 3.49Å
406	G	83.7	Confident	81.9	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.5	-39.5	174.1	0	0	0	0	0	112.4	Y353 N402 N409 L410	Y353-G406 VanDerWaalsContact CB-O 3.32Å; Y353-G406 WeakPolarHBondContact CB-O 3.35Å; N402-G406 PolarHBondContact O-N 2.83Å; G406-N409 PolarHBondContact O-N 3.1Å; G406-L410 PolarHBondContact O-N 3.13Å
407	F	87.5	Confident	83.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-68.8	-38.7	178.4	-175.8	-110.8	0	0	0	113.2	Y346 T403 W404 L405 N409 L410 L411 V527 I566 L568	Y346-F407 HydrophobicContact CD1-CD2 4.03Å; Y346-F407 HydrophobicContact CD2-CD2 4.18Å; Y346-F407 HydrophobicContact CE1-CB 3.98Å; Y346-F407 AromaticContact CE1-CD2 3.99Å; Y346-F407 HydrophobicContact CE1-CD2 3.99Å; Y346-F407 HydrophobicContact CE1-CG 4.37Å; Y346-F407 HydrophobicContact CE2-CD2 4.17Å; Y346-F407 HydrophobicContact CG-CD2 4.09Å; Y346-F407 HydrophobicContact CG-CE2 4.49Å; T403-F407 VanDerWaalsContact O-CB 3.23Å; T403-F407 WeakPolarHBondContact O-CB 3.49Å; T403-F407 PolarHBondContact O-N 2.69Å; W404-F407 AromaticContact CE3-CD1 3.89Å; W404-F407 HydrophobicContact CE3-CD1 3.89Å; W404-F407 AromaticContact CZ3-CD1 3.76Å; W404-F407 HydrophobicContact CZ3-CD1 3.76Å; W404-F407 HydrophobicContact CZ3-CE1 4.03Å; W404-F407 PolarHBondContact O-N 3.41Å; L405-F407 VanDerWaalsContact C-N 3.29Å; L405-F407 PolarHBondContact O-N 3.43Å; F407-N409 VanDerWaalsContact C-N 3.32Å; F407-N409 PolarHBondContact O-N 3.26Å; F407-L410 HydrophobicContact CD2-CD2 4.2Å; F407-L410 HydrophobicContact CE2-CD2 4.31Å; F407-L410 WeakPolarHBondContact O-CB 3.46Å; F407-L410 PolarHBondContact O-N 3.19Å; F407-L411 HydrophobicContact CD1-CD1 4.09Å; F407-L411 HydrophobicContact CD1-CG 4.39Å; F407-L411 HydrophobicContact CE1-CD1 3.64Å; F407-L411 HydrophobicContact CE1-CD2 4.29Å; F407-L411 HydrophobicContact CE1-CG 3.99Å; F407-L411 HydrophobicContact CE2-CD2 4.45Å; F407-L411 HydrophobicContact CZ-CD1 4.15Å; F407-L411 HydrophobicContact CZ-CD2 3.93Å; F407-L411 HydrophobicContact CZ-CG 4.06Å; F407-L411 WeakPolarHBondContact O-CG 3.36Å; F407-L411 PolarHBondContact O-N 2.86Å; F407-V527 HydrophobicContact CE1-CB 4.37Å; F407-V527 HydrophobicContact CE1-CG1 3.79Å; F407-V527 HydrophobicContact CE1-CG2 3.74Å; F407-V527 HydrophobicContact CZ-CB 4.41Å; F407-V527 HydrophobicContact CZ-CG1 3.86Å; F407-V527 HydrophobicContact CZ-CG2 3.62Å; F407-I566 HydrophobicContact CE2-CB 4.49Å; F407-I566 HydrophobicContact CE2-CD1 3.86Å; F407-I566 HydrophobicContact CE2-CG2 3.87Å; F407-I566 HydrophobicContact CZ-CB 4.38Å; F407-I566 HydrophobicContact CZ-CD1 3.95Å; F407-I566 HydrophobicContact CZ-CG2 4.16Å; F407-L568 HydrophobicContact CD1-CD2 4.32Å; F407-L568 HydrophobicContact CD2-CD2 3.96Å; F407-L568 HydrophobicContact CE1-CD2 4.37Å; F407-L568 HydrophobicContact CE2-CD2 4.04Å; F407-L568 HydrophobicContact CG-CD2 4.11Å; F407-L568 HydrophobicContact CZ-CD2 4.24Å
408	V	89.1	Confident	84.5	Confident	3 Å²	3	45.6 Å²	45.6	2%	0.018	22%	0.223	C	C	.	.	H	α-helix	trans	-66.4	-36.8	175.9	174.3	0	0	0	0	111	W404 L405 L411 K412 M417 L436 V439 L441 I508	W404-V408 VanDerWaalsContact O-CG2 3.25Å; W404-V408 WeakPolarHBondContact O-CG2 3.29Å; W404-V408 PolarHBondContact O-N 3.34Å; L405-V408 PolarHBondContact O-N 3.05Å; V408-L411 PolarHBondContact O-N 3.17Å; V408-K412 WeakPolarHBondContact O-CB 3.3Å; V408-K412 PolarHBondContact O-N 2.87Å; V408-M417 HydrophobicContact CG1-CE 4.47Å; V408-L436 HydrophobicContact CG2-CD1 4.15Å; V408-L436 HydrophobicContact CG2-CD2 4.08Å; V408-V439 HydrophobicContact CG1-CG1 3.94Å; V408-L441 HydrophobicContact CG1-CD1 4.37Å; V408-L441 HydrophobicContact CG1-CD2 4.04Å; V408-I508 HydrophobicContact CG1-CD1 4.12Å; V408-I508 HydrophobicContact CG2-CD1 3.77Å
409	N	86.5	Confident	85.8	Confident	70 Å²	70	40.9 Å²	40.9	37%	0.374	20%	0.199	S	C	.	.	H	α-helix	trans	-62.6	-43.4	172.2	-69.5	-20.8	0	0	0	111.5	Y353 L405 G406 F407 L411 K412 E413	Y353-N409 HydrophobicContact CD1-CB 4.21Å; L405-N409 PolarHBondContact O-N 3.01Å; L405-N409 VanDerWaalsContact O-N 3.13Å; L405-N409 PolarHBondContact O-ND2 3.4Å; G406-N409 PolarHBondContact O-N 3.1Å; F407-N409 VanDerWaalsContact C-N 3.32Å; F407-N409 PolarHBondContact O-N 3.26Å; N409-L411 PolarHBondContact O-N 3.39Å; N409-K412 PolarHBondContact O-N 3.2Å; N409-K412 VanDerWaalsContact O-N 3.16Å; N409-E413 WeakPolarHBondContact O-CG 3.4Å; N409-E413 PolarHBondContact O-N 3.15Å
410	L	87.9	Confident	87	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-56.2	-48.1	173.1	-175.3	72.1	0	0	0	112	Y346 Y353 L357 G406 F407 K412 E413 Q414	Y346-L410 HydrophobicContact CD2-CD2 4.09Å; Y346-L410 HydrophobicContact CE2-CD2 3.85Å; Y353-L410 HydrophobicContact CD2-CD1 4.28Å; L357-L410 HydrophobicContact CD1-CD2 4.43Å; G406-L410 PolarHBondContact O-N 3.13Å; F407-L410 HydrophobicContact CD2-CD2 4.2Å; F407-L410 HydrophobicContact CE2-CD2 4.31Å; F407-L410 WeakPolarHBondContact O-CB 3.46Å; F407-L410 PolarHBondContact O-N 3.19Å; L410-K412 VanDerWaalsContact C-N 3.25Å; L410-K412 PolarHBondContact O-N 2.79Å; L410-E413 PolarHBondContact O-N 2.99Å; L410-Q414 HydrophobicContact CD1-CG 4.18Å; L410-Q414 WeakPolarHBondContact O-CB 3.46Å; L410-Q414 WeakPolarHBondContact O-CG 3.45Å; L410-Q414 PolarHBondContact O-N 3.45Å
411	L	90.5	Very high	87.9	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-61.3	-35.8	179.1	-69.7	178.2	0	0	0	112.1	F407 V408 N409 N415 L416 M417 A419 I508	F407-L411 HydrophobicContact CD1-CD1 4.09Å; F407-L411 HydrophobicContact CD1-CG 4.39Å; F407-L411 HydrophobicContact CE1-CD1 3.64Å; F407-L411 HydrophobicContact CE1-CD2 4.29Å; F407-L411 HydrophobicContact CE1-CG 3.99Å; F407-L411 HydrophobicContact CE2-CD2 4.45Å; F407-L411 HydrophobicContact CZ-CD1 4.15Å; F407-L411 HydrophobicContact CZ-CD2 3.93Å; F407-L411 HydrophobicContact CZ-CG 4.06Å; F407-L411 WeakPolarHBondContact O-CG 3.36Å; F407-L411 PolarHBondContact O-N 2.86Å; V408-L411 PolarHBondContact O-N 3.17Å; N409-L411 PolarHBondContact O-N 3.39Å; L411-N415 PolarHBondContact O-N 3.45Å; L411-L416 HydrophobicContact CD2-CB 3.68Å; L411-L416 HydrophobicContact CD2-CD1 4.11Å; L411-L416 PolarHBondContact O-N 3.06Å; L411-M417 HydrophobicContact CB-CE 3.8Å; L411-M417 HydrophobicContact CB-CG 4.33Å; L411-A419 HydrophobicContact CD1-CB 4.05Å; L411-I508 HydrophobicContact CD1-CD1 4.15Å
412	K	89.1	Confident	88.7	Confident	129 Å²	129	33.2 Å²	33.2	56%	0.561	16%	0.164	S	C	*	.	H	α-helix	trans	-72.1	-47.9	-179	-171.8	177.5	179.5	179.6	0	111.2	V408 N409 L410 N415 M417	V408-K412 WeakPolarHBondContact O-CB 3.3Å; V408-K412 PolarHBondContact O-N 2.87Å; N409-K412 PolarHBondContact O-N 3.2Å; N409-K412 VanDerWaalsContact O-N 3.16Å; L410-K412 VanDerWaalsContact C-N 3.25Å; L410-K412 PolarHBondContact O-N 2.79Å; K412-N415 PolarHBondContact O-N 3.38Å; K412-M417 HydrophobicContact CB-CE 3.81Å
413	E	86.6	Confident	89.3	Confident	108 Å²	108	30.6 Å²	30.6	51%	0.505	15%	0.15	S	C	.	.	H	α-helix	trans	-67.9	-37.9	-178.8	-69.9	-175.2	-173.4	0	0	112.8	Y353 N409 L410 N415	Y353-E413 VanDerWaalsContact CE2-CD 3.42Å; Y353-E413 WeakPolarHBondContact CE2-OE1 3.38Å; Y353-E413 WeakPolarHBondContact CE2-OE2 3.4Å; Y353-E413 VanDerWaalsContact OH-CD 3.31Å; Y353-E413 PolarHBondContact OH-OE1 2.77Å; Y353-E413 PolarHBondContact OH-OE2 3.21Å; N409-E413 WeakPolarHBondContact O-CG 3.4Å; N409-E413 PolarHBondContact O-N 3.15Å; L410-E413 PolarHBondContact O-N 2.99Å; E413-N415 VanDerWaalsContact C-N 3.27Å; E413-N415 PolarHBondContact O-N 3.5Å
414	Q	86.8	Confident	89.6	Confident	114 Å²	114	32.4 Å²	32.4	53%	0.533	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	4.5	179.6	-65.5	-107.2	-17.4	0	0	113.2	L410 L416	L410-Q414 HydrophobicContact CD1-CG 4.18Å; L410-Q414 WeakPolarHBondContact O-CB 3.46Å; L410-Q414 WeakPolarHBondContact O-CG 3.45Å; L410-Q414 PolarHBondContact O-N 3.45Å; Q414-L416 VanDerWaalsContact C-N 3.28Å; Q414-L416 HydrophobicContact CB-CD1 3.77Å; Q414-L416 HydrophobicContact CB-CD2 4.41Å; Q414-L416 HydrophobicContact CB-CG 3.65Å; Q414-L416 PolarHBondContact O-N 2.87Å
415	N	89.8	Confident	89.7	Confident	116 Å²	116	34.4 Å²	34.4	62%	0.62	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.8	43.7	-176.2	-73.6	-46	0	0	0	113.5	L411 K412 E413 M417 R524	L411-N415 PolarHBondContact O-N 3.45Å; K412-N415 PolarHBondContact O-N 3.38Å; E413-N415 VanDerWaalsContact C-N 3.27Å; E413-N415 PolarHBondContact O-N 3.5Å; N415-M417 VanDerWaalsContact C-N 3.35Å; N415-R524 WeakPolarHBondContact O-CD 3.41Å; N415-R524 PolarHBondContact O-NE 2.8Å; N415-R524 PolarHBondContact O-NH1 3.38Å
416	L	90.7	Very high	89.8	Confident	5 Å²	5	36.7 Å²	36.7	3%	0.026	18%	0.179	C	C	.	.			trans	-91.3	8	-175.7	-63.3	178.5	0	0	0	114.1	L411 Q414 C525 L564	L411-L416 HydrophobicContact CD2-CB 3.68Å; L411-L416 HydrophobicContact CD2-CD1 4.11Å; L411-L416 PolarHBondContact O-N 3.06Å; Q414-L416 VanDerWaalsContact C-N 3.28Å; Q414-L416 HydrophobicContact CB-CD1 3.77Å; Q414-L416 HydrophobicContact CB-CD2 4.41Å; Q414-L416 HydrophobicContact CB-CG 3.65Å; Q414-L416 PolarHBondContact O-N 2.87Å; L416-C525 HydrophobicContact CB-CB 4.36Å; L416-C525 WeakPolarHBondContact O-CB 3.37Å; L416-L564 HydrophobicContact CD1-CD2 3.91Å; L416-L564 HydrophobicContact CD2-CD1 4Å; L416-L564 HydrophobicContact CD2-CD2 3.68Å; L416-L564 HydrophobicContact CD2-CG 4.39Å; L416-L564 HydrophobicContact CG-CD2 4.45Å
417	M	90.3	Very high	90	Very high	39 Å²	39	40.3 Å²	40.3	19%	0.192	20%	0.204	C	C	.	.			trans	-87.4	148.2	177.5	-59.7	-179.8	-162.9	0	0	111.1	V408 L411 K412 N415 L441 K507	V408-M417 HydrophobicContact CG1-CE 4.47Å; L411-M417 HydrophobicContact CB-CE 3.8Å; L411-M417 HydrophobicContact CB-CG 4.33Å; K412-M417 HydrophobicContact CB-CE 3.81Å; N415-M417 VanDerWaalsContact C-N 3.35Å; M417-L441 HydrophobicContact CE-CD1 4.18Å; M417-L441 HydrophobicContact CE-CD2 4.07Å; M417-L441 HydrophobicContact SD-CD1 4.13Å; M417-K507 HydrophobicContact SD-CB 3.82Å; M417-K507 HydrophobicContact SD-CG 4.5Å
418	P	93.9	Very high	90	Very high	16 Å²	16	42.4 Å²	42.4	10%	0.104	22%	0.219	C	C	.	.	S	Bend	cis	-76.1	147.6	3.7	31.6	-34.9	0	0	0	112.9	F501 K507 R524 C525	P418-F501 HydrophobicContact CB-CE2 3.95Å; P418-F501 HydrophobicContact CB-CZ 3.97Å; P418-F501 HydrophobicContact CG-CZ 4.38Å; P418-K507 CarbonylContact C-O 3.27Å; P418-K507 VanDerWaalsContact CA-O 3.28Å; P418-K507 WeakPolarHBondContact CA-O 3.29Å; P418-R524 PolarHBondContact O-N 3.4Å; P418-C525 PolarHBondContact O-N 2.68Å
419	A	94.8	Very high	90.1	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	141	-179.5	0	0	0	0	0	112.2	L411 K507 I508 L509 C525	L411-A419 HydrophobicContact CD1-CB 4.05Å; A419-K507 PolarHBondContact N-O 2.84Å; A419-I508 WeakPolarHBondContact O-CA 3.32Å; A419-L509 PolarHBondContact O-N 2.9Å; A419-C525 CarbonylContact C-O 3.48Å; A419-C525 VanDerWaalsContact CA-O 3.24Å; A419-C525 WeakPolarHBondContact CA-O 3.17Å; A419-C525 HydrophobicContact CB-CB 4.14Å
420	I	95.3	Very high	90.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.9	172.4	-64.1	169.9	0	0	0	109	F422 F501 L509 A511 T521 A523 C525 V526 V527 R553	I420-F422 HydrophobicContact CG2-CD1 4.43Å; I420-F422 HydrophobicContact CG2-CD2 4.18Å; I420-F422 HydrophobicContact CG2-CE1 4.08Å; I420-F422 HydrophobicContact CG2-CE2 3.8Å; I420-F422 HydrophobicContact CG2-CG 4.48Å; I420-F422 HydrophobicContact CG2-CZ 3.75Å; I420-F501 HydrophobicContact CD1-CE1 4.21Å; I420-F501 HydrophobicContact CD1-CZ 3.93Å; I420-F501 HydrophobicContact CG1-CE1 4.46Å; I420-F501 HydrophobicContact CG1-CE2 4.15Å; I420-F501 HydrophobicContact CG1-CZ 3.7Å; I420-L509 CarbonylContact C-O 3.46Å; I420-L509 WeakPolarHBondContact CA-O 3.45Å; I420-L509 HydrophobicContact CG1-CB 4.3Å; I420-L509 HydrophobicContact CG1-CD2 4.33Å; I420-A511 HydrophobicContact CG2-CB 4.06Å; I420-T521 VanDerWaalsContact CD1-O 3.29Å; I420-T521 WeakPolarHBondContact CD1-O 3.49Å; I420-A523 HydrophobicContact CB-CB 4.41Å; I420-A523 HydrophobicContact CD1-CB 3.67Å; I420-A523 HydrophobicContact CG1-CB 3.7Å; I420-C525 PolarHBondContact N-O 2.92Å; I420-V526 CarbonylContact O-C 3.35Å; I420-V526 WeakPolarHBondContact O-CA 3.48Å; I420-V527 PolarHBondContact O-N 3.29Å; I420-R553 HydrophobicContact CD1-CB 4.5Å
421	A	94.7	Very high	90.5	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	110.3	175.7	0	0	0	0	0	110.8	W404 L509 F510 A511 V527 T529	W404-A421 HydrophobicContact CH2-CB 3.7Å; W404-A421 HydrophobicContact CZ3-CB 4.35Å; A421-L509 PolarHBondContact N-O 3.47Å; A421-F510 HydrophobicContact CB-CD1 3.62Å; A421-F510 HydrophobicContact CB-CE1 3.77Å; A421-F510 HydrophobicContact CB-CG 4.46Å; A421-F510 WeakPolarHBondContact O-CA 3.46Å; A421-A511 PolarHBondContact O-N 2.9Å; A421-V527 CarbonylContact C-O 3.59Å; A421-V527 WeakPolarHBondContact CA-O 3.5Å; A421-V527 HydrophobicContact CB-CB 4.3Å; A421-T529 HydrophobicContact CB-CG2 4.26Å
422	F	94.7	Very high	90.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.4	-179.9	-74.9	-68.1	0	0	0	112.4	I420 A511 V515 V526 V527 F528 T529 M550	I420-F422 HydrophobicContact CG2-CD1 4.43Å; I420-F422 HydrophobicContact CG2-CD2 4.18Å; I420-F422 HydrophobicContact CG2-CE1 4.08Å; I420-F422 HydrophobicContact CG2-CE2 3.8Å; I420-F422 HydrophobicContact CG2-CG 4.48Å; I420-F422 HydrophobicContact CG2-CZ 3.75Å; F422-A511 VanDerWaalsContact CA-O 3.31Å; F422-A511 WeakPolarHBondContact CA-O 3.49Å; F422-A511 HydrophobicContact CD1-CB 4.25Å; F422-A511 HydrophobicContact CE1-CB 4.22Å; F422-V515 HydrophobicContact CE1-CB 4.32Å; F422-V526 HydrophobicContact CD2-CG1 3.61Å; F422-V526 HydrophobicContact CE2-CG1 3.62Å; F422-V526 HydrophobicContact CE2-CG2 4.46Å; F422-V527 PolarHBondContact N-O 2.86Å; F422-F528 HydrophobicContact CB-CD1 4.45Å; F422-F528 HydrophobicContact CD2-CE1 4.45Å; F422-T529 WeakPolarHBondContact O-CG2 3.25Å; F422-T529 PolarHBondContact O-N 3.32Å; F422-T529 VanDerWaalsContact O-N 3.13Å; F422-T529 PolarHBondContact O-OG1 2.9Å; F422-M550 HydrophobicContact CB-SD 4.25Å; F422-M550 HydrophobicContact CD1-CG 4.35Å; F422-M550 HydrophobicContact CD1-SD 3.96Å; F422-M550 HydrophobicContact CD2-CB 3.96Å; F422-M550 HydrophobicContact CD2-CG 4.19Å; F422-M550 HydrophobicContact CD2-SD 4.12Å; F422-M550 HydrophobicContact CE1-CG 4.14Å; F422-M550 HydrophobicContact CE1-SD 4.33Å; F422-M550 HydrophobicContact CE2-CB 3.67Å; F422-M550 HydrophobicContact CE2-CG 3.97Å; F422-M550 HydrophobicContact CE2-SD 4.48Å; F422-M550 HydrophobicContact CG-CG 4.38Å; F422-M550 HydrophobicContact CG-SD 3.85Å; F422-M550 HydrophobicContact CZ-CB 4.09Å; F422-M550 HydrophobicContact CZ-CG 3.95Å
423	A	91.5	Very high	90.6	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.207	C	C	.	.			trans	-130.9	133.8	170.2	0	0	0	0	0	110.8	S425 V429 L432 A511 T512 T529	A423-S425 VanDerWaalsContact C-N 3.29Å; A423-S425 PolarHBondContact O-N 2.73Å; A423-V429 HydrophobicContact CB-CG2 3.82Å; A423-L432 HydrophobicContact CB-CD1 4.05Å; A423-A511 PolarHBondContact N-O 3.49Å; A423-T512 WeakPolarHBondContact O-CA 3.48Å; A423-T512 WeakPolarHBondContact O-CG2 3.37Å; A423-T529 WeakPolarHBondContact CB-OG1 3.48Å
424	F	88.7	Confident	90.7	Very high	39 Å²	39	38.5 Å²	38.5	17%	0.171	20%	0.203	C	C	.	.	S	Bend	trans	-88.8	22.2	-170.6	-51.9	-63.7	0	0	0	115	E513 S530 E532 K533 L542 M550	F424-E513 HydrophobicContact CD1-CB 4.5Å; F424-E513 HydrophobicContact CE1-CB 4.39Å; F424-S530 VanDerWaalsContact CE2-O 3.28Å; F424-S530 WeakPolarHBondContact CE2-O 3.46Å; F424-E532 VanDerWaalsContact CD2-O 3.27Å; F424-E532 WeakPolarHBondContact CD2-O 3.5Å; F424-K533 HydrophobicContact CB-CB 3.98Å; F424-K533 HydrophobicContact CD1-CB 4.36Å; F424-K533 HydrophobicContact CD2-CB 4.04Å; F424-K533 HydrophobicContact CG-CB 3.85Å; F424-L542 HydrophobicContact CE1-CD2 3.97Å; F424-L542 HydrophobicContact CE2-CD1 3.97Å; F424-L542 HydrophobicContact CE2-CD2 3.96Å; F424-L542 HydrophobicContact CE2-CG 4.25Å; F424-L542 HydrophobicContact CZ-CD1 3.61Å; F424-L542 HydrophobicContact CZ-CD2 3.61Å; F424-L542 HydrophobicContact CZ-CG 4.1Å; F424-M550 HydrophobicContact CE1-CE 3.87Å; F424-M550 HydrophobicContact CE1-SD 3.68Å; F424-M550 HydrophobicContact CZ-CE 3.93Å; F424-M550 HydrophobicContact CZ-SD 4.03Å
425	S	86.9	Confident	90.7	Very high	44 Å²	44	34.8 Å²	34.8	31%	0.308	19%	0.187	S	C	.	.	S	Bend	trans	-141.6	137.1	172.2	174.9	0	0	0	0	109.9	A423 S427 S428 V429	A423-S425 VanDerWaalsContact C-N 3.29Å; A423-S425 PolarHBondContact O-N 2.73Å; S425-S427 VanDerWaalsContact C-N 3.3Å; S425-S427 PolarHBondContact O-N 2.8Å; S425-S427 PolarHBondContact OG-N 2.84Å; S425-S427 PolarHBondContact OG-OG 3.11Å; S425-S428 WeakPolarHBondContact O-CB 3.33Å; S425-S428 PolarHBondContact O-N 3.4Å; S425-S428 VanDerWaalsContact O-N 3.09Å; S425-V429 PolarHBondContact O-N 3.41Å
426	R	87.1	Confident	90.5	Very high	81 Å²	81	29.3 Å²	29.3	31%	0.306	16%	0.158	S	C	.	.	H	α-helix	trans	-56.2	-46.2	176.6	-57.3	178.8	-175.2	171.9	3.6	111	S428 V429 E430 H486 S487 S1254	R426-S428 VanDerWaalsContact C-N 3.3Å; R426-S428 PolarHBondContact O-N 3.41Å; R426-V429 PolarHBondContact O-N 3.25Å; R426-E430 PolarHBondContact O-N 3.05Å; R426-H486 HydrophobicContact CG-CB 4.14Å; R426-S487 PolarHBondContact NE-OG 2.93Å; R426-S487 PolarHBondContact NH2-OG 3.32Å; R426-S1254 PolarHBondContact NH1-OG 2.73Å
427	S	87.1	Confident	90	Very high	75 Å²	75	31.4 Å²	31.4	52%	0.524	17%	0.173	S	C	.	.	H	α-helix	trans	-64.9	-34.1	178.1	59.2	0	0	0	0	112.7	S425 T431	S425-S427 VanDerWaalsContact C-N 3.3Å; S425-S427 PolarHBondContact O-N 2.8Å; S425-S427 PolarHBondContact OG-N 2.84Å; S425-S427 PolarHBondContact OG-OG 3.11Å; S427-T431 VanDerWaalsContact O-CB 3.3Å; S427-T431 WeakPolarHBondContact O-CB 3.49Å; S427-T431 PolarHBondContact O-N 2.97Å; S427-T431 PolarHBondContact O-OG1 2.99Å
428	S	87.7	Confident	89.7	Confident	44 Å²	44	33.4 Å²	33.4	31%	0.308	19%	0.19	S	C	.	.	H	α-helix	trans	-67.4	-46.4	177.3	-171.8	0	0	0	0	111	S425 R426 E430 T431 L432	S425-S428 WeakPolarHBondContact O-CB 3.33Å; S425-S428 PolarHBondContact O-N 3.4Å; S425-S428 VanDerWaalsContact O-N 3.09Å; R426-S428 VanDerWaalsContact C-N 3.3Å; R426-S428 PolarHBondContact O-N 3.41Å; S428-E430 PolarHBondContact O-N 2.9Å; S428-T431 PolarHBondContact O-N 2.93Å; S428-L432 WeakPolarHBondContact O-CB 3.43Å; S428-L432 VanDerWaalsContact O-CG 3.25Å; S428-L432 WeakPolarHBondContact O-CG 3.32Å; S428-L432 PolarHBondContact O-N 3.46Å
429	V	91.9	Very high	89.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-54.5	-50.1	176.2	166.4	0	0	0	0	111.2	A423 S425 R426 A433 V484 F510 T512	A423-V429 HydrophobicContact CB-CG2 3.82Å; S425-V429 PolarHBondContact O-N 3.41Å; R426-V429 PolarHBondContact O-N 3.25Å; V429-A433 PolarHBondContact O-N 3.36Å; V429-A433 VanDerWaalsContact O-N 3.14Å; V429-V484 HydrophobicContact CG1-CB 3.73Å; V429-V484 HydrophobicContact CG1-CG1 3.72Å; V429-F510 HydrophobicContact CG1-CB 3.77Å; V429-F510 VanDerWaalsContact CG1-O 3.26Å; V429-F510 WeakPolarHBondContact CG1-O 3.33Å; V429-T512 HydrophobicContact CG2-CG2 4.1Å
430	E	91.7	Very high	89.4	Confident	62 Å²	62	37.4 Å²	37.4	29%	0.29	21%	0.212	S	C	.	.	H	α-helix	trans	-66.3	-39	178.4	-69.3	-174.9	-168.6	0	0	113.1	R426 S428 A433 K434 F473 H486	R426-E430 PolarHBondContact O-N 3.05Å; S428-E430 PolarHBondContact O-N 2.9Å; E430-A433 PolarHBondContact O-N 2.91Å; E430-K434 WeakPolarHBondContact O-CB 3.47Å; E430-K434 VanDerWaalsContact O-CG 3.25Å; E430-K434 WeakPolarHBondContact O-CG 3.26Å; E430-K434 PolarHBondContact O-N 3.43Å; E430-K434 IonicContact OE2-NZ 2.85Å; E430-F473 HydrophobicContact CG-CE1 4.28Å; E430-H486 IonicContact OE1-CE1 2.89Å; E430-H486 IonicContact OE1-NE2 2.87Å; E430-H486 PolarHBondContact OE1-NE2 3.31Å
431	T	90.2	Very high	89.2	Confident	60 Å²	60	38.7 Å²	38.7	37%	0.368	22%	0.218	S	C	.	.	H	α-helix	trans	-65.7	-43.2	-180	-58.7	0	0	0	0	111	S427 S428 K434 N435	S427-T431 VanDerWaalsContact O-CB 3.3Å; S427-T431 WeakPolarHBondContact O-CB 3.49Å; S427-T431 PolarHBondContact O-N 2.97Å; S427-T431 PolarHBondContact O-OG1 2.99Å; S428-T431 PolarHBondContact O-N 2.93Å; T431-K434 PolarHBondContact O-N 2.94Å; T431-N435 PolarHBondContact O-N 3.39Å; T431-N435 PolarHBondContact O-ND2 2.74Å; T431-N435 PolarHBondContact O-OD1 2.66Å
432	L	89.7	Confident	89.1	Confident	13 Å²	13	39.3 Å²	39.3	7%	0.068	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-44.6	176.2	-70.6	174.9	0	0	0	111.6	T400 W404 A423 S428 N435 L436 F510 T529	T400-L432 HydrophobicContact CG2-CD2 4.16Å; W404-L432 HydrophobicContact CZ2-CD1 4.37Å; W404-L432 HydrophobicContact CZ2-CD2 4.46Å; A423-L432 HydrophobicContact CB-CD1 4.05Å; S428-L432 WeakPolarHBondContact O-CB 3.43Å; S428-L432 VanDerWaalsContact O-CG 3.25Å; S428-L432 WeakPolarHBondContact O-CG 3.32Å; S428-L432 PolarHBondContact O-N 3.46Å; L432-N435 PolarHBondContact O-N 3.25Å; L432-L436 PolarHBondContact O-N 3.17Å; L432-F510 HydrophobicContact CB-CD1 3.92Å; L432-F510 HydrophobicContact CB-CE1 4.02Å; L432-F510 HydrophobicContact CD1-CD1 4.38Å; L432-T529 HydrophobicContact CD1-CG2 4.06Å
433	A	91.8	Very high	89	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-41.3	175.9	0	0	0	0	0	112.4	V429 E430 N435 L436 S437 L477 V484 F510	V429-A433 PolarHBondContact O-N 3.36Å; V429-A433 VanDerWaalsContact O-N 3.14Å; E430-A433 PolarHBondContact O-N 2.91Å; A433-N435 PolarHBondContact O-N 3.41Å; A433-L436 PolarHBondContact O-N 3.48Å; A433-S437 PolarHBondContact O-N 2.89Å; A433-L477 HydrophobicContact CB-CD1 3.97Å; A433-L477 HydrophobicContact CB-CD2 4.41Å; A433-V484 HydrophobicContact CB-CG1 3.51Å; A433-F510 HydrophobicContact CB-CD2 3.89Å; A433-F510 HydrophobicContact CB-CE2 4.37Å; A433-F510 HydrophobicContact CB-CG 4.49Å
434	K	89.4	Confident	89	Confident	99 Å²	99	50.5 Å²	50.5	43%	0.43	28%	0.278	S	S	.	.	H	α-helix	trans	-61.5	-41.3	176.2	-77.7	168.2	-177	164.9	0	112.1	E430 T431 L436 S437 F473	E430-K434 WeakPolarHBondContact O-CB 3.47Å; E430-K434 VanDerWaalsContact O-CG 3.25Å; E430-K434 WeakPolarHBondContact O-CG 3.26Å; E430-K434 PolarHBondContact O-N 3.43Å; E430-K434 IonicContact OE2-NZ 2.85Å; T431-K434 PolarHBondContact O-N 2.94Å; K434-L436 PolarHBondContact O-N 3.01Å; K434-S437 VanDerWaalsContact O-CB 3.26Å; K434-S437 WeakPolarHBondContact O-CB 3.49Å; K434-S437 PolarHBondContact O-N 3.11Å; K434-S437 VanDerWaalsContact O-N 3.12Å; K434-S437 PolarHBondContact O-OG 3.27Å; K434-F473 HydrophobicContact CD-CE2 4.19Å; K434-F473 HydrophobicContact CD-CZ 4.37Å; K434-F473 VanDerWaalsContact CE-CE2 3.5Å; K434-F473 HydrophobicContact CG-CE2 3.57Å; K434-F473 HydrophobicContact CG-CZ 3.86Å
435	N	86	Confident	89.3	Confident	36 Å²	36	51.8 Å²	51.8	19%	0.193	29%	0.291	C	S	.	.	H	α-helix	trans	-62.6	-27.9	179.2	-71.3	-15.8	0	0	0	113	T431 L432 A433	T431-N435 PolarHBondContact O-N 3.39Å; T431-N435 PolarHBondContact O-ND2 2.74Å; T431-N435 PolarHBondContact O-OD1 2.66Å; L432-N435 PolarHBondContact O-N 3.25Å; A433-N435 PolarHBondContact O-N 3.41Å
436	L	87.3	Confident	89.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	10	178.7	-75.1	171	0	0	0	114	W404 L405 V408 L432 A433 K434 S438 V439 L482 F510	W404-L436 HydrophobicContact CB-CD1 4.12Å; W404-L436 HydrophobicContact CB-CD2 3.93Å; W404-L436 HydrophobicContact CB-CG 4.17Å; W404-L436 HydrophobicContact CD2-CD1 4.21Å; W404-L436 HydrophobicContact CE3-CD1 3.91Å; W404-L436 HydrophobicContact CG-CD1 4.33Å; L405-L436 HydrophobicContact CD2-CD2 4Å; L405-L436 HydrophobicContact CG-CD2 4.49Å; V408-L436 HydrophobicContact CG2-CD1 4.15Å; V408-L436 HydrophobicContact CG2-CD2 4.08Å; L432-L436 PolarHBondContact O-N 3.17Å; A433-L436 PolarHBondContact O-N 3.48Å; K434-L436 PolarHBondContact O-N 3.01Å; L436-S438 PolarHBondContact O-N 3.02Å; L436-S438 VanDerWaalsContact O-N 3.08Å; L436-V439 HydrophobicContact CD2-CG2 3.95Å; L436-V439 PolarHBondContact O-N 3.45Å; L436-L482 HydrophobicContact CB-CD1 4Å; L436-L482 WeakPolarHBondContact O-CD1 3.3Å; L436-F510 HydrophobicContact CD1-CE1 4.36Å; L436-F510 HydrophobicContact CD1-CE2 4.14Å; L436-F510 HydrophobicContact CD1-CZ 3.46Å; L436-F510 VanDerWaalsContact CD1-CZ 3.46Å
437	S	80.2	Confident	89.9	Confident	49 Å²	49	50 Å²	50	34%	0.343	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-28.6	178.2	54.6	0	0	0	0	113	A433 K434 V439 R480	A433-S437 PolarHBondContact O-N 2.89Å; K434-S437 VanDerWaalsContact O-CB 3.26Å; K434-S437 WeakPolarHBondContact O-CB 3.49Å; K434-S437 PolarHBondContact O-N 3.11Å; K434-S437 VanDerWaalsContact O-N 3.12Å; K434-S437 PolarHBondContact O-OG 3.27Å; S437-V439 PolarHBondContact O-N 2.8Å; S437-R480 WeakPolarHBondContact O-CD 3.5Å; S437-R480 PolarHBondContact O-NH1 3.01Å
438	S	84	Confident	90.2	Very high	81 Å²	81	53.3 Å²	53.3	57%	0.566	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-13.8	177	56.1	0	0	0	0	114.8	L436	L436-S438 PolarHBondContact O-N 3.02Å; L436-S438 VanDerWaalsContact O-N 3.08Å
439	V	88.3	Confident	90.4	Very high	24 Å²	24	56.1 Å²	56.1	15%	0.145	30%	0.297	C	S	.	.			trans	-92.5	138.7	-177.3	-173.1	0	0	0	0	110.5	L405 V408 L436 S437 L441 R480	L405-V439 HydrophobicContact CD2-CG2 3.49Å; L405-V439 VanDerWaalsContact CD2-CG2 3.49Å; V408-V439 HydrophobicContact CG1-CG1 3.94Å; L436-V439 HydrophobicContact CD2-CG2 3.95Å; L436-V439 PolarHBondContact O-N 3.45Å; S437-V439 PolarHBondContact O-N 2.8Å; V439-L441 HydrophobicContact CG1-CD2 3.79Å; V439-L441 HydrophobicContact CG1-CG 4.02Å; V439-R480 WeakPolarHBondContact O-CB 3.41Å
440	D	92.5	Very high	90.4	Very high	77 Å²	77	56.2 Å²	56.2	41%	0.412	30%	0.297	S	S	.	.			trans	-128	111.7	-178.9	-171.9	17.2	0	0	0	109.6	T442 K447	D440-T442 PolarHBondContact OD1-OG1 2.91Å; D440-K447 WeakPolarHBondContact OD1-CE 3.37Å; D440-K447 IonicContact OD1-NZ 2.9Å; D440-K447 PolarHBondContact OD1-NZ 2.88Å; D440-K447 IonicContact OD2-NZ 3.23Å; D440-K447 PolarHBondContact OD2-NZ 2.97Å
441	L	91.8	Very high	90.5	Very high	26 Å²	26	55.8 Å²	55.8	14%	0.136	30%	0.299	C	S	.	.			trans	-108.3	2.2	-172.5	-60	178.3	0	0	0	113.5	V408 M417 V439 R480 L482 K507 I508	V408-L441 HydrophobicContact CG1-CD1 4.37Å; V408-L441 HydrophobicContact CG1-CD2 4.04Å; M417-L441 HydrophobicContact CE-CD1 4.18Å; M417-L441 HydrophobicContact CE-CD2 4.07Å; M417-L441 HydrophobicContact SD-CD1 4.13Å; V439-L441 HydrophobicContact CG1-CD2 3.79Å; V439-L441 HydrophobicContact CG1-CG 4.02Å; L441-R480 WeakPolarHBondContact CB-O 3.49Å; L441-R480 PolarHBondContact N-O 2.96Å; L441-L482 HydrophobicContact CD1-CD2 3.97Å; L441-K507 HydrophobicContact CB-CB 4.15Å; L441-K507 HydrophobicContact CB-CG 3.93Å; L441-K507 HydrophobicContact CD1-CB 3.95Å; L441-I508 HydrophobicContact CD1-CD1 3.67Å; L441-I508 HydrophobicContact CD1-CG1 3.84Å
442	T	91.8	Very high	90.5	Very high	14 Å²	14	57.4 Å²	57.4	9%	0.086	30%	0.301	C	S	.	.			trans	-109.9	144.4	-175.8	50.3	0	0	0	0	111.9	D440 E446 K447 I450 R479 G481	D440-T442 PolarHBondContact OD1-OG1 2.91Å; T442-E446 WeakPolarHBondContact CA-OE2 3.23Å; T442-E446 HydrophobicContact CG2-CB 4.41Å; T442-K447 WeakPolarHBondContact OG1-CE 3.49Å; T442-K447 WeakPolarHBondContact OG1-CG 3.47Å; T442-I450 HydrophobicContact CG2-CD1 4.1Å; T442-R479 PolarHBondContact OG1-O 3.07Å; T442-G481 VanDerWaalsContact CG2-CA 3.42Å; T442-G481 VanDerWaalsContact CG2-N 3.32Å
443	S	92.8	Very high	90.5	Very high	56 Å²	56	58 Å²	58	39%	0.392	30%	0.303	S	S	.	.			trans	-73	166.3	170	69	0	0	0	0	111.8	S445 E446 K447	S443-S445 VanDerWaalsContact C-N 3.26Å; S443-S445 PolarHBondContact O-N 2.89Å; S443-E446 PolarHBondContact N-OE2 2.91Å; S443-E446 PolarHBondContact O-N 3.34Å; S443-E446 VanDerWaalsContact OG-CG 3.28Å; S443-E446 WeakPolarHBondContact OG-CG 3.33Å; S443-E446 PolarHBondContact OG-N 3.43Å; S443-E446 PolarHBondContact OG-OE2 2.93Å; S443-K447 WeakPolarHBondContact O-CG 3.47Å; S443-K447 PolarHBondContact O-N 3.19Å
444	K	93	Very high	90.4	Very high	179 Å²	179	58.1 Å²	58.1	78%	0.778	30%	0.303	S	S	*	.	H	α-helix	trans	-60.1	-35.8	175.8	-67.7	-178.4	-179.1	177.6	0	112.5	Q448	K444-Q448 WeakPolarHBondContact O-CG 3.37Å; K444-Q448 PolarHBondContact O-N 2.84Å
445	S	93.6	Very high	90.3	Very high	66 Å²	66	56.6 Å²	56.6	46%	0.462	31%	0.305	S	S	.	.	H	α-helix	trans	-69.5	-47.8	178.1	177.4	0	0	0	0	111.5	S443 K447 Q448 Q449	S443-S445 VanDerWaalsContact C-N 3.26Å; S443-S445 PolarHBondContact O-N 2.89Å; S445-K447 VanDerWaalsContact C-N 3.26Å; S445-K447 PolarHBondContact O-N 2.98Å; S445-Q448 WeakPolarHBondContact O-CB 3.33Å; S445-Q448 PolarHBondContact O-N 2.93Å; S445-Q449 PolarHBondContact O-N 2.83Å
446	E	93.4	Very high	90.3	Very high	39 Å²	39	57.8 Å²	57.8	18%	0.182	31%	0.314	C	S	.	.	H	α-helix	trans	-59.1	-39.7	175.9	-70.1	168.7	138.9	0	0	111.1	T442 S443 Q448 Q449 I450 L505 K507	T442-E446 WeakPolarHBondContact CA-OE2 3.23Å; T442-E446 HydrophobicContact CG2-CB 4.41Å; S443-E446 PolarHBondContact N-OE2 2.91Å; S443-E446 PolarHBondContact O-N 3.34Å; S443-E446 VanDerWaalsContact OG-CG 3.28Å; S443-E446 WeakPolarHBondContact OG-CG 3.33Å; S443-E446 PolarHBondContact OG-N 3.43Å; S443-E446 PolarHBondContact OG-OE2 2.93Å; E446-Q448 VanDerWaalsContact C-N 3.33Å; E446-Q448 PolarHBondContact O-N 3.25Å; E446-Q449 PolarHBondContact O-N 3.35Å; E446-I450 WeakPolarHBondContact O-CB 3.46Å; E446-I450 WeakPolarHBondContact O-CG1 3.19Å; E446-I450 PolarHBondContact O-N 2.96Å; E446-L505 HydrophobicContact CB-CD2 3.93Å; E446-L505 HydrophobicContact CG-CD2 3.87Å; E446-K507 WeakPolarHBondContact OE1-CE 3.49Å; E446-K507 IonicContact OE1-NZ 4Å; E446-K507 PolarHBondContact OE1-NZ 2.91Å
447	K	94	Very high	90.2	Very high	49 Å²	49	58 Å²	58	21%	0.213	31%	0.314	C	S	.	.	H	α-helix	trans	-59.1	-42.4	174.2	-76.1	175.5	-175.9	-179	0	112.9	D440 T442 S443 S445 T451 R479	D440-K447 WeakPolarHBondContact OD1-CE 3.37Å; D440-K447 IonicContact OD1-NZ 2.9Å; D440-K447 PolarHBondContact OD1-NZ 2.88Å; D440-K447 IonicContact OD2-NZ 3.23Å; D440-K447 PolarHBondContact OD2-NZ 2.97Å; T442-K447 WeakPolarHBondContact OG1-CE 3.49Å; T442-K447 WeakPolarHBondContact OG1-CG 3.47Å; S443-K447 WeakPolarHBondContact O-CG 3.47Å; S443-K447 PolarHBondContact O-N 3.19Å; S445-K447 VanDerWaalsContact C-N 3.26Å; S445-K447 PolarHBondContact O-N 2.98Å; K447-T451 WeakPolarHBondContact O-CB 3.48Å; K447-T451 PolarHBondContact O-N 3.34Å; K447-T451 PolarHBondContact O-OG1 3.28Å; K447-T451 VanDerWaalsContact O-OG1 3.07Å; K447-R479 WeakPolarHBondContact CE-O 3.2Å; K447-R479 WeakPolarHBondContact CG-O 3.19Å
448	Q	93.2	Very high	90.4	Very high	145 Å²	145	57.1 Å²	57.1	68%	0.678	31%	0.308	S	S	*	.	H	α-helix	trans	-65.7	-42.9	177.4	-73.3	173.6	-15.6	0	0	111.2	K444 S445 E446 T451 K452	K444-Q448 WeakPolarHBondContact O-CG 3.37Å; K444-Q448 PolarHBondContact O-N 2.84Å; S445-Q448 WeakPolarHBondContact O-CB 3.33Å; S445-Q448 PolarHBondContact O-N 2.93Å; E446-Q448 VanDerWaalsContact C-N 3.33Å; E446-Q448 PolarHBondContact O-N 3.25Å; Q448-T451 PolarHBondContact O-N 3.44Å; Q448-K452 WeakPolarHBondContact O-CB 3.31Å; Q448-K452 PolarHBondContact O-N 3.35Å
449	Q	92.3	Very high	90.5	Very high	103 Å²	103	55.2 Å²	55.2	48%	0.481	30%	0.3	S	S	.	.	H	α-helix	trans	-60.7	-46.5	175.9	-69.3	178.6	-6.6	0	0	111.7	S445 E446 T451 K452 F453	S445-Q449 PolarHBondContact O-N 2.83Å; E446-Q449 PolarHBondContact O-N 3.35Å; Q449-T451 PolarHBondContact O-N 3.49Å; Q449-K452 PolarHBondContact O-N 3.35Å; Q449-F453 WeakPolarHBondContact O-CB 3.26Å; Q449-F453 PolarHBondContact O-N 2.99Å
450	I	92.5	Very high	90.2	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	31%	0.305	C	S	.	.	H	α-helix	trans	-61.5	-44.8	177.1	-66.3	166.9	0	0	0	110.5	T442 E446 F453 F454 T478 R479 L500 L505	T442-I450 HydrophobicContact CG2-CD1 4.1Å; E446-I450 WeakPolarHBondContact O-CB 3.46Å; E446-I450 WeakPolarHBondContact O-CG1 3.19Å; E446-I450 PolarHBondContact O-N 2.96Å; I450-F453 PolarHBondContact O-N 3.1Å; I450-F454 HydrophobicContact CG2-CD2 3.85Å; I450-F454 HydrophobicContact CG2-CE2 4.15Å; I450-F454 WeakPolarHBondContact O-CB 3.39Å; I450-F454 WeakPolarHBondContact O-CD2 3.36Å; I450-F454 PolarHBondContact O-N 3.43Å; I450-T478 VanDerWaalsContact CD1-O 3.29Å; I450-T478 WeakPolarHBondContact CD1-O 3.24Å; I450-R479 HydrophobicContact CG2-CG 4.31Å; I450-L500 HydrophobicContact CG1-CD2 4.4Å; I450-L505 HydrophobicContact CD1-CB 4.03Å; I450-L505 HydrophobicContact CG1-CB 3.96Å; I450-L505 HydrophobicContact CG1-CD1 3.96Å; I450-L505 HydrophobicContact CG1-CD2 4.3Å; I450-L505 HydrophobicContact CG1-CG 4.3Å
451	T	92.5	Very high	89.9	Confident	54 Å²	54	54 Å²	54	33%	0.331	29%	0.288	S	S	.	.	H	α-helix	trans	-65.9	-40	177.7	-63.6	0	0	0	0	112.1	K447 Q448 Q449 S455	K447-T451 WeakPolarHBondContact O-CB 3.48Å; K447-T451 PolarHBondContact O-N 3.34Å; K447-T451 PolarHBondContact O-OG1 3.28Å; K447-T451 VanDerWaalsContact O-OG1 3.07Å; Q448-T451 PolarHBondContact O-N 3.44Å; Q449-T451 PolarHBondContact O-N 3.49Å; T451-S455 WeakPolarHBondContact O-CB 3.5Å; T451-S455 PolarHBondContact O-N 3.39Å
452	K	91.4	Very high	89.5	Confident	94 Å²	94	59.2 Å²	59.2	41%	0.409	31%	0.306	S	S	.	.	H	α-helix	trans	-58.6	-50.5	172.6	-173	-177.6	177.9	-172.5	0	109.5	Q448 Q449 F454 S455 T456 D1314	Q448-K452 WeakPolarHBondContact O-CB 3.31Å; Q448-K452 PolarHBondContact O-N 3.35Å; Q449-K452 PolarHBondContact O-N 3.35Å; K452-F454 PolarHBondContact O-N 2.98Å; K452-S455 WeakPolarHBondContact O-CB 3.42Å; K452-S455 PolarHBondContact O-N 2.93Å; K452-S455 VanDerWaalsContact O-N 3.14Å; K452-S455 PolarHBondContact O-OG 3.3Å; K452-T456 PolarHBondContact O-N 3.09Å; K452-T456 VanDerWaalsContact O-N 3.11Å; K452-T456 PolarHBondContact O-OG1 3Å; K452-D1314 PolarHBondContact NZ-OXT 3.39Å
453	F	89.5	Confident	89.2	Confident	26 Å²	26	66.8 Å²	66.8	11%	0.114	34%	0.337	C	S	.	.	H	α-helix	trans	-60	-47.9	179.7	-169.3	-109.4	0	0	0	113	Q449 I450 S455 T456 I457 T496 L499 L500 I1308	Q449-F453 WeakPolarHBondContact O-CB 3.26Å; Q449-F453 PolarHBondContact O-N 2.99Å; I450-F453 PolarHBondContact O-N 3.1Å; F453-S455 VanDerWaalsContact C-N 3.3Å; F453-S455 PolarHBondContact O-N 3.02Å; F453-T456 WeakPolarHBondContact O-CB 3.45Å; F453-T456 PolarHBondContact O-N 3.42Å; F453-I457 HydrophobicContact CD1-CD1 3.46Å; F453-I457 VanDerWaalsContact CD1-CD1 3.46Å; F453-I457 HydrophobicContact CE1-CD1 3.25Å; F453-I457 HydrophobicContact CE1-CG1 4.45Å; F453-I457 HydrophobicContact CE2-CD1 4.47Å; F453-I457 HydrophobicContact CG-CD1 4.19Å; F453-I457 HydrophobicContact CZ-CD1 3.8Å; F453-I457 PolarHBondContact O-N 3.24Å; F453-I457 VanDerWaalsContact O-N 3.1Å; F453-T496 HydrophobicContact CD1-CG2 4.29Å; F453-T496 HydrophobicContact CE1-CG2 3.93Å; F453-L499 HydrophobicContact CE1-CB 4.47Å; F453-L499 HydrophobicContact CZ-CB 4.04Å; F453-L499 HydrophobicContact CZ-CD1 3.95Å; F453-L500 HydrophobicContact CB-CD2 4.46Å; F453-L500 HydrophobicContact CD1-CD1 4.21Å; F453-L500 HydrophobicContact CD1-CD2 3.52Å; F453-L500 HydrophobicContact CD1-CG 3.84Å; F453-L500 HydrophobicContact CE1-CD1 4.47Å; F453-L500 HydrophobicContact CE1-CD2 3.94Å; F453-L500 HydrophobicContact CE1-CG 3.86Å; F453-L500 HydrophobicContact CG-CD2 4.13Å; F453-I1308 HydrophobicContact CE2-CG2 4.38Å
454	F	88.8	Confident	88.8	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.009	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-34.3	175.4	-96.8	-87.1	0	0	0	112.7	I450 K452 T456 I457 T458 L474 H475 T478 T496 L500	I450-F454 HydrophobicContact CG2-CD2 3.85Å; I450-F454 HydrophobicContact CG2-CE2 4.15Å; I450-F454 WeakPolarHBondContact O-CB 3.39Å; I450-F454 WeakPolarHBondContact O-CD2 3.36Å; I450-F454 PolarHBondContact O-N 3.43Å; K452-F454 PolarHBondContact O-N 2.98Å; F454-T456 VanDerWaalsContact C-N 3.33Å; F454-I457 PolarHBondContact O-N 3.08Å; F454-T458 VanDerWaalsContact O-CB 3.32Å; F454-T458 WeakPolarHBondContact O-CB 3.33Å; F454-T458 VanDerWaalsContact O-CG2 3.26Å; F454-T458 WeakPolarHBondContact O-CG2 3.36Å; F454-T458 PolarHBondContact O-N 3.26Å; F454-T458 PolarHBondContact O-OG1 3.28Å; F454-L474 HydrophobicContact CE1-CD2 4.32Å; F454-L474 HydrophobicContact CE1-CG 4.46Å; F454-L474 HydrophobicContact CZ-CD2 3.98Å; F454-L474 HydrophobicContact CZ-CG 3.95Å; F454-H475 HydrophobicContact CD1-CB 4.11Å; F454-H475 HydrophobicContact CE1-CB 4.15Å; F454-H475 AromaticContact CG-CD2 3.77Å; F454-T478 HydrophobicContact CE2-CG2 3.9Å; F454-T478 WeakPolarHBondContact CE2-OG1 2.99Å; F454-T478 HydrophobicContact CZ-CG2 4.04Å; F454-T478 WeakPolarHBondContact CZ-OG1 3.12Å; F454-T496 HydrophobicContact CE1-CG2 4.17Å; F454-T496 HydrophobicContact CE2-CG2 3.97Å; F454-T496 HydrophobicContact CZ-CG2 3.71Å; F454-L500 HydrophobicContact CD2-CD1 4.29Å; F454-L500 HydrophobicContact CE2-CD1 3.59Å; F454-L500 HydrophobicContact CZ-CD1 4.41Å
455	S	87.4	Confident	88.4	Confident	67 Å²	67	58 Å²	58	47%	0.469	30%	0.298	S	S	.	.	H	α-helix	trans	-64.3	-39.3	176.2	77.2	0	0	0	0	111.8	T451 K452 F453 T458 G459	T451-S455 WeakPolarHBondContact O-CB 3.5Å; T451-S455 PolarHBondContact O-N 3.39Å; K452-S455 WeakPolarHBondContact O-CB 3.42Å; K452-S455 PolarHBondContact O-N 2.93Å; K452-S455 VanDerWaalsContact O-N 3.14Å; K452-S455 PolarHBondContact O-OG 3.3Å; F453-S455 VanDerWaalsContact C-N 3.3Å; F453-S455 PolarHBondContact O-N 3.02Å; S455-T458 WeakPolarHBondContact CA-OG1 3.5Å; S455-T458 PolarHBondContact O-OG1 3.42Å; S455-G459 PolarHBondContact O-N 3.24Å
456	T	86.8	Confident	88.1	Confident	60 Å²	60	59.6 Å²	59.6	37%	0.368	29%	0.294	S	S	.	.	H	α-helix	trans	-63.5	-47.2	174.5	-53	0	0	0	0	111.4	K452 F453 F454 G459	K452-T456 PolarHBondContact O-N 3.09Å; K452-T456 VanDerWaalsContact O-N 3.11Å; K452-T456 PolarHBondContact O-OG1 3Å; F453-T456 WeakPolarHBondContact O-CB 3.45Å; F453-T456 PolarHBondContact O-N 3.42Å; F454-T456 VanDerWaalsContact C-N 3.33Å; T456-G459 PolarHBondContact O-N 3.44Å
457	I	85.1	Confident	87.7	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.026	32%	0.316	C	S	.	.	H	α-helix	trans	-66.9	-48.2	-179.7	-66.7	158	0	0	0	111.4	F453 F454 G459 R460 I492 T496 L1302	F453-I457 HydrophobicContact CD1-CD1 3.46Å; F453-I457 VanDerWaalsContact CD1-CD1 3.46Å; F453-I457 HydrophobicContact CE1-CD1 3.25Å; F453-I457 HydrophobicContact CE1-CG1 4.45Å; F453-I457 HydrophobicContact CE2-CD1 4.47Å; F453-I457 HydrophobicContact CG-CD1 4.19Å; F453-I457 HydrophobicContact CZ-CD1 3.8Å; F453-I457 PolarHBondContact O-N 3.24Å; F453-I457 VanDerWaalsContact O-N 3.1Å; F454-I457 PolarHBondContact O-N 3.08Å; I457-G459 PolarHBondContact O-N 3.49Å; I457-R460 WeakPolarHBondContact O-CB 3.43Å; I457-R460 PolarHBondContact O-N 2.96Å; I457-I492 HydrophobicContact CG2-CD1 3.77Å; I457-I492 HydrophobicContact CG2-CG1 3.92Å; I457-T496 HydrophobicContact CD1-CG2 3.52Å; I457-T496 VanDerWaalsContact CD1-OG1 3.27Å; I457-T496 WeakPolarHBondContact CD1-OG1 3.38Å; I457-L1302 HydrophobicContact CD1-CD1 4.25Å; I457-L1302 HydrophobicContact CG1-CD1 4.31Å; I457-L1302 HydrophobicContact CG1-CD2 4.46Å
458	T	84.3	Confident	87.4	Confident	32 Å²	32	62.7 Å²	62.7	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-27.9	177.7	55.4	0	0	0	0	111.5	F454 S455 R460 L461 R466 V471	F454-T458 VanDerWaalsContact O-CB 3.32Å; F454-T458 WeakPolarHBondContact O-CB 3.33Å; F454-T458 VanDerWaalsContact O-CG2 3.26Å; F454-T458 WeakPolarHBondContact O-CG2 3.36Å; F454-T458 PolarHBondContact O-N 3.26Å; F454-T458 PolarHBondContact O-OG1 3.28Å; S455-T458 WeakPolarHBondContact CA-OG1 3.5Å; S455-T458 PolarHBondContact O-OG1 3.42Å; T458-R460 PolarHBondContact O-N 3.3Å; T458-L461 PolarHBondContact O-N 3.02Å; T458-L461 VanDerWaalsContact O-N 3.07Å; T458-R466 WeakPolarHBondContact O-CD 3.2Å; T458-R466 WeakPolarHBondContact O-CG 3.46Å; T458-R466 PolarHBondContact O-NE 3.08Å; T458-V471 HydrophobicContact CG2-CG1 3.94Å
459	G	85	Confident	87.2	Confident	40 Å²	40	59.3 Å²	59.3	41%	0.412	30%	0.304	S	S	.	.	H	α-helix	trans	-52.8	-35.9	168.9	0	0	0	0	0	113.5	S455 T456 I457 R466	S455-G459 PolarHBondContact O-N 3.24Å; T456-G459 PolarHBondContact O-N 3.44Å; I457-G459 PolarHBondContact O-N 3.49Å; G459-R466 PolarHBondContact O-NH2 3.32Å
460	R	83.1	Confident	87	Confident	68 Å²	68	55.6 Å²	55.6	26%	0.257	29%	0.289	S	S	.	.	H	α-helix	trans	-74.9	-22.5	178.3	-60.6	-179.9	169.3	-177.5	-6.8	113.7	I457 T458 S1305 D1307	I457-R460 WeakPolarHBondContact O-CB 3.43Å; I457-R460 PolarHBondContact O-N 2.96Å; T458-R460 PolarHBondContact O-N 3.3Å; R460-S1305 PolarHBondContact NH1-OG 2.71Å; R460-S1305 PolarHBondContact NH2-OG 3.34Å; R460-D1307 IonicContact CZ-OD2 2.63Å; R460-D1307 IonicContact NH2-OD2 2.76Å; R460-D1307 PolarHBondContact NH2-OD2 2.66Å
461	L	84.8	Confident	86.9	Confident	7 Å²	7	55.8 Å²	55.8	4%	0.037	29%	0.291	C	S	.	.	S	Bend	trans	-84.4	149.7	178.8	-60.5	177.2	0	0	0	111.3	T458 D465 R466 V471 I492 I1296	T458-L461 PolarHBondContact O-N 3.02Å; T458-L461 VanDerWaalsContact O-N 3.07Å; L461-D465 HydrophobicContact CB-CB 4.4Å; L461-R466 HydrophobicContact CB-CG 3.97Å; L461-R466 PolarHBondContact O-NE 3.46Å; L461-R466 PolarHBondContact O-NH2 3.48Å; L461-V471 HydrophobicContact CD1-CG2 4.31Å; L461-I492 HydrophobicContact CD2-CD1 4.06Å; L461-I492 HydrophobicContact CG-CD1 4.46Å; L461-I1296 HydrophobicContact CD2-CD1 4.38Å; L461-I1296 HydrophobicContact CD2-CG1 4.37Å
462	R	85	Confident	86.8	Confident	136 Å²	136	58.8 Å²	58.8	51%	0.513	30%	0.299	S	S	.	.			trans	-62.2	154.3	171.4	-73.5	-171.7	165.5	-172.6	-4	111.1	C464 D465 R466 D1295	R462-C464 PolarHBondContact O-N 3.22Å; R462-C464 VanDerWaalsContact O-N 3.14Å; R462-D465 PolarHBondContact O-N 2.93Å; R462-R466 WeakPolarHBondContact O-CG 2.9Å; R462-R466 PolarHBondContact O-N 3.38Å; R462-D1295 IonicContact CZ-OD1 3.35Å; R462-D1295 IonicContact CZ-OD2 3.22Å; R462-D1295 VanDerWaalsContact CZ-OD2 3.27Å; R462-D1295 VanDerWaalsContact NE-CG 3.28Å; R462-D1295 IonicContact NE-OD1 2.79Å; R462-D1295 PolarHBondContact NE-OD1 3.22Å; R462-D1295 IonicContact NE-OD2 2.92Å; R462-D1295 IonicContact NH1-OD1 3.08Å; R462-D1295 PolarHBondContact NH1-OD1 3.27Å; R462-D1295 IonicContact NH1-OD2 3.85Å; R462-D1295 PolarHBondContact NH1-OD2 3.4Å; R462-D1295 IonicContact NH2-OD1 3.78Å; R462-D1295 PolarHBondContact NH2-OD1 3.24Å
463	K	85.3	Confident	86.8	Confident	173 Å²	173	56.7 Å²	56.7	75%	0.752	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-35.3	-178	-68.9	-176.9	-178.9	177.8	0	113.5
464	C	84.4	Confident	87	Confident	49 Å²	49	55.5 Å²	55.5	33%	0.331	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-43.7	174.9	51.4	0	0	0	0	112	R462 R466 K467	R462-C464 PolarHBondContact O-N 3.22Å; R462-C464 VanDerWaalsContact O-N 3.14Å; C464-R466 VanDerWaalsContact C-N 3.35Å; C464-R466 PolarHBondContact O-N 2.95Å; C464-K467 WeakPolarHBondContact O-CB 3.32Å; C464-K467 PolarHBondContact O-N 2.83Å; C464-K467 VanDerWaalsContact O-N 3.14Å
465	D	84.8	Confident	87.2	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-75.2	-25.5	-174.1	-55.4	-26	0	0	0	112.3	L461 R462 K467 L468	L461-D465 HydrophobicContact CB-CB 4.4Å; R462-D465 PolarHBondContact O-N 2.93Å; D465-K467 PolarHBondContact O-N 3.38Å; D465-K467 VanDerWaalsContact O-N 3.13Å; D465-L468 HydrophobicContact CB-CD1 4.1Å; D465-L468 WeakPolarHBondContact O-CB 3.43Å; D465-L468 WeakPolarHBondContact O-CD1 3.5Å; D465-L468 WeakPolarHBondContact O-CG 3.47Å; D465-L468 PolarHBondContact O-N 3.42Å; D465-L468 VanDerWaalsContact O-N 3.13Å
466	R	87.2	Confident	87.4	Confident	100 Å²	100	58 Å²	58	38%	0.377	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-58.4	-23.4	169.5	-67.6	176.7	-161.8	-170.8	-3.3	113.2	T458 G459 L461 R462 C464	T458-R466 WeakPolarHBondContact O-CD 3.2Å; T458-R466 WeakPolarHBondContact O-CG 3.46Å; T458-R466 PolarHBondContact O-NE 3.08Å; G459-R466 PolarHBondContact O-NH2 3.32Å; L461-R466 HydrophobicContact CB-CG 3.97Å; L461-R466 PolarHBondContact O-NE 3.46Å; L461-R466 PolarHBondContact O-NH2 3.48Å; R462-R466 WeakPolarHBondContact O-CG 2.9Å; R462-R466 PolarHBondContact O-N 3.38Å; C464-R466 VanDerWaalsContact C-N 3.35Å; C464-R466 PolarHBondContact O-N 2.95Å
467	K	85.2	Confident	87.8	Confident	148 Å²	148	55.4 Å²	55.4	64%	0.643	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-91.4	-0.3	-178.2	-62.4	-178.1	-179.1	-178.9	0	113.3	C464 D465	C464-K467 WeakPolarHBondContact O-CB 3.32Å; C464-K467 PolarHBondContact O-N 2.83Å; C464-K467 VanDerWaalsContact O-N 3.14Å; D465-K467 PolarHBondContact O-N 3.38Å; D465-K467 VanDerWaalsContact O-N 3.13Å
468	L	87.6	Confident	88.2	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.026	27%	0.274	C	S	.	.			trans	-53.2	139.7	178	-73.2	168.3	0	0	0	111.1	D465 S470 V471 K472 L490 F1241 I1296	D465-L468 HydrophobicContact CB-CD1 4.1Å; D465-L468 WeakPolarHBondContact O-CB 3.43Å; D465-L468 WeakPolarHBondContact O-CD1 3.5Å; D465-L468 WeakPolarHBondContact O-CG 3.47Å; D465-L468 PolarHBondContact O-N 3.42Å; D465-L468 VanDerWaalsContact O-N 3.13Å; L468-S470 VanDerWaalsContact C-N 3.26Å; L468-S470 PolarHBondContact O-N 3.36Å; L468-V471 HydrophobicContact CB-CB 4.41Å; L468-V471 HydrophobicContact CB-CG2 3.89Å; L468-V471 HydrophobicContact CD1-CG2 4.49Å; L468-V471 PolarHBondContact O-N 2.95Å; L468-K472 PolarHBondContact O-N 2.99Å; L468-L490 HydrophobicContact CD1-CD1 4.01Å; L468-F1241 HydrophobicContact CD1-CD1 3.96Å; L468-F1241 HydrophobicContact CD1-CE1 4.38Å; L468-F1241 HydrophobicContact CD2-CD1 4.21Å; L468-I1296 HydrophobicContact CD1-CD1 4.33Å
469	A	87.3	Confident	88.6	Confident	75 Å²	75	58.6 Å²	58.6	62%	0.62	28%	0.283	S	S	*	.	H	α-helix	trans	-60.6	-38.5	-176.9	0	0	0	0	0	111.6	K472 F473	A469-K472 PolarHBondContact O-N 3.46Å; A469-F473 WeakPolarHBondContact O-CB 3.49Å; A469-F473 PolarHBondContact O-N 2.94Å
470	S	88.8	Confident	89	Confident	25 Å²	25	60.9 Å²	60.9	18%	0.175	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-39.7	176.9	55.2	0	0	0	0	113.6	L468 L474 E1252	L468-S470 VanDerWaalsContact C-N 3.26Å; L468-S470 PolarHBondContact O-N 3.36Å; S470-L474 WeakPolarHBondContact O-CB 3.36Å; S470-L474 PolarHBondContact O-N 3.34Å; S470-E1252 WeakPolarHBondContact CB-OE2 3.45Å; S470-E1252 VanDerWaalsContact OG-CD 3.31Å; S470-E1252 PolarHBondContact OG-OE1 3.06Å; S470-E1252 PolarHBondContact OG-OE2 2.98Å
471	V	90.8	Very high	89.5	Confident	5 Å²	5	57.7 Å²	57.7	3%	0.03	27%	0.267	C	S	.	.	H	α-helix	trans	-64	-47.8	177.3	178.7	0	0	0	0	110.3	T458 L461 L468 L474 H475 L493	T458-V471 HydrophobicContact CG2-CG1 3.94Å; L461-V471 HydrophobicContact CD1-CG2 4.31Å; L468-V471 HydrophobicContact CB-CB 4.41Å; L468-V471 HydrophobicContact CB-CG2 3.89Å; L468-V471 HydrophobicContact CD1-CG2 4.49Å; L468-V471 PolarHBondContact O-N 2.95Å; V471-L474 PolarHBondContact O-N 2.9Å; V471-H475 WeakPolarHBondContact O-CB 3.47Å; V471-H475 PolarHBondContact O-N 2.84Å; V471-L493 HydrophobicContact CG2-CD1 4.02Å; V471-L493 HydrophobicContact CG2-CD2 4.24Å
472	K	90.8	Very high	90	Very high	117 Å²	117	57.4 Å²	57.4	51%	0.509	27%	0.266	S	S	.	.	H	α-helix	trans	-63.4	-46.2	177.5	-68.7	-178.7	179.5	177	0	111.8	L468 A469 L474 H475 D476	L468-K472 PolarHBondContact O-N 2.99Å; A469-K472 PolarHBondContact O-N 3.46Å; K472-L474 VanDerWaalsContact C-N 3.33Å; K472-L474 PolarHBondContact O-N 3.4Å; K472-H475 PolarHBondContact O-N 3.38Å; K472-D476 PolarHBondContact O-N 3.3Å
473	F	91.4	Very high	90.4	Very high	49 Å²	49	50.9 Å²	50.9	22%	0.215	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-46.9	178.2	174.9	-114.1	0	0	0	111.7	E430 K434 A469 D476 L477 V484	E430-F473 HydrophobicContact CG-CE1 4.28Å; K434-F473 HydrophobicContact CD-CE2 4.19Å; K434-F473 HydrophobicContact CD-CZ 4.37Å; K434-F473 VanDerWaalsContact CE-CE2 3.5Å; K434-F473 HydrophobicContact CG-CE2 3.57Å; K434-F473 HydrophobicContact CG-CZ 3.86Å; A469-F473 WeakPolarHBondContact O-CB 3.49Å; A469-F473 PolarHBondContact O-N 2.94Å; F473-D476 PolarHBondContact O-N 3.17Å; F473-L477 HydrophobicContact CD1-CD1 4.15Å; F473-L477 HydrophobicContact CD2-CD1 4.27Å; F473-L477 HydrophobicContact CD2-CG 4.49Å; F473-L477 HydrophobicContact CE1-CD1 3.58Å; F473-L477 HydrophobicContact CE2-CD1 3.7Å; F473-L477 HydrophobicContact CE2-CG 4.14Å; F473-L477 HydrophobicContact CG-CD1 4.48Å; F473-L477 HydrophobicContact CZ-CD1 3.34Å; F473-L477 HydrophobicContact CZ-CG 4.28Å; F473-L477 WeakPolarHBondContact O-CG 3.48Å; F473-L477 PolarHBondContact O-N 2.91Å; F473-L477 VanDerWaalsContact O-N 3.15Å; F473-V484 HydrophobicContact CE1-CG2 4.16Å
474	L	93	Very high	90.9	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-68.6	-41	179.3	-173.8	67.7	0	0	0	112.4	F454 S470 V471 K472 D476 L477 T478 A483 V484 M489 L493 V497	F454-L474 HydrophobicContact CE1-CD2 4.32Å; F454-L474 HydrophobicContact CE1-CG 4.46Å; F454-L474 HydrophobicContact CZ-CD2 3.98Å; F454-L474 HydrophobicContact CZ-CG 3.95Å; S470-L474 WeakPolarHBondContact O-CB 3.36Å; S470-L474 PolarHBondContact O-N 3.34Å; V471-L474 PolarHBondContact O-N 2.9Å; K472-L474 VanDerWaalsContact C-N 3.33Å; K472-L474 PolarHBondContact O-N 3.4Å; L474-D476 VanDerWaalsContact C-N 3.33Å; L474-D476 PolarHBondContact O-N 3.48Å; L474-L477 PolarHBondContact O-N 3.24Å; L474-T478 HydrophobicContact CD1-CG2 4.01Å; L474-T478 HydrophobicContact CG-CG2 4.08Å; L474-T478 WeakPolarHBondContact O-CB 3.47Å; L474-T478 VanDerWaalsContact O-CG2 3.31Å; L474-T478 WeakPolarHBondContact O-CG2 3.3Å; L474-T478 PolarHBondContact O-N 3.29Å; L474-T478 PolarHBondContact O-OG1 2.75Å; L474-A483 HydrophobicContact CD1-CB 4.49Å; L474-V484 HydrophobicContact CD1-CG2 4.24Å; L474-M489 HydrophobicContact CD1-CE 4.12Å; L474-M489 HydrophobicContact CD2-CE 4.05Å; L474-L493 HydrophobicContact CD2-CB 3.85Å; L474-L493 HydrophobicContact CD2-CD1 4.41Å; L474-L493 HydrophobicContact CD2-CD2 4.11Å; L474-L493 HydrophobicContact CD2-CG 4.34Å; L474-V497 HydrophobicContact CD1-CG2 3.65Å; L474-V497 HydrophobicContact CD2-CG2 3.76Å; L474-V497 HydrophobicContact CG-CG2 4.24Å
475	H	92.8	Very high	91.3	Very high	47 Å²	47	41 Å²	41	22%	0.218	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-44.7	175.8	172.8	-96.6	0	0	0	111.7	F454 V471 K472 L477 T478 R479	F454-H475 HydrophobicContact CD1-CB 4.11Å; F454-H475 HydrophobicContact CE1-CB 4.15Å; F454-H475 AromaticContact CG-CD2 3.77Å; V471-H475 WeakPolarHBondContact O-CB 3.47Å; V471-H475 PolarHBondContact O-N 2.84Å; K472-H475 PolarHBondContact O-N 3.38Å; H475-L477 PolarHBondContact O-N 3.07Å; H475-T478 WeakPolarHBondContact CA-OG1 3.49Å; H475-T478 PolarHBondContact O-OG1 3.13Å; H475-T478 VanDerWaalsContact O-OG1 3.07Å; H475-R479 WeakPolarHBondContact CE1-CD 3.38Å; H475-R479 WeakPolarHBondContact O-CG 3.31Å; H475-R479 PolarHBondContact O-N 3.05Å; H475-R479 VanDerWaalsContact O-N 3.12Å
476	D	92.5	Very high	91.6	Very high	74 Å²	74	41.2 Å²	41.2	40%	0.396	19%	0.194	S	C	.	.	H	α-helix	trans	-71.5	-28.7	-178.5	-69.4	-13.9	0	0	0	113.5	K472 F473 L474 R480	K472-D476 PolarHBondContact O-N 3.3Å; F473-D476 PolarHBondContact O-N 3.17Å; L474-D476 VanDerWaalsContact C-N 3.33Å; L474-D476 PolarHBondContact O-N 3.48Å; D476-R480 PolarHBondContact O-NE 2.91Å; D476-R480 VanDerWaalsContact O-NE 3.08Å
477	L	93.9	Very high	91.4	Very high	5 Å²	5	38.7 Å²	38.7	3%	0.026	19%	0.192	C	C	.	.	H	α-helix	trans	-75.1	-49.2	173.2	-75.9	179.4	0	0	0	112	A433 F473 L474 H475 R479 R480 G481 L482 V484	A433-L477 HydrophobicContact CB-CD1 3.97Å; A433-L477 HydrophobicContact CB-CD2 4.41Å; F473-L477 HydrophobicContact CD1-CD1 4.15Å; F473-L477 HydrophobicContact CD2-CD1 4.27Å; F473-L477 HydrophobicContact CD2-CG 4.49Å; F473-L477 HydrophobicContact CE1-CD1 3.58Å; F473-L477 HydrophobicContact CE2-CD1 3.7Å; F473-L477 HydrophobicContact CE2-CG 4.14Å; F473-L477 HydrophobicContact CG-CD1 4.48Å; F473-L477 HydrophobicContact CZ-CD1 3.34Å; F473-L477 HydrophobicContact CZ-CG 4.28Å; F473-L477 WeakPolarHBondContact O-CG 3.48Å; F473-L477 PolarHBondContact O-N 2.91Å; F473-L477 VanDerWaalsContact O-N 3.15Å; L474-L477 PolarHBondContact O-N 3.24Å; H475-L477 PolarHBondContact O-N 3.07Å; L477-R479 VanDerWaalsContact C-N 3.28Å; L477-R479 PolarHBondContact O-N 3.15Å; L477-R480 WeakPolarHBondContact O-CA 3.23Å; L477-R480 WeakPolarHBondContact O-CB 3.35Å; L477-R480 PolarHBondContact O-N 3.38Å; L477-G481 PolarHBondContact O-N 3.42Å; L477-L482 CarbonylContact C-O 3.59Å; L477-L482 HydrophobicContact CB-CB 4.46Å; L477-L482 WeakPolarHBondContact CB-O 3.34Å; L477-L482 HydrophobicContact CD2-CB 4.39Å; L477-L482 PolarHBondContact O-N 3.18Å; L477-L482 VanDerWaalsContact O-N 3.12Å; L477-V484 HydrophobicContact CD1-CG1 4.28Å
478	T	93.3	Very high	91.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-36.7	-177	49.2	0	0	0	0	111.4	I450 F454 L474 H475 R480 G481 L482 A483 L500	I450-T478 VanDerWaalsContact CD1-O 3.29Å; I450-T478 WeakPolarHBondContact CD1-O 3.24Å; F454-T478 HydrophobicContact CE2-CG2 3.9Å; F454-T478 WeakPolarHBondContact CE2-OG1 2.99Å; F454-T478 HydrophobicContact CZ-CG2 4.04Å; F454-T478 WeakPolarHBondContact CZ-OG1 3.12Å; L474-T478 HydrophobicContact CD1-CG2 4.01Å; L474-T478 HydrophobicContact CG-CG2 4.08Å; L474-T478 WeakPolarHBondContact O-CB 3.47Å; L474-T478 VanDerWaalsContact O-CG2 3.31Å; L474-T478 WeakPolarHBondContact O-CG2 3.3Å; L474-T478 PolarHBondContact O-N 3.29Å; L474-T478 PolarHBondContact O-OG1 2.75Å; H475-T478 WeakPolarHBondContact CA-OG1 3.49Å; H475-T478 PolarHBondContact O-OG1 3.13Å; H475-T478 VanDerWaalsContact O-OG1 3.07Å; T478-R480 PolarHBondContact O-N 3.41Å; T478-R480 VanDerWaalsContact O-N 3.07Å; T478-G481 PolarHBondContact O-N 3.41Å; T478-L482 WeakPolarHBondContact CA-O 3.27Å; T478-L482 PolarHBondContact N-O 3.14Å; T478-A483 HydrophobicContact CG2-CB 4.19Å; T478-L500 HydrophobicContact CG2-CD1 4.07Å
479	R	94	Very high	91.6	Very high	104 Å²	104	32.3 Å²	32.3	39%	0.392	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-23.1	171.2	-77.2	-176.7	74.3	-162.4	5.9	113.9	T442 K447 I450 H475 L477	T442-R479 PolarHBondContact OG1-O 3.07Å; K447-R479 WeakPolarHBondContact CE-O 3.2Å; K447-R479 WeakPolarHBondContact CG-O 3.19Å; I450-R479 HydrophobicContact CG2-CG 4.31Å; H475-R479 WeakPolarHBondContact CE1-CD 3.38Å; H475-R479 WeakPolarHBondContact O-CG 3.31Å; H475-R479 PolarHBondContact O-N 3.05Å; H475-R479 VanDerWaalsContact O-N 3.12Å; L477-R479 VanDerWaalsContact C-N 3.28Å; L477-R479 PolarHBondContact O-N 3.15Å
480	R	92.8	Very high	91.7	Very high	89 Å²	89	28.7 Å²	28.7	34%	0.336	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	3.1	176.5	-59.2	177.7	-143	-139.9	-2.7	113	S437 V439 L441 D476 L477 T478	S437-R480 WeakPolarHBondContact O-CD 3.5Å; S437-R480 PolarHBondContact O-NH1 3.01Å; V439-R480 WeakPolarHBondContact O-CB 3.41Å; L441-R480 WeakPolarHBondContact CB-O 3.49Å; L441-R480 PolarHBondContact N-O 2.96Å; D476-R480 PolarHBondContact O-NE 2.91Å; D476-R480 VanDerWaalsContact O-NE 3.08Å; L477-R480 WeakPolarHBondContact O-CA 3.23Å; L477-R480 WeakPolarHBondContact O-CB 3.35Å; L477-R480 PolarHBondContact O-N 3.38Å; T478-R480 PolarHBondContact O-N 3.41Å; T478-R480 VanDerWaalsContact O-N 3.07Å
481	G	93.6	Very high	91.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	14.3	-176.7	0	0	0	0	0	114.2	T442 L477 T478 K507 I508	T442-G481 VanDerWaalsContact CG2-CA 3.42Å; T442-G481 VanDerWaalsContact CG2-N 3.32Å; L477-G481 PolarHBondContact O-N 3.42Å; T478-G481 PolarHBondContact O-N 3.41Å; G481-K507 PolarHBondContact O-N 3.05Å; G481-I508 PolarHBondContact O-N 2.88Å; G481-I508 VanDerWaalsContact O-N 3.15Å
482	L	95	Very high	91.5	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.005	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	144.4	177.8	-55.7	179.4	0	0	0	109.7	L436 L441 L477 T478 I508	L436-L482 HydrophobicContact CB-CD1 4Å; L436-L482 WeakPolarHBondContact O-CD1 3.3Å; L441-L482 HydrophobicContact CD1-CD2 3.97Å; L477-L482 CarbonylContact C-O 3.59Å; L477-L482 HydrophobicContact CB-CB 4.46Å; L477-L482 WeakPolarHBondContact CB-O 3.34Å; L477-L482 HydrophobicContact CD2-CB 4.39Å; L477-L482 PolarHBondContact O-N 3.18Å; L477-L482 VanDerWaalsContact O-N 3.12Å; T478-L482 WeakPolarHBondContact CA-O 3.27Å; T478-L482 PolarHBondContact N-O 3.14Å; L482-I508 WeakPolarHBondContact CA-O 3.1Å; L482-I508 HydrophobicContact CD2-CB 3.81Å; L482-I508 HydrophobicContact CD2-CD1 4.27Å; L482-I508 HydrophobicContact CD2-CG1 4.33Å
483	A	94.9	Very high	91.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	162.6	170.8	0	0	0	0	0	111.8	L474 T478 V497 V506 I508 L509 F510	L474-A483 HydrophobicContact CD1-CB 4.49Å; T478-A483 HydrophobicContact CG2-CB 4.19Å; A483-V497 HydrophobicContact CB-CG1 3.69Å; A483-V497 HydrophobicContact CB-CG2 4.11Å; A483-V506 HydrophobicContact CB-CB 4.47Å; A483-V506 HydrophobicContact CB-CG1 3.69Å; A483-V506 HydrophobicContact CB-CG2 3.87Å; A483-I508 PolarHBondContact N-O 3.09Å; A483-I508 VanDerWaalsContact N-O 3.08Å; A483-L509 HydrophobicContact CB-CD1 3.87Å; A483-F510 PolarHBondContact O-N 3.39Å
484	V	95	Very high	91.4	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.024	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	146.3	172.7	-67.1	0	0	0	0	109.5	V429 A433 F473 L474 L477 M489 F510	V429-V484 HydrophobicContact CG1-CB 3.73Å; V429-V484 HydrophobicContact CG1-CG1 3.72Å; A433-V484 HydrophobicContact CB-CG1 3.51Å; F473-V484 HydrophobicContact CE1-CG2 4.16Å; L474-V484 HydrophobicContact CD1-CG2 4.24Å; L477-V484 HydrophobicContact CD1-CG1 4.28Å; V484-M489 HydrophobicContact CG2-CE 4.06Å; V484-M489 HydrophobicContact CG2-SD 3.96Å; V484-M489 WeakPolarHBondContact O-CE 3.44Å; V484-F510 CarbonylContact C-O 3.57Å; V484-F510 VanDerWaalsContact CA-O 3.29Å; V484-F510 WeakPolarHBondContact CA-O 3.36Å; V484-F510 HydrophobicContact CG1-CB 4.41Å
485	H	93.4	Very high	91.2	Very high	10 Å²	10	25.1 Å²	25.1	5%	0.046	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	116.8	172.5	-170.9	-62.8	0	0	0	111.2	E498 L509 F510 A511 T512 V515	H485-E498 IonicContact CD2-OE1 3.82Å; H485-E498 IonicContact CE1-OE1 2.66Å; H485-E498 IonicContact NE2-OE1 2.74Å; H485-E498 PolarHBondContact NE2-OE1 3.32Å; H485-L509 HydrophobicContact CB-CD1 4Å; H485-F510 PolarHBondContact N-O 3.35Å; H485-A511 HydrophobicContact CB-CB 4.45Å; H485-A511 VanDerWaalsContact O-CA 3.32Å; H485-A511 WeakPolarHBondContact O-CA 3.22Å; H485-T512 PolarHBondContact O-N 2.78Å; H485-V515 HydrophobicContact CB-CG2 3.74Å; H485-V515 WeakPolarHBondContact ND1-CG2 2.95Å
486	H	90.8	Very high	91	Very high	5 Å²	5	22.9 Å²	22.9	2%	0.023	11%	0.111	C	C	.	.			trans	-155.7	162.2	171.5	56.4	74.6	0	0	0	112	R426 E430 G488 M489 T512	R426-H486 HydrophobicContact CG-CB 4.14Å; E430-H486 IonicContact OE1-CE1 2.89Å; E430-H486 IonicContact OE1-NE2 2.87Å; E430-H486 PolarHBondContact OE1-NE2 3.31Å; H486-G488 PolarHBondContact ND1-N 3.3Å; H486-G488 PolarHBondContact O-N 2.61Å; H486-M489 WeakPolarHBondContact O-CB 3Å; H486-M489 PolarHBondContact O-N 3.32Å; H486-T512 WeakPolarHBondContact CA-OG1 3.29Å; H486-T512 HydrophobicContact CB-CG2 3.76Å
487	S	83.5	Confident	91	Very high	47 Å²	47	19.4 Å²	19.4	33%	0.329	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-26.3	-177.8	49.2	0	0	0	0	115.4	R426 M489	R426-S487 PolarHBondContact NE-OG 2.93Å; R426-S487 PolarHBondContact NH2-OG 3.32Å; S487-M489 VanDerWaalsContact C-N 3.29Å; S487-M489 PolarHBondContact O-N 2.73Å
488	G	85.8	Confident	90.8	Very high	4 Å²	4	19.7 Å²	19.7	4%	0.041	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9.2	177	0	0	0	0	0	116	H486 G1253	H486-G488 PolarHBondContact ND1-N 3.3Å; H486-G488 PolarHBondContact O-N 2.61Å; G488-G1253 WeakPolarHBondContact O-CA 3.1Å; G488-G1253 PolarHBondContact O-N 3.25Å
489	M	90.9	Very high	90.5	Very high	15 Å²	15	20.7 Å²	20.7	7%	0.074	10%	0.099	C	C	.	.	S	Bend	trans	-79.2	151.4	177.8	-66	174.6	70.6	0	0	112.1	L474 V484 H486 S487 L493 K494 V497 G1253	L474-M489 HydrophobicContact CD1-CE 4.12Å; L474-M489 HydrophobicContact CD2-CE 4.05Å; V484-M489 HydrophobicContact CG2-CE 4.06Å; V484-M489 HydrophobicContact CG2-SD 3.96Å; V484-M489 WeakPolarHBondContact O-CE 3.44Å; H486-M489 WeakPolarHBondContact O-CB 3Å; H486-M489 PolarHBondContact O-N 3.32Å; S487-M489 VanDerWaalsContact C-N 3.29Å; S487-M489 PolarHBondContact O-N 2.73Å; M489-L493 HydrophobicContact CE-CB 4.21Å; M489-K494 HydrophobicContact CB-CD 4.12Å; M489-K494 HydrophobicContact CB-CG 3.59Å; M489-K494 WeakPolarHBondContact O-CE 3.36Å; M489-K494 HydrophobicContact SD-CG 4.43Å; M489-V497 HydrophobicContact CE-CG2 4.26Å; M489-G1253 WeakPolarHBondContact O-CA 3.49Å
490	L	89.8	Confident	90.4	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.08	C	C	.	.			trans	-54.1	136	171.6	-69.5	168.5	0	0	0	111.1	L468 I492 L493 K494 F1241 E1252 I1256 I1296	L468-L490 HydrophobicContact CD1-CD1 4.01Å; L490-I492 HydrophobicContact CB-CG2 4.37Å; L490-I492 PolarHBondContact O-N 3.04Å; L490-L493 HydrophobicContact CB-CB 4.24Å; L490-L493 HydrophobicContact CB-CD1 4.1Å; L490-L493 HydrophobicContact CB-CG 3.96Å; L490-L493 HydrophobicContact CD1-CD1 3.92Å; L490-L493 HydrophobicContact CD1-CG 4.33Å; L490-L493 HydrophobicContact CG-CD1 4.46Å; L490-L493 PolarHBondContact O-N 2.96Å; L490-K494 PolarHBondContact O-N 2.88Å; L490-F1241 HydrophobicContact CD2-CE1 3.97Å; L490-F1241 HydrophobicContact CD2-CZ 4.12Å; L490-E1252 HydrophobicContact CD2-CB 3.88Å; L490-E1252 HydrophobicContact CG-CB 4.07Å; L490-I1256 HydrophobicContact CD2-CD1 4.46Å; L490-I1256 HydrophobicContact CD2-CG1 3.68Å; L490-I1296 HydrophobicContact CD1-CD1 3.81Å; L490-I1296 HydrophobicContact CD2-CD1 3.69Å; L490-I1296 HydrophobicContact CG-CD1 4.3Å
491	P	86.9	Confident	90.3	Very high	43 Å²	43	11.9 Å²	11.9	28%	0.279	7%	0.066	S	C	.	.	H	α-helix	trans	-49.6	-49.9	180	-29.9	36.3	0	0	0	114.1	L493 K494 E495 I1256	P491-L493 VanDerWaalsContact C-N 3.25Å; P491-L493 PolarHBondContact O-N 2.64Å; P491-K494 WeakPolarHBondContact O-CB 3.27Å; P491-K494 PolarHBondContact O-N 3.06Å; P491-K494 VanDerWaalsContact O-N 3.1Å; P491-E495 WeakPolarHBondContact O-CG 3.42Å; P491-E495 PolarHBondContact O-N 3.04Å; P491-I1256 HydrophobicContact CG-CG2 3.83Å
492	I	88.3	Confident	89.9	Confident	8 Å²	8	17.9 Å²	17.9	4%	0.041	9%	0.089	C	C	.	.	H	α-helix	trans	-57.6	-36.6	178.3	-165.5	174	0	0	0	112.9	I457 L461 L490 T496 L1302	I457-I492 HydrophobicContact CG2-CD1 3.77Å; I457-I492 HydrophobicContact CG2-CG1 3.92Å; L461-I492 HydrophobicContact CD2-CD1 4.06Å; L461-I492 HydrophobicContact CG-CD1 4.46Å; L490-I492 HydrophobicContact CB-CG2 4.37Å; L490-I492 PolarHBondContact O-N 3.04Å; I492-T496 WeakPolarHBondContact O-CB 3.47Å; I492-T496 PolarHBondContact O-N 3.16Å; I492-T496 PolarHBondContact O-OG1 3.43Å; I492-L1302 HydrophobicContact CD1-CD2 4.44Å; I492-L1302 HydrophobicContact CG1-CD1 4.33Å; I492-L1302 HydrophobicContact CG1-CD2 4.06Å; I492-L1302 HydrophobicContact CG1-CG 4.24Å
493	L	90.9	Very high	89.5	Confident	4 Å²	4	20.9 Å²	20.9	2%	0.021	11%	0.105	C	C	.	.	H	α-helix	trans	-75.4	-34.4	179.1	-63.4	-172.5	0	0	0	112	V471 L474 M489 L490 P491 T496 V497	V471-L493 HydrophobicContact CG2-CD1 4.02Å; V471-L493 HydrophobicContact CG2-CD2 4.24Å; L474-L493 HydrophobicContact CD2-CB 3.85Å; L474-L493 HydrophobicContact CD2-CD1 4.41Å; L474-L493 HydrophobicContact CD2-CD2 4.11Å; L474-L493 HydrophobicContact CD2-CG 4.34Å; M489-L493 HydrophobicContact CE-CB 4.21Å; L490-L493 HydrophobicContact CB-CB 4.24Å; L490-L493 HydrophobicContact CB-CD1 4.1Å; L490-L493 HydrophobicContact CB-CG 3.96Å; L490-L493 HydrophobicContact CD1-CD1 3.92Å; L490-L493 HydrophobicContact CD1-CG 4.33Å; L490-L493 HydrophobicContact CG-CD1 4.46Å; L490-L493 PolarHBondContact O-N 2.96Å; P491-L493 VanDerWaalsContact C-N 3.25Å; P491-L493 PolarHBondContact O-N 2.64Å; L493-T496 WeakPolarHBondContact O-CB 3.24Å; L493-T496 PolarHBondContact O-N 3.44Å; L493-V497 WeakPolarHBondContact O-CG2 3.43Å; L493-V497 PolarHBondContact O-N 2.93Å; L493-V497 VanDerWaalsContact O-N 3.08Å
494	K	88.8	Confident	89.1	Confident	49 Å²	49	22.2 Å²	22.2	21%	0.213	12%	0.119	C	C	.	.	H	α-helix	trans	-63.1	-49.5	173.7	-68.8	-178.4	-64.8	-174.9	0	110.8	M489 L490 P491 T496 V497 E498	M489-K494 HydrophobicContact CB-CD 4.12Å; M489-K494 HydrophobicContact CB-CG 3.59Å; M489-K494 WeakPolarHBondContact O-CE 3.36Å; M489-K494 HydrophobicContact SD-CG 4.43Å; L490-K494 PolarHBondContact O-N 2.88Å; P491-K494 WeakPolarHBondContact O-CB 3.27Å; P491-K494 PolarHBondContact O-N 3.06Å; P491-K494 VanDerWaalsContact O-N 3.1Å; K494-T496 VanDerWaalsContact C-N 3.26Å; K494-T496 PolarHBondContact O-N 3.25Å; K494-V497 PolarHBondContact O-N 2.87Å; K494-V497 VanDerWaalsContact O-N 3.09Å; K494-E498 VanDerWaalsContact O-CG 3.31Å; K494-E498 WeakPolarHBondContact O-CG 3.34Å; K494-E498 PolarHBondContact O-N 3.22Å
495	E	87.8	Confident	89	Confident	19 Å²	19	22.7 Å²	22.7	9%	0.089	12%	0.121	C	C	.	.	H	α-helix	trans	-61.3	-37.3	177.5	-63.7	-179.6	165.9	0	0	111.4	P491 V497 E498 L499 S1301 L1302 Y1303	P491-E495 WeakPolarHBondContact O-CG 3.42Å; P491-E495 PolarHBondContact O-N 3.04Å; E495-V497 PolarHBondContact O-N 3.13Å; E495-E498 PolarHBondContact O-N 3.09Å; E495-L499 WeakPolarHBondContact O-CB 3.38Å; E495-L499 VanDerWaalsContact O-CG 3.32Å; E495-L499 WeakPolarHBondContact O-CG 3.29Å; E495-L499 PolarHBondContact O-N 3.32Å; E495-S1301 WeakPolarHBondContact OE1-CB 3.03Å; E495-S1301 PolarHBondContact OE1-OG 3.47Å; E495-S1301 WeakPolarHBondContact OE2-CA 3.18Å; E495-S1301 PolarHBondContact OE2-OG 2.96Å; E495-L1302 HydrophobicContact CB-CB 4.2Å; E495-L1302 HydrophobicContact CB-CD1 3.93Å; E495-L1302 HydrophobicContact CB-CG 4.16Å; E495-L1302 WeakPolarHBondContact OE2-CB 3.32Å; E495-L1302 PolarHBondContact OE2-N 3.09Å; E495-Y1303 HydrophobicContact CB-CE2 4.16Å; E495-Y1303 HydrophobicContact CG-CD2 4.11Å; E495-Y1303 HydrophobicContact CG-CE2 3.85Å
496	T	90.3	Very high	89	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-57.1	-47.6	173	-60.7	0	0	0	0	111.5	F453 F454 I457 I492 L493 K494 L500	F453-T496 HydrophobicContact CD1-CG2 4.29Å; F453-T496 HydrophobicContact CE1-CG2 3.93Å; F454-T496 HydrophobicContact CE1-CG2 4.17Å; F454-T496 HydrophobicContact CE2-CG2 3.97Å; F454-T496 HydrophobicContact CZ-CG2 3.71Å; I457-T496 HydrophobicContact CD1-CG2 3.52Å; I457-T496 VanDerWaalsContact CD1-OG1 3.27Å; I457-T496 WeakPolarHBondContact CD1-OG1 3.38Å; I492-T496 WeakPolarHBondContact O-CB 3.47Å; I492-T496 PolarHBondContact O-N 3.16Å; I492-T496 PolarHBondContact O-OG1 3.43Å; L493-T496 WeakPolarHBondContact O-CB 3.24Å; L493-T496 PolarHBondContact O-N 3.44Å; K494-T496 VanDerWaalsContact C-N 3.26Å; K494-T496 PolarHBondContact O-N 3.25Å; T496-L500 HydrophobicContact CG2-CD1 3.9Å; T496-L500 HydrophobicContact CG2-CG 4.47Å; T496-L500 WeakPolarHBondContact O-CB 3.38Å; T496-L500 VanDerWaalsContact O-CG 3.24Å; T496-L500 WeakPolarHBondContact O-CG 3.42Å; T496-L500 PolarHBondContact O-N 2.85Å
497	V	92.1	Very high	89.2	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.4	-40.8	179.1	172.8	0	0	0	0	111.6	L474 A483 M489 L493 K494 E495 L500 F501 L509	L474-V497 HydrophobicContact CD1-CG2 3.65Å; L474-V497 HydrophobicContact CD2-CG2 3.76Å; L474-V497 HydrophobicContact CG-CG2 4.24Å; A483-V497 HydrophobicContact CB-CG1 3.69Å; A483-V497 HydrophobicContact CB-CG2 4.11Å; M489-V497 HydrophobicContact CE-CG2 4.26Å; L493-V497 WeakPolarHBondContact O-CG2 3.43Å; L493-V497 PolarHBondContact O-N 2.93Å; L493-V497 VanDerWaalsContact O-N 3.08Å; K494-V497 PolarHBondContact O-N 2.87Å; K494-V497 VanDerWaalsContact O-N 3.09Å; E495-V497 PolarHBondContact O-N 3.13Å; V497-L500 PolarHBondContact O-N 3.36Å; V497-F501 VanDerWaalsContact O-CB 3.25Å; V497-F501 WeakPolarHBondContact O-CB 3.45Å; V497-F501 PolarHBondContact O-N 2.94Å; V497-L509 HydrophobicContact CG1-CD1 3.46Å; V497-L509 VanDerWaalsContact CG1-CD1 3.46Å
498	E	88.7	Confident	89.7	Confident	11 Å²	11	21.9 Å²	21.9	5%	0.051	11%	0.112	C	C	.	.	H	α-helix	trans	-62.4	-45.9	178.5	-67.7	166.5	-168	0	0	111.6	H485 K494 E495 F501 R502 V519 Y1303	H485-E498 IonicContact CD2-OE1 3.82Å; H485-E498 IonicContact CE1-OE1 2.66Å; H485-E498 IonicContact NE2-OE1 2.74Å; H485-E498 PolarHBondContact NE2-OE1 3.32Å; K494-E498 VanDerWaalsContact O-CG 3.31Å; K494-E498 WeakPolarHBondContact O-CG 3.34Å; K494-E498 PolarHBondContact O-N 3.22Å; E495-E498 PolarHBondContact O-N 3.09Å; E498-F501 PolarHBondContact O-N 3.29Å; E498-R502 WeakPolarHBondContact O-CB 3.26Å; E498-R502 PolarHBondContact O-N 3.23Å; E498-V519 HydrophobicContact CB-CG1 4.45Å; E498-V519 HydrophobicContact CG-CG1 3.92Å; E498-Y1303 WeakPolarHBondContact CB-OH 3.37Å; E498-Y1303 PolarHBondContact OE2-OH 3.28Å
499	L	87.4	Confident	90.2	Very high	21 Å²	21	21.8 Å²	21.8	11%	0.11	11%	0.11	C	C	.	.	H	α-helix	trans	-64.4	-46.2	176.3	-69	172.5	0	0	0	111.8	F453 E495 F501 R502 D503 L1302 Y1303	F453-L499 HydrophobicContact CE1-CB 4.47Å; F453-L499 HydrophobicContact CZ-CB 4.04Å; F453-L499 HydrophobicContact CZ-CD1 3.95Å; E495-L499 WeakPolarHBondContact O-CB 3.38Å; E495-L499 VanDerWaalsContact O-CG 3.32Å; E495-L499 WeakPolarHBondContact O-CG 3.29Å; E495-L499 PolarHBondContact O-N 3.32Å; L499-F501 VanDerWaalsContact C-N 3.31Å; L499-F501 PolarHBondContact O-N 3.34Å; L499-R502 PolarHBondContact O-N 2.87Å; L499-D503 PolarHBondContact O-N 3.28Å; L499-L1302 HydrophobicContact CD1-CB 3.95Å; L499-L1302 HydrophobicContact CD1-CD1 4.14Å; L499-Y1303 HydrophobicContact CD2-CD1 4.32Å; L499-Y1303 HydrophobicContact CD2-CE1 3.76Å; L499-Y1303 HydrophobicContact CG-CE1 4.39Å
500	L	91.4	Very high	90.4	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-65.5	-32.3	177.9	-70.4	174.9	0	0	0	113	I450 F453 F454 T478 T496 V497 G504 L505 V506	I450-L500 HydrophobicContact CG1-CD2 4.4Å; F453-L500 HydrophobicContact CB-CD2 4.46Å; F453-L500 HydrophobicContact CD1-CD1 4.21Å; F453-L500 HydrophobicContact CD1-CD2 3.52Å; F453-L500 HydrophobicContact CD1-CG 3.84Å; F453-L500 HydrophobicContact CE1-CD1 4.47Å; F453-L500 HydrophobicContact CE1-CD2 3.94Å; F453-L500 HydrophobicContact CE1-CG 3.86Å; F453-L500 HydrophobicContact CG-CD2 4.13Å; F454-L500 HydrophobicContact CD2-CD1 4.29Å; F454-L500 HydrophobicContact CE2-CD1 3.59Å; F454-L500 HydrophobicContact CZ-CD1 4.41Å; T478-L500 HydrophobicContact CG2-CD1 4.07Å; T496-L500 HydrophobicContact CG2-CD1 3.9Å; T496-L500 HydrophobicContact CG2-CG 4.47Å; T496-L500 WeakPolarHBondContact O-CB 3.38Å; T496-L500 VanDerWaalsContact O-CG 3.24Å; T496-L500 WeakPolarHBondContact O-CG 3.42Å; T496-L500 PolarHBondContact O-N 2.85Å; V497-L500 PolarHBondContact O-N 3.36Å; L500-G504 PolarHBondContact O-N 2.92Å; L500-L505 HydrophobicContact CB-CB 4.5Å; L500-L505 HydrophobicContact CD2-CB 4.27Å; L500-L505 HydrophobicContact CD2-CD1 3.57Å; L500-L505 WeakPolarHBondContact O-CB 3.36Å; L500-L505 PolarHBondContact O-N 3.35Å; L500-V506 HydrophobicContact CB-CG2 3.85Å; L500-V506 PolarHBondContact O-N 3.32Å
501	F	91.1	Very high	90.6	Very high	8 Å²	8	21.1 Å²	21.1	4%	0.035	11%	0.107	C	C	.	.	H	α-helix	trans	-71	-41.8	174.2	-171.8	-93	0	0	0	111.3	P418 I420 V497 E498 L499 D503 G504 V506 L509 T521 A523	P418-F501 HydrophobicContact CB-CE2 3.95Å; P418-F501 HydrophobicContact CB-CZ 3.97Å; P418-F501 HydrophobicContact CG-CZ 4.38Å; I420-F501 HydrophobicContact CD1-CE1 4.21Å; I420-F501 HydrophobicContact CD1-CZ 3.93Å; I420-F501 HydrophobicContact CG1-CE1 4.46Å; I420-F501 HydrophobicContact CG1-CE2 4.15Å; I420-F501 HydrophobicContact CG1-CZ 3.7Å; V497-F501 VanDerWaalsContact O-CB 3.25Å; V497-F501 WeakPolarHBondContact O-CB 3.45Å; V497-F501 PolarHBondContact O-N 2.94Å; E498-F501 PolarHBondContact O-N 3.29Å; L499-F501 VanDerWaalsContact C-N 3.31Å; L499-F501 PolarHBondContact O-N 3.34Å; F501-D503 VanDerWaalsContact C-N 3.32Å; F501-D503 PolarHBondContact O-N 2.96Å; F501-G504 PolarHBondContact O-N 3.48Å; F501-V506 HydrophobicContact CB-CB 4.31Å; F501-V506 HydrophobicContact CD2-CB 4Å; F501-V506 HydrophobicContact CD2-CG1 3.92Å; F501-L509 HydrophobicContact CD2-CB 3.87Å; F501-L509 HydrophobicContact CD2-CD2 4.09Å; F501-L509 HydrophobicContact CE2-CB 3.77Å; F501-L509 HydrophobicContact CE2-CD2 4.31Å; F501-L509 HydrophobicContact CG-CD2 4.35Å; F501-T521 HydrophobicContact CD1-CG2 3.82Å; F501-T521 HydrophobicContact CE1-CG2 4.41Å; F501-A523 HydrophobicContact CZ-CB 4.02Å
502	R	85.4	Confident	90.8	Very high	125 Å²	125	19.7 Å²	19.7	47%	0.472	10%	0.097	S	C	.	.	H	α-helix	trans	-59.8	-41.7	174.3	-179.4	-179.2	173.3	-171.6	-3.4	111.9	E498 L499 G504	E498-R502 WeakPolarHBondContact O-CB 3.26Å; E498-R502 PolarHBondContact O-N 3.23Å; L499-R502 PolarHBondContact O-N 2.87Å; R502-G504 PolarHBondContact O-N 3.02Å
503	D	85.6	Confident	90.8	Very high	64 Å²	64	22.7 Å²	22.7	34%	0.342	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-0.6	177.6	-70.8	-11.3	0	0	0	113	L499 F501 L505 K1312	L499-D503 PolarHBondContact O-N 3.28Å; F501-D503 VanDerWaalsContact C-N 3.32Å; F501-D503 PolarHBondContact O-N 2.96Å; D503-L505 VanDerWaalsContact C-N 3.26Å; D503-L505 HydrophobicContact CB-CD1 4.31Å; D503-L505 HydrophobicContact CB-CG 4.34Å; D503-L505 PolarHBondContact O-N 2.93Å; D503-K1312 VanDerWaalsContact CG-NZ 3.32Å; D503-K1312 IonicContact OD1-NZ 3.76Å; D503-K1312 PolarHBondContact OD1-NZ 2.85Å; D503-K1312 WeakPolarHBondContact OD2-CE 3.42Å; D503-K1312 IonicContact OD2-NZ 3.76Å; D503-K1312 PolarHBondContact OD2-NZ 3.45Å; D503-K1312 VanDerWaalsContact OD2-NZ 3.13Å
504	G	88.1	Confident	90.4	Very high	29 Å²	29	24.8 Å²	24.8	30%	0.299	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	11.2	177.1	0	0	0	0	0	114.7	L500 F501 R502 K507	L500-G504 PolarHBondContact O-N 2.92Å; F501-G504 PolarHBondContact O-N 3.48Å; R502-G504 PolarHBondContact O-N 3.02Å; G504-K507 PolarHBondContact O-NZ 3.32Å
505	L	92.3	Very high	90.3	Very high	13 Å²	13	22.5 Å²	22.5	7%	0.068	11%	0.114	C	C	.	.			trans	-78.8	-29	179.6	-66.1	173	0	0	0	112.3	E446 I450 L500 D503	E446-L505 HydrophobicContact CB-CD2 3.93Å; E446-L505 HydrophobicContact CG-CD2 3.87Å; I450-L505 HydrophobicContact CD1-CB 4.03Å; I450-L505 HydrophobicContact CG1-CB 3.96Å; I450-L505 HydrophobicContact CG1-CD1 3.96Å; I450-L505 HydrophobicContact CG1-CD2 4.3Å; I450-L505 HydrophobicContact CG1-CG 4.3Å; L500-L505 HydrophobicContact CB-CB 4.5Å; L500-L505 HydrophobicContact CD2-CB 4.27Å; L500-L505 HydrophobicContact CD2-CD1 3.57Å; L500-L505 WeakPolarHBondContact O-CB 3.36Å; L500-L505 PolarHBondContact O-N 3.35Å; D503-L505 VanDerWaalsContact C-N 3.26Å; D503-L505 HydrophobicContact CB-CD1 4.31Å; D503-L505 HydrophobicContact CB-CG 4.34Å; D503-L505 PolarHBondContact O-N 2.93Å
506	V	93.7	Very high	90	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.111	C	C	.	.			trans	-90.1	118.6	169.3	176.8	0	0	0	0	109.3	A483 L500 F501 I508 L509	A483-V506 HydrophobicContact CB-CB 4.47Å; A483-V506 HydrophobicContact CB-CG1 3.69Å; A483-V506 HydrophobicContact CB-CG2 3.87Å; L500-V506 HydrophobicContact CB-CG2 3.85Å; L500-V506 PolarHBondContact O-N 3.32Å; F501-V506 HydrophobicContact CB-CB 4.31Å; F501-V506 HydrophobicContact CD2-CB 4Å; F501-V506 HydrophobicContact CD2-CG1 3.92Å; V506-I508 WeakPolarHBondContact CG1-O 3.4Å; V506-L509 HydrophobicContact CG1-CB 4.32Å
507	K	94	Very high	89.1	Confident	44 Å²	44	23.4 Å²	23.4	19%	0.191	12%	0.121	C	C	.	.	S	Bend	trans	-89.4	-35.9	-179.2	-51.9	-54.5	-178.3	-172.1	0	112.4	M417 P418 A419 L441 E446 G481 G504	M417-K507 HydrophobicContact SD-CB 3.82Å; M417-K507 HydrophobicContact SD-CG 4.5Å; P418-K507 CarbonylContact C-O 3.27Å; P418-K507 VanDerWaalsContact CA-O 3.28Å; P418-K507 WeakPolarHBondContact CA-O 3.29Å; A419-K507 PolarHBondContact N-O 2.84Å; L441-K507 HydrophobicContact CB-CB 4.15Å; L441-K507 HydrophobicContact CB-CG 3.93Å; L441-K507 HydrophobicContact CD1-CB 3.95Å; E446-K507 WeakPolarHBondContact OE1-CE 3.49Å; E446-K507 IonicContact OE1-NZ 4Å; E446-K507 PolarHBondContact OE1-NZ 2.91Å; G481-K507 PolarHBondContact O-N 3.05Å; G504-K507 PolarHBondContact O-NZ 3.32Å
508	I	95	Very high	87.8	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	122.3	175.9	-55.3	179.6	0	0	0	109.6	V408 L411 A419 L441 G481 L482 A483 V506 F510	V408-I508 HydrophobicContact CG1-CD1 4.12Å; V408-I508 HydrophobicContact CG2-CD1 3.77Å; L411-I508 HydrophobicContact CD1-CD1 4.15Å; A419-I508 WeakPolarHBondContact O-CA 3.32Å; L441-I508 HydrophobicContact CD1-CD1 3.67Å; L441-I508 HydrophobicContact CD1-CG1 3.84Å; G481-I508 PolarHBondContact O-N 2.88Å; G481-I508 VanDerWaalsContact O-N 3.15Å; L482-I508 WeakPolarHBondContact CA-O 3.1Å; L482-I508 HydrophobicContact CD2-CB 3.81Å; L482-I508 HydrophobicContact CD2-CD1 4.27Å; L482-I508 HydrophobicContact CD2-CG1 4.33Å; A483-I508 PolarHBondContact N-O 3.09Å; A483-I508 VanDerWaalsContact N-O 3.08Å; V506-I508 WeakPolarHBondContact CG1-O 3.4Å; I508-F510 HydrophobicContact CG2-CD2 4.37Å; I508-F510 HydrophobicContact CG2-CE1 4.43Å; I508-F510 HydrophobicContact CG2-CE2 3.73Å; I508-F510 HydrophobicContact CG2-CZ 3.73Å
509	L	95.2	Very high	86.9	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116	177.5	179.7	64.3	0	0	0	110.3	A419 I420 A421 A483 H485 V497 F501 V506 A511 V515	A419-L509 PolarHBondContact O-N 2.9Å; I420-L509 CarbonylContact C-O 3.46Å; I420-L509 WeakPolarHBondContact CA-O 3.45Å; I420-L509 HydrophobicContact CG1-CB 4.3Å; I420-L509 HydrophobicContact CG1-CD2 4.33Å; A421-L509 PolarHBondContact N-O 3.47Å; A483-L509 HydrophobicContact CB-CD1 3.87Å; H485-L509 HydrophobicContact CB-CD1 4Å; V497-L509 HydrophobicContact CG1-CD1 3.46Å; V497-L509 VanDerWaalsContact CG1-CD1 3.46Å; F501-L509 HydrophobicContact CD2-CB 3.87Å; F501-L509 HydrophobicContact CD2-CD2 4.09Å; F501-L509 HydrophobicContact CE2-CB 3.77Å; F501-L509 HydrophobicContact CE2-CD2 4.31Å; F501-L509 HydrophobicContact CG-CD2 4.35Å; V506-L509 HydrophobicContact CG1-CB 4.32Å; L509-A511 HydrophobicContact CG-CB 4.36Å; L509-V515 HydrophobicContact CD2-CG1 4.39Å
510	F	95.2	Very high	86.2	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	117.9	170	-63.1	-83.9	0	0	0	109.3	W404 A421 V429 L432 A433 L436 A483 V484 H485 I508	W404-F510 HydrophobicContact CE3-CE1 4.28Å; W404-F510 HydrophobicContact CE3-CZ 4.41Å; W404-F510 AromaticContact CH2-CE1 3.7Å; W404-F510 HydrophobicContact CH2-CE1 3.7Å; W404-F510 HydrophobicContact CZ2-CE1 4.09Å; W404-F510 AromaticContact CZ3-CE1 3.79Å; W404-F510 HydrophobicContact CZ3-CE1 3.79Å; W404-F510 HydrophobicContact CZ3-CZ 4.16Å; A421-F510 HydrophobicContact CB-CD1 3.62Å; A421-F510 HydrophobicContact CB-CE1 3.77Å; A421-F510 HydrophobicContact CB-CG 4.46Å; A421-F510 WeakPolarHBondContact O-CA 3.46Å; V429-F510 HydrophobicContact CG1-CB 3.77Å; V429-F510 VanDerWaalsContact CG1-O 3.26Å; V429-F510 WeakPolarHBondContact CG1-O 3.33Å; L432-F510 HydrophobicContact CB-CD1 3.92Å; L432-F510 HydrophobicContact CB-CE1 4.02Å; L432-F510 HydrophobicContact CD1-CD1 4.38Å; A433-F510 HydrophobicContact CB-CD2 3.89Å; A433-F510 HydrophobicContact CB-CE2 4.37Å; A433-F510 HydrophobicContact CB-CG 4.49Å; L436-F510 HydrophobicContact CD1-CE1 4.36Å; L436-F510 HydrophobicContact CD1-CE2 4.14Å; L436-F510 HydrophobicContact CD1-CZ 3.46Å; L436-F510 VanDerWaalsContact CD1-CZ 3.46Å; A483-F510 PolarHBondContact O-N 3.39Å; V484-F510 CarbonylContact C-O 3.57Å; V484-F510 VanDerWaalsContact CA-O 3.29Å; V484-F510 WeakPolarHBondContact CA-O 3.36Å; V484-F510 HydrophobicContact CG1-CB 4.41Å; H485-F510 PolarHBondContact N-O 3.35Å; I508-F510 HydrophobicContact CG2-CD2 4.37Å; I508-F510 HydrophobicContact CG2-CE1 4.43Å; I508-F510 HydrophobicContact CG2-CE2 3.73Å; I508-F510 HydrophobicContact CG2-CZ 3.73Å
511	A	94.3	Very high	85.5	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.8	-168.4	0	0	0	0	0	113.2	I420 A421 F422 A423 H485 L509 V515	I420-A511 HydrophobicContact CG2-CB 4.06Å; A421-A511 PolarHBondContact O-N 2.9Å; F422-A511 VanDerWaalsContact CA-O 3.31Å; F422-A511 WeakPolarHBondContact CA-O 3.49Å; F422-A511 HydrophobicContact CD1-CB 4.25Å; F422-A511 HydrophobicContact CE1-CB 4.22Å; A423-A511 PolarHBondContact N-O 3.49Å; H485-A511 HydrophobicContact CB-CB 4.45Å; H485-A511 VanDerWaalsContact O-CA 3.32Å; H485-A511 WeakPolarHBondContact O-CA 3.22Å; L509-A511 HydrophobicContact CG-CB 4.36Å; A511-V515 HydrophobicContact CB-CB 3.9Å; A511-V515 HydrophobicContact CB-CG1 4.47Å; A511-V515 HydrophobicContact CB-CG2 3.49Å; A511-V515 VanDerWaalsContact CB-CG2 3.49Å
512	T	91.9	Very high	84.9	Confident	13 Å²	13	28 Å²	28	8%	0.08	15%	0.151	C	C	.	.			trans	-80.4	168.7	159.4	51.7	0	0	0	0	111	A423 V429 H485 H486 T514 V515	A423-T512 WeakPolarHBondContact O-CA 3.48Å; A423-T512 WeakPolarHBondContact O-CG2 3.37Å; V429-T512 HydrophobicContact CG2-CG2 4.1Å; H485-T512 PolarHBondContact O-N 2.78Å; H486-T512 WeakPolarHBondContact CA-OG1 3.29Å; H486-T512 HydrophobicContact CB-CG2 3.76Å; T512-T514 PolarHBondContact O-N 2.87Å; T512-T514 PolarHBondContact OG1-OG1 3.32Å; T512-V515 PolarHBondContact O-N 3.24Å; T512-V515 VanDerWaalsContact O-N 3.12Å
513	E	87.5	Confident	85.2	Confident	71 Å²	71	22 Å²	22	33%	0.332	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-54.1	-20.6	177.1	69.7	-175.8	169.2	0	0	113.5	F424 V515 S516 K533 M550	F424-E513 HydrophobicContact CD1-CB 4.5Å; F424-E513 HydrophobicContact CE1-CB 4.39Å; E513-V515 PolarHBondContact O-N 2.86Å; E513-S516 PolarHBondContact O-N 3.41Å; E513-S516 PolarHBondContact O-OG 2.88Å; E513-K533 IonicContact OE1-NZ 2.8Å; E513-K533 IonicContact OE2-NZ 3.31Å; E513-K533 PolarHBondContact OE2-NZ 3.45Å; E513-M550 HydrophobicContact CB-SD 4.16Å
514	T	83.6	Confident	85.6	Confident	48 Å²	48	22.8 Å²	22.8	29%	0.294	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-58.9	-19	176.5	57.3	0	0	0	0	114.7	T512 T517	T512-T514 PolarHBondContact O-N 2.87Å; T512-T514 PolarHBondContact OG1-OG1 3.32Å; T514-T517 WeakPolarHBondContact CA-OG1 3.32Å; T514-T517 PolarHBondContact O-OG1 2.71Å
515	V	86.1	Confident	85.9	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.006	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-76.2	-31.1	173.7	175.2	0	0	0	0	111.5	F422 H485 L509 A511 T512 E513 T517 T521	F422-V515 HydrophobicContact CE1-CB 4.32Å; H485-V515 HydrophobicContact CB-CG2 3.74Å; H485-V515 WeakPolarHBondContact ND1-CG2 2.95Å; L509-V515 HydrophobicContact CD2-CG1 4.39Å; A511-V515 HydrophobicContact CB-CB 3.9Å; A511-V515 HydrophobicContact CB-CG1 4.47Å; A511-V515 HydrophobicContact CB-CG2 3.49Å; A511-V515 VanDerWaalsContact CB-CG2 3.49Å; T512-V515 PolarHBondContact O-N 3.24Å; T512-V515 VanDerWaalsContact O-N 3.12Å; E513-V515 PolarHBondContact O-N 2.86Å; V515-T517 PolarHBondContact O-N 2.76Å; V515-T521 VanDerWaalsContact CG1-OG1 3.26Å; V515-T521 WeakPolarHBondContact CG1-OG1 3.35Å
516	S	81.5	Confident	86.1	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.014	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-11.9	174.8	66.3	0	0	0	0	112.5	E513 M550 R553	E513-S516 PolarHBondContact O-N 3.41Å; E513-S516 PolarHBondContact O-OG 2.88Å; S516-M550 WeakPolarHBondContact OG-CG 3.48Å; S516-R553 PolarHBondContact O-NH2 3.34Å
517	T	71.6	Confident	86.1	Confident	37 Å²	37	20.9 Å²	20.9	23%	0.227	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	103.3	176.3	55.9	0	0	0	0	111.7	Y281 T514 V515 V519	Y281-T517 WeakPolarHBondContact OH-CB 3.24Å; Y281-T517 WeakPolarHBondContact OH-CG2 3.43Å; T514-T517 WeakPolarHBondContact CA-OG1 3.32Å; T514-T517 PolarHBondContact O-OG1 2.71Å; V515-T517 PolarHBondContact O-N 2.76Å; T517-V519 PolarHBondContact O-N 2.96Å
518	G	64.3	Low	86.2	Confident	7 Å²	7	18.8 Å²	18.8	7%	0.072	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	12.3	163.1	0	0	0	0	0	118.5	L218	L218-G518 VanDerWaalsContact CB-O 3.31Å; L218-G518 WeakPolarHBondContact CB-O 3.4Å; L218-G518 VanDerWaalsContact CD1-O 3.26Å; L218-G518 WeakPolarHBondContact CD1-O 3.48Å
519	V	70.9	Confident	86	Confident	11 Å²	11	19 Å²	19	7%	0.067	10%	0.102	C	C	.	.			trans	-117	141.3	170.9	-168.2	0	0	0	0	109.9	E498 T517 T521 R553	E498-V519 HydrophobicContact CB-CG1 4.45Å; E498-V519 HydrophobicContact CG-CG1 3.92Å; T517-V519 PolarHBondContact O-N 2.96Å; V519-T521 HydrophobicContact CG1-CG2 3.94Å; V519-T521 PolarHBondContact O-N 3.32Å; V519-R553 PolarHBondContact O-NH1 3.22Å; V519-R553 PolarHBondContact O-NH2 2.88Å
520	N	72	Confident	85.7	Confident	76 Å²	76	19.8 Å²	19.8	41%	0.406	11%	0.107	S	C	.	.			trans	-86.8	79.7	177.9	-168.7	16.5	0	0	0	111.7	P522	N520-P522 VanDerWaalsContact C-CD 3.44Å; N520-P522 WeakPolarHBondContact O-CD 3.37Å; N520-P522 WeakPolarHBondContact OD1-CD 3.26Å
521	T	76.5	Confident	85.5	Confident	3 Å²	3	19.8 Å²	19.8	2%	0.018	11%	0.107	C	C	.	.			trans	-120.4	68.6	177.2	47.9	0	0	0	0	111.4	I420 F501 V515 V519 A523	I420-T521 VanDerWaalsContact CD1-O 3.29Å; I420-T521 WeakPolarHBondContact CD1-O 3.49Å; F501-T521 HydrophobicContact CD1-CG2 3.82Å; F501-T521 HydrophobicContact CE1-CG2 4.41Å; V515-T521 VanDerWaalsContact CG1-OG1 3.26Å; V515-T521 WeakPolarHBondContact CG1-OG1 3.35Å; V519-T521 HydrophobicContact CG1-CG2 3.94Å; V519-T521 PolarHBondContact O-N 3.32Å; T521-A523 PolarHBondContact O-N 3.27Å
522	P	78.9	Confident	85.2	Confident	40 Å²	40	21.3 Å²	21.3	26%	0.26	11%	0.114	S	C	.	.			trans	-72.7	131.6	179.6	33.6	-35.4	0	0	0	109.8	N520 R556	N520-P522 VanDerWaalsContact C-CD 3.44Å; N520-P522 WeakPolarHBondContact O-CD 3.37Å; N520-P522 WeakPolarHBondContact OD1-CD 3.26Å; P522-R556 HydrophobicContact CB-CG 3.87Å; P522-R556 HydrophobicContact CG-CG 4.18Å
523	A	91.5	Very high	85	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-113.9	159.8	-178.8	0	0	0	0	0	110.2	I420 F501 T521 C525 R553 A554 G555	I420-A523 HydrophobicContact CB-CB 4.41Å; I420-A523 HydrophobicContact CD1-CB 3.67Å; I420-A523 HydrophobicContact CG1-CB 3.7Å; F501-A523 HydrophobicContact CZ-CB 4.02Å; T521-A523 PolarHBondContact O-N 3.27Å; A523-C525 WeakPolarHBondContact CB-O 3.44Å; A523-R553 PolarHBondContact N-O 3.27Å; A523-A554 CarbonylContact O-C 3.59Å; A523-A554 VanDerWaalsContact O-CA 3.29Å; A523-A554 WeakPolarHBondContact O-CA 3.4Å; A523-G555 PolarHBondContact O-N 2.91Å
524	R	93.4	Very high	84.9	Confident	80 Å²	80	23.1 Å²	23.1	30%	0.302	12%	0.12	S	C	.	.	S	Bend	trans	-74.2	-39.3	171.1	-179.1	169.3	178	160.3	-0.4	110.9	N415 P418 D560 L564	N415-R524 WeakPolarHBondContact O-CD 3.41Å; N415-R524 PolarHBondContact O-NE 2.8Å; N415-R524 PolarHBondContact O-NH1 3.38Å; P418-R524 PolarHBondContact O-N 3.4Å; R524-D560 WeakPolarHBondContact CD-OD1 3.49Å; R524-D560 IonicContact NE-OD1 2.76Å; R524-L564 PolarHBondContact O-N 3.49Å
525	C	95.1	Very high	84.6	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	139.7	-179.7	-176.6	0	0	0	0	112	L416 P418 A419 I420 A523 L564	L416-C525 HydrophobicContact CB-CB 4.36Å; L416-C525 WeakPolarHBondContact O-CB 3.37Å; P418-C525 PolarHBondContact O-N 2.68Å; A419-C525 CarbonylContact C-O 3.48Å; A419-C525 VanDerWaalsContact CA-O 3.24Å; A419-C525 WeakPolarHBondContact CA-O 3.17Å; A419-C525 HydrophobicContact CB-CB 4.14Å; I420-C525 PolarHBondContact N-O 2.92Å; A523-C525 WeakPolarHBondContact CB-O 3.44Å; C525-L564 CarbonylContact C-O 3.57Å; C525-L564 VanDerWaalsContact CA-O 3.27Å; C525-L564 WeakPolarHBondContact CA-O 3.43Å; C525-L564 HydrophobicContact CB-CB 4.48Å
526	V	95.5	Very high	83.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	134.9	168.5	169.2	0	0	0	0	108.8	I420 F422 F528 R553 A554 L564 V565 I566	I420-V526 CarbonylContact O-C 3.35Å; I420-V526 WeakPolarHBondContact O-CA 3.48Å; F422-V526 HydrophobicContact CD2-CG1 3.61Å; F422-V526 HydrophobicContact CE2-CG1 3.62Å; F422-V526 HydrophobicContact CE2-CG2 4.46Å; V526-F528 HydrophobicContact CG1-CD2 4.35Å; V526-F528 HydrophobicContact CG1-CE2 3.91Å; V526-F528 HydrophobicContact CG1-CZ 4.33Å; V526-R553 HydrophobicContact CG2-CB 3.98Å; V526-A554 HydrophobicContact CB-CB 4.01Å; V526-A554 HydrophobicContact CG2-CB 3.69Å; V526-L564 PolarHBondContact N-O 3.12Å; V526-V565 CarbonylContact O-C 3.58Å; V526-V565 WeakPolarHBondContact O-CA 3.36Å; V526-I566 PolarHBondContact O-N 3.46Å
527	V	95.2	Very high	83.5	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	122.1	-174.4	-173.9	0	0	0	0	109	W404 F407 I420 A421 F422 I566 L568	W404-V527 HydrophobicContact CH2-CG1 4.24Å; F407-V527 HydrophobicContact CE1-CB 4.37Å; F407-V527 HydrophobicContact CE1-CG1 3.79Å; F407-V527 HydrophobicContact CE1-CG2 3.74Å; F407-V527 HydrophobicContact CZ-CB 4.41Å; F407-V527 HydrophobicContact CZ-CG1 3.86Å; F407-V527 HydrophobicContact CZ-CG2 3.62Å; I420-V527 PolarHBondContact O-N 3.29Å; A421-V527 CarbonylContact C-O 3.59Å; A421-V527 WeakPolarHBondContact CA-O 3.5Å; A421-V527 HydrophobicContact CB-CB 4.3Å; F422-V527 PolarHBondContact N-O 2.86Å; V527-I566 CarbonylContact C-O 3.58Å; V527-I566 VanDerWaalsContact CA-O 3.26Å; V527-I566 WeakPolarHBondContact CA-O 3.48Å; V527-L568 HydrophobicContact CG1-CD1 3.79Å; V527-L568 HydrophobicContact CG1-CD2 4.18Å; V527-L568 HydrophobicContact CG1-CG 3.71Å
528	F	94.4	Very high	84	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	113.7	174.2	-73	-85.3	0	0	0	109.6	F422 V526 L531 L542 F547 M550 A551 V565 I566 I567 L568	F422-F528 HydrophobicContact CB-CD1 4.45Å; F422-F528 HydrophobicContact CD2-CE1 4.45Å; V526-F528 HydrophobicContact CG1-CD2 4.35Å; V526-F528 HydrophobicContact CG1-CE2 3.91Å; V526-F528 HydrophobicContact CG1-CZ 4.33Å; F528-L531 HydrophobicContact CB-CD2 3.94Å; F528-L531 HydrophobicContact CD1-CD2 4.28Å; F528-L531 HydrophobicContact CG-CD2 4.16Å; F528-L542 HydrophobicContact CD1-CD1 4.18Å; F528-L542 HydrophobicContact CE1-CD1 4.08Å; F528-F547 HydrophobicContact CD1-CE2 4.44Å; F528-F547 AromaticContact CD2-CE2 3.75Å; F528-F547 HydrophobicContact CD2-CE2 3.75Å; F528-F547 HydrophobicContact CD2-CZ 4.33Å; F528-F547 AromaticContact CE1-CD2 3.96Å; F528-F547 HydrophobicContact CE1-CD2 3.96Å; F528-F547 HydrophobicContact CE1-CE2 4.13Å; F528-F547 AromaticContact CE2-CD2 3.94Å; F528-F547 HydrophobicContact CE2-CD2 3.94Å; F528-F547 AromaticContact CE2-CE2 3.37Å; F528-F547 HydrophobicContact CE2-CE2 3.37Å; F528-F547 AromaticContact CE2-CZ 3.81Å; F528-F547 HydrophobicContact CE2-CZ 3.81Å; F528-F547 HydrophobicContact CG-CE2 4.26Å; F528-F547 AromaticContact CZ-CD2 3.62Å; F528-F547 HydrophobicContact CZ-CD2 3.62Å; F528-F547 AromaticContact CZ-CE2 3.58Å; F528-F547 HydrophobicContact CZ-CE2 3.58Å; F528-F547 HydrophobicContact CZ-CG 4.36Å; F528-F547 HydrophobicContact CZ-CZ 4.28Å; F528-M550 HydrophobicContact CE1-CB 3.86Å; F528-M550 HydrophobicContact CE1-CE 3.79Å; F528-M550 HydrophobicContact CE1-SD 3.87Å; F528-M550 HydrophobicContact CZ-CB 3.65Å; F528-A551 HydrophobicContact CE2-CB 4.28Å; F528-A551 HydrophobicContact CZ-CB 4.4Å; F528-V565 HydrophobicContact CD2-CG1 3.78Å; F528-V565 HydrophobicContact CE2-CG1 3.59Å; F528-I566 PolarHBondContact N-O 2.98Å; F528-I567 HydrophobicContact CB-CG1 4.34Å; F528-I567 HydrophobicContact CD2-CG1 4.46Å; F528-L568 PolarHBondContact O-N 3.38Å
529	T	91.1	Very high	85	Confident	7 Å²	7	44.6 Å²	44.6	4%	0.043	21%	0.205	C	C	.	.	S	Bend	trans	-82.6	-29	176.9	79.5	0	0	0	0	111.5	W404 A421 F422 A423 L432 L568 T571	W404-T529 HydrophobicContact CH2-CG2 3.9Å; W404-T529 HydrophobicContact CZ2-CG2 3.51Å; A421-T529 HydrophobicContact CB-CG2 4.26Å; F422-T529 WeakPolarHBondContact O-CG2 3.25Å; F422-T529 PolarHBondContact O-N 3.32Å; F422-T529 VanDerWaalsContact O-N 3.13Å; F422-T529 PolarHBondContact O-OG1 2.9Å; A423-T529 WeakPolarHBondContact CB-OG1 3.48Å; L432-T529 HydrophobicContact CD1-CG2 4.06Å; T529-L568 HydrophobicContact CG2-CD1 4.47Å; T529-T571 CarbonylContact O-C 3.54Å; T529-T571 VanDerWaalsContact O-CB 3.22Å; T529-T571 WeakPolarHBondContact O-CB 3.46Å; T529-T571 PolarHBondContact O-OG1 3.3Å
530	S	88.7	Confident	85.9	Confident	18 Å²	18	45.9 Å²	45.9	13%	0.126	21%	0.208	C	C	.	.			trans	-134.6	154.5	175.9	-179.6	0	0	0	0	108.5	F424 E532 I572	F424-S530 VanDerWaalsContact CE2-O 3.28Å; F424-S530 WeakPolarHBondContact CE2-O 3.46Å; S530-E532 WeakPolarHBondContact OG-CG 3.5Å; S530-E532 PolarHBondContact OG-N 3.48Å; S530-E532 VanDerWaalsContact OG-N 3.12Å; S530-E532 PolarHBondContact OG-O 2.93Å; S530-I572 PolarHBondContact OG-O 2.99Å
531	L	90.9	Very high	86.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-115	1	166	-59.6	177.8	0	0	0	112.3	F528 P541 L542 F547 I567 I572 L576 P584 L589 M592	F528-L531 HydrophobicContact CB-CD2 3.94Å; F528-L531 HydrophobicContact CD1-CD2 4.28Å; F528-L531 HydrophobicContact CG-CD2 4.16Å; L531-P541 WeakPolarHBondContact O-CA 3.13Å; L531-L542 HydrophobicContact CD2-CD1 4.33Å; L531-L542 PolarHBondContact O-N 3.46Å; L531-F547 HydrophobicContact CD2-CE2 4.38Å; L531-I567 HydrophobicContact CD1-CD1 4.36Å; L531-I567 HydrophobicContact CD1-CG2 3.89Å; L531-I567 HydrophobicContact CD2-CD1 4.42Å; L531-I567 HydrophobicContact CD2-CG2 4.2Å; L531-I567 HydrophobicContact CG-CG2 4.09Å; L531-I572 HydrophobicContact CB-CG2 3.84Å; L531-I572 HydrophobicContact CD1-CD1 4.31Å; L531-I572 HydrophobicContact CD1-CG2 3.89Å; L531-I572 HydrophobicContact CG-CG2 3.85Å; L531-I572 PolarHBondContact N-O 3.48Å; L531-I572 VanDerWaalsContact N-O 3.12Å; L531-L576 HydrophobicContact CB-CD1 3.89Å; L531-P584 HydrophobicContact CD1-CG 4.22Å; L531-L589 HydrophobicContact CD1-CD2 3.95Å; L531-M592 HydrophobicContact CB-CE 4.17Å; L531-M592 HydrophobicContact CB-SD 4.31Å; L531-M592 HydrophobicContact CD1-SD 4.25Å; L531-M592 HydrophobicContact CD2-SD 3.94Å; L531-M592 HydrophobicContact CG-SD 4.41Å
532	E	89.4	Confident	87.6	Confident	32 Å²	32	44.6 Å²	44.6	15%	0.15	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	137.6	173	62.2	179	171.2	0	0	111.1	F424 S530 R540 G573 S575 L576	F424-E532 VanDerWaalsContact CD2-O 3.27Å; F424-E532 WeakPolarHBondContact CD2-O 3.5Å; S530-E532 WeakPolarHBondContact OG-CG 3.5Å; S530-E532 PolarHBondContact OG-N 3.48Å; S530-E532 VanDerWaalsContact OG-N 3.12Å; S530-E532 PolarHBondContact OG-O 2.93Å; E532-R540 WeakPolarHBondContact CA-O 3.48Å; E532-G573 WeakPolarHBondContact OE1-CA 3.29Å; E532-S575 WeakPolarHBondContact OE2-CB 3.23Å; E532-S575 PolarHBondContact OE2-OG 2.98Å; E532-L576 HydrophobicContact CB-CD1 3.95Å; E532-L576 HydrophobicContact CB-CG 4.4Å
533	K	88.1	Confident	88.1	Confident	17 Å²	17	45.3 Å²	45.3	7%	0.074	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	158.9	171.8	76.6	171.1	179.6	173.3	0	111.7	F424 E513 R539 R540 L542 E546	F424-K533 HydrophobicContact CB-CB 3.98Å; F424-K533 HydrophobicContact CD1-CB 4.36Å; F424-K533 HydrophobicContact CD2-CB 4.04Å; F424-K533 HydrophobicContact CG-CB 3.85Å; E513-K533 IonicContact OE1-NZ 2.8Å; E513-K533 IonicContact OE2-NZ 3.31Å; E513-K533 PolarHBondContact OE2-NZ 3.45Å; K533-R539 CarbonylContact O-C 3.55Å; K533-R539 WeakPolarHBondContact O-CA 3.45Å; K533-R540 VanDerWaalsContact CE-NH2 3.29Å; K533-R540 PolarHBondContact N-O 3.5Å; K533-R540 PolarHBondContact O-N 3.46Å; K533-L542 HydrophobicContact CB-CD2 4.3Å; K533-L542 HydrophobicContact CD-CD2 3.85Å; K533-L542 HydrophobicContact CG-CD2 4.05Å; K533-E546 VanDerWaalsContact CE-CD 3.43Å; K533-E546 WeakPolarHBondContact CE-OE1 3.14Å; K533-E546 WeakPolarHBondContact CE-OE2 3.34Å; K533-E546 IonicContact NZ-OE1 3.78Å; K533-E546 PolarHBondContact NZ-OE1 2.91Å; K533-E546 IonicContact NZ-OE2 2.95Å; K533-E546 PolarHBondContact NZ-OE2 2.71Å
534	F	84.1	Confident	88	Confident	105 Å²	105	46.5 Å²	46.5	46%	0.461	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	119.3	172.3	-173.6	-114.8	0	0	0	108.3	G536 R538 R539	F534-G536 VanDerWaalsContact C-N 3.27Å; F534-G536 VanDerWaalsContact CZ-O 3.3Å; F534-G536 WeakPolarHBondContact CZ-O 3.4Å; F534-R538 WeakPolarHBondContact CA-O 3.39Å; F534-R538 WeakPolarHBondContact CD2-O 3.4Å; F534-R539 HydrophobicContact CD2-CG 4.25Å
535	D	77.7	Confident	87.7	Confident	40 Å²	40	44.2 Å²	44.2	21%	0.214	21%	0.209	C	C	.	.			trans	-90.6	11.8	179.8	63.8	9.3	0	0	0	113	Q537 R538 R540 Q1153	D535-Q537 PolarHBondContact OD1-N 3.36Å; D535-R538 PolarHBondContact N-O 2.94Å; D535-R538 VanDerWaalsContact N-O 3.12Å; D535-R538 PolarHBondContact OD1-N 2.97Å; D535-R540 HydrophobicContact CB-CG 4.42Å; D535-R540 WeakPolarHBondContact OD2-CD 3.29Å; D535-R540 IonicContact OD2-NE 3.57Å; D535-R540 PolarHBondContact OD2-NE 2.93Å; D535-Q1153 PolarHBondContact O-NE2 3.05Å
536	G	70.9	Confident	87.4	Confident	15 Å²	15	45.8 Å²	45.8	16%	0.155	22%	0.217	C	C	.	.	S	Bend	trans	96.1	-21.3	-175.4	0	0	0	0	0	114.5	F534 Q1153	F534-G536 VanDerWaalsContact C-N 3.27Å; F534-G536 VanDerWaalsContact CZ-O 3.3Å; F534-G536 WeakPolarHBondContact CZ-O 3.4Å; G536-Q1153 VanDerWaalsContact CA-CD 3.45Å
537	Q	72.5	Confident	87.3	Confident	179 Å²	179	45.9 Å²	45.9	84%	0.836	22%	0.217	S	C	*	.	S	Bend	trans	-116.7	-47	178.8	-64.2	-177.5	-5.7	0	0	111.1	D535	D535-Q537 PolarHBondContact OD1-N 3.36Å
538	R	83.8	Confident	87	Confident	169 Å²	169	47.5 Å²	47.5	64%	0.638	23%	0.227	S	C	*	.			trans	-138.7	160.8	-177.2	62.3	-178.9	-179.4	179.5	1.3	112.2	F534 D535	F534-R538 WeakPolarHBondContact CA-O 3.39Å; F534-R538 WeakPolarHBondContact CD2-O 3.4Å; D535-R538 PolarHBondContact N-O 2.94Å; D535-R538 VanDerWaalsContact N-O 3.12Å; D535-R538 PolarHBondContact OD1-N 2.97Å
539	R	84.2	Confident	86.7	Confident	144 Å²	144	49.2 Å²	49.2	54%	0.543	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	115	165.3	-72.4	-78.5	-179.1	176.5	-4.8	107.7	K533 F534	K533-R539 CarbonylContact O-C 3.55Å; K533-R539 WeakPolarHBondContact O-CA 3.45Å; F534-R539 HydrophobicContact CD2-CG 4.25Å
540	R	89.9	Confident	86.8	Confident	38 Å²	38	48.9 Å²	48.9	14%	0.143	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	156	179.3	65.7	162.2	178.8	82.2	-7.7	111.3	E532 K533 D535 D543 E546	E532-R540 WeakPolarHBondContact CA-O 3.48Å; K533-R540 VanDerWaalsContact CE-NH2 3.29Å; K533-R540 PolarHBondContact N-O 3.5Å; K533-R540 PolarHBondContact O-N 3.46Å; D535-R540 HydrophobicContact CB-CG 4.42Å; D535-R540 WeakPolarHBondContact OD2-CD 3.29Å; D535-R540 IonicContact OD2-NE 3.57Å; D535-R540 PolarHBondContact OD2-NE 2.93Å; R540-D543 IonicContact CZ-OD2 3.7Å; R540-D543 VanDerWaalsContact NH1-CG 3.34Å; R540-D543 IonicContact NH1-OD1 3.95Å; R540-D543 PolarHBondContact NH1-OD1 2.81Å; R540-D543 IonicContact NH1-OD2 3.75Å; R540-D543 PolarHBondContact NH1-OD2 3.37Å; R540-D543 VanDerWaalsContact NH1-OD2 3.13Å; R540-D543 IonicContact NH2-OD2 3.95Å; R540-D543 PolarHBondContact NH2-OD2 3.46Å; R540-D543 VanDerWaalsContact NH2-OD2 3.15Å; R540-E546 IonicContact CZ-OE1 3.29Å; R540-E546 IonicContact CZ-OE2 3.47Å; R540-E546 IonicContact NH1-OE1 2.73Å; R540-E546 IonicContact NH1-OE2 3.63Å; R540-E546 PolarHBondContact NH1-OE2 2.91Å; R540-E546 IonicContact NH2-OE1 3.51Å; R540-E546 PolarHBondContact NH2-OE1 2.87Å; R540-E546 IonicContact NH2-OE2 3.16Å; R540-E546 PolarHBondContact NH2-OE2 3.41Å
541	P	91.7	Very high	86.9	Confident	45 Å²	45	48.1 Å²	48.1	29%	0.292	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	157.5	166.9	27.8	-34.7	0	0	0	111.1	L531 L576 L588 M592	L531-P541 WeakPolarHBondContact O-CA 3.13Å; P541-L576 HydrophobicContact CB-CD1 4.39Å; P541-L576 HydrophobicContact CB-CD2 4.24Å; P541-L588 HydrophobicContact CB-CD1 3.93Å; P541-L588 HydrophobicContact CG-CD1 4.1Å; P541-M592 HydrophobicContact CB-CE 3.85Å
542	L	91.8	Very high	86.8	Confident	6 Å²	6	48.3 Å²	48.3	3%	0.031	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-62.8	140.7	172.6	-62.6	169	0	0	0	111.1	F424 F528 L531 K533 F547 M550 M592	F424-L542 HydrophobicContact CE1-CD2 3.97Å; F424-L542 HydrophobicContact CE2-CD1 3.97Å; F424-L542 HydrophobicContact CE2-CD2 3.96Å; F424-L542 HydrophobicContact CE2-CG 4.25Å; F424-L542 HydrophobicContact CZ-CD1 3.61Å; F424-L542 HydrophobicContact CZ-CD2 3.61Å; F424-L542 HydrophobicContact CZ-CG 4.1Å; F528-L542 HydrophobicContact CD1-CD1 4.18Å; F528-L542 HydrophobicContact CE1-CD1 4.08Å; L531-L542 HydrophobicContact CD2-CD1 4.33Å; L531-L542 PolarHBondContact O-N 3.46Å; K533-L542 HydrophobicContact CB-CD2 4.3Å; K533-L542 HydrophobicContact CD-CD2 3.85Å; K533-L542 HydrophobicContact CG-CD2 4.05Å; L542-F547 HydrophobicContact CD1-CD2 4.45Å; L542-M550 HydrophobicContact CD1-CE 3.76Å; L542-M550 HydrophobicContact CD2-CE 3.89Å; L542-M550 HydrophobicContact CG-CE 4.37Å; L542-M592 HydrophobicContact CB-CE 4.16Å; L542-M592 HydrophobicContact CB-SD 4.18Å
543	D	89.5	Confident	86.8	Confident	56 Å²	56	47.5 Å²	47.5	30%	0.299	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-75.2	155.2	172.9	-62	-37.7	0	0	0	110.1	R540 S545 E546 F547 T598	R540-D543 IonicContact CZ-OD2 3.7Å; R540-D543 VanDerWaalsContact NH1-CG 3.34Å; R540-D543 IonicContact NH1-OD1 3.95Å; R540-D543 PolarHBondContact NH1-OD1 2.81Å; R540-D543 IonicContact NH1-OD2 3.75Å; R540-D543 PolarHBondContact NH1-OD2 3.37Å; R540-D543 VanDerWaalsContact NH1-OD2 3.13Å; R540-D543 IonicContact NH2-OD2 3.95Å; R540-D543 PolarHBondContact NH2-OD2 3.46Å; R540-D543 VanDerWaalsContact NH2-OD2 3.15Å; D543-S545 PolarHBondContact O-N 3.01Å; D543-E546 HydrophobicContact CB-CG 4.11Å; D543-E546 PolarHBondContact N-OE2 2.95Å; D543-E546 WeakPolarHBondContact O-CB 3.37Å; D543-E546 PolarHBondContact O-N 3.2Å; D543-E546 VanDerWaalsContact O-N 3.11Å; D543-F547 PolarHBondContact O-N 3.39Å; D543-T598 HydrophobicContact CB-CG2 4.37Å
544	P	91.3	Very high	87	Confident	25 Å²	25	46.7 Å²	46.7	16%	0.162	22%	0.221	C	C	.	.	H	α-helix	trans	-58.4	-34.1	-177.6	-25.5	34.8	0	0	0	113.7	T548 N591 M592	P544-T548 VanDerWaalsContact O-CB 3.26Å; P544-T548 WeakPolarHBondContact O-CB 3.47Å; P544-T548 PolarHBondContact O-N 2.88Å; P544-T548 PolarHBondContact O-OG1 2.74Å; P544-N591 WeakPolarHBondContact CG-O 3.37Å; P544-M592 WeakPolarHBondContact CA-O 3.41Å
545	S	86.8	Confident	87.3	Confident	31 Å²	31	41.7 Å²	41.7	22%	0.217	20%	0.199	C	C	.	.	H	α-helix	trans	-69	-42.2	176.5	49.7	0	0	0	0	112.5	D543 T548 Q549 T598	D543-S545 PolarHBondContact O-N 3.01Å; S545-T548 PolarHBondContact O-N 3.5Å; S545-Q549 WeakPolarHBondContact O-CB 3.34Å; S545-Q549 PolarHBondContact O-N 3.43Å; S545-T598 VanDerWaalsContact CB-OG1 3.26Å; S545-T598 WeakPolarHBondContact CB-OG1 3.25Å; S545-T598 WeakPolarHBondContact OG-CG2 3.37Å; S545-T598 PolarHBondContact OG-OG1 3.04Å
546	E	88.9	Confident	87.7	Confident	34 Å²	34	42.3 Å²	42.3	16%	0.159	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-45.8	176.2	-60.4	173.3	149.7	0	0	110.6	K533 R540 D543 Q549 M550	K533-E546 VanDerWaalsContact CE-CD 3.43Å; K533-E546 WeakPolarHBondContact CE-OE1 3.14Å; K533-E546 WeakPolarHBondContact CE-OE2 3.34Å; K533-E546 IonicContact NZ-OE1 3.78Å; K533-E546 PolarHBondContact NZ-OE1 2.91Å; K533-E546 IonicContact NZ-OE2 2.95Å; K533-E546 PolarHBondContact NZ-OE2 2.71Å; R540-E546 IonicContact CZ-OE1 3.29Å; R540-E546 IonicContact CZ-OE2 3.47Å; R540-E546 IonicContact NH1-OE1 2.73Å; R540-E546 IonicContact NH1-OE2 3.63Å; R540-E546 PolarHBondContact NH1-OE2 2.91Å; R540-E546 IonicContact NH2-OE1 3.51Å; R540-E546 PolarHBondContact NH2-OE1 2.87Å; R540-E546 IonicContact NH2-OE2 3.16Å; R540-E546 PolarHBondContact NH2-OE2 3.41Å; D543-E546 HydrophobicContact CB-CG 4.11Å; D543-E546 PolarHBondContact N-OE2 2.95Å; D543-E546 WeakPolarHBondContact O-CB 3.37Å; D543-E546 PolarHBondContact O-N 3.2Å; D543-E546 VanDerWaalsContact O-N 3.11Å; E546-Q549 PolarHBondContact O-N 2.73Å; E546-M550 HydrophobicContact CB-CE 4.34Å; E546-M550 VanDerWaalsContact O-CE 3.27Å; E546-M550 WeakPolarHBondContact O-CE 3.48Å; E546-M550 PolarHBondContact O-N 3.27Å; E546-M550 VanDerWaalsContact O-N 3.14Å
547	F	92.4	Very high	88.4	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.009	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-49.7	175.6	-176.2	-91.5	0	0	0	111.3	H343 F528 L531 L542 D543 Q549 M550 A551 V565 M592 I593	H343-F547 AromaticContact CD2-CE1 3.84Å; H343-F547 AromaticContact CD2-CZ 3.85Å; H343-F547 AromaticContact NE2-CE1 3.71Å; F528-F547 HydrophobicContact CD1-CE2 4.44Å; F528-F547 AromaticContact CD2-CE2 3.75Å; F528-F547 HydrophobicContact CD2-CE2 3.75Å; F528-F547 HydrophobicContact CD2-CZ 4.33Å; F528-F547 AromaticContact CE1-CD2 3.96Å; F528-F547 HydrophobicContact CE1-CD2 3.96Å; F528-F547 HydrophobicContact CE1-CE2 4.13Å; F528-F547 AromaticContact CE2-CD2 3.94Å; F528-F547 HydrophobicContact CE2-CD2 3.94Å; F528-F547 AromaticContact CE2-CE2 3.37Å; F528-F547 HydrophobicContact CE2-CE2 3.37Å; F528-F547 AromaticContact CE2-CZ 3.81Å; F528-F547 HydrophobicContact CE2-CZ 3.81Å; F528-F547 HydrophobicContact CG-CE2 4.26Å; F528-F547 AromaticContact CZ-CD2 3.62Å; F528-F547 HydrophobicContact CZ-CD2 3.62Å; F528-F547 AromaticContact CZ-CE2 3.58Å; F528-F547 HydrophobicContact CZ-CE2 3.58Å; F528-F547 HydrophobicContact CZ-CG 4.36Å; F528-F547 HydrophobicContact CZ-CZ 4.28Å; L531-F547 HydrophobicContact CD2-CE2 4.38Å; L542-F547 HydrophobicContact CD1-CD2 4.45Å; D543-F547 PolarHBondContact O-N 3.39Å; F547-Q549 VanDerWaalsContact C-N 3.33Å; F547-Q549 PolarHBondContact O-N 3.02Å; F547-M550 PolarHBondContact O-N 3.1Å; F547-A551 HydrophobicContact CD1-CB 4.28Å; F547-A551 HydrophobicContact CE1-CB 3.99Å; F547-A551 HydrophobicContact CZ-CB 4.43Å; F547-A551 WeakPolarHBondContact O-CB 3.48Å; F547-A551 PolarHBondContact O-N 3.19Å; F547-V565 HydrophobicContact CZ-CG1 4.07Å; F547-M592 HydrophobicContact CB-CG 3.91Å; F547-M592 HydrophobicContact CD2-CG 3.96Å; F547-M592 HydrophobicContact CD2-SD 3.85Å; F547-M592 HydrophobicContact CE2-SD 4.4Å; F547-M592 HydrophobicContact CG-CG 3.9Å; F547-M592 HydrophobicContact CG-SD 4.4Å; F547-I593 HydrophobicContact CD1-CG1 4.38Å; F547-I593 HydrophobicContact CE1-CB 4.26Å; F547-I593 HydrophobicContact CE1-CG1 3.73Å; F547-I593 HydrophobicContact CE1-CG2 4.22Å; F547-I593 HydrophobicContact CZ-CD1 4.49Å; F547-I593 HydrophobicContact CZ-CG1 3.86Å
548	T	90	Very high	88.9	Confident	34 Å²	34	41.2 Å²	41.2	21%	0.209	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-39.3	180	-58.9	0	0	0	0	111.9	P544 S545 G552	P544-T548 VanDerWaalsContact O-CB 3.26Å; P544-T548 WeakPolarHBondContact O-CB 3.47Å; P544-T548 PolarHBondContact O-N 2.88Å; P544-T548 PolarHBondContact O-OG1 2.74Å; S545-T548 PolarHBondContact O-N 3.5Å; T548-G552 WeakPolarHBondContact O-CA 3.43Å; T548-G552 PolarHBondContact O-N 2.89Å
549	Q	88	Confident	89	Confident	36 Å²	36	38.7 Å²	38.7	17%	0.168	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-41.3	178.6	-166.6	-179	31.7	0	0	112.1	H280 S545 E546 F547	H280-Q549 PolarHBondContact NE2-NE2 3.07Å; S545-Q549 WeakPolarHBondContact O-CB 3.34Å; S545-Q549 PolarHBondContact O-N 3.43Å; E546-Q549 PolarHBondContact O-N 2.73Å; F547-Q549 VanDerWaalsContact C-N 3.33Å; F547-Q549 PolarHBondContact O-N 3.02Å
550	M	91.4	Very high	89.3	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-70.9	-49.2	176	-75.3	-174.6	-78.9	0	0	112.1	F422 F424 E513 S516 F528 L542 E546 F547 G552 R553	F422-M550 HydrophobicContact CB-SD 4.25Å; F422-M550 HydrophobicContact CD1-CG 4.35Å; F422-M550 HydrophobicContact CD1-SD 3.96Å; F422-M550 HydrophobicContact CD2-CB 3.96Å; F422-M550 HydrophobicContact CD2-CG 4.19Å; F422-M550 HydrophobicContact CD2-SD 4.12Å; F422-M550 HydrophobicContact CE1-CG 4.14Å; F422-M550 HydrophobicContact CE1-SD 4.33Å; F422-M550 HydrophobicContact CE2-CB 3.67Å; F422-M550 HydrophobicContact CE2-CG 3.97Å; F422-M550 HydrophobicContact CE2-SD 4.48Å; F422-M550 HydrophobicContact CG-CG 4.38Å; F422-M550 HydrophobicContact CG-SD 3.85Å; F422-M550 HydrophobicContact CZ-CB 4.09Å; F422-M550 HydrophobicContact CZ-CG 3.95Å; F424-M550 HydrophobicContact CE1-CE 3.87Å; F424-M550 HydrophobicContact CE1-SD 3.68Å; F424-M550 HydrophobicContact CZ-CE 3.93Å; F424-M550 HydrophobicContact CZ-SD 4.03Å; E513-M550 HydrophobicContact CB-SD 4.16Å; S516-M550 WeakPolarHBondContact OG-CG 3.48Å; F528-M550 HydrophobicContact CE1-CB 3.86Å; F528-M550 HydrophobicContact CE1-CE 3.79Å; F528-M550 HydrophobicContact CE1-SD 3.87Å; F528-M550 HydrophobicContact CZ-CB 3.65Å; L542-M550 HydrophobicContact CD1-CE 3.76Å; L542-M550 HydrophobicContact CD2-CE 3.89Å; L542-M550 HydrophobicContact CG-CE 4.37Å; E546-M550 HydrophobicContact CB-CE 4.34Å; E546-M550 VanDerWaalsContact O-CE 3.27Å; E546-M550 WeakPolarHBondContact O-CE 3.48Å; E546-M550 PolarHBondContact O-N 3.27Å; E546-M550 VanDerWaalsContact O-N 3.14Å; F547-M550 PolarHBondContact O-N 3.1Å; M550-G552 VanDerWaalsContact C-N 3.27Å; M550-G552 PolarHBondContact O-N 3.28Å; M550-R553 WeakPolarHBondContact O-CB 3.24Å; M550-R553 WeakPolarHBondContact O-CG 3.1Å; M550-R553 PolarHBondContact O-N 3.03Å
551	A	92.4	Very high	89.3	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-35	177.9	0	0	0	0	0	112	L341 F528 F547 R553 A554 V565	L341-A551 HydrophobicContact CD1-CB 4.29Å; F528-A551 HydrophobicContact CE2-CB 4.28Å; F528-A551 HydrophobicContact CZ-CB 4.4Å; F547-A551 HydrophobicContact CD1-CB 4.28Å; F547-A551 HydrophobicContact CE1-CB 3.99Å; F547-A551 HydrophobicContact CZ-CB 4.43Å; F547-A551 WeakPolarHBondContact O-CB 3.48Å; F547-A551 PolarHBondContact O-N 3.19Å; A551-R553 PolarHBondContact O-N 2.63Å; A551-A554 WeakPolarHBondContact O-CB 3.49Å; A551-A554 PolarHBondContact O-N 2.76Å; A551-V565 HydrophobicContact CB-CG1 4.38Å; A551-V565 HydrophobicContact CB-CG2 3.92Å
552	G	88.6	Confident	89.2	Confident	4 Å²	4	36.8 Å²	36.8	4%	0.041	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-6.3	177.4	0	0	0	0	0	114.9	T187 R337 T548 M550	T187-G552 WeakPolarHBondContact OG1-CA 3.41Å; T187-G552 PolarHBondContact OG1-O 2.9Å; R337-G552 PolarHBondContact NH2-O 3.12Å; T548-G552 WeakPolarHBondContact O-CA 3.43Å; T548-G552 PolarHBondContact O-N 2.89Å; M550-G552 VanDerWaalsContact C-N 3.27Å; M550-G552 PolarHBondContact O-N 3.28Å
553	R	89.7	Confident	89.3	Confident	15 Å²	15	36.5 Å²	36.5	6%	0.057	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-15.5	169.3	-57.1	-62.3	176.1	165.5	2.6	113.4	I420 S516 V519 A523 V526 M550 A551	I420-R553 HydrophobicContact CD1-CB 4.5Å; S516-R553 PolarHBondContact O-NH2 3.34Å; V519-R553 PolarHBondContact O-NH1 3.22Å; V519-R553 PolarHBondContact O-NH2 2.88Å; A523-R553 PolarHBondContact N-O 3.27Å; V526-R553 HydrophobicContact CG2-CB 3.98Å; M550-R553 WeakPolarHBondContact O-CB 3.24Å; M550-R553 WeakPolarHBondContact O-CG 3.1Å; M550-R553 PolarHBondContact O-N 3.03Å; A551-R553 PolarHBondContact O-N 2.63Å
554	A	91.8	Very high	89.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-81.2	135.6	178.2	0	0	0	0	0	112.5	R337 L341 A523 V526 A551 V565	R337-A554 PolarHBondContact NH1-O 3.35Å; R337-A554 PolarHBondContact NH2-O 2.9Å; L341-A554 HydrophobicContact CD2-CB 3.82Å; L341-A554 WeakPolarHBondContact CD2-O 3.31Å; A523-A554 CarbonylContact O-C 3.59Å; A523-A554 VanDerWaalsContact O-CA 3.29Å; A523-A554 WeakPolarHBondContact O-CA 3.4Å; V526-A554 HydrophobicContact CB-CB 4.01Å; V526-A554 HydrophobicContact CG2-CB 3.69Å; A551-A554 WeakPolarHBondContact O-CB 3.49Å; A551-A554 PolarHBondContact O-N 2.76Å; A554-V565 HydrophobicContact CB-CG2 4.21Å
555	G	89.6	Confident	89.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	86.9	107.5	-178	0	0	0	0	0	112.2	A523	A523-G555 PolarHBondContact O-N 2.91Å
556	R	87.7	Confident	90.1	Very high	53 Å²	53	31.6 Å²	31.6	20%	0.2	19%	0.185	C	C	.	.			trans	-86.4	120	177	-63.8	166.4	-64.9	171	5.3	109.8	P522 G558 I559 D560	P522-R556 HydrophobicContact CB-CG 3.87Å; P522-R556 HydrophobicContact CG-CG 4.18Å; R556-G558 PolarHBondContact O-N 3.26Å; R556-I559 HydrophobicContact CB-CB 4.06Å; R556-I559 HydrophobicContact CB-CD1 4.18Å; R556-I559 HydrophobicContact CB-CG1 4.45Å; R556-I559 PolarHBondContact O-N 2.96Å; R556-I559 VanDerWaalsContact O-N 3.07Å; R556-D560 VanDerWaalsContact CB-OD2 3.28Å; R556-D560 WeakPolarHBondContact CB-OD2 3.34Å; R556-D560 WeakPolarHBondContact CG-OD2 3.48Å; R556-D560 IonicContact CZ-OD1 3.8Å; R556-D560 IonicContact CZ-OD2 3.67Å; R556-D560 PolarHBondContact N-OD2 2.94Å; R556-D560 IonicContact NE-OD1 3.13Å; R556-D560 IonicContact NE-OD2 2.82Å; R556-D560 PolarHBondContact NE-OD2 2.85Å; R556-D560 IonicContact NH2-OD1 3.77Å; R556-D560 PolarHBondContact NH2-OD1 3.37Å; R556-D560 IonicContact NH2-OD2 3.19Å; R556-D560 PolarHBondContact O-N 3.5Å
557	R	84.4	Confident	90.4	Very high	88 Å²	88	30 Å²	30	33%	0.332	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	129.4	178.4	-173.7	176.6	175.7	148.2	9.1	110.1	D165 S189 V339 I559	D165-R557 IonicContact OD1-CZ 3.62Å; D165-R557 IonicContact OD1-NH2 3.41Å; D165-R557 PolarHBondContact OD1-NH2 2.91Å; D165-R557 IonicContact OD2-CZ 2.79Å; D165-R557 VanDerWaalsContact OD2-CZ 3.29Å; D165-R557 IonicContact OD2-NH1 2.65Å; D165-R557 PolarHBondContact OD2-NH1 3.38Å; D165-R557 IonicContact OD2-NH2 2.75Å; D165-R557 PolarHBondContact OD2-NH2 2.88Å; S189-R557 PolarHBondContact O-NH1 2.94Å; V339-R557 HydrophobicContact CG2-CB 4.37Å; R557-I559 VanDerWaalsContact C-N 3.28Å; R557-I559 PolarHBondContact O-N 2.97Å
558	G	82.6	Confident	90.2	Very high	83 Å²	83	30 Å²	30	86%	0.856	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.3	-8.8	-179.2	0	0	0	0	0	115.6	R556	R556-G558 PolarHBondContact O-N 3.26Å
559	I	86	Confident	89.9	Confident	117 Å²	117	28.4 Å²	28.4	60%	0.6	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.3	-49.6	-179.2	-55.4	173.8	0	0	0	110.8	R556 R557	R556-I559 HydrophobicContact CB-CB 4.06Å; R556-I559 HydrophobicContact CB-CD1 4.18Å; R556-I559 HydrophobicContact CB-CG1 4.45Å; R556-I559 PolarHBondContact O-N 2.96Å; R556-I559 VanDerWaalsContact O-N 3.07Å; R557-I559 VanDerWaalsContact C-N 3.28Å; R557-I559 PolarHBondContact O-N 2.97Å
560	D	90.3	Very high	89.2	Confident	12 Å²	12	27.3 Å²	27.3	6%	0.064	16%	0.164	C	C	.	.			trans	-101.9	129	-176.1	-54.6	-46.7	0	0	0	110.2	R524 R556 K562	R524-D560 WeakPolarHBondContact CD-OD1 3.49Å; R524-D560 IonicContact NE-OD1 2.76Å; R556-D560 VanDerWaalsContact CB-OD2 3.28Å; R556-D560 WeakPolarHBondContact CB-OD2 3.34Å; R556-D560 WeakPolarHBondContact CG-OD2 3.48Å; R556-D560 IonicContact CZ-OD1 3.8Å; R556-D560 IonicContact CZ-OD2 3.67Å; R556-D560 PolarHBondContact N-OD2 2.94Å; R556-D560 IonicContact NE-OD1 3.13Å; R556-D560 IonicContact NE-OD2 2.82Å; R556-D560 PolarHBondContact NE-OD2 2.85Å; R556-D560 IonicContact NH2-OD1 3.77Å; R556-D560 PolarHBondContact NH2-OD1 3.37Å; R556-D560 IonicContact NH2-OD2 3.19Å; R556-D560 PolarHBondContact O-N 3.5Å; D560-K562 VanDerWaalsContact C-N 3.28Å; D560-K562 PolarHBondContact O-N 2.87Å
561	A	89.9	Confident	88.3	Confident	95 Å²	95	28.5 Å²	28.5	79%	0.785	17%	0.172	S	C	*	.	S	Bend	trans	-68.5	-29.1	175.2	0	0	0	0	0	112.7
562	K	91.1	Very high	87.4	Confident	80 Å²	80	28.5 Å²	28.5	35%	0.348	17%	0.171	S	C	.	.	S	Bend	trans	-147.8	146.8	177.6	55	172.7	175.1	176.9	0	110.6	E342 D560 L564	E342-K562 HydrophobicContact CG-CD 4.27Å; E342-K562 WeakPolarHBondContact OE1-CD 3.38Å; E342-K562 IonicContact OE1-NZ 3.9Å; E342-K562 PolarHBondContact OE1-NZ 3.24Å; E342-K562 WeakPolarHBondContact OE2-CD 3.35Å; E342-K562 WeakPolarHBondContact OE2-CE 2.88Å; E342-K562 IonicContact OE2-NZ 2.86Å; E342-K562 PolarHBondContact OE2-NZ 3.34Å; D560-K562 VanDerWaalsContact C-N 3.28Å; D560-K562 PolarHBondContact O-N 2.87Å; K562-L564 HydrophobicContact CD-CD1 4.46Å; K562-L564 HydrophobicContact CG-CD1 4.2Å
563	G	93	Very high	86.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	135.2	171.1	0	0	0	0	0	110.7	P340 L341 E342	P340-G563 PolarHBondContact O-N 3.5Å; L341-G563 WeakPolarHBondContact CA-O 3.42Å; E342-G563 PolarHBondContact N-O 2.93Å
564	L	94.8	Very high	85.5	Confident	9 Å²	9	37.4 Å²	37.4	5%	0.047	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	130	179.2	-76.7	81.9	0	0	0	110.8	Y344 L416 R524 C525 V526 K562	Y344-L564 HydrophobicContact CE2-CD2 4.07Å; Y344-L564 HydrophobicContact CE2-CG 4.25Å; L416-L564 HydrophobicContact CD1-CD2 3.91Å; L416-L564 HydrophobicContact CD2-CD1 4Å; L416-L564 HydrophobicContact CD2-CD2 3.68Å; L416-L564 HydrophobicContact CD2-CG 4.39Å; L416-L564 HydrophobicContact CG-CD2 4.45Å; R524-L564 PolarHBondContact O-N 3.49Å; C525-L564 CarbonylContact C-O 3.57Å; C525-L564 VanDerWaalsContact CA-O 3.27Å; C525-L564 WeakPolarHBondContact CA-O 3.43Å; C525-L564 HydrophobicContact CB-CB 4.48Å; V526-L564 PolarHBondContact N-O 3.12Å; K562-L564 HydrophobicContact CD-CD1 4.46Å; K562-L564 HydrophobicContact CG-CD1 4.2Å
565	V	95.8	Very high	84.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	120.1	173.1	-177.8	0	0	0	0	108.5	L341 E342 H343 Y344 V526 F528 F547 A551 A554	L341-V565 HydrophobicContact CD1-CG2 4.4Å; L341-V565 HydrophobicContact CD2-CG2 4.14Å; E342-V565 PolarHBondContact O-N 3.45Å; H343-V565 CarbonylContact C-O 3.55Å; H343-V565 WeakPolarHBondContact CA-O 3.26Å; Y344-V565 PolarHBondContact N-O 3.04Å; V526-V565 CarbonylContact O-C 3.58Å; V526-V565 WeakPolarHBondContact O-CA 3.36Å; F528-V565 HydrophobicContact CD2-CG1 3.78Å; F528-V565 HydrophobicContact CE2-CG1 3.59Å; F547-V565 HydrophobicContact CZ-CG1 4.07Å; A551-V565 HydrophobicContact CB-CG1 4.38Å; A551-V565 HydrophobicContact CB-CG2 3.92Å; A554-V565 HydrophobicContact CB-CG2 4.21Å
566	I	94.7	Very high	84.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	129.1	-176.8	-55.5	178.7	0	0	0	109.8	Y344 L357 F407 V526 V527 F528	Y344-I566 WeakPolarHBondContact O-CA 3.14Å; L357-I566 HydrophobicContact CD1-CD1 4.08Å; L357-I566 HydrophobicContact CD1-CG1 4.27Å; L357-I566 HydrophobicContact CD1-CG2 3.97Å; F407-I566 HydrophobicContact CE2-CB 4.49Å; F407-I566 HydrophobicContact CE2-CD1 3.86Å; F407-I566 HydrophobicContact CE2-CG2 3.87Å; F407-I566 HydrophobicContact CZ-CB 4.38Å; F407-I566 HydrophobicContact CZ-CD1 3.95Å; F407-I566 HydrophobicContact CZ-CG2 4.16Å; V526-I566 PolarHBondContact O-N 3.46Å; V527-I566 CarbonylContact C-O 3.58Å; V527-I566 VanDerWaalsContact CA-O 3.26Å; V527-I566 WeakPolarHBondContact CA-O 3.48Å; F528-I566 PolarHBondContact N-O 2.98Å
567	I	93.5	Very high	83.5	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	120.5	175.7	-56.5	172.1	0	0	0	108.6	Y344 L345 Y346 F528 L531 V569 I572 L589 I593	Y344-I567 PolarHBondContact O-N 3.41Å; L345-I567 HydrophobicContact CD2-CB 3.92Å; L345-I567 HydrophobicContact CD2-CD1 4.17Å; L345-I567 HydrophobicContact CD2-CG2 4.28Å; Y346-I567 PolarHBondContact N-O 2.91Å; F528-I567 HydrophobicContact CB-CG1 4.34Å; F528-I567 HydrophobicContact CD2-CG1 4.46Å; L531-I567 HydrophobicContact CD1-CD1 4.36Å; L531-I567 HydrophobicContact CD1-CG2 3.89Å; L531-I567 HydrophobicContact CD2-CD1 4.42Å; L531-I567 HydrophobicContact CD2-CG2 4.2Å; L531-I567 HydrophobicContact CG-CG2 4.09Å; I567-V569 PolarHBondContact O-N 2.96Å; I567-I572 HydrophobicContact CG2-CD1 3.59Å; I567-I572 HydrophobicContact CG2-CG1 3.98Å; I567-L589 HydrophobicContact CD1-CD2 4.24Å; I567-I593 HydrophobicContact CD1-CD1 4.47Å
568	L	89.5	Confident	82.9	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	103.5	179.6	-62.3	-179.8	0	0	0	110.9	Y346 W404 F407 V527 F528 T529 S570 T571 I572	Y346-L568 HydrophobicContact CD1-CD2 3.56Å; Y346-L568 HydrophobicContact CE1-CD2 4.4Å; Y346-L568 HydrophobicContact CG-CD2 4.08Å; W404-L568 HydrophobicContact CD2-CD1 4.44Å; W404-L568 HydrophobicContact CH2-CD1 3.62Å; W404-L568 HydrophobicContact CZ2-CD1 3.32Å; W404-L568 HydrophobicContact CZ3-CD1 4.31Å; F407-L568 HydrophobicContact CD1-CD2 4.32Å; F407-L568 HydrophobicContact CD2-CD2 3.96Å; F407-L568 HydrophobicContact CE1-CD2 4.37Å; F407-L568 HydrophobicContact CE2-CD2 4.04Å; F407-L568 HydrophobicContact CG-CD2 4.11Å; F407-L568 HydrophobicContact CZ-CD2 4.24Å; V527-L568 HydrophobicContact CG1-CD1 3.79Å; V527-L568 HydrophobicContact CG1-CD2 4.18Å; V527-L568 HydrophobicContact CG1-CG 3.71Å; F528-L568 PolarHBondContact O-N 3.38Å; T529-L568 HydrophobicContact CG2-CD1 4.47Å; L568-S570 VanDerWaalsContact C-N 3.29Å; L568-S570 PolarHBondContact O-N 3.19Å; L568-T571 PolarHBondContact O-N 2.93Å; L568-T571 PolarHBondContact O-OG1 2.86Å; L568-I572 WeakPolarHBondContact O-CG1 3.13Å; L568-I572 PolarHBondContact O-N 3.31Å
569	V	82.7	Confident	82.1	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-61.4	-35.1	-173.6	172.2	0	0	0	0	113.5	L345 Y346 T347 I567 T571 I572 K577 L583	L345-V569 HydrophobicContact CB-CG2 4.17Å; L345-V569 HydrophobicContact CD2-CG2 4.4Å; Y346-V569 WeakPolarHBondContact O-CB 3.12Å; Y346-V569 WeakPolarHBondContact O-CG2 3.1Å; Y346-V569 PolarHBondContact O-N 3.26Å; T347-V569 HydrophobicContact CG2-CG2 4.13Å; I567-V569 PolarHBondContact O-N 2.96Å; V569-T571 PolarHBondContact O-N 3.48Å; V569-I572 HydrophobicContact CB-CD1 4.37Å; V569-I572 HydrophobicContact CG2-CD1 4.23Å; V569-K577 VanDerWaalsContact O-CE 3.28Å; V569-K577 WeakPolarHBondContact O-CE 3.34Å; V569-K577 PolarHBondContact O-NZ 3.5Å; V569-K577 VanDerWaalsContact O-NZ 3.17Å; V569-L583 HydrophobicContact CB-CD2 4.06Å; V569-L583 HydrophobicContact CG1-CD2 3.41Å; V569-L583 VanDerWaalsContact CG1-CD2 3.41Å; V569-L583 HydrophobicContact CG1-CG 4.42Å; V569-L583 HydrophobicContact CG2-CD2 3.42Å; V569-L583 VanDerWaalsContact CG2-CD2 3.42Å
570	S	73.9	Confident	81.2	Confident	12 Å²	12	40.6 Å²	40.6	8%	0.084	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-60.2	-34.8	-177.6	60.7	0	0	0	0	112.4	M349 L568 K577	M349-S570 WeakPolarHBondContact SD-CB 3.38Å; L568-S570 VanDerWaalsContact C-N 3.29Å; L568-S570 PolarHBondContact O-N 3.19Å; S570-K577 PolarHBondContact O-NZ 2.81Å
571	T	72.9	Confident	80.2	Confident	27 Å²	27	41.2 Å²	41.2	17%	0.166	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-112.1	3.9	-170.3	54.8	0	0	0	0	115.6	T400 T529 L568 V569 G573	T400-T571 HydrophobicContact CG2-CG2 4.19Å; T529-T571 CarbonylContact O-C 3.54Å; T529-T571 VanDerWaalsContact O-CB 3.22Å; T529-T571 WeakPolarHBondContact O-CB 3.46Å; T529-T571 PolarHBondContact O-OG1 3.3Å; L568-T571 PolarHBondContact O-N 2.93Å; L568-T571 PolarHBondContact O-OG1 2.86Å; V569-T571 PolarHBondContact O-N 3.48Å; T571-G573 PolarHBondContact O-N 3.2Å
572	I	73.2	Confident	79.5	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.213	C	C	.	.	S	Bend	trans	-51.3	-30.9	-172	-64.3	-176.4	0	0	0	115	S530 L531 I567 L568 V569 L576 P584	S530-I572 PolarHBondContact OG-O 2.99Å; L531-I572 HydrophobicContact CB-CG2 3.84Å; L531-I572 HydrophobicContact CD1-CD1 4.31Å; L531-I572 HydrophobicContact CD1-CG2 3.89Å; L531-I572 HydrophobicContact CG-CG2 3.85Å; L531-I572 PolarHBondContact N-O 3.48Å; L531-I572 VanDerWaalsContact N-O 3.12Å; I567-I572 HydrophobicContact CG2-CD1 3.59Å; I567-I572 HydrophobicContact CG2-CG1 3.98Å; L568-I572 WeakPolarHBondContact O-CG1 3.13Å; L568-I572 PolarHBondContact O-N 3.31Å; V569-I572 HydrophobicContact CB-CD1 4.37Å; V569-I572 HydrophobicContact CG2-CD1 4.23Å; I572-L576 HydrophobicContact CG2-CB 4.39Å; I572-L576 HydrophobicContact CG2-CD1 4.29Å; I572-P584 HydrophobicContact CD1-CG 3.44Å; I572-P584 VanDerWaalsContact CD1-CG 3.44Å; I572-P584 HydrophobicContact CG2-CG 3.98Å
573	G	69.3	Low	79	Confident	11 Å²	11	33.6 Å²	33.6	11%	0.113	20%	0.197	C	C	.	.			trans	126.4	142.6	-171.2	0	0	0	0	0	111.5	E532 T571 K577	E532-G573 WeakPolarHBondContact OE1-CA 3.29Å; T571-G573 PolarHBondContact O-N 3.2Å; G573-K577 WeakPolarHBondContact O-CG 3.4Å
574	K	69.1	Low	78.5	Confident	195 Å²	195	33.6 Å²	33.6	85%	0.848	20%	0.197	S	C	*	.	S	Bend	trans	-72.8	-30.7	-177.9	-70.7	-176.8	-178.5	178.3	0	112.2	L576	K574-L576 VanDerWaalsContact C-N 3.33Å; K574-L576 PolarHBondContact O-N 3.42Å
575	S	73.6	Confident	78.1	Confident	82 Å²	82	36 Å²	36	57%	0.573	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-29.9	-174.8	70.6	0	0	0	0	113.3	E532	E532-S575 WeakPolarHBondContact OE2-CB 3.23Å; E532-S575 PolarHBondContact OE2-OG 2.98Å
576	L	78.1	Confident	77.7	Confident	24 Å²	24	39.2 Å²	39.2	13%	0.126	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-11.8	-174.5	-59	-179.3	0	0	0	113.3	L531 E532 P541 I572 K574 S578 P584 L588	L531-L576 HydrophobicContact CB-CD1 3.89Å; E532-L576 HydrophobicContact CB-CD1 3.95Å; E532-L576 HydrophobicContact CB-CG 4.4Å; P541-L576 HydrophobicContact CB-CD1 4.39Å; P541-L576 HydrophobicContact CB-CD2 4.24Å; I572-L576 HydrophobicContact CG2-CB 4.39Å; I572-L576 HydrophobicContact CG2-CD1 4.29Å; K574-L576 VanDerWaalsContact C-N 3.33Å; K574-L576 PolarHBondContact O-N 3.42Å; L576-S578 PolarHBondContact O-N 2.91Å; L576-P584 WeakPolarHBondContact O-CA 3.2Å; L576-L588 HydrophobicContact CB-CD2 4.23Å; L576-L588 HydrophobicContact CD1-CD2 4.28Å; L576-L588 HydrophobicContact CD2-CD2 3.83Å; L576-L588 HydrophobicContact CG-CD2 4.33Å
577	K	74.6	Confident	77.4	Confident	67 Å²	67	42.6 Å²	42.6	29%	0.291	25%	0.251	S	S	.	.	B	Isolated β-bridge	trans	-76	123.6	-179.5	-71.4	-178.2	-172.6	-167.5	0	109.9	V569 S570 G573 S579 G582	V569-K577 VanDerWaalsContact O-CE 3.28Å; V569-K577 WeakPolarHBondContact O-CE 3.34Å; V569-K577 PolarHBondContact O-NZ 3.5Å; V569-K577 VanDerWaalsContact O-NZ 3.17Å; S570-K577 PolarHBondContact O-NZ 2.81Å; G573-K577 WeakPolarHBondContact O-CG 3.4Å; K577-S579 PolarHBondContact O-N 2.77Å; K577-G582 WeakPolarHBondContact CG-O 3.44Å
578	S	73.3	Confident	77.2	Confident	32 Å²	32	44.2 Å²	44.2	22%	0.224	26%	0.259	C	S	.	.			trans	-59.9	134.1	167.7	174.3	0	0	0	0	109.8	L576 V580 T581 G582 L583	L576-S578 PolarHBondContact O-N 2.91Å; S578-V580 PolarHBondContact O-N 2.86Å; S578-V580 VanDerWaalsContact O-N 3.15Å; S578-V580 PolarHBondContact OG-N 3.41Å; S578-T581 WeakPolarHBondContact CB-OG1 3.45Å; S578-G582 WeakPolarHBondContact O-CA 3.31Å; S578-G582 PolarHBondContact O-N 2.86Å; S578-L583 WeakPolarHBondContact CB-O 3.41Å; S578-L583 PolarHBondContact N-O 2.92Å
579	S	66	Low	77.3	Confident	105 Å²	105	44.1 Å²	44.1	73%	0.734	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.2	175.2	54.3	0	0	0	0	112.7	R383 K577	R383-S579 PolarHBondContact NH2-O 3.49Å; K577-S579 PolarHBondContact O-N 2.77Å
580	V	66.5	Low	77.8	Confident	97 Å²	97	47.7 Å²	47.7	59%	0.588	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-62.6	-178.7	-176.1	0	0	0	0	110.7	N380 R383 S578	N380-V580 PolarHBondContact OD1-O 3.43Å; N380-V580 VanDerWaalsContact OD1-O 3.05Å; R383-V580 PolarHBondContact NH2-O 2.96Å; R383-V580 VanDerWaalsContact NH2-O 3.16Å; S578-V580 PolarHBondContact O-N 2.86Å; S578-V580 VanDerWaalsContact O-N 3.15Å; S578-V580 PolarHBondContact OG-N 3.41Å
581	T	69.8	Low	78.7	Confident	25 Å²	25	52.2 Å²	52.2	15%	0.153	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-14.9	-169.9	58.7	0	0	0	0	114.2	A376 N379 N380 S578 L583	A376-T581 HydrophobicContact CB-CG2 4.09Å; N379-T581 PolarHBondContact ND2-O 3.38Å; N380-T581 WeakPolarHBondContact OD1-CA 3.35Å; N380-T581 PolarHBondContact OD1-O 2.97Å; S578-T581 WeakPolarHBondContact CB-OG1 3.45Å; T581-L583 PolarHBondContact O-N 2.84Å; T581-L583 VanDerWaalsContact O-N 3.14Å; T581-L583 PolarHBondContact OG1-N 3.36Å
582	G	73.7	Confident	79.6	Confident	16 Å²	16	51.1 Å²	51.1	17%	0.165	29%	0.288	C	S	.	.	S	Bend	trans	64.9	8.5	-169.9	0	0	0	0	0	114.2	N379 K577 S578	N379-G582 WeakPolarHBondContact ND2-CA 3.47Å; N379-G582 PolarHBondContact ND2-O 3.11Å; K577-G582 WeakPolarHBondContact CG-O 3.44Å; S578-G582 WeakPolarHBondContact O-CA 3.31Å; S578-G582 PolarHBondContact O-N 2.86Å
583	L	80.6	Confident	80.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	-107.4	161	176.3	-71.9	168.8	0	0	0	110.4	L345 Y372 A375 A376 V569 S578 T581	L345-L583 HydrophobicContact CD1-CD2 4.25Å; Y372-L583 HydrophobicContact CE2-CB 4.43Å; Y372-L583 HydrophobicContact CE2-CD1 4.31Å; A375-L583 HydrophobicContact CB-CD1 4.08Å; A376-L583 HydrophobicContact CB-CD1 3.7Å; V569-L583 HydrophobicContact CB-CD2 4.06Å; V569-L583 HydrophobicContact CG1-CD2 3.41Å; V569-L583 VanDerWaalsContact CG1-CD2 3.41Å; V569-L583 HydrophobicContact CG1-CG 4.42Å; V569-L583 HydrophobicContact CG2-CD2 3.42Å; V569-L583 VanDerWaalsContact CG2-CD2 3.42Å; S578-L583 WeakPolarHBondContact CB-O 3.41Å; S578-L583 PolarHBondContact N-O 2.92Å; T581-L583 PolarHBondContact O-N 2.84Å; T581-L583 VanDerWaalsContact O-N 3.14Å; T581-L583 PolarHBondContact OG1-N 3.36Å
584	P	83.6	Confident	81.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-56.1	144.9	163.1	-21.4	35.2	0	0	0	110.4	Y372 L531 I572 L576 L588 L589	Y372-P584 WeakPolarHBondContact CE2-O 3.4Å; Y372-P584 PolarHBondContact OH-O 3.37Å; L531-P584 HydrophobicContact CD1-CG 4.22Å; I572-P584 HydrophobicContact CD1-CG 3.44Å; I572-P584 VanDerWaalsContact CD1-CG 3.44Å; I572-P584 HydrophobicContact CG2-CG 3.98Å; L576-P584 WeakPolarHBondContact O-CA 3.2Å; P584-L588 HydrophobicContact CB-CD2 4.26Å; P584-L589 HydrophobicContact CB-CD1 4.29Å; P584-L589 HydrophobicContact CB-CD2 3.98Å; P584-L589 HydrophobicContact CB-CG 3.93Å; P584-L589 HydrophobicContact CG-CD2 4.24Å
585	T	85.7	Confident	82.4	Confident	60 Å²	60	47 Å²	47	37%	0.368	28%	0.278	S	S	.	.			trans	-59.6	145.5	175.5	57.8	0	0	0	0	110.3	S587 L588 L589	T585-S587 PolarHBondContact O-N 2.87Å; T585-S587 PolarHBondContact OG1-OG 3.24Å; T585-L588 WeakPolarHBondContact O-CB 3.42Å; T585-L588 PolarHBondContact O-N 3.44Å; T585-L588 VanDerWaalsContact O-N 3.09Å; T585-L588 VanDerWaalsContact OG1-CB 3.25Å; T585-L588 WeakPolarHBondContact OG1-CB 3.16Å; T585-L588 PolarHBondContact OG1-N 2.79Å; T585-L589 PolarHBondContact O-N 2.78Å; T585-L589 VanDerWaalsContact O-N 3.13Å
586	E	87.4	Confident	83	Confident	67 Å²	67	51.5 Å²	51.5	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-57	-41.6	178.7	-168.5	-167.7	137.7	0	0	111.5	F367 Y372 L588 L589 R590	F367-E586 HydrophobicContact CE1-CG 3.71Å; F367-E586 HydrophobicContact CZ-CG 3.82Å; Y372-E586 HydrophobicContact CD1-CB 4.38Å; Y372-E586 HydrophobicContact CD1-CG 4.39Å; Y372-E586 HydrophobicContact CE1-CB 4.03Å; Y372-E586 HydrophobicContact CE2-CB 4.46Å; Y372-E586 PolarHBondContact OH-N 2.98Å; E586-L588 VanDerWaalsContact C-N 3.31Å; E586-L588 PolarHBondContact O-N 2.79Å; E586-L589 PolarHBondContact O-N 3.44Å; E586-R590 HydrophobicContact CG-CG 4.4Å; E586-R590 WeakPolarHBondContact O-CB 3.49Å; E586-R590 WeakPolarHBondContact O-CG 3.34Å; E586-R590 PolarHBondContact O-N 3.02Å; E586-R590 IonicContact OE1-CZ 2.96Å; E586-R590 IonicContact OE1-NE 3.11Å; E586-R590 PolarHBondContact OE1-NE 3.33Å; E586-R590 IonicContact OE1-NH2 2.82Å; E586-R590 PolarHBondContact OE1-NH2 2.98Å
587	S	88.9	Confident	83.3	Confident	71 Å²	71	52.4 Å²	52.4	50%	0.497	29%	0.286	S	S	.	.	H	α-helix	trans	-58.5	-39.8	175.9	56	0	0	0	0	112.9	T585 N591	T585-S587 PolarHBondContact O-N 2.87Å; T585-S587 PolarHBondContact OG1-OG 3.24Å; S587-N591 VanDerWaalsContact O-CB 3.24Å; S587-N591 WeakPolarHBondContact O-CB 3.21Å; S587-N591 PolarHBondContact O-N 2.94Å; S587-N591 PolarHBondContact O-ND2 2.75Å
588	L	90	Very high	83.9	Confident	34 Å²	34	51.9 Å²	51.9	18%	0.178	29%	0.288	C	S	.	.	H	α-helix	trans	-67.3	-44.6	177.5	179.4	67.8	0	0	0	111.1	P541 L576 P584 T585 E586 N591 M592	P541-L588 HydrophobicContact CB-CD1 3.93Å; P541-L588 HydrophobicContact CG-CD1 4.1Å; L576-L588 HydrophobicContact CB-CD2 4.23Å; L576-L588 HydrophobicContact CD1-CD2 4.28Å; L576-L588 HydrophobicContact CD2-CD2 3.83Å; L576-L588 HydrophobicContact CG-CD2 4.33Å; P584-L588 HydrophobicContact CB-CD2 4.26Å; T585-L588 WeakPolarHBondContact O-CB 3.42Å; T585-L588 PolarHBondContact O-N 3.44Å; T585-L588 VanDerWaalsContact O-N 3.09Å; T585-L588 VanDerWaalsContact OG1-CB 3.25Å; T585-L588 WeakPolarHBondContact OG1-CB 3.16Å; T585-L588 PolarHBondContact OG1-N 2.79Å; E586-L588 VanDerWaalsContact C-N 3.31Å; E586-L588 PolarHBondContact O-N 2.79Å; L588-N591 PolarHBondContact O-N 3.13Å; L588-M592 HydrophobicContact CD1-CE 4.44Å; L588-M592 HydrophobicContact CG-CE 4.49Å; L588-M592 VanDerWaalsContact O-CB 3.23Å; L588-M592 WeakPolarHBondContact O-CB 3.44Å; L588-M592 PolarHBondContact O-N 3.07Å
589	L	91.3	Very high	84.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-66	-43.8	178.1	-68.1	176.5	0	0	0	111.7	L345 I360 F367 Y372 L531 I567 P584 T585 E586 M592 I593	L345-L589 HydrophobicContact CD1-CD1 4.35Å; L345-L589 HydrophobicContact CD2-CD1 4.38Å; I360-L589 HydrophobicContact CD1-CD1 4.39Å; F367-L589 HydrophobicContact CE2-CB 4.26Å; Y372-L589 HydrophobicContact CD2-CD1 3.99Å; Y372-L589 HydrophobicContact CE2-CD1 3.76Å; L531-L589 HydrophobicContact CD1-CD2 3.95Å; I567-L589 HydrophobicContact CD1-CD2 4.24Å; P584-L589 HydrophobicContact CB-CD1 4.29Å; P584-L589 HydrophobicContact CB-CD2 3.98Å; P584-L589 HydrophobicContact CB-CG 3.93Å; P584-L589 HydrophobicContact CG-CD2 4.24Å; T585-L589 PolarHBondContact O-N 2.78Å; T585-L589 VanDerWaalsContact O-N 3.13Å; E586-L589 PolarHBondContact O-N 3.44Å; L589-M592 PolarHBondContact O-N 3.49Å; L589-I593 WeakPolarHBondContact O-CB 3.34Å; L589-I593 VanDerWaalsContact O-CG1 3.31Å; L589-I593 WeakPolarHBondContact O-CG1 3.47Å; L589-I593 PolarHBondContact O-N 3.36Å
590	R	92.7	Very high	85.7	Confident	76 Å²	76	49.5 Å²	49.5	29%	0.287	26%	0.262	S	S	.	.	H	α-helix	trans	-59.5	-47.5	175.4	-75.9	179.3	175	-92.2	6.3	111	F367 D369 E586 M592 L594 G595	F367-R590 HydrophobicContact CD1-CG 4.31Å; F367-R590 VanDerWaalsContact CD1-NH2 3.27Å; F367-R590 HydrophobicContact CD2-CG 3.67Å; F367-R590 HydrophobicContact CE1-CG 4.4Å; F367-R590 HydrophobicContact CE2-CG 3.8Å; F367-R590 HydrophobicContact CG-CG 3.93Å; F367-R590 HydrophobicContact CZ-CG 4.17Å; D369-R590 VanDerWaalsContact CG-NH2 3.3Å; D369-R590 IonicContact OD1-CZ 3.75Å; D369-R590 IonicContact OD1-NH2 3.39Å; D369-R590 PolarHBondContact OD1-NH2 3.48Å; D369-R590 IonicContact OD2-NH2 2.82Å; D369-R590 PolarHBondContact OD2-NH2 3.3Å; E586-R590 HydrophobicContact CG-CG 4.4Å; E586-R590 WeakPolarHBondContact O-CB 3.49Å; E586-R590 WeakPolarHBondContact O-CG 3.34Å; E586-R590 PolarHBondContact O-N 3.02Å; E586-R590 IonicContact OE1-CZ 2.96Å; E586-R590 IonicContact OE1-NE 3.11Å; E586-R590 PolarHBondContact OE1-NE 3.33Å; E586-R590 IonicContact OE1-NH2 2.82Å; E586-R590 PolarHBondContact OE1-NH2 2.98Å; R590-M592 PolarHBondContact O-N 2.87Å; R590-L594 CarbonylContact O-C 3.57Å; R590-L594 WeakPolarHBondContact O-CA 3.5Å; R590-L594 WeakPolarHBondContact O-CB 3.28Å; R590-L594 PolarHBondContact O-N 3.11Å; R590-G595 PolarHBondContact O-N 3.48Å
591	N	92.2	Very high	86.8	Confident	107 Å²	107	49.6 Å²	49.6	57%	0.572	26%	0.259	S	S	*	.	H	α-helix	trans	-66.6	-36.1	178.2	-70.3	-13.5	0	0	0	112.5	P544 S587 L588 G595	P544-N591 WeakPolarHBondContact CG-O 3.37Å; S587-N591 VanDerWaalsContact O-CB 3.24Å; S587-N591 WeakPolarHBondContact O-CB 3.21Å; S587-N591 PolarHBondContact O-N 2.94Å; S587-N591 PolarHBondContact O-ND2 2.75Å; L588-N591 PolarHBondContact O-N 3.13Å; N591-G595 WeakPolarHBondContact O-CA 3.36Å; N591-G595 PolarHBondContact O-N 2.85Å; N591-G595 VanDerWaalsContact O-N 3.09Å
592	M	92.4	Very high	87.8	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.02	26%	0.257	C	S	.	.	H	α-helix	trans	-74.4	-40.4	-179.6	-174.6	-179.7	-64.3	0	0	112.9	L531 P541 L542 P544 F547 L588 L589 R590	L531-M592 HydrophobicContact CB-CE 4.17Å; L531-M592 HydrophobicContact CB-SD 4.31Å; L531-M592 HydrophobicContact CD1-SD 4.25Å; L531-M592 HydrophobicContact CD2-SD 3.94Å; L531-M592 HydrophobicContact CG-SD 4.41Å; P541-M592 HydrophobicContact CB-CE 3.85Å; L542-M592 HydrophobicContact CB-CE 4.16Å; L542-M592 HydrophobicContact CB-SD 4.18Å; P544-M592 WeakPolarHBondContact CA-O 3.41Å; F547-M592 HydrophobicContact CB-CG 3.91Å; F547-M592 HydrophobicContact CD2-CG 3.96Å; F547-M592 HydrophobicContact CD2-SD 3.85Å; F547-M592 HydrophobicContact CE2-SD 4.4Å; F547-M592 HydrophobicContact CG-CG 3.9Å; F547-M592 HydrophobicContact CG-SD 4.4Å; L588-M592 HydrophobicContact CD1-CE 4.44Å; L588-M592 HydrophobicContact CG-CE 4.49Å; L588-M592 VanDerWaalsContact O-CB 3.23Å; L588-M592 WeakPolarHBondContact O-CB 3.44Å; L588-M592 PolarHBondContact O-N 3.07Å; L589-M592 PolarHBondContact O-N 3.49Å; R590-M592 PolarHBondContact O-N 2.87Å
593	I	92.3	Very high	88.5	Confident	17 Å²	17	53.6 Å²	53.6	9%	0.087	27%	0.269	C	S	.	.	H	α-helix	trans	-89	-43.4	-174.6	-58.2	170.6	0	0	0	111.8	H343 I360 V361 F547 I567 L589	H343-I593 HydrophobicContact CB-CD1 4.43Å; I360-I593 HydrophobicContact CD1-CD1 3.77Å; V361-I593 HydrophobicContact CG2-CD1 4.29Å; V361-I593 HydrophobicContact CG2-CG2 3.98Å; F547-I593 HydrophobicContact CD1-CG1 4.38Å; F547-I593 HydrophobicContact CE1-CB 4.26Å; F547-I593 HydrophobicContact CE1-CG1 3.73Å; F547-I593 HydrophobicContact CE1-CG2 4.22Å; F547-I593 HydrophobicContact CZ-CD1 4.49Å; F547-I593 HydrophobicContact CZ-CG1 3.86Å; I567-I593 HydrophobicContact CD1-CD1 4.47Å; L589-I593 WeakPolarHBondContact O-CB 3.34Å; L589-I593 VanDerWaalsContact O-CG1 3.31Å; L589-I593 WeakPolarHBondContact O-CG1 3.47Å; L589-I593 PolarHBondContact O-N 3.36Å
594	L	90.5	Very high	88.9	Confident	80 Å²	80	54.1 Å²	54.1	42%	0.419	27%	0.271	S	S	.	.	H	α-helix	trans	-109.7	-1	-174.3	-57.2	176.8	0	0	0	113.1	V361 G365 F367 R590	V361-L594 HydrophobicContact CG1-CD2 4.22Å; G365-L594 WeakPolarHBondContact O-CD2 3.42Å; F367-L594 HydrophobicContact CB-CD1 3.95Å; R590-L594 CarbonylContact O-C 3.57Å; R590-L594 WeakPolarHBondContact O-CA 3.5Å; R590-L594 WeakPolarHBondContact O-CB 3.28Å; R590-L594 PolarHBondContact O-N 3.11Å
595	G	86.7	Confident	89.1	Confident	24 Å²	24	57.6 Å²	57.6	25%	0.247	28%	0.284	C	S	.	.	S	Bend	trans	-69.3	164.1	-177.8	0	0	0	0	0	113.4	R590 N591 Q597	R590-G595 PolarHBondContact O-N 3.48Å; N591-G595 WeakPolarHBondContact O-CA 3.36Å; N591-G595 PolarHBondContact O-N 2.85Å; N591-G595 VanDerWaalsContact O-N 3.09Å; G595-Q597 PolarHBondContact O-N 3.45Å
596	R	86.4	Confident	89.2	Confident	175 Å²	175	54.8 Å²	54.8	66%	0.66	27%	0.267	S	S	*	.	P	Polyproline II helix	trans	-64.1	132.6	177.2	-166.6	173.8	-177.9	-151.6	-10.1	109.8	E599	R596-E599 IonicContact CZ-OE1 2.69Å; R596-E599 IonicContact NH1-OE1 3.97Å; R596-E599 PolarHBondContact NH1-OE1 2.87Å; R596-E599 IonicContact NH2-OE1 3.75Å; R596-E599 PolarHBondContact NH2-OE1 2.67Å
597	Q	85.4	Confident	89.3	Confident	44 Å²	44	52.3 Å²	52.3	21%	0.206	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-65.2	153.6	176.2	-65.4	173	0.3	0	0	110.7	T310 G595 E599	T310-Q597 PolarHBondContact O-OE1 2.5Å; T310-Q597 PolarHBondContact OG1-NE2 3.4Å; T310-Q597 PolarHBondContact OG1-OE1 2.97Å; G595-Q597 PolarHBondContact O-N 3.45Å; Q597-E599 PolarHBondContact O-N 3.36Å
598	T	86	Confident	89.4	Confident	55 Å²	55	48.9 Å²	48.9	34%	0.337	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-64.8	127.7	179.1	52.6	0	0	0	0	110.7	D543 S545	D543-T598 HydrophobicContact CB-CG2 4.37Å; S545-T598 VanDerWaalsContact CB-OG1 3.26Å; S545-T598 WeakPolarHBondContact CB-OG1 3.25Å; S545-T598 WeakPolarHBondContact OG-CG2 3.37Å; S545-T598 PolarHBondContact OG-OG1 3.04Å
599	E	89.5	Confident	89.3	Confident	83 Å²	83	48.3 Å²	48.3	39%	0.388	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-62.2	151.4	171.6	-76.2	170	-177.1	0	0	111.2	N283 P312 N313 R596 Q597	N283-E599 PolarHBondContact ND2-O 2.93Å; P312-E599 HydrophobicContact CB-CG 4.48Å; P312-E599 HydrophobicContact CG-CB 4.4Å; P312-E599 HydrophobicContact CG-CG 3.57Å; N313-E599 HydrophobicContact CB-CG 4.39Å; R596-E599 IonicContact CZ-OE1 2.69Å; R596-E599 IonicContact NH1-OE1 3.97Å; R596-E599 PolarHBondContact NH1-OE1 2.87Å; R596-E599 IonicContact NH2-OE1 3.75Å; R596-E599 PolarHBondContact NH2-OE1 2.67Å; Q597-E599 PolarHBondContact O-N 3.36Å
600	L	87.8	Confident	89.1	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.026	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-79	121.4	171.8	-63.9	-177.9	0	0	0	109.7	H280 N283 V311 N313 I317	H280-L600 HydrophobicContact CB-CD2 3.99Å; N283-L600 HydrophobicContact CB-CD2 4.32Å; N283-L600 VanDerWaalsContact OD1-CA 3.25Å; N283-L600 WeakPolarHBondContact OD1-CA 3.44Å; V311-L600 HydrophobicContact CB-CD1 4.12Å; V311-L600 HydrophobicContact CB-CG 4.12Å; V311-L600 HydrophobicContact CG1-CD1 3.91Å; V311-L600 HydrophobicContact CG1-CD2 4Å; V311-L600 HydrophobicContact CG1-CG 3.86Å; V311-L600 HydrophobicContact CG2-CD1 3.94Å; V311-L600 HydrophobicContact CG2-CG 4.46Å; N313-L600 PolarHBondContact ND2-O 3.18Å; N313-L600 PolarHBondContact OD1-N 2.72Å; I317-L600 HydrophobicContact CD1-CB 3.4Å; I317-L600 HydrophobicContact CD1-CD1 3.26Å; I317-L600 HydrophobicContact CD1-CG 3.89Å
601	I	90	Very high	89	Confident	99 Å²	99	44.7 Å²	44.7	51%	0.508	22%	0.217	S	C	.	.			trans	-115.6	135.9	-178.8	-56.9	172.1	0	0	0	107.5	N283 R603	N283-I601 PolarHBondContact OD1-N 3.22Å; N283-I601 PolarHBondContact OD1-O 2.92Å; N283-I601 VanDerWaalsContact OD1-O 3.12Å; I601-R603 PolarHBondContact O-N 2.86Å
602	S	90.5	Very high	88.9	Confident	17 Å²	17	39.6 Å²	39.6	12%	0.119	19%	0.19	C	C	.	.			trans	-59	132.8	173.9	-179.3	0	0	0	0	110.8	E292 F604	E292-S602 WeakPolarHBondContact OE2-CB 3.23Å; E292-S602 PolarHBondContact OE2-OG 3.5Å; S602-F604 VanDerWaalsContact OG-CB 3.22Å; S602-F604 WeakPolarHBondContact OG-CB 3.12Å; S602-F604 PolarHBondContact OG-N 3.41Å; S602-F604 VanDerWaalsContact OG-N 3.12Å
603	R	89.1	Confident	88.7	Confident	108 Å²	108	39.8 Å²	39.8	41%	0.408	19%	0.191	S	C	.	.			trans	-106.9	21.2	168.7	-61.8	-61.7	-169.5	178.5	-5.5	111.3	I282 N283 Y289 I601 R605	I282-R603 WeakPolarHBondContact O-CG 3.5Å; N283-R603 PolarHBondContact O-NE 2.81Å; N283-R603 VanDerWaalsContact O-NE 3.13Å; Y289-R603 WeakPolarHBondContact CB-O 3.44Å; I601-R603 PolarHBondContact O-N 2.86Å; R603-R605 PolarHBondContact O-N 3.47Å
604	F	88.9	Confident	88.4	Confident	11 Å²	11	39.1 Å²	39.1	5%	0.048	19%	0.188	C	C	.	.			trans	-59.6	127.6	-176.4	-167.2	-88.6	0	0	0	110.8	E292 Q293 S602 M610 I625 M626 L1079	E292-F604 HydrophobicContact CB-CD2 4.26Å; E292-F604 HydrophobicContact CG-CD2 4.3Å; Q293-F604 HydrophobicContact CG-CE2 3.78Å; S602-F604 VanDerWaalsContact OG-CB 3.22Å; S602-F604 WeakPolarHBondContact OG-CB 3.12Å; S602-F604 PolarHBondContact OG-N 3.41Å; S602-F604 VanDerWaalsContact OG-N 3.12Å; F604-M610 HydrophobicContact CE1-SD 4.33Å; F604-M610 HydrophobicContact CE2-SD 4.49Å; F604-M610 HydrophobicContact CZ-CE 4.41Å; F604-M610 HydrophobicContact CZ-SD 3.7Å; F604-I625 HydrophobicContact CE2-CG2 3.86Å; F604-I625 HydrophobicContact CZ-CG2 3.72Å; F604-M626 HydrophobicContact CE1-CG 4.11Å; F604-L1079 HydrophobicContact CD1-CD1 3.53Å; F604-L1079 HydrophobicContact CE1-CD1 3.98Å
605	R	87.7	Confident	88.1	Confident	72 Å²	72	37.8 Å²	37.8	27%	0.272	18%	0.179	S	C	.	.			trans	-136	145.7	177.4	64.8	-178.1	-177.4	-178.5	3.5	109.8	D286 Y289 R603 T607	D286-R605 PolarHBondContact O-NH2 2.82Å; Y289-R605 HydrophobicContact CD1-CG 3.95Å; Y289-R605 HydrophobicContact CD2-CG 4.5Å; Y289-R605 HydrophobicContact CE1-CG 4.48Å; Y289-R605 HydrophobicContact CG-CG 3.97Å; R603-R605 PolarHBondContact O-N 3.47Å; R605-T607 HydrophobicContact CG-CG2 4.07Å
606	V	88.5	Confident	87.9	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	18%	0.181	C	C	.	.			trans	-79	123.2	173.3	-176	0	0	0	0	107.7	M610 I611 M626 L1079 Y1083 R1086	V606-M610 HydrophobicContact CB-CE 4.12Å; V606-M610 HydrophobicContact CG1-CE 3.72Å; V606-M610 HydrophobicContact CG2-CE 4.18Å; V606-I611 HydrophobicContact CG1-CD1 3.69Å; V606-I611 HydrophobicContact CG1-CG1 3.88Å; V606-M626 HydrophobicContact CG2-CE 4.4Å; V606-M626 HydrophobicContact CG2-SD 4.32Å; V606-L1079 HydrophobicContact CG2-CB 4.1Å; V606-L1079 HydrophobicContact CG2-CD1 4.05Å; V606-Y1083 HydrophobicContact CG1-CD2 4.24Å; V606-R1086 PolarHBondContact O-NE 2.86Å; V606-R1086 VanDerWaalsContact O-NE 3.16Å; V606-R1086 PolarHBondContact O-NH1 3.37Å; V606-R1086 PolarHBondContact O-NH2 3.04Å
607	T	88.8	Confident	87.3	Confident	15 Å²	15	33.2 Å²	33.2	9%	0.092	16%	0.159	C	C	.	.			trans	-114.1	159.8	173.3	63.8	0	0	0	0	110.3	Y289 R605 S609 M610 I611	Y289-T607 HydrophobicContact CE2-CG2 4.17Å; R605-T607 HydrophobicContact CG-CG2 4.07Å; T607-S609 VanDerWaalsContact C-N 3.32Å; T607-M610 PolarHBondContact O-N 2.91Å; T607-M610 WeakPolarHBondContact OG1-CB 3.5Å; T607-M610 PolarHBondContact OG1-N 3.32Å; T607-M610 VanDerWaalsContact OG1-N 3.12Å; T607-I611 WeakPolarHBondContact O-CG1 3.48Å; T607-I611 PolarHBondContact O-N 3.43Å
608	Y	90.9	Very high	86.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-44.1	174.5	-69.6	-62.4	0	0	0	110.9	M610 I611 L612 R1086 V1089 L1090 E1119 V1120 Q1210 E1221	Y608-M610 VanDerWaalsContact C-N 3.32Å; Y608-M610 PolarHBondContact O-N 3.41Å; Y608-I611 PolarHBondContact O-N 3.38Å; Y608-I611 VanDerWaalsContact O-N 3.1Å; Y608-L612 WeakPolarHBondContact O-CB 3.3Å; Y608-L612 VanDerWaalsContact O-CG 3.3Å; Y608-L612 WeakPolarHBondContact O-CG 3.26Å; Y608-L612 PolarHBondContact O-N 2.98Å; Y608-R1086 HydrophobicContact CD1-CB 4.13Å; Y608-R1086 HydrophobicContact CD1-CG 4.28Å; Y608-R1086 HydrophobicContact CE1-CB 3.65Å; Y608-R1086 HydrophobicContact CE1-CG 3.72Å; Y608-V1089 HydrophobicContact CE1-CB 4.33Å; Y608-V1089 HydrophobicContact CE1-CG1 4.37Å; Y608-V1089 WeakPolarHBondContact OH-CG1 3.32Å; Y608-L1090 HydrophobicContact CD1-CD1 3.93Å; Y608-L1090 HydrophobicContact CD1-CD2 3.67Å; Y608-L1090 HydrophobicContact CD1-CG 3.68Å; Y608-L1090 HydrophobicContact CE1-CD2 4.12Å; Y608-L1090 HydrophobicContact CE1-CG 3.93Å; Y608-L1090 HydrophobicContact CG-CD2 4.43Å; Y608-E1119 VanDerWaalsContact CB-OE1 3.25Å; Y608-E1119 WeakPolarHBondContact CB-OE1 3.39Å; Y608-V1120 HydrophobicContact CD1-CG2 4.09Å; Y608-V1120 HydrophobicContact CD2-CG2 3.74Å; Y608-V1120 HydrophobicContact CE2-CG2 4.25Å; Y608-V1120 HydrophobicContact CG-CG2 3.65Å; Y608-Q1210 PolarHBondContact OH-OE1 3.01Å; Y608-E1221 HydrophobicContact CD2-CG 4.11Å; Y608-E1221 HydrophobicContact CE2-CG 3.96Å
609	S	88	Confident	85.6	Confident	21 Å²	21	39.5 Å²	39.5	15%	0.147	21%	0.21	C	C	.	.	H	α-helix	trans	-54.8	-43	174.9	178.9	0	0	0	0	112.7	T607 N613 E1119	T607-S609 VanDerWaalsContact C-N 3.32Å; S609-N613 VanDerWaalsContact O-CB 3.24Å; S609-N613 WeakPolarHBondContact O-CB 3.49Å; S609-N613 PolarHBondContact O-N 3.04Å; S609-N613 PolarHBondContact O-ND2 2.87Å; S609-N613 PolarHBondContact OG-ND2 3.46Å; S609-N613 VanDerWaalsContact OG-ND2 3.14Å; S609-E1119 WeakPolarHBondContact CA-OE1 3.11Å; S609-E1119 WeakPolarHBondContact CB-OE1 3.26Å; S609-E1119 PolarHBondContact N-OE1 3.03Å
610	M	87.6	Confident	85.2	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-62.1	-48.3	175.6	-176.6	-170.7	80.8	0	0	111	Q293 F604 V606 T607 Y608 L612 L614	Q293-M610 PolarHBondContact NE2-SD 3.49Å; F604-M610 HydrophobicContact CE1-SD 4.33Å; F604-M610 HydrophobicContact CE2-SD 4.49Å; F604-M610 HydrophobicContact CZ-CE 4.41Å; F604-M610 HydrophobicContact CZ-SD 3.7Å; V606-M610 HydrophobicContact CB-CE 4.12Å; V606-M610 HydrophobicContact CG1-CE 3.72Å; V606-M610 HydrophobicContact CG2-CE 4.18Å; T607-M610 PolarHBondContact O-N 2.91Å; T607-M610 WeakPolarHBondContact OG1-CB 3.5Å; T607-M610 PolarHBondContact OG1-N 3.32Å; T607-M610 VanDerWaalsContact OG1-N 3.12Å; Y608-M610 VanDerWaalsContact C-N 3.32Å; Y608-M610 PolarHBondContact O-N 3.41Å; M610-L612 PolarHBondContact O-N 2.98Å; M610-L614 HydrophobicContact CG-CD1 3.6Å; M610-L614 HydrophobicContact CG-CG 4.36Å; M610-L614 VanDerWaalsContact O-CB 3.26Å; M610-L614 WeakPolarHBondContact O-CB 3.49Å; M610-L614 WeakPolarHBondContact O-CD1 3.4Å; M610-L614 WeakPolarHBondContact O-CG 3.28Å; M610-L614 PolarHBondContact O-N 3.49Å; M610-L614 HydrophobicContact SD-CD1 4.45Å
611	I	90	Very high	85.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.4	-49.5	-179.9	-63.4	171.9	0	0	0	110.1	V606 T607 Y608 H615 Y1083 R1086 L1087 L1090 I1096	V606-I611 HydrophobicContact CG1-CD1 3.69Å; V606-I611 HydrophobicContact CG1-CG1 3.88Å; T607-I611 WeakPolarHBondContact O-CG1 3.48Å; T607-I611 PolarHBondContact O-N 3.43Å; Y608-I611 PolarHBondContact O-N 3.38Å; Y608-I611 VanDerWaalsContact O-N 3.1Å; I611-H615 PolarHBondContact O-N 2.87Å; I611-H615 PolarHBondContact O-ND1 3.49Å; I611-Y1083 HydrophobicContact CD1-CD2 4.03Å; I611-Y1083 HydrophobicContact CD1-CE2 4.25Å; I611-Y1083 HydrophobicContact CG1-CD2 4.15Å; I611-Y1083 HydrophobicContact CG1-CE2 4.11Å; I611-R1086 HydrophobicContact CD1-CB 3.66Å; I611-L1087 HydrophobicContact CG2-CD1 4.39Å; I611-L1090 HydrophobicContact CB-CD1 4.27Å; I611-L1090 HydrophobicContact CG2-CD1 3.83Å; I611-I1096 HydrophobicContact CG2-CD1 4.44Å
612	L	90.5	Very high	84.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-64.2	-51.1	-176.3	-68.1	169.3	0	0	0	111.6	Y608 M610 L614 H615 R616 L1090 F1095 L1105 A1112 E1119	Y608-L612 WeakPolarHBondContact O-CB 3.3Å; Y608-L612 VanDerWaalsContact O-CG 3.3Å; Y608-L612 WeakPolarHBondContact O-CG 3.26Å; Y608-L612 PolarHBondContact O-N 2.98Å; M610-L612 PolarHBondContact O-N 2.98Å; L612-L614 VanDerWaalsContact C-N 3.32Å; L612-L614 PolarHBondContact O-N 3.45Å; L612-H615 PolarHBondContact O-N 2.99Å; L612-R616 PolarHBondContact O-N 2.93Å; L612-L1090 HydrophobicContact CD2-CD1 4.13Å; L612-L1090 HydrophobicContact CD2-CD2 4.38Å; L612-L1090 HydrophobicContact CG-CD1 4.31Å; L612-F1095 HydrophobicContact CD2-CB 4.43Å; L612-L1105 HydrophobicContact CD2-CD2 3.63Å; L612-A1112 HydrophobicContact CD1-CB 3.59Å; L612-E1119 HydrophobicContact CD1-CG 4.18Å
613	N	87.4	Confident	84.7	Confident	7 Å²	7	38.6 Å²	38.6	4%	0.037	21%	0.207	C	C	.	.	H	α-helix	trans	-63.3	-36.5	-179.2	-78.7	-53.2	0	0	0	112.8	C262 S609 R616 S617	C262-N613 HydrophobicContact CB-CB 4.18Å; S609-N613 VanDerWaalsContact O-CB 3.24Å; S609-N613 WeakPolarHBondContact O-CB 3.49Å; S609-N613 PolarHBondContact O-N 3.04Å; S609-N613 PolarHBondContact O-ND2 2.87Å; S609-N613 PolarHBondContact OG-ND2 3.46Å; S609-N613 VanDerWaalsContact OG-ND2 3.14Å; N613-R616 VanDerWaalsContact O-CB 3.27Å; N613-R616 WeakPolarHBondContact O-CB 3.39Å; N613-R616 PolarHBondContact O-N 2.81Å; N613-S617 PolarHBondContact O-N 2.92Å; N613-S617 VanDerWaalsContact O-N 3.17Å; N613-S617 PolarHBondContact O-OG 3.39Å
614	L	85.5	Confident	84.5	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-75.3	-30.6	177.5	-67.4	174.2	0	0	0	113.3	M297 M610 L612 R616 S617 P622 I625	M297-L614 HydrophobicContact CE-CD2 4.07Å; M297-L614 HydrophobicContact SD-CD2 4.42Å; M610-L614 HydrophobicContact CG-CD1 3.6Å; M610-L614 HydrophobicContact CG-CG 4.36Å; M610-L614 VanDerWaalsContact O-CB 3.26Å; M610-L614 WeakPolarHBondContact O-CB 3.49Å; M610-L614 WeakPolarHBondContact O-CD1 3.4Å; M610-L614 WeakPolarHBondContact O-CG 3.28Å; M610-L614 PolarHBondContact O-N 3.49Å; M610-L614 HydrophobicContact SD-CD1 4.45Å; L612-L614 VanDerWaalsContact C-N 3.32Å; L612-L614 PolarHBondContact O-N 3.45Å; L614-R616 PolarHBondContact O-N 3.21Å; L614-S617 PolarHBondContact O-N 3.41Å; L614-S617 PolarHBondContact O-OG 3.47Å; L614-P622 HydrophobicContact CB-CG 3.85Å; L614-P622 HydrophobicContact CD1-CB 4.13Å; L614-P622 HydrophobicContact CD1-CG 4.06Å; L614-I625 HydrophobicContact CD1-CD1 3.51Å; L614-I625 HydrophobicContact CD1-CG1 4.48Å; L614-I625 HydrophobicContact CD2-CD1 3.36Å; L614-I625 HydrophobicContact CG-CD1 4.06Å
615	H	84.7	Confident	84.5	Confident	52 Å²	52	35.4 Å²	35.4	24%	0.241	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-24.2	169.4	-76.6	83	0	0	0	111.7	I611 L612 Y1103 L1105	I611-H615 PolarHBondContact O-N 2.87Å; I611-H615 PolarHBondContact O-ND1 3.49Å; L612-H615 PolarHBondContact O-N 2.99Å; H615-Y1103 PolarHBondContact CD2-O 3.2Å; H615-L1105 HydrophobicContact CB-CD1 4.48Å; H615-L1105 HydrophobicContact CB-CD2 3.97Å; H615-L1105 HydrophobicContact CB-CG 4.03Å
616	R	83.5	Confident	84.6	Confident	75 Å²	75	32 Å²	32	28%	0.283	19%	0.186	S	C	.	.	H	α-helix	trans	-70.1	-37.5	172.3	-156	179.6	77.1	167.6	1	112.1	C262 N263 L612 N613 L614 L1105 F1110 E1114	C262-R616 PolarHBondContact O-NH2 2.73Å; N263-R616 PolarHBondContact OD1-NH2 3.23Å; L612-R616 PolarHBondContact O-N 2.93Å; N613-R616 VanDerWaalsContact O-CB 3.27Å; N613-R616 WeakPolarHBondContact O-CB 3.39Å; N613-R616 PolarHBondContact O-N 2.81Å; L614-R616 PolarHBondContact O-N 3.21Å; R616-L1105 HydrophobicContact CB-CD1 3.76Å; R616-L1105 HydrophobicContact CG-CD1 4.12Å; R616-F1110 HydrophobicContact CG-CD1 4.37Å; R616-F1110 HydrophobicContact CG-CE1 3.98Å; R616-E1114 IonicContact NH1-OE1 3.04Å; R616-E1114 PolarHBondContact NH1-OE1 3.23Å
617	S	72.4	Confident	84.4	Confident	28 Å²	28	37 Å²	37	20%	0.196	21%	0.207	C	C	.	.			trans	-97	128.5	-178	68.2	0	0	0	0	112.5	N613 L614 S619	N613-S617 PolarHBondContact O-N 2.92Å; N613-S617 VanDerWaalsContact O-N 3.17Å; N613-S617 PolarHBondContact O-OG 3.39Å; L614-S617 PolarHBondContact O-N 3.41Å; L614-S617 PolarHBondContact O-OG 3.47Å; S617-S619 PolarHBondContact O-N 3.13Å
618	S	62.6	Low	84.5	Confident	134 Å²	134	40.8 Å²	40.8	94%	0.937	22%	0.22	S	C	*	.	S	Bend	trans	-80.9	-7.1	-175.1	55.6	0	0	0	0	116.1
619	S	73.6	Confident	84.5	Confident	97 Å²	97	40.9 Å²	40.9	68%	0.678	22%	0.22	S	C	*	.	S	Bend	trans	-78.9	-36.1	-168.6	68.2	0	0	0	0	114.8	S617	S617-S619 PolarHBondContact O-N 3.13Å
620	L	82	Confident	84.6	Confident	22 Å²	22	41 Å²	41	12%	0.115	22%	0.219	C	C	.	.			trans	-139.7	129.4	-177.7	-66.4	173.5	0	0	0	108.8	M297 D624 I625	M297-L620 HydrophobicContact CG-CD1 4.29Å; L620-D624 HydrophobicContact CD2-CB 4.42Å; L620-I625 HydrophobicContact CB-CD1 4.22Å; L620-I625 HydrophobicContact CB-CG1 4.27Å; L620-I625 HydrophobicContact CD1-CD1 4.35Å; L620-I625 HydrophobicContact CD1-CG1 4.28Å
621	T	85.2	Confident	84.6	Confident	63 Å²	63	43.4 Å²	43.4	39%	0.387	23%	0.23	S	C	.	.			trans	-80.7	158.4	173.4	69.7	0	0	0	0	110.7	Q623 D624 I625	T621-Q623 PolarHBondContact O-N 3.48Å; T621-D624 WeakPolarHBondContact CB-OD2 3.4Å; T621-D624 PolarHBondContact N-OD2 2.82Å; T621-D624 WeakPolarHBondContact O-CB 3.34Å; T621-D624 PolarHBondContact O-N 3.05Å; T621-D624 PolarHBondContact OG1-N 3.16Å; T621-D624 VanDerWaalsContact OG1-N 3.17Å; T621-D624 PolarHBondContact OG1-OD2 3.42Å; T621-I625 PolarHBondContact O-N 3.14Å
622	P	86.1	Confident	84.4	Confident	4 Å²	4	43.5 Å²	43.5	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-51.3	-37.6	170.5	-26.7	33.4	0	0	0	113.4	L614 I625 M626 Y1083	L614-P622 HydrophobicContact CB-CG 3.85Å; L614-P622 HydrophobicContact CD1-CB 4.13Å; L614-P622 HydrophobicContact CD1-CG 4.06Å; P622-I625 PolarHBondContact O-N 3.04Å; P622-M626 WeakPolarHBondContact O-CG 3.27Å; P622-M626 PolarHBondContact O-N 3.36Å; P622-Y1083 HydrophobicContact CB-CD2 4.33Å; P622-Y1083 HydrophobicContact CB-CE2 3.63Å; P622-Y1083 HydrophobicContact CG-CE2 4.17Å
623	Q	85.3	Confident	84.1	Confident	97 Å²	97	44 Å²	44	45%	0.453	23%	0.234	S	C	.	.	H	α-helix	trans	-67.5	-36.4	178	-66.6	-177.6	-20.6	0	0	112.2	T621 M626 K627 Y1083	T621-Q623 PolarHBondContact O-N 3.48Å; Q623-M626 PolarHBondContact O-N 2.89Å; Q623-K627 WeakPolarHBondContact O-CB 3.49Å; Q623-K627 VanDerWaalsContact O-CG 3.29Å; Q623-K627 WeakPolarHBondContact O-CG 3.45Å; Q623-K627 PolarHBondContact O-N 3.14Å; Q623-Y1083 HydrophobicContact CG-CE1 4.09Å
624	D	85.4	Confident	83.7	Confident	50 Å²	50	46.8 Å²	46.8	27%	0.267	26%	0.258	S	S	.	.	H	α-helix	trans	-65.5	-41	176.4	-62.4	-44.8	0	0	0	111.5	L620 T621 K627 R628	L620-D624 HydrophobicContact CD2-CB 4.42Å; T621-D624 WeakPolarHBondContact CB-OD2 3.4Å; T621-D624 PolarHBondContact N-OD2 2.82Å; T621-D624 WeakPolarHBondContact O-CB 3.34Å; T621-D624 PolarHBondContact O-N 3.05Å; T621-D624 PolarHBondContact OG1-N 3.16Å; T621-D624 VanDerWaalsContact OG1-N 3.17Å; T621-D624 PolarHBondContact OG1-OD2 3.42Å; D624-K627 PolarHBondContact O-N 3.34Å; D624-R628 WeakPolarHBondContact O-CB 3.3Å; D624-R628 WeakPolarHBondContact O-CD 3.29Å; D624-R628 VanDerWaalsContact O-CG 3.23Å; D624-R628 WeakPolarHBondContact O-CG 3.34Å; D624-R628 PolarHBondContact O-N 3.15Å; D624-R628 VanDerWaalsContact O-N 3.11Å
625	I	88.4	Confident	83.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-68.5	-41.6	176.6	-71.2	171.5	0	0	0	110.7	I296 M297 F604 L614 L620 T621 P622 K627 R628 S629	I296-I625 HydrophobicContact CD1-CG2 4.23Å; I296-I625 HydrophobicContact CG2-CG1 4.16Å; M297-I625 HydrophobicContact CG-CD1 3.79Å; M297-I625 HydrophobicContact SD-CD1 4.08Å; F604-I625 HydrophobicContact CE2-CG2 3.86Å; F604-I625 HydrophobicContact CZ-CG2 3.72Å; L614-I625 HydrophobicContact CD1-CD1 3.51Å; L614-I625 HydrophobicContact CD1-CG1 4.48Å; L614-I625 HydrophobicContact CD2-CD1 3.36Å; L614-I625 HydrophobicContact CG-CD1 4.06Å; L620-I625 HydrophobicContact CB-CD1 4.22Å; L620-I625 HydrophobicContact CB-CG1 4.27Å; L620-I625 HydrophobicContact CD1-CD1 4.35Å; L620-I625 HydrophobicContact CD1-CG1 4.28Å; T621-I625 PolarHBondContact O-N 3.14Å; P622-I625 PolarHBondContact O-N 3.04Å; I625-K627 PolarHBondContact O-N 2.92Å; I625-R628 CarbonylContact O-C 3.57Å; I625-R628 PolarHBondContact O-N 3.3Å; I625-S629 PolarHBondContact O-N 3.04Å
626	M	89.2	Confident	83.1	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-59.8	-45.4	174.9	-70.9	164.6	67.3	0	0	111.9	F604 V606 P622 Q623 R628 S629 E632 L1077 L1079 Y1083	F604-M626 HydrophobicContact CE1-CG 4.11Å; V606-M626 HydrophobicContact CG2-CE 4.4Å; V606-M626 HydrophobicContact CG2-SD 4.32Å; P622-M626 WeakPolarHBondContact O-CG 3.27Å; P622-M626 PolarHBondContact O-N 3.36Å; Q623-M626 PolarHBondContact O-N 2.89Å; M626-R628 VanDerWaalsContact C-N 3.25Å; M626-R628 PolarHBondContact O-N 3.45Å; M626-S629 VanDerWaalsContact O-CB 3.25Å; M626-S629 WeakPolarHBondContact O-CB 3.35Å; M626-S629 PolarHBondContact O-N 3.28Å; M626-S629 VanDerWaalsContact O-N 3.16Å; M626-S629 PolarHBondContact O-OG 2.83Å; M626-E632 WeakPolarHBondContact O-CG 3.26Å; M626-L1077 HydrophobicContact CB-CD1 4.26Å; M626-L1077 HydrophobicContact CE-CD1 4.33Å; M626-L1079 HydrophobicContact CE-CB 3.62Å; M626-L1079 WeakPolarHBondContact CE-O 3.36Å; M626-Y1083 HydrophobicContact CE-CG 4.28Å; M626-Y1083 HydrophobicContact SD-CD2 4.08Å; M626-Y1083 HydrophobicContact SD-CG 3.95Å
627	K	86.3	Confident	82.8	Confident	106 Å²	106	49.5 Å²	49.5	46%	0.461	27%	0.273	S	S	.	.	H	α-helix	trans	-61.4	-33.1	176.5	-76.5	175.4	180	-179.6	0	113.2	Q623 D624 I625 L1077	Q623-K627 WeakPolarHBondContact O-CB 3.49Å; Q623-K627 VanDerWaalsContact O-CG 3.29Å; Q623-K627 WeakPolarHBondContact O-CG 3.45Å; Q623-K627 PolarHBondContact O-N 3.14Å; D624-K627 PolarHBondContact O-N 3.34Å; I625-K627 PolarHBondContact O-N 2.92Å; K627-L1077 HydrophobicContact CG-CD1 3.99Å; K627-L1077 HydrophobicContact CG-CD2 3.98Å
628	R	89.2	Confident	83.2	Confident	94 Å²	94	52.6 Å²	52.6	36%	0.355	28%	0.281	S	S	.	.	H	α-helix	trans	-88.2	-3.5	179.6	-67.6	171	-171.1	-170	8.9	113.2	I296 W320 V324 D624 I625 M626	I296-R628 HydrophobicContact CD1-CB 4.25Å; I296-R628 HydrophobicContact CG1-CB 4.35Å; I296-R628 HydrophobicContact CG2-CB 3.84Å; W320-R628 VanDerWaalsContact CZ2-O 3.27Å; W320-R628 WeakPolarHBondContact CZ2-O 3.28Å; W320-R628 PolarHBondContact NE1-O 3.05Å; V324-R628 HydrophobicContact CG1-CB 4.04Å; V324-R628 HydrophobicContact CG1-CG 4.22Å; V324-R628 HydrophobicContact CG2-CB 4.09Å; V324-R628 HydrophobicContact CG2-CG 4.48Å; D624-R628 WeakPolarHBondContact O-CB 3.3Å; D624-R628 WeakPolarHBondContact O-CD 3.29Å; D624-R628 VanDerWaalsContact O-CG 3.23Å; D624-R628 WeakPolarHBondContact O-CG 3.34Å; D624-R628 PolarHBondContact O-N 3.15Å; D624-R628 VanDerWaalsContact O-N 3.11Å; I625-R628 CarbonylContact O-C 3.57Å; I625-R628 PolarHBondContact O-N 3.3Å; M626-R628 VanDerWaalsContact C-N 3.25Å; M626-R628 PolarHBondContact O-N 3.45Å
629	S	91.7	Very high	84	Confident	1 Å²	1	48 Å²	48	1%	0.007	25%	0.245	C	C	.	.	S	Bend	trans	-60.4	151.2	177.7	70.7	0	0	0	0	111.6	E292 W320 I625 M626 M631 E632 A633	E292-S629 WeakPolarHBondContact OE1-CA 3.47Å; E292-S629 WeakPolarHBondContact OE1-CB 3.39Å; W320-S629 PolarHBondContact NE1-O 3.04Å; I625-S629 PolarHBondContact O-N 3.04Å; M626-S629 VanDerWaalsContact O-CB 3.25Å; M626-S629 WeakPolarHBondContact O-CB 3.35Å; M626-S629 PolarHBondContact O-N 3.28Å; M626-S629 VanDerWaalsContact O-N 3.16Å; M626-S629 PolarHBondContact O-OG 2.83Å; S629-M631 PolarHBondContact O-N 3.17Å; S629-E632 PolarHBondContact O-N 3.25Å; S629-E632 WeakPolarHBondContact OG-CG 3.34Å; S629-E632 PolarHBondContact OG-N 3.32Å; S629-A633 PolarHBondContact O-N 2.72Å
630	F	90.2	Very high	84.2	Confident	25 Å²	25	45.5 Å²	45.5	11%	0.11	23%	0.225	C	C	.	.	S	Bend	trans	-64.4	-32.1	175.4	-177.6	-122	0	0	0	111	E292 E316 I317 W320 E632 A633	E292-F630 HydrophobicContact CG-CB 4.49Å; E292-F630 PolarHBondContact OE1-N 3.43Å; E316-F630 HydrophobicContact CG-CE2 4.12Å; E316-F630 HydrophobicContact CG-CZ 4.25Å; I317-F630 HydrophobicContact CG1-CE1 4.29Å; I317-F630 HydrophobicContact CG1-CE2 4.05Å; I317-F630 HydrophobicContact CG1-CZ 3.87Å; W320-F630 HydrophobicContact CB-CD2 3.86Å; W320-F630 HydrophobicContact CB-CE2 4.17Å; W320-F630 HydrophobicContact CD2-CB 3.9Å; W320-F630 AromaticContact CD2-CD2 3.68Å; W320-F630 HydrophobicContact CD2-CD2 3.68Å; W320-F630 HydrophobicContact CD2-CG 4.22Å; W320-F630 HydrophobicContact CE3-CB 4.16Å; W320-F630 AromaticContact CE3-CD2 3.96Å; W320-F630 HydrophobicContact CE3-CD2 3.96Å; W320-F630 HydrophobicContact CE3-CG 4.36Å; W320-F630 HydrophobicContact CG-CB 4.48Å; W320-F630 AromaticContact CG-CD2 3.62Å; W320-F630 HydrophobicContact CG-CD2 3.62Å; W320-F630 HydrophobicContact CG-CE2 4.41Å; W320-F630 HydrophobicContact CH2-CB 4.18Å; W320-F630 HydrophobicContact CZ2-CB 3.89Å; W320-F630 HydrophobicContact CZ3-CB 4.3Å; F630-E632 VanDerWaalsContact C-N 3.27Å; F630-E632 PolarHBondContact O-N 3.41Å; F630-A633 HydrophobicContact CD2-CB 4.17Å; F630-A633 WeakPolarHBondContact O-CB 3.25Å; F630-A633 PolarHBondContact O-N 3.47Å; F630-A633 VanDerWaalsContact O-N 3.09Å
631	M	87.3	Confident	84.1	Confident	51 Å²	51	50.4 Å²	50.4	25%	0.251	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-36.6	174.9	-170.9	163.9	62.7	0	0	112.9	S629 L1079	S629-M631 PolarHBondContact O-N 3.17Å; M631-L1079 HydrophobicContact CE-CD1 3.17Å; M631-L1079 HydrophobicContact CE-CD2 3.85Å; M631-L1079 HydrophobicContact CE-CG 3.26Å
632	E	85.6	Confident	83.9	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.009	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	2.2	177.6	-63.6	-65.7	177.4	0	0	113.3	M626 S629 F630 A634 S635 H636 Y1075 L1077 Q1078	M626-E632 WeakPolarHBondContact O-CG 3.26Å; S629-E632 PolarHBondContact O-N 3.25Å; S629-E632 WeakPolarHBondContact OG-CG 3.34Å; S629-E632 PolarHBondContact OG-N 3.32Å; F630-E632 VanDerWaalsContact C-N 3.27Å; F630-E632 PolarHBondContact O-N 3.41Å; E632-A634 PolarHBondContact O-N 3.49Å; E632-S635 WeakPolarHBondContact O-CB 3.33Å; E632-S635 PolarHBondContact O-N 3.41Å; E632-S635 WeakPolarHBondContact OE2-CB 3.45Å; E632-S635 PolarHBondContact OE2-OG 3.41Å; E632-S635 VanDerWaalsContact OE2-OG 3.12Å; E632-H636 VanDerWaalsContact O-CB 3.31Å; E632-H636 WeakPolarHBondContact O-CB 3.36Å; E632-H636 PolarHBondContact O-N 2.82Å; E632-Y1075 PolarHBondContact OE2-OH 3.48Å; E632-L1077 HydrophobicContact CG-CD2 4.08Å; E632-L1077 WeakPolarHBondContact OE1-CA 3.26Å; E632-Q1078 WeakPolarHBondContact OE1-CB 3.4Å; E632-Q1078 PolarHBondContact OE1-N 2.98Å
633	A	83.6	Confident	83.8	Confident	9 Å²	9	54.9 Å²	54.9	7%	0.074	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-41.4	-174.4	0	0	0	0	0	112.9	W320 S629 F630 H636 R637	W320-A633 HydrophobicContact CB-CB 4.37Å; W320-A633 HydrophobicContact CG-CB 4.13Å; S629-A633 PolarHBondContact O-N 2.72Å; F630-A633 HydrophobicContact CD2-CB 4.17Å; F630-A633 WeakPolarHBondContact O-CB 3.25Å; F630-A633 PolarHBondContact O-N 3.47Å; F630-A633 VanDerWaalsContact O-N 3.09Å; A633-H636 PolarHBondContact O-N 3.13Å; A633-R637 WeakPolarHBondContact O-CG 3.37Å; A633-R637 PolarHBondContact O-N 2.92Å
634	A	80.7	Confident	83.6	Confident	66 Å²	66	54.2 Å²	54.2	55%	0.545	25%	0.253	S	S	.	.	H	α-helix	trans	-64.9	-44.9	176.6	0	0	0	0	0	111.2	E632 R637 W638	E632-A634 PolarHBondContact O-N 3.49Å; A634-R637 PolarHBondContact O-N 3.27Å; A634-W638 WeakPolarHBondContact O-CB 3.25Å; A634-W638 PolarHBondContact O-N 3.44Å
635	S	80.2	Confident	83.6	Confident	24 Å²	24	53.3 Å²	53.3	17%	0.168	25%	0.247	C	C	.	.	H	α-helix	trans	-61.1	-43	175.7	-50.7	0	0	0	0	112.1	E632 W638 E639 Y1075	E632-S635 WeakPolarHBondContact O-CB 3.33Å; E632-S635 PolarHBondContact O-N 3.41Å; E632-S635 WeakPolarHBondContact OE2-CB 3.45Å; E632-S635 PolarHBondContact OE2-OG 3.41Å; E632-S635 VanDerWaalsContact OE2-OG 3.12Å; S635-W638 WeakPolarHBondContact O-CB 3.49Å; S635-W638 PolarHBondContact O-N 3.04Å; S635-E639 WeakPolarHBondContact O-CB 3.39Å; S635-E639 PolarHBondContact O-N 3.35Å; S635-Y1075 WeakPolarHBondContact CB-OH 3.29Å
636	H	76.8	Confident	83.5	Confident	84 Å²	84	55 Å²	55	39%	0.389	26%	0.256	S	S	.	.	H	α-helix	trans	-66.8	-40.4	177.5	-176.5	-85	0	0	0	112.3	E632 A633 W638 E639 T640	E632-H636 VanDerWaalsContact O-CB 3.31Å; E632-H636 WeakPolarHBondContact O-CB 3.36Å; E632-H636 PolarHBondContact O-N 2.82Å; A633-H636 PolarHBondContact O-N 3.13Å; H636-W638 VanDerWaalsContact C-N 3.32Å; H636-E639 PolarHBondContact O-N 2.82Å; H636-T640 PolarHBondContact CE1-OG1 3.08Å; H636-T640 WeakPolarHBondContact O-CB 3.45Å; H636-T640 PolarHBondContact O-N 2.98Å; H636-T640 PolarHBondContact O-OG1 3.38Å
637	R	77.8	Confident	83.2	Confident	79 Å²	79	58.6 Å²	58.6	30%	0.298	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-44	171.9	-77.2	178.2	-179.4	155.2	3.3	110.8	E316 D319 A633 A634 T640 K641	E316-R637 IonicContact OE1-NH1 2.71Å; D319-R637 IonicContact OD2-CZ 2.98Å; D319-R637 IonicContact OD2-NE 2.8Å; D319-R637 IonicContact OD2-NH2 2.68Å; D319-R637 PolarHBondContact OD2-NH2 3.2Å; A633-R637 WeakPolarHBondContact O-CG 3.37Å; A633-R637 PolarHBondContact O-N 2.92Å; A634-R637 PolarHBondContact O-N 3.27Å; R637-T640 PolarHBondContact O-N 3.33Å; R637-K641 VanDerWaalsContact O-CB 3.29Å; R637-K641 WeakPolarHBondContact O-CB 3.41Å; R637-K641 PolarHBondContact O-N 3.49Å
638	W	80.5	Confident	83.1	Confident	94 Å²	94	56 Å²	56	36%	0.356	27%	0.274	S	S	.	.	H	α-helix	trans	-60.4	-47.3	175.2	175.9	97.2	0	0	0	111.2	A634 S635 H636 T640 K641 K642 N1071 L1072 Y1075	A634-W638 WeakPolarHBondContact O-CB 3.25Å; A634-W638 PolarHBondContact O-N 3.44Å; S635-W638 WeakPolarHBondContact O-CB 3.49Å; S635-W638 PolarHBondContact O-N 3.04Å; H636-W638 VanDerWaalsContact C-N 3.32Å; W638-T640 PolarHBondContact O-N 2.89Å; W638-K641 PolarHBondContact O-N 2.57Å; W638-K642 HydrophobicContact CD2-CG 3.94Å; W638-K642 HydrophobicContact CE3-CG 4.39Å; W638-K642 HydrophobicContact CG-CG 4.42Å; W638-K642 HydrophobicContact CH2-CG 4.3Å; W638-K642 HydrophobicContact CZ2-CD 4.38Å; W638-K642 HydrophobicContact CZ2-CG 3.87Å; W638-K642 WeakPolarHBondContact O-CB 3.34Å; W638-K642 VanDerWaalsContact O-CG 3.26Å; W638-K642 WeakPolarHBondContact O-CG 3.2Å; W638-K642 PolarHBondContact O-N 2.9Å; W638-N1071 HydrophobicContact CH2-CB 3.9Å; W638-N1071 HydrophobicContact CZ2-CB 4.08Å; W638-L1072 HydrophobicContact CH2-CD2 4.4Å; W638-L1072 HydrophobicContact CZ3-CD2 3.98Å; W638-Y1075 HydrophobicContact CZ3-CD2 4.32Å
639	E	79	Confident	82.9	Confident	38 Å²	38	51.6 Å²	51.6	18%	0.178	26%	0.257	C	S	.	.	H	α-helix	trans	-60.2	-49.2	178.6	-172.1	-173	167.9	0	0	111.1	S635 H636 K641 K642 R643 L1072	S635-E639 WeakPolarHBondContact O-CB 3.39Å; S635-E639 PolarHBondContact O-N 3.35Å; H636-E639 PolarHBondContact O-N 2.82Å; E639-K641 VanDerWaalsContact C-N 3.34Å; E639-K641 PolarHBondContact O-N 3.04Å; E639-K642 PolarHBondContact O-N 2.92Å; E639-R643 WeakPolarHBondContact O-CB 3.26Å; E639-R643 WeakPolarHBondContact O-CG 3.5Å; E639-R643 PolarHBondContact O-N 2.97Å; E639-R643 IonicContact OE1-CZ 2.97Å; E639-R643 VanDerWaalsContact OE1-CZ 3.22Å; E639-R643 IonicContact OE1-NE 2.82Å; E639-R643 PolarHBondContact OE1-NE 2.8Å; E639-R643 IonicContact OE1-NH2 3.63Å; E639-R643 PolarHBondContact OE1-NH2 2.97Å; E639-L1072 HydrophobicContact CG-CD2 3.8Å
640	T	77.9	Confident	82.6	Confident	43 Å²	43	53.7 Å²	53.7	26%	0.264	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-47.1	178.9	-55.3	0	0	0	0	110.8	H636 R637 W638 R643 Q644	H636-T640 PolarHBondContact CE1-OG1 3.08Å; H636-T640 WeakPolarHBondContact O-CB 3.45Å; H636-T640 PolarHBondContact O-N 2.98Å; H636-T640 PolarHBondContact O-OG1 3.38Å; R637-T640 PolarHBondContact O-N 3.33Å; W638-T640 PolarHBondContact O-N 2.89Å; T640-R643 PolarHBondContact O-N 2.92Å; T640-Q644 WeakPolarHBondContact O-CG 3Å; T640-Q644 PolarHBondContact O-N 3.03Å
641	K	79.9	Confident	82.3	Confident	125 Å²	125	58.9 Å²	58.9	54%	0.543	29%	0.291	S	S	.	.	H	α-helix	trans	-64.1	-42.8	178.6	-172.8	175.2	-176.9	179.4	0	111.7	R637 W638 E639 Q644 H645	R637-K641 VanDerWaalsContact O-CB 3.29Å; R637-K641 WeakPolarHBondContact O-CB 3.41Å; R637-K641 PolarHBondContact O-N 3.49Å; W638-K641 PolarHBondContact O-N 2.57Å; E639-K641 VanDerWaalsContact C-N 3.34Å; E639-K641 PolarHBondContact O-N 3.04Å; K641-Q644 WeakPolarHBondContact O-CB 3.2Å; K641-Q644 PolarHBondContact O-N 3.15Å; K641-H645 WeakPolarHBondContact CG-NE2 3.48Å; K641-H645 PolarHBondContact O-CD2 3.11Å; K641-H645 PolarHBondContact O-N 3.13Å
642	K	81.8	Confident	82.1	Confident	27 Å²	27	57.8 Å²	57.8	12%	0.117	29%	0.285	C	S	.	.	H	α-helix	trans	-66.5	-38.1	177.1	-71.1	-68.2	-176.2	174.1	0	112.3	W638 E639 H645 L646 I1068 L1072	W638-K642 HydrophobicContact CD2-CG 3.94Å; W638-K642 HydrophobicContact CE3-CG 4.39Å; W638-K642 HydrophobicContact CG-CG 4.42Å; W638-K642 HydrophobicContact CH2-CG 4.3Å; W638-K642 HydrophobicContact CZ2-CD 4.38Å; W638-K642 HydrophobicContact CZ2-CG 3.87Å; W638-K642 WeakPolarHBondContact O-CB 3.34Å; W638-K642 VanDerWaalsContact O-CG 3.26Å; W638-K642 WeakPolarHBondContact O-CG 3.2Å; W638-K642 PolarHBondContact O-N 2.9Å; E639-K642 PolarHBondContact O-N 2.92Å; K642-H645 WeakPolarHBondContact O-CB 3.3Å; K642-H645 PolarHBondContact O-N 3.13Å; K642-L646 WeakPolarHBondContact O-CB 3.44Å; K642-L646 PolarHBondContact O-N 3.23Å; K642-I1068 HydrophobicContact CB-CG2 4.09Å; K642-I1068 HydrophobicContact CD-CG1 4.32Å; K642-I1068 HydrophobicContact CD-CG2 4.4Å; K642-L1072 HydrophobicContact CB-CD2 4.26Å
643	R	83.5	Confident	81.9	Confident	134 Å²	134	58.7 Å²	58.7	51%	0.506	29%	0.289	S	S	.	.	H	α-helix	trans	-64.6	-40.8	172.6	-72.5	-177	-175.4	-69.7	-3.2	112.2	E639 T640 L646 S647 L1072	E639-R643 WeakPolarHBondContact O-CB 3.26Å; E639-R643 WeakPolarHBondContact O-CG 3.5Å; E639-R643 PolarHBondContact O-N 2.97Å; E639-R643 IonicContact OE1-CZ 2.97Å; E639-R643 VanDerWaalsContact OE1-CZ 3.22Å; E639-R643 IonicContact OE1-NE 2.82Å; E639-R643 PolarHBondContact OE1-NE 2.8Å; E639-R643 IonicContact OE1-NH2 3.63Å; E639-R643 PolarHBondContact OE1-NH2 2.97Å; T640-R643 PolarHBondContact O-N 2.92Å; R643-L646 PolarHBondContact O-N 3.39Å; R643-S647 PolarHBondContact O-N 2.74Å; R643-L1072 HydrophobicContact CG-CD1 4.26Å
644	Q	80.9	Confident	81.7	Confident	84 Å²	84	63.5 Å²	63.5	39%	0.393	31%	0.314	S	S	.	.	H	α-helix	trans	-62.1	-46.2	172.5	-73.1	173.6	-8.6	0	0	111.4	T640 K641 L646 S647 V648	T640-Q644 WeakPolarHBondContact O-CG 3Å; T640-Q644 PolarHBondContact O-N 3.03Å; K641-Q644 WeakPolarHBondContact O-CB 3.2Å; K641-Q644 PolarHBondContact O-N 3.15Å; Q644-L646 VanDerWaalsContact C-N 3.33Å; Q644-L646 PolarHBondContact O-N 3.11Å; Q644-S647 WeakPolarHBondContact O-CB 3.34Å; Q644-S647 PolarHBondContact O-N 3.19Å; Q644-V648 WeakPolarHBondContact O-CG2 2.99Å; Q644-V648 PolarHBondContact O-N 2.93Å
645	H	84.7	Confident	81.6	Confident	31 Å²	31	65.4 Å²	65.4	14%	0.144	31%	0.312	C	S	.	.	H	α-helix	trans	-58.4	-44.9	174.9	-68.3	-172.4	0	0	0	111.6	K641 K642 S647 V648 L649 I847 I1068	K641-H645 WeakPolarHBondContact CG-NE2 3.48Å; K641-H645 PolarHBondContact O-CD2 3.11Å; K641-H645 PolarHBondContact O-N 3.13Å; K642-H645 WeakPolarHBondContact O-CB 3.3Å; K642-H645 PolarHBondContact O-N 3.13Å; H645-S647 VanDerWaalsContact C-N 3.32Å; H645-S647 PolarHBondContact O-N 3.33Å; H645-V648 PolarHBondContact O-N 2.86Å; H645-L649 WeakPolarHBondContact O-CB 3.45Å; H645-L649 WeakPolarHBondContact O-CG 3.41Å; H645-L649 PolarHBondContact O-N 2.78Å; H645-I847 HydrophobicContact CB-CD1 4.32Å; H645-I847 HydrophobicContact CB-CG1 4.38Å; H645-I847 HydrophobicContact CB-CG2 3.87Å; H645-I1068 HydrophobicContact CB-CD1 4.25Å
646	L	86	Confident	81.1	Confident	36 Å²	36	64.6 Å²	64.6	19%	0.188	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-39.9	176.9	-176.3	151.2	0	0	0	111.7	K642 R643 Q644 N650 I1068 E1069 L1072	K642-L646 WeakPolarHBondContact O-CB 3.44Å; K642-L646 PolarHBondContact O-N 3.23Å; R643-L646 PolarHBondContact O-N 3.39Å; Q644-L646 VanDerWaalsContact C-N 3.33Å; Q644-L646 PolarHBondContact O-N 3.11Å; L646-N650 WeakPolarHBondContact CD2-ND2 3.44Å; L646-N650 WeakPolarHBondContact CG-ND2 3.46Å; L646-N650 VanDerWaalsContact O-CB 3.26Å; L646-N650 WeakPolarHBondContact O-CB 3.16Å; L646-N650 PolarHBondContact O-N 3.34Å; L646-N650 PolarHBondContact O-ND2 3.03Å; L646-I1068 HydrophobicContact CB-CG2 4.2Å; L646-I1068 HydrophobicContact CD1-CG2 4.1Å; L646-E1069 HydrophobicContact CD1-CG 3.59Å; L646-L1072 HydrophobicContact CD1-CD1 4.16Å
647	S	83.8	Confident	80.7	Confident	77 Å²	77	62.3 Å²	62.3	54%	0.538	30%	0.298	S	S	.	.	H	α-helix	trans	-62.8	-45.9	174.5	-179.9	0	0	0	0	112	R643 Q644 H645 K651	R643-S647 PolarHBondContact O-N 2.74Å; Q644-S647 WeakPolarHBondContact O-CB 3.34Å; Q644-S647 PolarHBondContact O-N 3.19Å; H645-S647 VanDerWaalsContact C-N 3.32Å; H645-S647 PolarHBondContact O-N 3.33Å; S647-K651 WeakPolarHBondContact O-CB 3.41Å; S647-K651 PolarHBondContact O-N 3.35Å
648	V	84.3	Confident	79.8	Confident	53 Å²	53	60.8 Å²	60.8	32%	0.321	30%	0.297	S	S	.	.	H	α-helix	trans	-62.3	-48	177.5	173.1	0	0	0	0	111.1	Q644 H645 K651 K652 I847	Q644-V648 WeakPolarHBondContact O-CG2 2.99Å; Q644-V648 PolarHBondContact O-N 2.93Å; H645-V648 PolarHBondContact O-N 2.86Å; V648-K651 PolarHBondContact O-N 2.76Å; V648-K652 HydrophobicContact CG1-CD 4.49Å; V648-K652 WeakPolarHBondContact O-CG 3.43Å; V648-K652 PolarHBondContact O-N 2.7Å; V648-K652 VanDerWaalsContact O-N 3.07Å; V648-I847 HydrophobicContact CG1-CD1 4.32Å
649	L	85	Confident	78.4	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-43.2	-179.9	-69.5	175.1	0	0	0	112.2	H645 K651 K652 L653 I847 L848 R1061 A1064 I1065 I1068	H645-L649 WeakPolarHBondContact O-CB 3.45Å; H645-L649 WeakPolarHBondContact O-CG 3.41Å; H645-L649 PolarHBondContact O-N 2.78Å; L649-K651 VanDerWaalsContact C-N 3.34Å; L649-K651 PolarHBondContact O-N 3.14Å; L649-K652 PolarHBondContact O-N 2.85Å; L649-L653 VanDerWaalsContact O-CB 3.3Å; L649-L653 WeakPolarHBondContact O-CB 3.31Å; L649-L653 PolarHBondContact O-N 3.35Å; L649-I847 HydrophobicContact CD1-CG2 3.77Å; L649-I847 HydrophobicContact CD2-CG2 4.09Å; L649-I847 HydrophobicContact CG-CG2 3.97Å; L649-L848 HydrophobicContact CD2-CD2 3.83Å; L649-L848 HydrophobicContact CD2-CG 4.44Å; L649-R1061 HydrophobicContact CD2-CG 4.26Å; L649-A1064 HydrophobicContact CD1-CB 3.8Å; L649-I1065 HydrophobicContact CB-CD1 4.01Å; L649-I1065 HydrophobicContact CB-CG1 3.76Å; L649-I1065 HydrophobicContact CD1-CG1 4.15Å; L649-I1068 HydrophobicContact CD1-CD1 3.77Å
650	N	84.7	Confident	76.6	Confident	46 Å²	46	66.2 Å²	66.2	25%	0.246	33%	0.332	C	S	.	.	H	α-helix	trans	-63.9	-39.3	176.9	-85.8	-54.3	0	0	0	112.2	L646 L653 N654	L646-N650 WeakPolarHBondContact CD2-ND2 3.44Å; L646-N650 WeakPolarHBondContact CG-ND2 3.46Å; L646-N650 VanDerWaalsContact O-CB 3.26Å; L646-N650 WeakPolarHBondContact O-CB 3.16Å; L646-N650 PolarHBondContact O-N 3.34Å; L646-N650 PolarHBondContact O-ND2 3.03Å; N650-L653 PolarHBondContact O-N 3.19Å; N650-N654 WeakPolarHBondContact O-CB 3.31Å; N650-N654 VanDerWaalsContact O-CG 3.22Å; N650-N654 PolarHBondContact O-N 3.48Å; N650-N654 PolarHBondContact O-ND2 2.95Å
651	K	83.9	Confident	74.6	Confident	133 Å²	133	69.3 Å²	69.3	58%	0.578	36%	0.356	S	S	*	.	H	α-helix	trans	-60.4	-49.7	175.1	-174.6	-174.4	176.2	-164.7	0	111	S647 V648 L649 L653 N654 E655	S647-K651 WeakPolarHBondContact O-CB 3.41Å; S647-K651 PolarHBondContact O-N 3.35Å; V648-K651 PolarHBondContact O-N 2.76Å; L649-K651 VanDerWaalsContact C-N 3.34Å; L649-K651 PolarHBondContact O-N 3.14Å; K651-L653 VanDerWaalsContact C-N 3.34Å; K651-L653 PolarHBondContact O-N 3.25Å; K651-N654 PolarHBondContact O-N 3.06Å; K651-E655 VanDerWaalsContact CE-OE1 3.24Å; K651-E655 WeakPolarHBondContact CE-OE1 3.47Å; K651-E655 WeakPolarHBondContact O-CG 3.32Å; K651-E655 PolarHBondContact O-N 2.71Å
652	K	83.8	Confident	72.3	Confident	28 Å²	28	71.2 Å²	71.2	12%	0.122	37%	0.366	C	S	.	.	H	α-helix	trans	-64.7	-37.4	178.3	-71.7	-171.7	169.4	-172.2	0	112.9	V648 L649 E655 T656 D841 E844	V648-K652 HydrophobicContact CG1-CD 4.49Å; V648-K652 WeakPolarHBondContact O-CG 3.43Å; V648-K652 PolarHBondContact O-N 2.7Å; V648-K652 VanDerWaalsContact O-N 3.07Å; L649-K652 PolarHBondContact O-N 2.85Å; K652-E655 PolarHBondContact O-N 2.74Å; K652-T656 PolarHBondContact O-N 2.96Å; K652-T656 PolarHBondContact O-OG1 3.25Å; K652-D841 VanDerWaalsContact NZ-CG 3.32Å; K652-D841 IonicContact NZ-OD2 3.76Å; K652-D841 PolarHBondContact NZ-OD2 3.41Å; K652-E844 HydrophobicContact CD-CB 4.43Å; K652-E844 VanDerWaalsContact CD-CD 3.47Å; K652-E844 HydrophobicContact CD-CG 4.24Å; K652-E844 WeakPolarHBondContact CD-OE2 3.12Å; K652-E844 WeakPolarHBondContact CE-OE2 3.22Å; K652-E844 VanDerWaalsContact NZ-CB 3.28Å; K652-E844 IonicContact NZ-OE2 3.48Å; K652-E844 PolarHBondContact NZ-OE2 3.45Å
653	L	82	Confident	69.9	Low	21 Å²	21	76.9 Å²	76.9	11%	0.11	40%	0.398	C	S	.	.	H	α-helix	trans	-58.3	-52.5	174.6	-176.3	65.5	0	0	0	110.2	L649 N650 K651 E655 T656 T657 T1058 R1061 K1062 I1065	L649-L653 VanDerWaalsContact O-CB 3.3Å; L649-L653 WeakPolarHBondContact O-CB 3.31Å; L649-L653 PolarHBondContact O-N 3.35Å; N650-L653 PolarHBondContact O-N 3.19Å; K651-L653 VanDerWaalsContact C-N 3.34Å; K651-L653 PolarHBondContact O-N 3.25Å; L653-E655 VanDerWaalsContact C-N 3.29Å; L653-E655 PolarHBondContact O-N 3.46Å; L653-T656 PolarHBondContact O-N 2.87Å; L653-T656 PolarHBondContact O-OG1 3.12Å; L653-T657 HydrophobicContact CD1-CG2 4.02Å; L653-T657 HydrophobicContact CG-CG2 4.43Å; L653-T657 PolarHBondContact O-N 3.13Å; L653-T657 PolarHBondContact O-OG1 2.75Å; L653-T1058 HydrophobicContact CD1-CG2 3.76Å; L653-R1061 HydrophobicContact CD1-CB 4.39Å; L653-K1062 HydrophobicContact CD1-CG 3.99Å; L653-K1062 HydrophobicContact CD2-CG 4.26Å; L653-I1065 HydrophobicContact CB-CD1 4.4Å; L653-I1065 HydrophobicContact CD2-CD1 3.78Å
654	N	78	Confident	67.6	Low	110 Å²	110	77.4 Å²	77.4	59%	0.588	41%	0.41	S	S	*	.	H	α-helix	trans	-60.5	-34.2	178.7	-70.4	-24	0	0	0	113.4	N650 K651 T656	N650-N654 WeakPolarHBondContact O-CB 3.31Å; N650-N654 VanDerWaalsContact O-CG 3.22Å; N650-N654 PolarHBondContact O-N 3.48Å; N650-N654 PolarHBondContact O-ND2 2.95Å; K651-N654 PolarHBondContact O-N 3.06Å; N654-T656 VanDerWaalsContact C-N 3.32Å
655	E	78.3	Confident	65.7	Low	106 Å²	106	79.6 Å²	79.6	50%	0.495	43%	0.425	S	S	.	.	H	α-helix	trans	-64.2	-38.3	174.9	-73.9	167.2	-177.8	0	0	111.5	K651 K652 L653 K701	K651-E655 VanDerWaalsContact CE-OE1 3.24Å; K651-E655 WeakPolarHBondContact CE-OE1 3.47Å; K651-E655 WeakPolarHBondContact O-CG 3.32Å; K651-E655 PolarHBondContact O-N 2.71Å; K652-E655 PolarHBondContact O-N 2.74Å; L653-E655 VanDerWaalsContact C-N 3.29Å; L653-E655 PolarHBondContact O-N 3.46Å; E655-K701 PolarHBondContact O-NZ 2.7Å
656	T	71.1	Confident	63.5	Low	7 Å²	7	80.2 Å²	80.2	4%	0.043	43%	0.429	C	S	.	.	H	α-helix	trans	-91.9	-12.8	-174.8	52.8	0	0	0	0	116.5	K652 L653 N654 K701 L1054 R1061	K652-T656 PolarHBondContact O-N 2.96Å; K652-T656 PolarHBondContact O-OG1 3.25Å; L653-T656 PolarHBondContact O-N 2.87Å; L653-T656 PolarHBondContact O-OG1 3.12Å; N654-T656 VanDerWaalsContact C-N 3.32Å; T656-K701 PolarHBondContact O-N 3.29Å; T656-L1054 HydrophobicContact CG2-CD1 3.66Å; T656-R1061 PolarHBondContact OG1-NH1 3.45Å
657	T	67.8	Low	61.1	Low	36 Å²	36	82.4 Å²	82.4	22%	0.221	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-105.9	144.3	-179.7	54.4	0	0	0	0	112.5	L653 K701 T1058	L653-T657 HydrophobicContact CD1-CG2 4.02Å; L653-T657 HydrophobicContact CG-CG2 4.43Å; L653-T657 PolarHBondContact O-N 3.13Å; L653-T657 PolarHBondContact O-OG1 2.75Å; T657-K701 VanDerWaalsContact O-CE 3.29Å; T657-K701 WeakPolarHBondContact O-CE 3.4Å; T657-T1058 HydrophobicContact CG2-CG2 4Å
658	T	59.8	Low	58.8	Low	48 Å²	48	84.1 Å²	84.1	29%	0.294	45%	0.45	S	S	.	.			trans	-101.4	147.4	169.5	23.2	0	0	0	0	111.1	Q699 K701	T658-Q699 PolarHBondContact N-O 3.49Å; T658-K701 HydrophobicContact CG2-CD 4.18Å; T658-K701 HydrophobicContact CG2-CG 3.61Å
659	I	49.7	Very low	56.5	Low	171 Å²	171	85.7 Å²	85.7	88%	0.877	46%	0.456	S	S	*	.			trans	-97.1	106	167.1	-56.1	172.2	0	0	0	106.5
660	I	41.6	Very low	54.2	Low	74 Å²	74	90.4 Å²	90.4	38%	0.379	48%	0.48	S	S	.	.			trans	-110.6	130.3	170.2	-56.1	177.3	0	0	0	108.3	V707	I660-V707 HydrophobicContact CD1-CG1 4.23Å
661	S	35.3	Very low	51.7	Low	109 Å²	109	92 Å²	92	76%	0.762	49%	0.491	S	S	*	.			trans	-60.1	131.3	-178.4	47.4	0	0	0	0	112.6
662	H	32	Very low	49.4	Very low	165 Å²	165	92.4 Å²	92.4	76%	0.764	50%	0.496	S	S	*	.			trans	-43.3	132.3	178.3	-89.1	-72.7	0	0	0	114.9
663	N	32.4	Very low	47	Very low	146 Å²	146	96 Å²	96	78%	0.781	52%	0.519	S	S	*	.			trans	-111.7	134.6	153.9	-101	-16.2	0	0	0	109.8	N665	N663-N665 VanDerWaalsContact C-N 3.34Å; N663-N665 PolarHBondContact O-N 2.95Å
664	N	35.5	Very low	44.8	Very low	144 Å²	144	98.7 Å²	98.7	77%	0.77	54%	0.54	S	S	*	.	S	Bend	trans	-73.3	26.2	-159.2	-72.6	-32.1	0	0	0	118.3
665	N	40.4	Very low	42.7	Very low	130 Å²	130	99.8 Å²	99.8	70%	0.695	55%	0.546	S	S	*	.			trans	-101.9	4	-171.7	-81.6	-8	0	0	0	116.4	N663	N663-N665 VanDerWaalsContact C-N 3.34Å; N663-N665 PolarHBondContact O-N 2.95Å
666	I	38	Very low	40.7	Very low	45 Å²	45	101.4 Å²	101.4	23%	0.231	56%	0.557	C	S	.	*	T	Hydrogen-bonded Turn	trans	-81.9	-23.7	-167.8	-59.1	174.9	0	0	0	112.8	N668 I669 I670 Y697	I666-N668 PolarHBondContact O-N 3.36Å; I666-I669 PolarHBondContact O-N 3.04Å; I666-I670 HydrophobicContact CG2-CD1 3.92Å; I666-I670 HydrophobicContact CG2-CG1 4.45Å; I666-Y697 HydrophobicContact CB-CE2 4.41Å; I666-Y697 HydrophobicContact CD1-CD1 4.22Å; I666-Y697 HydrophobicContact CD1-CD2 4.32Å; I666-Y697 HydrophobicContact CD1-CE1 3.62Å; I666-Y697 HydrophobicContact CD1-CE2 3.76Å; I666-Y697 HydrophobicContact CG1-CE1 4.27Å; I666-Y697 HydrophobicContact CG1-CE2 4.18Å; I666-Y697 VanDerWaalsContact CG1-OH 3.31Å; I666-Y697 WeakPolarHBondContact CG1-OH 3.35Å; I666-Y697 HydrophobicContact CG2-CD2 4.4Å; I666-Y697 HydrophobicContact CG2-CE2 3.4Å; I666-Y697 WeakPolarHBondContact CG2-OH 3.22Å
667	S	35.1	Very low	38.9	Very low	81 Å²	81	106.2 Å²	106.2	57%	0.566	59%	0.586	S	S	*	*	H	α-helix	trans	-66.7	-18.9	-178.4	54.9	0	0	0	0	114.5	T671	S667-T671 PolarHBondContact O-OG1 2.99Å
668	N	36	Very low	36.9	Very low	113 Å²	113	113.1 Å²	113.1	60%	0.604	62%	0.618	S	S	*	*	H	α-helix	trans	-92.3	-17.3	-178.2	-73.3	-8.2	0	0	0	113.7	I666	I666-N668 PolarHBondContact O-N 3.36Å
669	I	36.3	Very low	35.5	Very low	86 Å²	86	116 Å²	116	44%	0.441	64%	0.64	S	S	.	*	H	α-helix	trans	-88.5	-36.4	-178.3	-61.1	174.4	0	0	0	110.3	I666 T671 Q672 V673	I666-I669 PolarHBondContact O-N 3.04Å; I669-T671 PolarHBondContact O-N 2.92Å; I669-Q672 PolarHBondContact O-N 3.12Å; I669-Q672 VanDerWaalsContact O-N 3.11Å; I669-V673 PolarHBondContact O-N 2.87Å
670	I	35.9	Very low	34.6	Very low	99 Å²	99	113.1 Å²	113.1	51%	0.508	63%	0.63	S	S	.	*	H	α-helix	trans	-61.7	-34.4	178.2	-64.3	172.3	0	0	0	111.2	I666 S674	I666-I670 HydrophobicContact CG2-CD1 3.92Å; I666-I670 HydrophobicContact CG2-CG1 4.45Å; I670-S674 PolarHBondContact O-N 2.97Å; I670-S674 PolarHBondContact O-OG 3Å
671	T	33.5	Very low	34	Very low	80 Å²	80	118.6 Å²	118.6	49%	0.491	65%	0.648	S	S	.	*	H	α-helix	trans	-74.8	-20.2	176.8	5.2	0	0	0	0	114.4	S667 I669 S674 N675	S667-T671 PolarHBondContact O-OG1 2.99Å; I669-T671 PolarHBondContact O-N 2.92Å; T671-S674 PolarHBondContact O-OG 3.21Å; T671-S674 VanDerWaalsContact O-OG 3.06Å; T671-N675 PolarHBondContact O-ND2 3.18Å
672	Q	34.5	Very low	34	Very low	142 Å²	142	119.5 Å²	119.5	66%	0.664	64%	0.642	S	S	*	*	H	α-helix	trans	-87.9	-33.5	177.7	-75.7	-175.9	-23.5	0	0	112	I669	I669-Q672 PolarHBondContact O-N 3.12Å; I669-Q672 VanDerWaalsContact O-N 3.11Å
673	V	34.2	Very low	34	Very low	102 Å²	102	120.2 Å²	120.2	62%	0.618	65%	0.646	S	S	*	*	H	α-helix	trans	-76.9	-28.2	178.6	-178.7	0	0	0	0	111.8	I669 N675	I669-V673 PolarHBondContact O-N 2.87Å; V673-N675 PolarHBondContact O-N 2.77Å
674	S	34.6	Very low	34	Very low	78 Å²	78	120.5 Å²	120.5	55%	0.545	65%	0.653	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.1	-14.4	176.3	57.7	0	0	0	0	114.8	I670 T671	I670-S674 PolarHBondContact O-N 2.97Å; I670-S674 PolarHBondContact O-OG 3Å; T671-S674 PolarHBondContact O-OG 3.21Å; T671-S674 VanDerWaalsContact O-OG 3.06Å
675	N	34.1	Very low	33.9	Very low	134 Å²	134	117.2 Å²	117.2	72%	0.717	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-0.3	-173.4	-70.6	-14.9	0	0	0	114.7	T671 V673	T671-N675 PolarHBondContact O-ND2 3.18Å; V673-N675 PolarHBondContact O-N 2.77Å
676	I	36.2	Very low	33.9	Very low	140 Å²	140	112.5 Å²	112.5	72%	0.718	62%	0.623	S	S	*	*	S	Bend	trans	-109.7	-8.4	-169	-64.3	177.3	0	0	0	114.5
677	T	33.2	Very low	33.9	Very low	107 Å²	107	116.5 Å²	116.5	66%	0.656	65%	0.645	S	S	*	*			trans	-135.6	93.4	-179.1	47.5	0	0	0	0	113.1
678	M	27.4	Very low	34.1	Very low	182 Å²	182	117.6 Å²	117.6	90%	0.897	64%	0.644	S	S	*	*			trans	-110.1	145.7	166.4	-99	-72	-146.5	0	0	108.9
679	S	30.7	Very low	34.4	Very low	107 Å²	107	115.8 Å²	115.8	75%	0.748	63%	0.631	S	S	*	*			trans	96.6	105.9	168.4	71	0	0	0	0	119.5
680	T	28.9	Very low	34.6	Very low	111 Å²	111	118.5 Å²	118.5	68%	0.681	64%	0.639	S	S	*	*	S	Bend	trans	63.1	95.3	133.2	52.6	0	0	0	0	120.3
681	Y	30.9	Very low	34.9	Very low	190 Å²	190	117 Å²	117	75%	0.745	64%	0.638	S	S	*	*	S	Bend	trans	161.8	3.2	135.5	-110.6	-90.2	0	0	0	114.5	E1010	Y681-E1010 WeakPolarHBondContact CD2-OE1 3.44Å; Y681-E1010 WeakPolarHBondContact CD2-OE2 3.4Å; Y681-E1010 WeakPolarHBondContact CE2-OE1 3.18Å; Y681-E1010 WeakPolarHBondContact CE2-OE2 3.43Å
682	I	35.2	Very low	35.4	Very low	127 Å²	127	113.8 Å²	113.8	65%	0.651	62%	0.618	S	S	*	*			trans	-109.2	59.9	-174.2	-43.9	177.7	0	0	0	111.7	S686	I682-S686 WeakPolarHBondContact O-CB 3.36Å; I682-S686 PolarHBondContact O-OG 3.39Å
683	E	30.4	Very low	35.8	Very low	180 Å²	180	110.9 Å²	110.9	84%	0.841	61%	0.606	S	S	*	*	S	Bend	trans	-98.5	-7.5	-175.9	-78.5	-170.7	164.4	0	0	115.7
684	V	32.9	Very low	36.2	Very low	152 Å²	152	112.1 Å²	112.1	92%	0.921	61%	0.609	S	S	*	*	S	Bend	trans	-112.9	-9.9	-176.9	-172.1	0	0	0	0	114.1
685	A	34	Very low	36.6	Very low	75 Å²	75	111.5 Å²	111.5	62%	0.62	60%	0.604	S	S	*	*	S	Bend	trans	-122	-4.2	178.8	0	0	0	0	0	114.6
686	S	40.2	Very low	37.2	Very low	32 Å²	32	106.3 Å²	106.3	22%	0.224	58%	0.577	C	S	.	*	H	α-helix	trans	-87.6	-26.6	-169.4	63.1	0	0	0	0	114.9	I682 L688 F689 K690	I682-S686 WeakPolarHBondContact O-CB 3.36Å; I682-S686 PolarHBondContact O-OG 3.39Å; S686-L688 PolarHBondContact O-N 2.73Å; S686-F689 PolarHBondContact O-N 3.21Å; S686-K690 VanDerWaalsContact O-CB 3.28Å; S686-K690 WeakPolarHBondContact O-CB 3.27Å; S686-K690 PolarHBondContact O-N 2.59Å
687	D	37	Very low	37.8	Very low	129 Å²	129	105.5 Å²	105.5	69%	0.69	57%	0.565	S	S	*	*	H	α-helix	trans	-67.5	-40.7	-177.5	-76.8	-22.5	0	0	0	112.7	F689 S691	D687-F689 VanDerWaalsContact C-N 3.33Å; D687-S691 WeakPolarHBondContact O-CB 3.18Å; D687-S691 PolarHBondContact O-N 3.24Å; D687-S691 VanDerWaalsContact O-N 3.1Å
688	L	39.8	Very low	38.7	Very low	103 Å²	103	100.9 Å²	100.9	54%	0.539	54%	0.537	S	S	.	.	H	α-helix	trans	-69.6	-34.3	175.6	-149.1	85.3	0	0	0	111.2	S686 L692	S686-L688 PolarHBondContact O-N 2.73Å; L688-L692 HydrophobicContact CG-CD1 4.35Å; L688-L692 WeakPolarHBondContact O-CB 3.21Å; L688-L692 WeakPolarHBondContact O-CD1 3.43Å; L688-L692 PolarHBondContact O-N 2.75Å
689	F	42.8	Very low	40.3	Very low	76 Å²	76	94.6 Å²	94.6	33%	0.333	51%	0.505	S	S	.	.	H	α-helix	trans	-80	-35.3	-178.5	-155.3	-108.4	0	0	0	112.1	S686 D687 L692 I693 Y721	S686-F689 PolarHBondContact O-N 3.21Å; D687-F689 VanDerWaalsContact C-N 3.33Å; F689-L692 PolarHBondContact O-N 3.49Å; F689-I693 HydrophobicContact CD1-CD1 3.47Å; F689-I693 VanDerWaalsContact CD1-CD1 3.47Å; F689-I693 HydrophobicContact CD1-CG1 4.09Å; F689-I693 HydrophobicContact CE1-CD1 3.41Å; F689-I693 VanDerWaalsContact CE1-CD1 3.41Å; F689-I693 HydrophobicContact CE1-CG1 4.09Å; F689-I693 HydrophobicContact CG-CD1 4.46Å; F689-I693 HydrophobicContact CZ-CD1 4.34Å; F689-I693 VanDerWaalsContact O-CB 3.26Å; F689-I693 WeakPolarHBondContact O-CB 3.47Å; F689-I693 WeakPolarHBondContact O-CG1 3.34Å; F689-I693 PolarHBondContact O-N 2.97Å; F689-Y721 AromaticContact CE2-CE1 3.8Å; F689-Y721 HydrophobicContact CE2-CE1 3.8Å; F689-Y721 HydrophobicContact CZ-CD1 4.12Å; F689-Y721 AromaticContact CZ-CE1 3.56Å; F689-Y721 HydrophobicContact CZ-CE1 3.56Å
690	K	39.9	Very low	42	Very low	142 Å²	142	89.5 Å²	89.5	62%	0.617	47%	0.47	S	S	*	.	H	α-helix	trans	-62.3	-48.3	169.7	-105.5	177.3	170.4	172.6	0	110.9	S686 L692 I693 D694	S686-K690 VanDerWaalsContact O-CB 3.28Å; S686-K690 WeakPolarHBondContact O-CB 3.27Å; S686-K690 PolarHBondContact O-N 2.59Å; K690-L692 VanDerWaalsContact C-N 3.27Å; K690-L692 PolarHBondContact O-N 3.24Å; K690-I693 PolarHBondContact O-N 3.34Å; K690-D694 PolarHBondContact O-N 3.35Å
691	S	42.2	Very low	44	Very low	69 Å²	69	88 Å²	88	48%	0.483	45%	0.454	S	S	.	.	H	α-helix	trans	-66.4	-31	177.9	107.3	0	0	0	0	112.2	D687	D687-S691 WeakPolarHBondContact O-CB 3.18Å; D687-S691 PolarHBondContact O-N 3.24Å; D687-S691 VanDerWaalsContact O-N 3.1Å
692	L	45.1	Very low	45.9	Very low	12 Å²	12	79.1 Å²	79.1	6%	0.063	42%	0.42	C	S	.	.	H	α-helix	trans	-72.7	-43.9	172.3	-106	112.9	0	0	0	111.7	L688 F689 K690 D694 S695 L696 L1063	L688-L692 HydrophobicContact CG-CD1 4.35Å; L688-L692 WeakPolarHBondContact O-CB 3.21Å; L688-L692 WeakPolarHBondContact O-CD1 3.43Å; L688-L692 PolarHBondContact O-N 2.75Å; F689-L692 PolarHBondContact O-N 3.49Å; K690-L692 VanDerWaalsContact C-N 3.27Å; K690-L692 PolarHBondContact O-N 3.24Å; L692-D694 VanDerWaalsContact C-N 3.32Å; L692-D694 PolarHBondContact O-N 3.36Å; L692-S695 CarbonylContact O-C 3.6Å; L692-S695 WeakPolarHBondContact O-CA 3.35Å; L692-S695 WeakPolarHBondContact O-CB 3.43Å; L692-S695 PolarHBondContact O-N 3.46Å; L692-S695 PolarHBondContact O-OG 3.09Å; L692-L696 HydrophobicContact CB-CD1 4.4Å; L692-L696 HydrophobicContact CD2-CD1 4.47Å; L692-L696 WeakPolarHBondContact O-CD1 3.48Å; L692-L696 WeakPolarHBondContact O-CG 3.25Å; L692-L696 PolarHBondContact O-N 3.35Å; L692-L696 VanDerWaalsContact O-N 3.16Å; L692-L1063 HydrophobicContact CD1-CD2 3.82Å; L692-L1063 HydrophobicContact CD2-CD2 3.51Å; L692-L1063 HydrophobicContact CD2-CG 4.13Å; L692-L1063 HydrophobicContact CG-CD2 4.33Å
693	I	42.7	Very low	47.3	Very low	80 Å²	80	75.3 Å²	75.3	41%	0.41	40%	0.403	S	S	.	.	H	α-helix	trans	-59.4	-41.1	178.8	-79.1	-179.3	0	0	0	111.6	F689 K690 S695 L696	F689-I693 HydrophobicContact CD1-CD1 3.47Å; F689-I693 VanDerWaalsContact CD1-CD1 3.47Å; F689-I693 HydrophobicContact CD1-CG1 4.09Å; F689-I693 HydrophobicContact CE1-CD1 3.41Å; F689-I693 VanDerWaalsContact CE1-CD1 3.41Å; F689-I693 HydrophobicContact CE1-CG1 4.09Å; F689-I693 HydrophobicContact CG-CD1 4.46Å; F689-I693 HydrophobicContact CZ-CD1 4.34Å; F689-I693 VanDerWaalsContact O-CB 3.26Å; F689-I693 WeakPolarHBondContact O-CB 3.47Å; F689-I693 WeakPolarHBondContact O-CG1 3.34Å; F689-I693 PolarHBondContact O-N 2.97Å; K690-I693 PolarHBondContact O-N 3.34Å; I693-S695 PolarHBondContact O-N 3.25Å; I693-L696 HydrophobicContact CG1-CD1 4.44Å; I693-L696 PolarHBondContact O-N 3.42Å
694	D	41.7	Very low	48.9	Very low	128 Å²	128	70.4 Å²	70.4	68%	0.684	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.5	174.5	-73.3	-20.3	0	0	0	113.1	K690 L692	K690-D694 PolarHBondContact O-N 3.35Å; L692-D694 VanDerWaalsContact C-N 3.32Å; L692-D694 PolarHBondContact O-N 3.36Å
695	S	43.7	Very low	50.2	Low	65 Å²	65	70.4 Å²	70.4	46%	0.455	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-1.7	179.2	80.4	0	0	0	0	114.8	L692 I693 Y697	L692-S695 CarbonylContact O-C 3.6Å; L692-S695 WeakPolarHBondContact O-CA 3.35Å; L692-S695 WeakPolarHBondContact O-CB 3.43Å; L692-S695 PolarHBondContact O-N 3.46Å; L692-S695 PolarHBondContact O-OG 3.09Å; I693-S695 PolarHBondContact O-N 3.25Å; S695-Y697 PolarHBondContact O-N 2.78Å
696	L	45.9	Very low	51.4	Low	25 Å²	25	68.2 Å²	68.2	13%	0.131	36%	0.36	C	S	.	.			trans	-95.6	37.8	-168.5	-80.4	166.8	0	0	0	114.5	L692 I693 V698 V1059	L692-L696 HydrophobicContact CB-CD1 4.4Å; L692-L696 HydrophobicContact CD2-CD1 4.47Å; L692-L696 WeakPolarHBondContact O-CD1 3.48Å; L692-L696 WeakPolarHBondContact O-CG 3.25Å; L692-L696 PolarHBondContact O-N 3.35Å; L692-L696 VanDerWaalsContact O-N 3.16Å; I693-L696 HydrophobicContact CG1-CD1 4.44Å; I693-L696 PolarHBondContact O-N 3.42Å; L696-V698 HydrophobicContact CB-CG2 4.1Å; L696-V698 HydrophobicContact CD2-CG2 3.28Å; L696-V698 HydrophobicContact CG-CG2 4.27Å; L696-V698 PolarHBondContact O-N 2.82Å; L696-V1059 HydrophobicContact CD2-CG2 4.23Å
697	Y	49	Very low	52.3	Low	123 Å²	123	71.1 Å²	71.1	48%	0.482	38%	0.376	S	S	.	.			trans	-68.2	79.7	148.5	-95.4	-91.4	0	0	0	108	I666 S695 Q699	I666-Y697 HydrophobicContact CB-CE2 4.41Å; I666-Y697 HydrophobicContact CD1-CD1 4.22Å; I666-Y697 HydrophobicContact CD1-CD2 4.32Å; I666-Y697 HydrophobicContact CD1-CE1 3.62Å; I666-Y697 HydrophobicContact CD1-CE2 3.76Å; I666-Y697 HydrophobicContact CG1-CE1 4.27Å; I666-Y697 HydrophobicContact CG1-CE2 4.18Å; I666-Y697 VanDerWaalsContact CG1-OH 3.31Å; I666-Y697 WeakPolarHBondContact CG1-OH 3.35Å; I666-Y697 HydrophobicContact CG2-CD2 4.4Å; I666-Y697 HydrophobicContact CG2-CE2 3.4Å; I666-Y697 WeakPolarHBondContact CG2-OH 3.22Å; S695-Y697 PolarHBondContact O-N 2.78Å; Y697-Q699 PolarHBondContact O-N 3.34Å; Y697-Q699 VanDerWaalsContact O-N 3.08Å
698	V	52.3	Low	53.4	Low	10 Å²	10	70.3 Å²	70.3	6%	0.061	37%	0.368	C	S	.	.			trans	-81.2	87.3	-179.5	-159.7	0	0	0	0	109	L696 V700 T1058 V1059	L696-V698 HydrophobicContact CB-CG2 4.1Å; L696-V698 HydrophobicContact CD2-CG2 3.28Å; L696-V698 HydrophobicContact CG-CG2 4.27Å; L696-V698 PolarHBondContact O-N 2.82Å; V698-V700 VanDerWaalsContact C-N 3.28Å; V698-V700 HydrophobicContact CB-CG2 4.22Å; V698-V700 HydrophobicContact CG1-CG2 3.29Å; V698-V700 PolarHBondContact O-N 3.21Å; V698-T1058 HydrophobicContact CG1-CG2 3.76Å; V698-V1059 HydrophobicContact CG2-CG2 4.43Å
699	Q	60	Low	54.7	Low	50 Å²	50	65.6 Å²	65.6	23%	0.234	34%	0.344	C	S	.	.			trans	-77.7	81.5	171.3	-68.9	-177.2	-11.8	0	0	109.9	T658 Y697	T658-Q699 PolarHBondContact N-O 3.49Å; Y697-Q699 PolarHBondContact O-N 3.34Å; Y697-Q699 VanDerWaalsContact O-N 3.08Å
700	V	68.1	Low	55.7	Low	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-83.7	138.2	175.1	-175.3	0	0	0	0	109.4	V698 C702 C710 L1054 V1055 T1058	V698-V700 VanDerWaalsContact C-N 3.28Å; V698-V700 HydrophobicContact CB-CG2 4.22Å; V698-V700 HydrophobicContact CG1-CG2 3.29Å; V698-V700 PolarHBondContact O-N 3.21Å; V700-C702 PolarHBondContact O-N 2.9Å; V700-C710 PolarHBondContact O-SG 3.24Å; V700-L1054 HydrophobicContact CG1-CB 4Å; V700-L1054 HydrophobicContact CG1-CD2 3.49Å; V700-L1054 VanDerWaalsContact CG1-CD2 3.49Å; V700-L1054 HydrophobicContact CG1-CG 3.51Å; V700-V1055 HydrophobicContact CB-CG2 3.95Å; V700-V1055 HydrophobicContact CG1-CG2 4.19Å; V700-V1055 HydrophobicContact CG2-CB 4.3Å; V700-V1055 HydrophobicContact CG2-CG2 3.69Å; V700-T1058 HydrophobicContact CG2-CG2 4.17Å
701	K	70.1	Confident	56.8	Low	79 Å²	79	60.3 Å²	60.3	34%	0.343	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-64.1	124.2	173.3	-74.9	174.3	-174.1	164.7	0	110	E655 T656 T657 T658 L1054	E655-K701 PolarHBondContact O-NZ 2.7Å; T656-K701 PolarHBondContact O-N 3.29Å; T657-K701 VanDerWaalsContact O-CE 3.29Å; T657-K701 WeakPolarHBondContact O-CE 3.4Å; T658-K701 HydrophobicContact CG2-CD 4.18Å; T658-K701 HydrophobicContact CG2-CG 3.61Å; K701-L1054 WeakPolarHBondContact O-CD2 3.3Å
702	C	70.1	Confident	58	Low	5 Å²	5	57.6 Å²	57.6	3%	0.034	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-58.2	129.4	165.7	178.4	0	0	0	0	109.5	V700 H704 N705 G706 C709	V700-C702 PolarHBondContact O-N 2.9Å; C702-H704 PolarHBondContact O-N 3.5Å; C702-H704 PolarHBondContact SG-N 2.91Å; C702-N705 PolarHBondContact O-N 3.36Å; C702-G706 WeakPolarHBondContact CB-O 3.46Å; C702-C709 PolarHBondContact SG-SG 3.03Å
703	P	65.5	Low	59.3	Low	47 Å²	47	57 Å²	57	31%	0.305	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-20.2	176.3	-24	31.8	0	0	0	114	Q1050 L1054	P703-Q1050 HydrophobicContact CB-CG 4.31Å; P703-Q1050 HydrophobicContact CG-CB 4.41Å; P703-Q1050 HydrophobicContact CG-CG 3.99Å; P703-L1054 HydrophobicContact CG-CD2 4.35Å
704	H	64.2	Low	60.5	Low	76 Å²	76	53.7 Å²	53.7	35%	0.352	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	19	-180	-70.3	-73.5	0	0	0	113.9	C702 G706 P1046 N1047	C702-H704 PolarHBondContact O-N 3.5Å; C702-H704 PolarHBondContact SG-N 2.91Å; H704-G706 PolarHBondContact O-N 2.82Å; H704-G706 VanDerWaalsContact O-N 3.11Å; H704-P1046 HydrophobicContact CB-CG 3.98Å; H704-N1047 WeakPolarHBondContact NE2-CB 3.42Å
705	N	59.3	Low	61.8	Low	153 Å²	153	51.5 Å²	51.5	82%	0.818	28%	0.275	S	S	*	.			trans	59.9	15.4	179.8	-78	-13.6	0	0	0	116	C702 V707	C702-N705 PolarHBondContact O-N 3.36Å; N705-V707 PolarHBondContact O-N 3.37Å
706	G	59.6	Low	63.3	Low	29 Å²	29	48.5 Å²	48.5	30%	0.299	25%	0.254	S	S	.	.			trans	-80.7	116.2	175.3	0	0	0	0	0	112.3	C702 H704 E708 C709 C710	C702-G706 WeakPolarHBondContact CB-O 3.46Å; H704-G706 PolarHBondContact O-N 2.82Å; H704-G706 VanDerWaalsContact O-N 3.11Å; G706-E708 VanDerWaalsContact C-N 3.34Å; G706-C709 PolarHBondContact O-SG 3.15Å; G706-C709 VanDerWaalsContact O-SG 3.42Å; G706-C710 PolarHBondContact O-SG 3.38Å; G706-C710 VanDerWaalsContact O-SG 3.37Å
707	V	60	Low	64.7	Low	93 Å²	93	47.8 Å²	47.8	56%	0.564	25%	0.25	S	C	*	.	S	Bend	trans	-70.9	-31.4	179	-173.6	0	0	0	0	111.8	I660 N705 C709 C710	I660-V707 HydrophobicContact CD1-CG1 4.23Å; N705-V707 PolarHBondContact O-N 3.37Å; V707-C709 VanDerWaalsContact C-N 3.31Å; V707-C709 PolarHBondContact O-N 2.99Å; V707-C710 WeakPolarHBondContact O-CB 3.47Å; V707-C710 PolarHBondContact O-N 3.05Å
708	E	60.2	Low	65.8	Low	111 Å²	111	45.8 Å²	45.8	52%	0.519	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-25.1	-168.9	-58.2	-173.7	-171.9	0	0	114.4	G706 K1044	G706-E708 VanDerWaalsContact C-N 3.34Å; E708-K1044 HydrophobicContact CB-CD 4.39Å; E708-K1044 WeakPolarHBondContact OE2-CD 3.32Å; E708-K1044 WeakPolarHBondContact OE2-CE 3.43Å; E708-K1044 IonicContact OE2-NZ 3.89Å; E708-K1044 PolarHBondContact OE2-NZ 3.46Å
709	C	65.4	Low	66.7	Low	4 Å²	4	47.7 Å²	47.7	3%	0.027	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-13	178.8	64.9	0	0	0	0	113.8	C702 G706 V707 D711 I713 C1045 H1051	C702-C709 PolarHBondContact SG-SG 3.03Å; G706-C709 PolarHBondContact O-SG 3.15Å; G706-C709 VanDerWaalsContact O-SG 3.42Å; V707-C709 VanDerWaalsContact C-N 3.31Å; V707-C709 PolarHBondContact O-N 2.99Å; C709-D711 VanDerWaalsContact C-N 3.31Å; C709-D711 PolarHBondContact O-N 3.1Å; C709-I713 WeakPolarHBondContact O-CB 3.28Å; C709-I713 PolarHBondContact O-N 3.16Å; C709-I713 VanDerWaalsContact O-N 3.16Å; C709-C1045 HydrophobicContact CB-CB 3.83Å; C709-H1051 PolarHBondContact SG-CE1 2.9Å
710	C	65.5	Low	67.5	Low	10 Å²	10	45.3 Å²	45.3	7%	0.068	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-28.3	-175.5	-62.9	0	0	0	0	113	V700 G706 V707	V700-C710 PolarHBondContact O-SG 3.24Å; G706-C710 PolarHBondContact O-SG 3.38Å; G706-C710 VanDerWaalsContact O-SG 3.37Å; V707-C710 WeakPolarHBondContact O-CB 3.47Å; V707-C710 PolarHBondContact O-N 3.05Å
711	D	62.9	Low	67.8	Low	98 Å²	98	46.5 Å²	46.5	52%	0.524	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-33.7	-177.9	-67.9	-27.4	0	0	0	112.5	C709	C709-D711 VanDerWaalsContact C-N 3.31Å; C709-D711 PolarHBondContact O-N 3.1Å
712	S	66.8	Low	68.1	Low	12 Å²	12	46.8 Å²	46.8	8%	0.084	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-19.5	-173.5	-50.2	0	0	0	0	114	G714 Q715 Y716 N1041	S712-G714 VanDerWaalsContact C-N 3.3Å; S712-G714 PolarHBondContact O-N 2.93Å; S712-Q715 PolarHBondContact O-N 3.42Å; S712-Y716 PolarHBondContact O-N 3.38Å; S712-N1041 WeakPolarHBondContact OG-CB 3.2Å
713	I	72	Confident	68.4	Low	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-63.4	-34	-179.5	-164.9	68.3	0	0	0	112.9	C709 Y716 Y717 L1042 L1048 H1051 L1052 V1055	C709-I713 WeakPolarHBondContact O-CB 3.28Å; C709-I713 PolarHBondContact O-N 3.16Å; C709-I713 VanDerWaalsContact O-N 3.16Å; I713-Y716 HydrophobicContact CD1-CD1 4.47Å; I713-Y716 PolarHBondContact O-N 2.69Å; I713-Y717 WeakPolarHBondContact O-CB 3.35Å; I713-Y717 PolarHBondContact O-N 3.02Å; I713-L1042 HydrophobicContact CD1-CD2 4.06Å; I713-L1048 HydrophobicContact CD1-CD1 3.45Å; I713-L1048 VanDerWaalsContact CD1-CD1 3.45Å; I713-H1051 HydrophobicContact CD1-CB 4.32Å; I713-H1051 HydrophobicContact CG1-CB 4.48Å; I713-L1052 HydrophobicContact CD1-CD2 4.07Å; I713-L1052 HydrophobicContact CD1-CG 4.23Å; I713-V1055 HydrophobicContact CG1-CG2 3.84Å; I713-V1055 HydrophobicContact CG2-CG2 3.98Å
714	G	68.5	Low	68.9	Low	10 Å²	10	45.5 Å²	45.5	10%	0.103	24%	0.238	C	C	.	.	H	α-helix	trans	-64	-44.6	179.9	0	0	0	0	0	112.3	S712 Y717 Q718	S712-G714 VanDerWaalsContact C-N 3.3Å; S712-G714 PolarHBondContact O-N 2.93Å; G714-Y717 PolarHBondContact O-N 3.24Å; G714-Q718 WeakPolarHBondContact O-CG 3.43Å; G714-Q718 PolarHBondContact O-N 3.18Å; G714-Q718 VanDerWaalsContact O-N 3.1Å
715	Q	69.1	Low	69.4	Low	82 Å²	82	45.1 Å²	45.1	38%	0.383	24%	0.236	S	C	.	.	H	α-helix	trans	-65.2	-40.4	176.8	-66.8	176.5	-4	0	0	111.5	S712 Q718 L719 F1037	S712-Q715 PolarHBondContact O-N 3.42Å; Q715-Q718 WeakPolarHBondContact O-CB 3.49Å; Q715-Q718 PolarHBondContact O-N 3.36Å; Q715-L719 PolarHBondContact O-N 3.34Å; Q715-L719 VanDerWaalsContact O-N 3.15Å; Q715-F1037 HydrophobicContact CB-CD2 4.03Å; Q715-F1037 HydrophobicContact CB-CE2 3.97Å
716	Y	74	Confident	70.2	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-42.8	176.9	-172.7	-117.8	0	0	0	112.9	S712 I713 Q718 L719 C720 P866 H868 L869 L1025 L1029 F1037 L1042 L1048 L1052	S712-Y716 PolarHBondContact O-N 3.38Å; I713-Y716 HydrophobicContact CD1-CD1 4.47Å; I713-Y716 PolarHBondContact O-N 2.69Å; Y716-Q718 VanDerWaalsContact C-N 3.27Å; Y716-Q718 PolarHBondContact O-N 2.99Å; Y716-L719 PolarHBondContact O-N 3.45Å; Y716-C720 PolarHBondContact O-N 3.24Å; Y716-C720 PolarHBondContact O-SG 3.35Å; Y716-P866 VanDerWaalsContact OH-CG 3.27Å; Y716-P866 WeakPolarHBondContact OH-CG 3.25Å; Y716-H868 PolarHBondContact OH-CE1 3.19Å; Y716-H868 PolarHBondContact OH-NE2 3.42Å; Y716-L869 HydrophobicContact CE1-CD1 4.26Å; Y716-L869 WeakPolarHBondContact OH-CD1 3.44Å; Y716-L1025 HydrophobicContact CE2-CD2 4.29Å; Y716-L1029 HydrophobicContact CE2-CD2 4.29Å; Y716-F1037 AromaticContact CD2-CE1 4Å; Y716-F1037 HydrophobicContact CD2-CE1 4Å; Y716-F1037 AromaticContact CD2-CZ 3.71Å; Y716-F1037 HydrophobicContact CD2-CZ 3.71Å; Y716-F1037 HydrophobicContact CG-CZ 4.01Å; Y716-L1042 VanDerWaalsContact CB-CD2 3.47Å; Y716-L1042 HydrophobicContact CD1-CD2 3.58Å; Y716-L1042 HydrophobicContact CD2-CD2 4.14Å; Y716-L1042 HydrophobicContact CE1-CD2 4.35Å; Y716-L1042 HydrophobicContact CG-CD2 3.46Å; Y716-L1042 VanDerWaalsContact CG-CD2 3.46Å; Y716-L1048 HydrophobicContact CD1-CD1 4.43Å; Y716-L1048 HydrophobicContact CE1-CD1 4.38Å; Y716-L1048 HydrophobicContact CE1-CD2 4.2Å; Y716-L1052 HydrophobicContact CD1-CD1 4.44Å; Y716-L1052 HydrophobicContact CD1-CD2 3.74Å; Y716-L1052 HydrophobicContact CD1-CG 4.43Å; Y716-L1052 HydrophobicContact CE1-CD1 3.92Å; Y716-L1052 HydrophobicContact CE1-CD2 4.05Å; Y716-L1052 HydrophobicContact CE1-CG 4.38Å
717	Y	76.5	Confident	71	Confident	10 Å²	10	37.1 Å²	37.1	4%	0.039	19%	0.186	C	C	.	.	H	α-helix	trans	-60.6	-37.7	174.3	175	-95.1	0	0	0	111.8	I713 G714 C720 Y721 P864 L1052 V1055 H1056 V1059	I713-Y717 WeakPolarHBondContact O-CB 3.35Å; I713-Y717 PolarHBondContact O-N 3.02Å; G714-Y717 PolarHBondContact O-N 3.24Å; Y717-C720 PolarHBondContact O-N 2.93Å; Y717-Y721 VanDerWaalsContact O-CB 3.31Å; Y717-Y721 WeakPolarHBondContact O-CB 3.45Å; Y717-Y721 PolarHBondContact O-N 2.83Å; Y717-P864 HydrophobicContact CD2-CG 4.42Å; Y717-P864 HydrophobicContact CE2-CG 3.85Å; Y717-L1052 HydrophobicContact CD2-CD2 4.42Å; Y717-V1055 HydrophobicContact CD1-CG1 3.82Å; Y717-V1055 HydrophobicContact CD2-CB 4.41Å; Y717-V1055 HydrophobicContact CD2-CG1 3.92Å; Y717-V1055 HydrophobicContact CE1-CG1 4.46Å; Y717-V1055 HydrophobicContact CG-CB 4.42Å; Y717-V1055 HydrophobicContact CG-CG1 3.52Å; Y717-H1056 HydrophobicContact CE2-CB 3.65Å; Y717-H1056 AromaticContact CE2-ND1 3.68Å; Y717-H1056 AromaticContact CZ-ND1 3.7Å; Y717-H1056 PolarHBondContact OH-ND1 2.98Å; Y717-V1059 HydrophobicContact CD1-CG2 4.33Å; Y717-V1059 HydrophobicContact CE1-CB 4.22Å; Y717-V1059 HydrophobicContact CE1-CG1 4.29Å; Y717-V1059 HydrophobicContact CE1-CG2 3.79Å
718	Q	70.8	Confident	71.7	Confident	80 Å²	80	34.8 Å²	34.8	37%	0.374	17%	0.171	S	C	.	.	H	α-helix	trans	-61.4	-43.2	174.8	-72.3	170.8	-10.2	0	0	112	G714 Q715 Y716 Y721 K722	G714-Q718 WeakPolarHBondContact O-CG 3.43Å; G714-Q718 PolarHBondContact O-N 3.18Å; G714-Q718 VanDerWaalsContact O-N 3.1Å; Q715-Q718 WeakPolarHBondContact O-CB 3.49Å; Q715-Q718 PolarHBondContact O-N 3.36Å; Y716-Q718 VanDerWaalsContact C-N 3.27Å; Y716-Q718 PolarHBondContact O-N 2.99Å; Q718-Y721 PolarHBondContact O-N 2.84Å; Q718-K722 VanDerWaalsContact O-CB 3.29Å; Q718-K722 WeakPolarHBondContact O-CB 3.27Å; Q718-K722 PolarHBondContact O-N 2.84Å
719	L	73	Confident	72.5	Confident	50 Å²	50	31.8 Å²	31.8	26%	0.262	16%	0.162	S	C	.	.	H	α-helix	trans	-62.6	-45.2	175.5	-66.2	171.8	0	0	0	111.6	Q715 Y716 Y721 K722 Y723 L1021 L1025 F1037	Q715-L719 PolarHBondContact O-N 3.34Å; Q715-L719 VanDerWaalsContact O-N 3.15Å; Y716-L719 PolarHBondContact O-N 3.45Å; L719-Y721 VanDerWaalsContact C-N 3.35Å; L719-Y721 PolarHBondContact O-N 2.82Å; L719-K722 PolarHBondContact O-N 2.7Å; L719-Y723 WeakPolarHBondContact O-CB 3.32Å; L719-Y723 PolarHBondContact O-N 3.32Å; L719-L1021 HydrophobicContact CD2-CD1 4.16Å; L719-L1025 HydrophobicContact CB-CD2 4.24Å; L719-F1037 HydrophobicContact CD1-CB 4.49Å; L719-F1037 HydrophobicContact CD1-CD2 4.5Å; L719-F1037 HydrophobicContact CD1-CG 4.35Å
720	C	75.4	Confident	73.1	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-62.4	-41.6	177.5	-61.6	0	0	0	0	112.1	Y716 Y717 Y723 R724 P864	Y716-C720 PolarHBondContact O-N 3.24Å; Y716-C720 PolarHBondContact O-SG 3.35Å; Y717-C720 PolarHBondContact O-N 2.93Å; C720-Y723 WeakPolarHBondContact O-CB 3.39Å; C720-Y723 PolarHBondContact O-N 3.38Å; C720-R724 PolarHBondContact O-N 2.79Å; C720-R724 VanDerWaalsContact O-N 3.17Å; C720-P864 HydrophobicContact CB-CB 4.19Å; C720-P864 HydrophobicContact CB-CG 4.33Å; C720-P864 WeakPolarHBondContact CB-O 3.12Å
721	Y	75.5	Confident	73.7	Confident	24 Å²	24	32.2 Å²	32.2	9%	0.094	16%	0.163	C	C	.	.	H	α-helix	trans	-66.1	-44.3	176.1	179.1	-101.5	0	0	0	111.8	F689 Y717 Q718 L719 Y723 R724 Q725 F857 M858	F689-Y721 AromaticContact CE2-CE1 3.8Å; F689-Y721 HydrophobicContact CE2-CE1 3.8Å; F689-Y721 HydrophobicContact CZ-CD1 4.12Å; F689-Y721 AromaticContact CZ-CE1 3.56Å; F689-Y721 HydrophobicContact CZ-CE1 3.56Å; Y717-Y721 VanDerWaalsContact O-CB 3.31Å; Y717-Y721 WeakPolarHBondContact O-CB 3.45Å; Y717-Y721 PolarHBondContact O-N 2.83Å; Q718-Y721 PolarHBondContact O-N 2.84Å; L719-Y721 VanDerWaalsContact C-N 3.35Å; L719-Y721 PolarHBondContact O-N 2.82Å; Y721-Y723 VanDerWaalsContact C-N 3.32Å; Y721-Y723 PolarHBondContact O-N 3.04Å; Y721-R724 PolarHBondContact O-N 3.02Å; Y721-R724 VanDerWaalsContact O-N 3.17Å; Y721-Q725 HydrophobicContact CD1-CG 4.18Å; Y721-Q725 HydrophobicContact CE1-CG 3.69Å; Y721-Q725 HydrophobicContact CE2-CG 4.35Å; Y721-Q725 PolarHBondContact O-N 2.76Å; Y721-Q725 PolarHBondContact OH-NE2 2.91Å; Y721-F857 HydrophobicContact CD2-CD1 4.12Å; Y721-F857 HydrophobicContact CD2-CE1 4.43Å; Y721-F857 AromaticContact CE2-CD1 3.92Å; Y721-F857 HydrophobicContact CE2-CD1 3.92Å; Y721-M858 HydrophobicContact CD1-CE 4.4Å; Y721-M858 HydrophobicContact CD2-CE 3.48Å; Y721-M858 VanDerWaalsContact CD2-CE 3.48Å; Y721-M858 HydrophobicContact CD2-SD 4.09Å; Y721-M858 HydrophobicContact CE1-CE 4.03Å; Y721-M858 HydrophobicContact CE2-CE 3.02Å; Y721-M858 HydrophobicContact CE2-CG 3.98Å; Y721-M858 HydrophobicContact CE2-SD 3.54Å; Y721-M858 VanDerWaalsContact CE2-SD 3.54Å; Y721-M858 HydrophobicContact CG-CE 4.15Å
722	K	75.2	Confident	74.2	Confident	85 Å²	85	30.4 Å²	30.4	37%	0.37	16%	0.158	S	C	.	.	H	α-helix	trans	-59.3	-42.8	175.9	-173.3	177.6	-178.9	-175.9	0	111.5	Q718 L719 R724 Q725 L726 E1017 L1021	Q718-K722 VanDerWaalsContact O-CB 3.29Å; Q718-K722 WeakPolarHBondContact O-CB 3.27Å; Q718-K722 PolarHBondContact O-N 2.84Å; L719-K722 PolarHBondContact O-N 2.7Å; K722-R724 VanDerWaalsContact C-N 3.32Å; K722-R724 PolarHBondContact O-N 3.31Å; K722-Q725 WeakPolarHBondContact O-CB 3.46Å; K722-Q725 PolarHBondContact O-N 3.22Å; K722-L726 HydrophobicContact CG-CD1 4.35Å; K722-L726 WeakPolarHBondContact O-CG 3.44Å; K722-L726 PolarHBondContact O-N 3.31Å; K722-E1017 WeakPolarHBondContact CE-OE1 3.4Å; K722-E1017 IonicContact NZ-OE1 3.67Å; K722-E1017 PolarHBondContact NZ-OE1 2.89Å; K722-L1021 HydrophobicContact CB-CD2 4.13Å; K722-L1021 HydrophobicContact CD-CD2 4.29Å; K722-L1021 HydrophobicContact CG-CD2 3.97Å
723	Y	76.7	Confident	74.8	Confident	12 Å²	12	30.7 Å²	30.7	5%	0.047	16%	0.16	C	C	.	.	H	α-helix	trans	-56.9	-45.4	174	169.5	-102.8	0	0	0	112.8	L719 C720 Y721 L726 T727 V897 Y1018 N1022 L1025	L719-Y723 WeakPolarHBondContact O-CB 3.32Å; L719-Y723 PolarHBondContact O-N 3.32Å; C720-Y723 WeakPolarHBondContact O-CB 3.39Å; C720-Y723 PolarHBondContact O-N 3.38Å; Y721-Y723 VanDerWaalsContact C-N 3.32Å; Y721-Y723 PolarHBondContact O-N 3.04Å; Y723-L726 PolarHBondContact O-N 2.82Å; Y723-T727 PolarHBondContact O-N 2.81Å; Y723-T727 PolarHBondContact O-OG1 3.01Å; Y723-V897 PolarHBondContact OH-O 2.86Å; Y723-Y1018 HydrophobicContact CD2-CE2 4.48Å; Y723-Y1018 AromaticContact CE2-CE2 3.93Å; Y723-Y1018 HydrophobicContact CE2-CE2 3.93Å; Y723-N1022 HydrophobicContact CE2-CB 3.89Å; Y723-N1022 WeakPolarHBondContact CE2-OD1 3.49Å; Y723-N1022 PolarHBondContact OH-OD1 2.94Å; Y723-N1022 VanDerWaalsContact OH-OD1 3.05Å; Y723-L1025 VanDerWaalsContact CB-CD1 3.44Å; Y723-L1025 HydrophobicContact CD2-CD1 4.24Å; Y723-L1025 HydrophobicContact CG-CD1 3.86Å
724	R	76.5	Confident	75	Confident	13 Å²	13	30.8 Å²	30.8	5%	0.049	16%	0.16	C	C	.	.	H	α-helix	trans	-67.4	-37.5	177.5	-172	60.6	174.8	-174.4	2.1	112.6	C720 Y721 K722 T727 N728 F857 P864 S893 D894	C720-R724 PolarHBondContact O-N 2.79Å; C720-R724 VanDerWaalsContact O-N 3.17Å; Y721-R724 PolarHBondContact O-N 3.02Å; Y721-R724 VanDerWaalsContact O-N 3.17Å; K722-R724 VanDerWaalsContact C-N 3.32Å; K722-R724 PolarHBondContact O-N 3.31Å; R724-T727 PolarHBondContact O-N 3.44Å; R724-N728 PolarHBondContact O-N 2.99Å; R724-N728 VanDerWaalsContact O-N 3.11Å; R724-F857 HydrophobicContact CB-CD1 4.48Å; R724-F857 HydrophobicContact CB-CE1 4.22Å; R724-F857 HydrophobicContact CB-CZ 4.39Å; R724-F857 HydrophobicContact CG-CD1 3.84Å; R724-F857 HydrophobicContact CG-CD2 3.69Å; R724-F857 HydrophobicContact CG-CE1 3.66Å; R724-F857 HydrophobicContact CG-CE2 3.5Å; R724-F857 HydrophobicContact CG-CG 3.89Å; R724-F857 HydrophobicContact CG-CZ 3.51Å; R724-F857 VanDerWaalsContact NE-CE2 3.28Å; R724-P864 HydrophobicContact CB-CB 4.21Å; R724-S893 PolarHBondContact NH2-O 3.05Å; R724-D894 PolarHBondContact NH2-O 3.11Å
725	Q	74.4	Confident	75.2	Confident	68 Å²	68	32 Å²	32	32%	0.318	16%	0.164	S	C	.	.	H	α-helix	trans	-61.9	-48.9	173.2	-75	-170.1	-47.3	0	0	111.7	Y721 K722 T727 N728 S729	Y721-Q725 HydrophobicContact CD1-CG 4.18Å; Y721-Q725 HydrophobicContact CE1-CG 3.69Å; Y721-Q725 HydrophobicContact CE2-CG 4.35Å; Y721-Q725 PolarHBondContact O-N 2.76Å; Y721-Q725 PolarHBondContact OH-NE2 2.91Å; K722-Q725 WeakPolarHBondContact O-CB 3.46Å; K722-Q725 PolarHBondContact O-N 3.22Å; Q725-T727 VanDerWaalsContact C-N 3.28Å; Q725-T727 PolarHBondContact O-N 2.9Å; Q725-N728 PolarHBondContact O-N 3.08Å; Q725-N728 VanDerWaalsContact O-N 3.12Å; Q725-S729 PolarHBondContact O-N 3.22Å; Q725-S729 PolarHBondContact O-OG 3.32Å
726	L	76.9	Confident	75.3	Confident	12 Å²	12	33.7 Å²	33.7	6%	0.063	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-38.7	177.5	-71	174.3	0	0	0	112.1	K722 Y723 N728 S729 I730 L1014 E1017 Y1018 L1021	K722-L726 HydrophobicContact CG-CD1 4.35Å; K722-L726 WeakPolarHBondContact O-CG 3.44Å; K722-L726 PolarHBondContact O-N 3.31Å; Y723-L726 PolarHBondContact O-N 2.82Å; L726-N728 PolarHBondContact O-N 2.96Å; L726-S729 PolarHBondContact O-N 3.32Å; L726-I730 WeakPolarHBondContact O-CG1 3.32Å; L726-I730 PolarHBondContact O-N 3.48Å; L726-L1014 HydrophobicContact CD2-CD1 3.68Å; L726-E1017 HydrophobicContact CD1-CB 4.44Å; L726-E1017 HydrophobicContact CD1-CG 3.85Å; L726-E1017 HydrophobicContact CD2-CG 4.49Å; L726-Y1018 HydrophobicContact CB-CD2 4.2Å; L726-L1021 HydrophobicContact CD1-CB 4.41Å; L726-L1021 HydrophobicContact CD1-CD2 3.73Å
727	T	76.3	Confident	75.3	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-59	-46.6	174.2	-53	0	0	0	0	111.3	Y723 R724 Q725 I730 I731	Y723-T727 PolarHBondContact O-N 2.81Å; Y723-T727 PolarHBondContact O-OG1 3.01Å; R724-T727 PolarHBondContact O-N 3.44Å; Q725-T727 VanDerWaalsContact C-N 3.28Å; Q725-T727 PolarHBondContact O-N 2.9Å; T727-I730 PolarHBondContact O-N 2.98Å; T727-I731 HydrophobicContact CG2-CD1 4.14Å; T727-I731 WeakPolarHBondContact O-CD1 3.49Å; T727-I731 VanDerWaalsContact O-CG1 3.27Å; T727-I731 WeakPolarHBondContact O-CG1 3.38Å; T727-I731 PolarHBondContact O-N 3.44Å; T727-I731 VanDerWaalsContact O-N 3.07Å
728	N	74.8	Confident	75.2	Confident	45 Å²	45	37.9 Å²	37.9	24%	0.241	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-39.4	177.4	-74.5	-15.9	0	0	0	112.5	R724 Q725 L726 I731 S732 S893	R724-N728 PolarHBondContact O-N 2.99Å; R724-N728 VanDerWaalsContact O-N 3.11Å; Q725-N728 PolarHBondContact O-N 3.08Å; Q725-N728 VanDerWaalsContact O-N 3.12Å; L726-N728 PolarHBondContact O-N 2.96Å; N728-I731 PolarHBondContact O-N 3.15Å; N728-S732 PolarHBondContact O-N 3.3Å; N728-S893 PolarHBondContact OD1-O 3.45Å
729	S	76.6	Confident	75.3	Confident	48 Å²	48	36 Å²	36	34%	0.336	20%	0.196	S	C	.	.	H	α-helix	trans	-59.8	-47.2	175	-64.4	0	0	0	0	110.7	Q725 L726 I731 S732 T733	Q725-S729 PolarHBondContact O-N 3.22Å; Q725-S729 PolarHBondContact O-OG 3.32Å; L726-S729 PolarHBondContact O-N 3.32Å; S729-I731 VanDerWaalsContact C-N 3.33Å; S729-I731 PolarHBondContact O-N 2.71Å; S729-S732 PolarHBondContact O-N 3.35Å; S729-S732 VanDerWaalsContact O-N 3.12Å; S729-S732 PolarHBondContact O-OG 3.13Å; S729-T733 PolarHBondContact O-N 2.89Å; S729-T733 PolarHBondContact O-OG1 2.79Å
730	I	78.4	Confident	75.2	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-58.9	-44.9	175.8	-76	171.7	0	0	0	111.7	L726 T727 S732 T733 L734 F999 L1014 F1015 Y1018	L726-I730 WeakPolarHBondContact O-CG1 3.32Å; L726-I730 PolarHBondContact O-N 3.48Å; T727-I730 PolarHBondContact O-N 2.98Å; I730-S732 VanDerWaalsContact C-N 3.3Å; I730-S732 PolarHBondContact O-N 3.21Å; I730-T733 PolarHBondContact O-N 3.08Å; I730-L734 HydrophobicContact CG2-CD1 3.87Å; I730-L734 HydrophobicContact CG2-CG 4.24Å; I730-L734 WeakPolarHBondContact O-CB 3.34Å; I730-L734 VanDerWaalsContact O-CG 3.24Å; I730-L734 WeakPolarHBondContact O-CG 3.02Å; I730-L734 PolarHBondContact O-N 2.93Å; I730-F999 HydrophobicContact CG2-CZ 4.32Å; I730-L1014 HydrophobicContact CG1-CD2 4.3Å; I730-L1014 HydrophobicContact CG1-CG 4.25Å; I730-F1015 HydrophobicContact CB-CE1 4.44Å; I730-F1015 HydrophobicContact CD1-CD1 3.95Å; I730-F1015 HydrophobicContact CD1-CE1 4.26Å; I730-F1015 HydrophobicContact CG1-CD1 4.08Å; I730-F1015 HydrophobicContact CG1-CE1 4.01Å; I730-F1015 HydrophobicContact CG2-CD1 4.44Å; I730-F1015 HydrophobicContact CG2-CE1 3.72Å; I730-F1015 HydrophobicContact CG2-CZ 4.41Å; I730-Y1018 HydrophobicContact CD1-CD1 3.2Å; I730-Y1018 HydrophobicContact CD1-CD2 3.74Å; I730-Y1018 HydrophobicContact CD1-CE1 3.87Å; I730-Y1018 HydrophobicContact CD1-CE2 4.37Å; I730-Y1018 HydrophobicContact CD1-CG 3.11Å
731	I	76.7	Confident	75.2	Confident	18 Å²	18	43.9 Å²	43.9	9%	0.092	23%	0.232	C	C	.	.	H	α-helix	trans	-60	-44	177.2	-67.1	161.6	0	0	0	110.2	T727 N728 S729 T733 L734 D735 L892 L896	T727-I731 HydrophobicContact CG2-CD1 4.14Å; T727-I731 WeakPolarHBondContact O-CD1 3.49Å; T727-I731 VanDerWaalsContact O-CG1 3.27Å; T727-I731 WeakPolarHBondContact O-CG1 3.38Å; T727-I731 PolarHBondContact O-N 3.44Å; T727-I731 VanDerWaalsContact O-N 3.07Å; N728-I731 PolarHBondContact O-N 3.15Å; S729-I731 VanDerWaalsContact C-N 3.33Å; S729-I731 PolarHBondContact O-N 2.71Å; I731-T733 PolarHBondContact O-N 2.92Å; I731-L734 PolarHBondContact O-N 3.01Å; I731-D735 VanDerWaalsContact O-CB 3.27Å; I731-D735 WeakPolarHBondContact O-CB 3.35Å; I731-D735 PolarHBondContact O-N 3.27Å; I731-L892 HydrophobicContact CD1-CB 4.32Å; I731-L892 VanDerWaalsContact CD1-O 3.23Å; I731-L892 WeakPolarHBondContact CD1-O 3.46Å; I731-L892 HydrophobicContact CG1-CB 4.45Å; I731-L892 HydrophobicContact CG2-CB 4.06Å; I731-L896 HydrophobicContact CD1-CB 4.26Å; I731-L896 HydrophobicContact CD1-CD2 4.19Å; I731-L896 HydrophobicContact CG1-CD2 4.11Å
732	S	75	Confident	75.1	Confident	61 Å²	61	42.8 Å²	42.8	43%	0.427	23%	0.227	S	C	.	.	H	α-helix	trans	-65.1	-37.4	177.7	72.6	0	0	0	0	113	N728 S729 I730 D735 V736	N728-S732 PolarHBondContact O-N 3.3Å; S729-S732 PolarHBondContact O-N 3.35Å; S729-S732 VanDerWaalsContact O-N 3.12Å; S729-S732 PolarHBondContact O-OG 3.13Å; I730-S732 VanDerWaalsContact C-N 3.3Å; I730-S732 PolarHBondContact O-N 3.21Å; S732-D735 PolarHBondContact O-N 3.29Å; S732-V736 WeakPolarHBondContact O-CB 3.44Å; S732-V736 WeakPolarHBondContact O-CG2 3.45Å; S732-V736 PolarHBondContact O-N 3.19Å
733	T	78	Confident	75	Confident	18 Å²	18	45.3 Å²	45.3	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-68.5	-39.6	175.9	-47.7	0	0	0	0	111	S729 I730 I731 D735 K737 Y738	S729-T733 PolarHBondContact O-N 2.89Å; S729-T733 PolarHBondContact O-OG1 2.79Å; I730-T733 PolarHBondContact O-N 3.08Å; I731-T733 PolarHBondContact O-N 2.92Å; T733-D735 VanDerWaalsContact C-N 3.33Å; T733-K737 HydrophobicContact CG2-CB 4.25Å; T733-K737 HydrophobicContact CG2-CD 4.02Å; T733-K737 HydrophobicContact CG2-CG 4.38Å; T733-K737 WeakPolarHBondContact O-CA 3.42Å; T733-K737 WeakPolarHBondContact O-CB 3.25Å; T733-K737 PolarHBondContact O-N 3.47Å; T733-Y738 HydrophobicContact CG2-CD2 3.97Å; T733-Y738 HydrophobicContact CG2-CE2 3.63Å; T733-Y738 PolarHBondContact O-N 3.38Å
734	L	76.7	Confident	74.9	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-38	173.6	-69.6	175.9	0	0	0	112.2	I730 I731 Y738 A739 L742 I745 F746 F999 F1015	I730-L734 HydrophobicContact CG2-CD1 3.87Å; I730-L734 HydrophobicContact CG2-CG 4.24Å; I730-L734 WeakPolarHBondContact O-CB 3.34Å; I730-L734 VanDerWaalsContact O-CG 3.24Å; I730-L734 WeakPolarHBondContact O-CG 3.02Å; I730-L734 PolarHBondContact O-N 2.93Å; I731-L734 PolarHBondContact O-N 3.01Å; L734-Y738 HydrophobicContact CD2-CD2 4.44Å; L734-Y738 CarbonylContact O-C 3.51Å; L734-A739 PolarHBondContact O-N 3.47Å; L734-L742 HydrophobicContact CB-CD2 4.26Å; L734-I745 HydrophobicContact CD2-CD1 3.42Å; L734-I745 VanDerWaalsContact CD2-CD1 3.42Å; L734-F746 HydrophobicContact CD1-CZ 4.44Å; L734-F999 HydrophobicContact CD1-CE1 4.29Å; L734-F999 HydrophobicContact CD2-CE1 4.41Å; L734-F1015 HydrophobicContact CD2-CZ 4.37Å
735	D	72	Confident	75	Confident	36 Å²	36	49 Å²	49	19%	0.193	26%	0.259	C	S	.	.	H	α-helix	trans	-69.1	-42.4	179.9	-157.7	59.6	0	0	0	112.4	I731 S732 T733 W774 I785	I731-D735 VanDerWaalsContact O-CB 3.27Å; I731-D735 WeakPolarHBondContact O-CB 3.35Å; I731-D735 PolarHBondContact O-N 3.27Å; S732-D735 PolarHBondContact O-N 3.29Å; T733-D735 VanDerWaalsContact C-N 3.33Å; D735-W774 VanDerWaalsContact OD1-CH2 3.26Å; D735-W774 WeakPolarHBondContact OD1-CH2 3.48Å; D735-W774 WeakPolarHBondContact OD1-CZ3 3.29Å; D735-I785 HydrophobicContact CB-CD1 4.35Å; D735-I785 WeakPolarHBondContact OD1-CD1 3.41Å; D735-I785 WeakPolarHBondContact OD1-CG1 3.37Å
736	V	71.8	Confident	75.3	Confident	116 Å²	116	45.8 Å²	45.8	70%	0.703	24%	0.244	S	C	*	.	H	α-helix	trans	-96.4	-52.2	-172.5	-179.8	0	0	0	0	112.9	S732	S732-V736 WeakPolarHBondContact O-CB 3.44Å; S732-V736 WeakPolarHBondContact O-CG2 3.45Å; S732-V736 PolarHBondContact O-N 3.19Å
737	K	74.1	Confident	75.4	Confident	97 Å²	97	46.3 Å²	46.3	42%	0.422	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-42.4	-173.2	-72.4	-169.1	-179.8	-176.7	0	112.8	T733 D1008 D1011	T733-K737 HydrophobicContact CG2-CB 4.25Å; T733-K737 HydrophobicContact CG2-CD 4.02Å; T733-K737 HydrophobicContact CG2-CG 4.38Å; T733-K737 WeakPolarHBondContact O-CA 3.42Å; T733-K737 WeakPolarHBondContact O-CB 3.25Å; T733-K737 PolarHBondContact O-N 3.47Å; K737-D1008 IonicContact NZ-OD2 3.82Å; K737-D1008 PolarHBondContact NZ-OD2 2.88Å; K737-D1011 WeakPolarHBondContact CD-OD2 3.22Å; K737-D1011 IonicContact NZ-OD1 3.52Å; K737-D1011 PolarHBondContact NZ-OD1 2.68Å; K737-D1011 IonicContact NZ-OD2 3.44Å; K737-D1011 PolarHBondContact NZ-OD2 2.8Å; K737-D1011 VanDerWaalsContact NZ-OD2 3.08Å
738	Y	75.2	Confident	75.4	Confident	3 Å²	3	49.2 Å²	49.2	1%	0.012	27%	0.267	C	S	.	.	S	Bend	trans	-104.2	23.3	-171.2	-57.9	-74.8	0	0	0	114.5	T733 L734 Q740 H741 L742 L1003 V1006 M1007 D1011 F1015	T733-Y738 HydrophobicContact CG2-CD2 3.97Å; T733-Y738 HydrophobicContact CG2-CE2 3.63Å; T733-Y738 PolarHBondContact O-N 3.38Å; L734-Y738 HydrophobicContact CD2-CD2 4.44Å; L734-Y738 CarbonylContact O-C 3.51Å; Y738-Q740 PolarHBondContact O-N 3.25Å; Y738-H741 PolarHBondContact O-N 3.41Å; Y738-L742 PolarHBondContact O-N 3.05Å; Y738-L1003 HydrophobicContact CD1-CD1 4.28Å; Y738-L1003 HydrophobicContact CD1-CD2 3.85Å; Y738-L1003 HydrophobicContact CD2-CD1 4.45Å; Y738-L1003 HydrophobicContact CE1-CD1 4.41Å; Y738-L1003 HydrophobicContact CE1-CD2 4.42Å; Y738-L1003 HydrophobicContact CG-CD1 4.3Å; Y738-L1003 HydrophobicContact CG-CD2 4.26Å; Y738-V1006 HydrophobicContact CD1-CG1 4.44Å; Y738-V1006 HydrophobicContact CE1-CB 4.27Å; Y738-V1006 HydrophobicContact CE1-CG1 4.14Å; Y738-M1007 HydrophobicContact CE1-CG 4.17Å; Y738-M1007 VanDerWaalsContact OH-CA 3.3Å; Y738-M1007 WeakPolarHBondContact OH-CA 3.45Å; Y738-M1007 WeakPolarHBondContact OH-CG 3.36Å; Y738-D1011 PolarHBondContact OH-OD2 3.31Å; Y738-F1015 HydrophobicContact CE2-CE2 4.19Å
739	A	71.7	Confident	75.4	Confident	40 Å²	40	47.1 Å²	47.1	33%	0.331	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-53.1	-33.1	-178.1	0	0	0	0	0	113.7	L734 L742 W774	L734-A739 PolarHBondContact O-N 3.47Å; A739-L742 HydrophobicContact CB-CD1 4.4Å; A739-L742 WeakPolarHBondContact O-CD1 3.46Å; A739-L742 WeakPolarHBondContact O-CG 2.9Å; A739-W774 HydrophobicContact CB-CZ2 4.42Å
740	Q	71.1	Confident	75.9	Confident	180 Å²	180	45 Å²	45	84%	0.841	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-73.6	-24	178.6	-62.2	-178.2	-0.7	0	0	113.4	Y738	Y738-Q740 PolarHBondContact O-N 3.25Å
741	H	74.7	Confident	76.3	Confident	38 Å²	38	44.9 Å²	44.9	18%	0.176	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-96.2	-0.7	-179.7	-62.4	-80.2	0	0	0	113	Y738 Q743 Q744 I745 L1003	Y738-H741 PolarHBondContact O-N 3.41Å; H741-Q743 PolarHBondContact O-N 2.79Å; H741-Q743 VanDerWaalsContact O-N 3.15Å; H741-Q744 WeakPolarHBondContact O-CB 3.4Å; H741-Q744 PolarHBondContact O-N 3.02Å; H741-I745 PolarHBondContact O-N 3.27Å; H741-L1003 HydrophobicContact CB-CD2 3.7Å
742	L	75.3	Confident	76.9	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58	-30.8	-178.6	-68.8	176.7	0	0	0	113.3	L734 Y738 A739 Q744 I745 F746 Y772 W774 I785	L734-L742 HydrophobicContact CB-CD2 4.26Å; Y738-L742 PolarHBondContact O-N 3.05Å; A739-L742 HydrophobicContact CB-CD1 4.4Å; A739-L742 WeakPolarHBondContact O-CD1 3.46Å; A739-L742 WeakPolarHBondContact O-CG 2.9Å; L742-Q744 VanDerWaalsContact C-N 3.26Å; L742-Q744 PolarHBondContact O-N 3.45Å; L742-I745 PolarHBondContact O-N 3.12Å; L742-F746 HydrophobicContact CB-CD2 4.39Å; L742-F746 HydrophobicContact CD2-CD2 3.88Å; L742-F746 HydrophobicContact CD2-CE2 3.68Å; L742-F746 PolarHBondContact O-N 3.3Å; L742-Y772 HydrophobicContact CB-CE2 4.22Å; L742-Y772 HydrophobicContact CD1-CE2 4.38Å; L742-W774 HydrophobicContact CD1-CH2 4.19Å; L742-W774 HydrophobicContact CD1-CZ2 3.58Å; L742-I785 HydrophobicContact CD1-CD1 3.66Å; L742-I785 HydrophobicContact CD1-CG1 4.45Å; L742-I785 HydrophobicContact CD2-CD1 4.14Å
743	Q	72.1	Confident	77.4	Confident	139 Å²	139	41.2 Å²	41.2	65%	0.65	22%	0.216	S	C	*	.	H	α-helix	trans	-64	-31.2	174.7	-71.3	-170.1	-13.8	0	0	112.8	H741 C747 Y772	H741-Q743 PolarHBondContact O-N 2.79Å; H741-Q743 VanDerWaalsContact O-N 3.15Å; Q743-C747 WeakPolarHBondContact O-CA 3.37Å; Q743-C747 WeakPolarHBondContact O-CB 3.39Å; Q743-C747 PolarHBondContact O-N 2.95Å; Q743-Y772 HydrophobicContact CG-CE1 4.13Å; Q743-Y772 WeakPolarHBondContact CG-OH 3.28Å
744	Q	74.8	Confident	77.8	Confident	101 Å²	101	40.4 Å²	40.4	47%	0.472	21%	0.211	S	C	.	.	H	α-helix	trans	-78.3	-25.9	177.1	-62.9	176.1	-8.3	0	0	111.9	H741 L742 R750 Y1002	H741-Q744 WeakPolarHBondContact O-CB 3.4Å; H741-Q744 PolarHBondContact O-N 3.02Å; L742-Q744 VanDerWaalsContact C-N 3.26Å; L742-Q744 PolarHBondContact O-N 3.45Å; Q744-R750 PolarHBondContact O-NH1 3.48Å; Q744-Y1002 PolarHBondContact OE1-O 3.41Å
745	I	77.9	Confident	78.1	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-91.2	-41.6	-178	-64.1	176.7	0	0	0	112	L734 H741 L742 R750 I899 M997 L1003	L734-I745 HydrophobicContact CD2-CD1 3.42Å; L734-I745 VanDerWaalsContact CD2-CD1 3.42Å; H741-I745 PolarHBondContact O-N 3.27Å; L742-I745 PolarHBondContact O-N 3.12Å; I745-R750 VanDerWaalsContact CA-NH1 3.33Å; I745-R750 VanDerWaalsContact O-CD 3.24Å; I745-R750 WeakPolarHBondContact O-CD 3.03Å; I745-R750 PolarHBondContact O-NH1 2.96Å; I745-I899 HydrophobicContact CG2-CD1 4.07Å; I745-M997 HydrophobicContact CB-CE 4.44Å; I745-M997 HydrophobicContact CG1-CE 4.14Å; I745-M997 HydrophobicContact CG2-CE 3.9Å; I745-L1003 HydrophobicContact CD1-CD1 4.35Å; I745-L1003 HydrophobicContact CD1-CD2 4.15Å; I745-L1003 HydrophobicContact CD1-CG 4.47Å
746	F	80.9	Confident	78.3	Confident	1 Å²	1	40.9 Å²	40.9	0%	0.004	21%	0.212	C	C	.	.	S	Bend	trans	-112	45	-178.6	-59.4	-54.3	0	0	0	111.4	L734 L742 I769 Y772 L787 L892 I899	L734-F746 HydrophobicContact CD1-CZ 4.44Å; L742-F746 HydrophobicContact CB-CD2 4.39Å; L742-F746 HydrophobicContact CD2-CD2 3.88Å; L742-F746 HydrophobicContact CD2-CE2 3.68Å; L742-F746 PolarHBondContact O-N 3.3Å; F746-I769 HydrophobicContact CB-CD1 4.15Å; F746-I769 HydrophobicContact CD1-CD1 3.71Å; F746-I769 HydrophobicContact CG-CD1 4.41Å; F746-Y772 HydrophobicContact CB-CD1 4.06Å; F746-L787 HydrophobicContact CB-CD2 4.17Å; F746-L787 HydrophobicContact CD1-CD1 4.16Å; F746-L787 HydrophobicContact CD1-CD2 4Å; F746-L787 HydrophobicContact CD2-CD2 4.3Å; F746-L787 HydrophobicContact CE1-CD1 4.2Å; F746-L787 HydrophobicContact CE1-CD2 4.47Å; F746-L787 HydrophobicContact CG-CD2 3.91Å; F746-L892 HydrophobicContact CE1-CD1 4.18Å; F746-L892 HydrophobicContact CE1-CD2 4.05Å; F746-L892 HydrophobicContact CE2-CD1 3.64Å; F746-L892 HydrophobicContact CZ-CD1 3.39Å; F746-L892 HydrophobicContact CZ-CD2 3.99Å; F746-L892 HydrophobicContact CZ-CG 4.36Å; F746-I899 HydrophobicContact CE1-CD1 3.82Å; F746-I899 HydrophobicContact CZ-CD1 4.32Å
747	C	79	Confident	78.3	Confident	23 Å²	23	39.6 Å²	39.6	16%	0.155	20%	0.199	C	C	.	.			trans	-65.8	146.2	177.7	60.7	0	0	0	0	111.7	Q743 G749 R750	Q743-C747 WeakPolarHBondContact O-CA 3.37Å; Q743-C747 WeakPolarHBondContact O-CB 3.39Å; Q743-C747 PolarHBondContact O-N 2.95Å; C747-G749 PolarHBondContact O-N 3.45Å; C747-R750 WeakPolarHBondContact O-CB 3.36Å; C747-R750 PolarHBondContact O-N 3.36Å; C747-R750 VanDerWaalsContact SG-CZ 3.52Å
748	P	77.1	Confident	77.9	Confident	62 Å²	62	36.9 Å²	36.9	40%	0.403	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	136.9	173.5	-24	33.5	0	0	0	111.6	I769 I770	P748-I769 WeakPolarHBondContact CA-O 3.37Å; P748-I770 WeakPolarHBondContact CB-O 3.35Å; P748-I770 WeakPolarHBondContact CG-O 3.33Å
749	G	74.9	Confident	77.2	Confident	1 Å²	1	40 Å²	40	1%	0.01	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.5	-9	-177.6	0	0	0	0	0	114.6	C747 I769 V904	C747-G749 PolarHBondContact O-N 3.45Å; G749-I769 PolarHBondContact N-O 3.12Å; G749-V904 WeakPolarHBondContact O-CB 3.36Å; G749-V904 PolarHBondContact O-N 2.88Å
750	R	85.9	Confident	76.5	Confident	3 Å²	3	43.9 Å²	43.9	1%	0.011	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	135.5	177.3	-178.1	156.3	-76.2	161.4	-0.6	112.2	Q744 I745 C747 V768 I769 M997	Q744-R750 PolarHBondContact O-NH1 3.48Å; I745-R750 VanDerWaalsContact CA-NH1 3.33Å; I745-R750 VanDerWaalsContact O-CD 3.24Å; I745-R750 WeakPolarHBondContact O-CD 3.03Å; I745-R750 PolarHBondContact O-NH1 2.96Å; C747-R750 WeakPolarHBondContact O-CB 3.36Å; C747-R750 PolarHBondContact O-N 3.36Å; C747-R750 VanDerWaalsContact SG-CZ 3.52Å; R750-V768 WeakPolarHBondContact O-CA 3.07Å; R750-I769 HydrophobicContact CB-CD1 4.29Å; R750-I769 PolarHBondContact O-N 2.88Å; R750-M997 PolarHBondContact NH1-SD 3.03Å; R750-M997 VanDerWaalsContact NH1-SD 3.44Å
751	L	87.3	Confident	76	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.016	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	136.2	176.6	-172.2	71.1	0	0	0	110.6	V768 C900 Q902 L967 C970 P994	L751-V768 HydrophobicContact CD1-CG2 4.16Å; L751-C900 HydrophobicContact CB-CB 4.07Å; L751-C900 HydrophobicContact CD2-CB 4.34Å; L751-C900 HydrophobicContact CG-CB 4.36Å; L751-C900 VanDerWaalsContact O-CB 3.23Å; L751-C900 WeakPolarHBondContact O-CB 3.16Å; L751-C900 PolarHBondContact O-N 3.27Å; L751-C900 VanDerWaalsContact O-N 3.08Å; L751-Q902 HydrophobicContact CB-CB 4.44Å; L751-Q902 HydrophobicContact CD2-CB 4.43Å; L751-Q902 PolarHBondContact N-O 3.27Å; L751-Q902 VanDerWaalsContact N-O 3.14Å; L751-L967 HydrophobicContact CD1-CD2 4.16Å; L751-C970 HydrophobicContact CD1-CB 4.4Å; L751-C970 HydrophobicContact CD2-CB 3.95Å; L751-P994 HydrophobicContact CD2-CB 4.29Å; L751-P994 HydrophobicContact CD2-CG 3.72Å
752	I	88.5	Confident	75.9	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	154.8	177.1	60.9	173.6	0	0	0	110.8	L754 P766 A767 I769 L787 V789 R898 I899	I752-L754 HydrophobicContact CD1-CD1 4.08Å; I752-L754 HydrophobicContact CD1-CD2 3.82Å; I752-L754 HydrophobicContact CD1-CG 3.95Å; I752-L754 HydrophobicContact CG1-CD2 4.47Å; I752-L754 HydrophobicContact CG1-CG 4.24Å; I752-P766 WeakPolarHBondContact O-CA 3.43Å; I752-A767 HydrophobicContact CG1-CB 4.03Å; I752-A767 WeakPolarHBondContact CG1-O 3.2Å; I752-A767 PolarHBondContact N-O 2.98Å; I752-A767 PolarHBondContact O-N 3.24Å; I752-I769 HydrophobicContact CD1-CD1 4.37Å; I752-I769 HydrophobicContact CD1-CG1 3.94Å; I752-I769 HydrophobicContact CG1-CG1 4.33Å; I752-I769 HydrophobicContact CG2-CD1 3.75Å; I752-I769 HydrophobicContact CG2-CG1 4.06Å; I752-L787 HydrophobicContact CD1-CD1 3.89Å; I752-V789 HydrophobicContact CD1-CG1 3.89Å; I752-R898 WeakPolarHBondContact CA-O 3.31Å; I752-I899 HydrophobicContact CG2-CG2 4.46Å
753	L	86.7	Confident	75.9	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.6	170.1	-59.3	178.9	0	0	0	109.6	L764 P766 V897 R898 I974 L990	L753-L764 HydrophobicContact CB-CD1 4.05Å; L753-L764 HydrophobicContact CD1-CD2 4.46Å; L753-P766 HydrophobicContact CD2-CB 4.01Å; L753-V897 HydrophobicContact CB-CB 4.37Å; L753-V897 WeakPolarHBondContact O-CB 3.42Å; L753-V897 PolarHBondContact O-N 2.93Å; L753-R898 HydrophobicContact CB-CB 4.02Å; L753-R898 HydrophobicContact CD1-CB 4.01Å; L753-R898 HydrophobicContact CG-CB 4.24Å; L753-R898 PolarHBondContact N-O 2.94Å; L753-R898 PolarHBondContact O-N 3.22Å; L753-I974 HydrophobicContact CD2-CD1 4.21Å; L753-L990 HydrophobicContact CD1-CD2 4.01Å
754	L	85.5	Confident	76.4	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	148.2	-178.3	-63.8	176.3	0	0	0	110.8	I752 F756 V765 A767 V789 V890 S895	I752-L754 HydrophobicContact CD1-CD1 4.08Å; I752-L754 HydrophobicContact CD1-CD2 3.82Å; I752-L754 HydrophobicContact CD1-CG 3.95Å; I752-L754 HydrophobicContact CG1-CD2 4.47Å; I752-L754 HydrophobicContact CG1-CG 4.24Å; L754-F756 HydrophobicContact CB-CD2 4.15Å; L754-F756 HydrophobicContact CB-CE2 3.53Å; L754-F756 HydrophobicContact CB-CZ 4.31Å; L754-F756 HydrophobicContact CD1-CE2 3.84Å; L754-F756 HydrophobicContact CD1-CZ 3.98Å; L754-F756 HydrophobicContact CG-CE2 4.35Å; L754-V765 PolarHBondContact N-O 3.12Å; L754-V765 PolarHBondContact O-N 2.94Å; L754-A767 HydrophobicContact CD1-CB 3.79Å; L754-A767 HydrophobicContact CG-CB 4.42Å; L754-V789 HydrophobicContact CD1-CG2 4.06Å; L754-V890 HydrophobicContact CD1-CB 4.45Å; L754-V890 HydrophobicContact CD1-CG1 4.17Å; L754-V890 HydrophobicContact CD1-CG2 4.11Å; L754-V890 HydrophobicContact CD2-CG1 4.27Å; L754-S895 CarbonylContact C-O 3.6Å; L754-S895 VanDerWaalsContact CA-O 3.25Å; L754-S895 WeakPolarHBondContact CA-O 3.29Å
755	Q	83.1	Confident	76.8	Confident	22 Å²	22	24.1 Å²	24.1	10%	0.103	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	137.5	168	60.3	169.7	29.8	0	0	111.1	V762 W763 M870 D894 S895 V897	Q755-V762 HydrophobicContact CB-CG1 3.86Å; Q755-W763 CarbonylContact C-O 3.58Å; Q755-W763 VanDerWaalsContact CA-O 3.27Å; Q755-W763 WeakPolarHBondContact CA-O 3.31Å; Q755-M870 HydrophobicContact CB-CE 4.26Å; Q755-M870 HydrophobicContact CB-SD 4.18Å; Q755-D894 PolarHBondContact NE2-O 3.11Å; Q755-S895 WeakPolarHBondContact CG-O 3.46Å; Q755-S895 PolarHBondContact N-O 3.49Å; Q755-S895 PolarHBondContact O-OG 2.92Å; Q755-V897 HydrophobicContact CB-CG2 3.67Å; Q755-V897 HydrophobicContact CG-CG2 3.89Å
756	F	76.8	Confident	77.3	Confident	27 Å²	27	24.2 Å²	24.2	12%	0.118	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	138.3	174.5	-73.1	-84.2	0	0	0	111.7	L754 W763 V765 L794 V890	L754-F756 HydrophobicContact CB-CD2 4.15Å; L754-F756 HydrophobicContact CB-CE2 3.53Å; L754-F756 HydrophobicContact CB-CZ 4.31Å; L754-F756 HydrophobicContact CD1-CE2 3.84Å; L754-F756 HydrophobicContact CD1-CZ 3.98Å; L754-F756 HydrophobicContact CG-CE2 4.35Å; F756-W763 PolarHBondContact N-O 3.41Å; F756-W763 PolarHBondContact O-N 2.66Å; F756-V765 HydrophobicContact CD2-CB 3.88Å; F756-V765 HydrophobicContact CD2-CG2 3.68Å; F756-V765 HydrophobicContact CE2-CB 4.17Å; F756-V765 HydrophobicContact CE2-CG2 4.42Å; F756-L794 HydrophobicContact CB-CD1 4.41Å; F756-V890 HydrophobicContact CE1-CG2 4.32Å; F756-V890 HydrophobicContact CZ-CG1 4.36Å; F756-V890 HydrophobicContact CZ-CG2 3.83Å
757	M	71.7	Confident	77.6	Confident	89 Å²	89	24.1 Å²	24.1	44%	0.438	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	117.4	174.2	-73.6	-66.6	-69	0	0	110.2	S761 V762 T862	M757-S761 WeakPolarHBondContact CA-O 3.47Å; M757-V762 HydrophobicContact SD-CB 4.07Å; M757-V762 HydrophobicContact SD-CG2 3.26Å; M757-V762 WeakPolarHBondContact SD-CG2 3.45Å; M757-T862 HydrophobicContact CE-CG2 4.5Å; M757-T862 HydrophobicContact CG-CG2 3.79Å; M757-T862 HydrophobicContact SD-CG2 4.17Å
758	I	65.8	Low	78	Confident	39 Å²	39	23.2 Å²	23.2	20%	0.2	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	129.7	172.1	-58.8	-165.6	0	0	0	108.8	Q760 S761 L794	I758-Q760 PolarHBondContact O-N 2.86Å; I758-Q760 VanDerWaalsContact O-N 3.16Å; I758-S761 PolarHBondContact N-O 3.28Å; I758-S761 PolarHBondContact O-N 3.46Å; I758-L794 HydrophobicContact CD1-CB 3.29Å; I758-L794 HydrophobicContact CD1-CD1 3.28Å; I758-L794 HydrophobicContact CD1-CG 3.89Å; I758-L794 HydrophobicContact CG1-CD1 4.1Å
759	N	59.5	Low	78.3	Confident	69 Å²	69	20.3 Å²	20.3	37%	0.369	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	41.9	-178.8	-58.2	-17.9	0	0	0	114.5	S761 I796 N800	N759-S761 VanDerWaalsContact C-N 3.26Å; N759-S761 PolarHBondContact O-N 3.05Å; N759-I796 PolarHBondContact ND2-O 3.41Å; N759-N800 WeakPolarHBondContact CB-OD1 3.43Å
760	Q	57.3	Low	78.5	Confident	122 Å²	122	21 Å²	21	57%	0.57	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	9.7	-178.1	-50.8	178.3	-9.1	0	0	115.8	I758	I758-Q760 PolarHBondContact O-N 2.86Å; I758-Q760 VanDerWaalsContact O-N 3.16Å
761	S	61	Low	78.2	Confident	16 Å²	16	23.3 Å²	23.3	11%	0.112	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	140.8	173.5	-48.6	0	0	0	0	111	M757 I758 N759 N800	M757-S761 WeakPolarHBondContact CA-O 3.47Å; I758-S761 PolarHBondContact N-O 3.28Å; I758-S761 PolarHBondContact O-N 3.46Å; N759-S761 VanDerWaalsContact C-N 3.26Å; N759-S761 PolarHBondContact O-N 3.05Å; S761-N800 PolarHBondContact OG-O 3.13Å; S761-N800 VanDerWaalsContact OG-O 3.08Å
762	V	72.4	Confident	77.9	Confident	16 Å²	16	26 Å²	26	10%	0.097	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	112	175.5	-175.3	0	0	0	0	108.8	Q755 M757 V865 M870 P871	Q755-V762 HydrophobicContact CB-CG1 3.86Å; M757-V762 HydrophobicContact SD-CB 4.07Å; M757-V762 HydrophobicContact SD-CG2 3.26Å; M757-V762 WeakPolarHBondContact SD-CG2 3.45Å; V762-V865 HydrophobicContact CB-CB 4.49Å; V762-V865 HydrophobicContact CB-CG2 4.35Å; V762-V865 HydrophobicContact CG2-CB 4.36Å; V762-V865 HydrophobicContact CG2-CG2 3.83Å; V762-M870 HydrophobicContact CG1-CE 4.01Å; V762-M870 HydrophobicContact CG1-CG 4.18Å; V762-M870 HydrophobicContact CG1-SD 3.96Å; V762-P871 VanDerWaalsContact O-CD 3.3Å; V762-P871 WeakPolarHBondContact O-CD 3.41Å
763	W	76.7	Confident	77.6	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.015	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	142.8	179.4	-69.2	79.3	0	0	0	111.6	Q755 F756 V765 L794 L798 P871 F873 V985	Q755-W763 CarbonylContact C-O 3.58Å; Q755-W763 VanDerWaalsContact CA-O 3.27Å; Q755-W763 WeakPolarHBondContact CA-O 3.31Å; F756-W763 PolarHBondContact N-O 3.41Å; F756-W763 PolarHBondContact O-N 2.66Å; W763-V765 HydrophobicContact CB-CG2 4.49Å; W763-L794 HydrophobicContact CB-CD1 4.03Å; W763-L794 HydrophobicContact CG-CD1 4.28Å; W763-L798 HydrophobicContact CD2-CD1 4.25Å; W763-L798 HydrophobicContact CE3-CD1 4.39Å; W763-L798 HydrophobicContact CH2-CB 4.03Å; W763-L798 HydrophobicContact CH2-CD1 4.04Å; W763-L798 HydrophobicContact CH2-CD2 3.62Å; W763-L798 HydrophobicContact CH2-CG 4.11Å; W763-L798 HydrophobicContact CZ2-CB 3.64Å; W763-L798 HydrophobicContact CZ2-CD1 3.87Å; W763-L798 HydrophobicContact CZ2-CD2 4.11Å; W763-L798 HydrophobicContact CZ2-CG 4.09Å; W763-L798 HydrophobicContact CZ3-CD1 4.28Å; W763-L798 HydrophobicContact CZ3-CD2 4.05Å; W763-P871 HydrophobicContact CD2-CB 4.4Å; W763-P871 HydrophobicContact CD2-CG 3.89Å; W763-P871 HydrophobicContact CE3-CB 3.92Å; W763-P871 HydrophobicContact CE3-CG 3.92Å; W763-P871 HydrophobicContact CG-CG 4.38Å; W763-P871 HydrophobicContact CH2-CB 4.13Å; W763-P871 HydrophobicContact CH2-CG 4.29Å; W763-P871 HydrophobicContact CZ2-CG 4.27Å; W763-P871 HydrophobicContact CZ3-CB 3.8Å; W763-P871 HydrophobicContact CZ3-CG 4.15Å; W763-F873 HydrophobicContact CE3-CB 4.28Å; W763-F873 HydrophobicContact CZ3-CB 4.39Å; W763-V985 HydrophobicContact CH2-CB 4.37Å; W763-V985 HydrophobicContact CH2-CG1 3.75Å; W763-V985 HydrophobicContact CH2-CG2 3.68Å; W763-V985 HydrophobicContact CZ3-CG1 3.9Å; W763-V985 HydrophobicContact CZ3-CG2 4.11Å
764	L	81	Confident	77.2	Confident	2 Å²	2	34 Å²	34	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	123.4	171.2	-170.7	70	0	0	0	109.7	L753 M870 P871 V872 V897 L990	L753-L764 HydrophobicContact CB-CD1 4.05Å; L753-L764 HydrophobicContact CD1-CD2 4.46Å; L764-M870 HydrophobicContact CB-CB 3.85Å; L764-M870 HydrophobicContact CB-SD 4.22Å; L764-M870 HydrophobicContact CD1-SD 3.97Å; L764-P871 PolarHBondContact N-O 3.46Å; L764-V872 HydrophobicContact CB-CG2 4.13Å; L764-V872 HydrophobicContact CD2-CG2 3.99Å; L764-V897 HydrophobicContact CD1-CB 4.14Å; L764-V897 HydrophobicContact CD1-CG1 4Å; L764-V897 HydrophobicContact CD1-CG2 4.05Å; L764-L990 HydrophobicContact CD2-CD2 4.11Å
765	V	83.5	Confident	76.5	Confident	4 Å²	4	36.3 Å²	36.3	2%	0.024	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.2	-175.6	-173.8	0	0	0	0	109.8	L754 F756 W763 Q791 L794	L754-V765 PolarHBondContact N-O 3.12Å; L754-V765 PolarHBondContact O-N 2.94Å; F756-V765 HydrophobicContact CD2-CB 3.88Å; F756-V765 HydrophobicContact CD2-CG2 3.68Å; F756-V765 HydrophobicContact CE2-CB 4.17Å; F756-V765 HydrophobicContact CE2-CG2 4.42Å; W763-V765 HydrophobicContact CB-CG2 4.49Å; V765-Q791 HydrophobicContact CG1-CB 4.01Å; V765-Q791 HydrophobicContact CG1-CG 4.45Å; V765-L794 HydrophobicContact CG2-CD1 3.65Å; V765-L794 HydrophobicContact CG2-CD2 4.31Å; V765-L794 HydrophobicContact CG2-CG 4.24Å
766	P	88.2	Confident	75.6	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.019	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	141.7	169.5	30.5	-32.6	0	0	0	110.6	I752 L753 W792 L967 C970 V971	I752-P766 WeakPolarHBondContact O-CA 3.43Å; L753-P766 HydrophobicContact CD2-CB 4.01Å; P766-W792 HydrophobicContact CG-CZ3 4.31Å; P766-L967 HydrophobicContact CB-CD2 3.99Å; P766-L967 HydrophobicContact CG-CD2 4.31Å; P766-L967 WeakPolarHBondContact O-CD2 3.33Å; P766-C970 HydrophobicContact CB-CB 4.48Å; P766-V971 HydrophobicContact CG-CG2 3.61Å
767	A	88.3	Confident	74.6	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	156.1	178.9	0	0	0	0	0	111.6	I752 L754 V789 I790 Q791	I752-A767 HydrophobicContact CG1-CB 4.03Å; I752-A767 WeakPolarHBondContact CG1-O 3.2Å; I752-A767 PolarHBondContact N-O 2.98Å; I752-A767 PolarHBondContact O-N 3.24Å; L754-A767 HydrophobicContact CD1-CB 3.79Å; L754-A767 HydrophobicContact CG-CB 4.42Å; A767-V789 HydrophobicContact CB-CB 3.96Å; A767-V789 HydrophobicContact CB-CG2 4.06Å; A767-I790 CarbonylContact C-O 3.55Å; A767-I790 VanDerWaalsContact CA-O 3.3Å; A767-I790 WeakPolarHBondContact CA-O 3.49Å; A767-Q791 HydrophobicContact CB-CB 3.92Å
768	V	86.6	Confident	73.5	Confident	3 Å²	3	49 Å²	49	2%	0.018	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.8	175.3	178.4	0	0	0	0	109.8	R750 L751 V789 I790 V904 I963 L967	R750-V768 WeakPolarHBondContact O-CA 3.07Å; L751-V768 HydrophobicContact CD1-CG2 4.16Å; V768-V789 CarbonylContact O-C 3.55Å; V768-V789 VanDerWaalsContact O-CA 3.24Å; V768-V789 WeakPolarHBondContact O-CA 3.38Å; V768-I790 PolarHBondContact N-O 3.13Å; V768-I790 PolarHBondContact O-N 2.89Å; V768-V904 HydrophobicContact CG1-CG2 4.48Å; V768-V904 HydrophobicContact CG2-CG2 4.12Å; V768-I963 HydrophobicContact CB-CG2 4.4Å; V768-I963 HydrophobicContact CG2-CG2 4.17Å; V768-L967 HydrophobicContact CG2-CD2 3.98Å; V768-L967 HydrophobicContact CG2-CG 4.37Å
769	I	84.5	Confident	72.4	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	131.4	179.3	-61.8	-179.8	0	0	0	110.6	F746 P748 G749 R750 I752 L787	F746-I769 HydrophobicContact CB-CD1 4.15Å; F746-I769 HydrophobicContact CD1-CD1 3.71Å; F746-I769 HydrophobicContact CG-CD1 4.41Å; P748-I769 WeakPolarHBondContact CA-O 3.37Å; G749-I769 PolarHBondContact N-O 3.12Å; R750-I769 HydrophobicContact CB-CD1 4.29Å; R750-I769 PolarHBondContact O-N 2.88Å; I752-I769 HydrophobicContact CD1-CD1 4.37Å; I752-I769 HydrophobicContact CD1-CG1 3.94Å; I752-I769 HydrophobicContact CG1-CG1 4.33Å; I752-I769 HydrophobicContact CG2-CD1 3.75Å; I752-I769 HydrophobicContact CG2-CG1 4.06Å; I769-L787 HydrophobicContact CD1-CD1 4.12Å; I769-L787 HydrophobicContact CG1-CD1 4.41Å
770	I	79.1	Confident	71.6	Confident	14 Å²	14	61.5 Å²	61.5	7%	0.072	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	-58.6	170.2	-52.7	176.2	0	0	0	109.5	P748 N788 I790 R887 L926 L930	P748-I770 WeakPolarHBondContact CB-O 3.35Å; P748-I770 WeakPolarHBondContact CG-O 3.33Å; I770-N788 HydrophobicContact CB-CB 4.27Å; I770-N788 WeakPolarHBondContact CB-O 3.34Å; I770-N788 HydrophobicContact CD1-CB 4.46Å; I770-N788 PolarHBondContact N-O 3.05Å; I770-I790 HydrophobicContact CD1-CD1 3.91Å; I770-I790 HydrophobicContact CD1-CG1 3.49Å; I770-I790 VanDerWaalsContact CD1-CG1 3.49Å; I770-I790 HydrophobicContact CG1-CD1 3.97Å; I770-I790 HydrophobicContact CG1-CG1 3.7Å; I770-R887 HydrophobicContact CD1-CG 3.98Å; I770-L926 HydrophobicContact CG2-CD2 3.54Å; I770-L926 HydrophobicContact CG2-CG 4.15Å; I770-L930 HydrophobicContact CD1-CD2 3.78Å; I770-L930 HydrophobicContact CG2-CD1 4.3Å; I770-L930 HydrophobicContact CG2-CD2 3.86Å; I770-L930 HydrophobicContact CG2-CG 4.39Å
771	N	77.9	Confident	71.2	Confident	52 Å²	52	57.9 Å²	57.9	28%	0.278	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	178.2	178.2	64.4	9.7	0	0	0	109.7	N788	N771-N788 PolarHBondContact O-N 3.08Å; N771-N788 VanDerWaalsContact OD1-CB 3.23Å; N771-N788 WeakPolarHBondContact OD1-CB 3.33Å; N771-N788 PolarHBondContact OD1-ND2 2.87Å
772	Y	81.4	Confident	71	Confident	59 Å²	59	59.7 Å²	59.7	23%	0.231	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	155.6	176.7	69.1	-87.2	0	0	0	111.2	L742 Q743 F746 M786	L742-Y772 HydrophobicContact CB-CE2 4.22Å; L742-Y772 HydrophobicContact CD1-CE2 4.38Å; Q743-Y772 HydrophobicContact CG-CE1 4.13Å; Q743-Y772 WeakPolarHBondContact CG-OH 3.28Å; F746-Y772 HydrophobicContact CB-CD1 4.06Å; Y772-M786 CarbonylContact C-O 3.52Å; Y772-M786 VanDerWaalsContact CA-O 3.32Å; Y772-M786 WeakPolarHBondContact CA-O 3.33Å
773	H	81.6	Confident	70.6	Confident	68 Å²	68	63.2 Å²	63.2	32%	0.315	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	162	176.3	62.8	-69.8	0	0	0	111.3	M786	H773-M786 WeakPolarHBondContact CE1-CB 3.46Å; H773-M786 PolarHBondContact N-O 2.9Å; H773-M786 PolarHBondContact ND1-O 2.96Å; H773-M786 PolarHBondContact O-N 2.81Å
774	W	78.5	Confident	70.3	Confident	101 Å²	101	64.4 Å²	64.4	38%	0.383	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	142.8	-178.6	-63	88.4	0	0	0	111.5	D735 A739 L742 N783 I785	D735-W774 VanDerWaalsContact OD1-CH2 3.26Å; D735-W774 WeakPolarHBondContact OD1-CH2 3.48Å; D735-W774 WeakPolarHBondContact OD1-CZ3 3.29Å; A739-W774 HydrophobicContact CB-CZ2 4.42Å; L742-W774 HydrophobicContact CD1-CH2 4.19Å; L742-W774 HydrophobicContact CD1-CZ2 3.58Å; W774-N783 HydrophobicContact CE3-CB 3.65Å; W774-N783 HydrophobicContact CZ3-CB 4.14Å; W774-I785 HydrophobicContact CD2-CG1 4.06Å; W774-I785 HydrophobicContact CE3-CG1 3.79Å; W774-I785 HydrophobicContact CH2-CD1 3.81Å; W774-I785 HydrophobicContact CH2-CG1 3.68Å; W774-I785 HydrophobicContact CZ2-CD1 4.13Å; W774-I785 HydrophobicContact CZ2-CG1 3.9Å; W774-I785 HydrophobicContact CZ3-CD1 4.19Å; W774-I785 HydrophobicContact CZ3-CG1 3.65Å
775	T	70.8	Confident	70.1	Confident	50 Å²	50	64.5 Å²	64.5	31%	0.307	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	150.4	175.1	58.5	0	0	0	0	110.8	N783 Q784 M786	T775-N783 CarbonylContact O-C 3.53Å; T775-N783 WeakPolarHBondContact O-CA 3.32Å; T775-Q784 PolarHBondContact N-O 3.21Å; T775-Q784 PolarHBondContact O-N 2.57Å; T775-Q784 PolarHBondContact OG1-O 3.06Å; T775-M786 HydrophobicContact CG2-CG 3.73Å; T775-M786 WeakPolarHBondContact OG1-CG 3.16Å
776	K	64.4	Low	70.1	Confident	177 Å²	177	66 Å²	66	77%	0.77	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	130.8	177.9	-77.5	-174.1	174.8	-174	0	111.1
777	R	55.5	Low	69.9	Low	95 Å²	95	65.9 Å²	65.9	36%	0.358	33%	0.33	S	S	.	.			trans	-87.4	110.9	168	-102.2	-178.6	176.2	-165.9	-3.1	110.1	S781 G782 Q784 S893 D894	R777-S781 CarbonylContact O-C 3.55Å; R777-S781 VanDerWaalsContact O-C 3.27Å; R777-S781 WeakPolarHBondContact O-CA 3.19Å; R777-S781 PolarHBondContact O-N 3.3Å; R777-S781 PolarHBondContact O-OG 2.64Å; R777-G782 WeakPolarHBondContact CB-O 3.46Å; R777-G782 PolarHBondContact N-O 2.9Å; R777-Q784 HydrophobicContact CG-CB 4.27Å; R777-Q784 VanDerWaalsContact CG-OE1 3.31Å; R777-Q784 VanDerWaalsContact NE-CD 3.3Å; R777-S893 PolarHBondContact NH2-OG 3.33Å; R777-D894 IonicContact NH2-OD1 2.64Å
778	N	50.4	Low	69.6	Low	134 Å²	134	66.3 Å²	66.3	72%	0.717	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	-178.9	175.3	-82.4	-18.6	0	0	0	115.1	D780	N778-D780 PolarHBondContact O-N 3.12Å
779	K	41.8	Very low	69.6	Low	204 Å²	204	66.2 Å²	66.2	89%	0.887	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-15.8	-174.2	-78.3	-178	177.3	177.2	0	113.8
780	D	42.8	Very low	69.6	Low	165 Å²	165	66.7 Å²	66.7	88%	0.882	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.2	-0.3	-168.1	-59.7	-47.4	0	0	0	114.6	N778	N778-D780 PolarHBondContact O-N 3.12Å
781	S	48.8	Very low	69.9	Low	47 Å²	47	66.3 Å²	66.3	33%	0.329	33%	0.332	S	S	.	.	S	Bend	trans	-116.2	154.7	178.8	35	0	0	0	0	112.5	R777	R777-S781 CarbonylContact O-C 3.55Å; R777-S781 VanDerWaalsContact O-C 3.27Å; R777-S781 WeakPolarHBondContact O-CA 3.19Å; R777-S781 PolarHBondContact O-N 3.3Å; R777-S781 PolarHBondContact O-OG 2.64Å
782	G	56	Low	70.3	Confident	54 Å²	54	64 Å²	64	56%	0.557	32%	0.319	S	S	*	.			trans	-62.4	-173.5	-166.1	0	0	0	0	0	116.6	R777	R777-G782 WeakPolarHBondContact CB-O 3.46Å; R777-G782 PolarHBondContact N-O 2.9Å
783	N	64	Low	70.3	Confident	89 Å²	89	64 Å²	64	48%	0.476	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	153.5	172.7	-62.6	-25.9	0	0	0	110.2	W774 T775	W774-N783 HydrophobicContact CE3-CB 3.65Å; W774-N783 HydrophobicContact CZ3-CB 4.14Å; T775-N783 CarbonylContact O-C 3.53Å; T775-N783 WeakPolarHBondContact O-CA 3.32Å
784	Q	71	Confident	69.9	Low	30 Å²	30	61.7 Å²	61.7	14%	0.14	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	132.9	177.4	-177.1	-179.3	7.9	0	0	109.6	T775 R777 S891 S893	T775-Q784 PolarHBondContact N-O 3.21Å; T775-Q784 PolarHBondContact O-N 2.57Å; T775-Q784 PolarHBondContact OG1-O 3.06Å; R777-Q784 HydrophobicContact CG-CB 4.27Å; R777-Q784 VanDerWaalsContact CG-OE1 3.31Å; R777-Q784 VanDerWaalsContact NE-CD 3.3Å; Q784-S891 PolarHBondContact NE2-OG 3.32Å; Q784-S893 PolarHBondContact NE2-OG 3.49Å
785	I	77.7	Confident	69.4	Low	4 Å²	4	58.7 Å²	58.7	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	128.2	174.9	-64.1	159.8	0	0	0	110.9	D735 L742 W774 L787 L892	D735-I785 HydrophobicContact CB-CD1 4.35Å; D735-I785 WeakPolarHBondContact OD1-CD1 3.41Å; D735-I785 WeakPolarHBondContact OD1-CG1 3.37Å; L742-I785 HydrophobicContact CD1-CD1 3.66Å; L742-I785 HydrophobicContact CD1-CG1 4.45Å; L742-I785 HydrophobicContact CD2-CD1 4.14Å; W774-I785 HydrophobicContact CD2-CG1 4.06Å; W774-I785 HydrophobicContact CE3-CG1 3.79Å; W774-I785 HydrophobicContact CH2-CD1 3.81Å; W774-I785 HydrophobicContact CH2-CG1 3.68Å; W774-I785 HydrophobicContact CZ2-CD1 4.13Å; W774-I785 HydrophobicContact CZ2-CG1 3.9Å; W774-I785 HydrophobicContact CZ3-CD1 4.19Å; W774-I785 HydrophobicContact CZ3-CG1 3.65Å; I785-L787 HydrophobicContact CG2-CD2 4.33Å; I785-L892 HydrophobicContact CB-CD1 3.87Å; I785-L892 HydrophobicContact CD1-CD1 4.44Å; I785-L892 HydrophobicContact CG2-CD1 3.53Å; I785-L892 HydrophobicContact CG2-CG 4.38Å
786	M	82.6	Confident	69	Low	34 Å²	34	62.9 Å²	62.9	17%	0.167	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123.7	174.3	-65.2	-65.6	-70.1	0	0	109.8	Y772 H773 T775	Y772-M786 CarbonylContact C-O 3.52Å; Y772-M786 VanDerWaalsContact CA-O 3.32Å; Y772-M786 WeakPolarHBondContact CA-O 3.33Å; H773-M786 WeakPolarHBondContact CE1-CB 3.46Å; H773-M786 PolarHBondContact N-O 2.9Å; H773-M786 PolarHBondContact ND1-O 2.96Å; H773-M786 PolarHBondContact O-N 2.81Å; T775-M786 HydrophobicContact CG2-CG 3.73Å; T775-M786 WeakPolarHBondContact OG1-CG 3.16Å
787	L	84.3	Confident	68.6	Low	2 Å²	2	61.7 Å²	61.7	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.1	174	-63	-174.4	0	0	0	110.4	F746 I752 I769 I785 V789 S889 V890 L892	F746-L787 HydrophobicContact CB-CD2 4.17Å; F746-L787 HydrophobicContact CD1-CD1 4.16Å; F746-L787 HydrophobicContact CD1-CD2 4Å; F746-L787 HydrophobicContact CD2-CD2 4.3Å; F746-L787 HydrophobicContact CE1-CD1 4.2Å; F746-L787 HydrophobicContact CE1-CD2 4.47Å; F746-L787 HydrophobicContact CG-CD2 3.91Å; I752-L787 HydrophobicContact CD1-CD1 3.89Å; I769-L787 HydrophobicContact CD1-CD1 4.12Å; I769-L787 HydrophobicContact CG1-CD1 4.41Å; I785-L787 HydrophobicContact CG2-CD2 4.33Å; L787-V789 HydrophobicContact CB-CG1 3.84Å; L787-S889 CarbonylContact O-C 3.53Å; L787-S889 VanDerWaalsContact O-CA 3.32Å; L787-S889 WeakPolarHBondContact O-CA 3.47Å; L787-V890 PolarHBondContact N-O 3.4Å; L787-V890 PolarHBondContact O-N 2.88Å; L787-L892 HydrophobicContact CD1-CD2 3.45Å; L787-L892 VanDerWaalsContact CD1-CD2 3.45Å; L787-L892 HydrophobicContact CD1-CG 4.11Å; L787-L892 HydrophobicContact CG-CD1 4.41Å; L787-L892 HydrophobicContact CG-CD2 3.93Å; L787-L892 HydrophobicContact CG-CG 4.01Å
788	N	82.4	Confident	68.6	Low	9 Å²	9	57.6 Å²	57.6	5%	0.048	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	121.8	163.9	-68.2	-44	0	0	0	108.4	I770 N771 R887 S889	I770-N788 HydrophobicContact CB-CB 4.27Å; I770-N788 WeakPolarHBondContact CB-O 3.34Å; I770-N788 HydrophobicContact CD1-CB 4.46Å; I770-N788 PolarHBondContact N-O 3.05Å; N771-N788 PolarHBondContact O-N 3.08Å; N771-N788 VanDerWaalsContact OD1-CB 3.23Å; N771-N788 WeakPolarHBondContact OD1-CB 3.33Å; N771-N788 PolarHBondContact OD1-ND2 2.87Å; N788-R887 PolarHBondContact ND2-NH2 2.89Å; N788-R887 VanDerWaalsContact ND2-NH2 3.14Å; N788-S889 PolarHBondContact OD1-OG 3.12Å
789	V	85.4	Confident	68.8	Low	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	155.3	-172.7	-54.5	0	0	0	0	111.1	I752 L754 A767 V768 L787 R887 Q888 V890	I752-V789 HydrophobicContact CD1-CG1 3.89Å; L754-V789 HydrophobicContact CD1-CG2 4.06Å; A767-V789 HydrophobicContact CB-CB 3.96Å; A767-V789 HydrophobicContact CB-CG2 4.06Å; V768-V789 CarbonylContact O-C 3.55Å; V768-V789 VanDerWaalsContact O-CA 3.24Å; V768-V789 WeakPolarHBondContact O-CA 3.38Å; L787-V789 HydrophobicContact CB-CG1 3.84Å; V789-R887 WeakPolarHBondContact O-CA 3.2Å; V789-Q888 WeakPolarHBondContact CG2-O 3.28Å; V789-Q888 PolarHBondContact N-O 3.39Å; V789-Q888 PolarHBondContact O-N 3.01Å; V789-V890 HydrophobicContact CG2-CG2 3.72Å
790	I	85.1	Confident	69	Low	12 Å²	12	49.4 Å²	49.4	6%	0.062	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	126.9	168.7	-59.2	175.4	0	0	0	108.3	A767 V768 I770 L885 T886 I933 I963	A767-I790 CarbonylContact C-O 3.55Å; A767-I790 VanDerWaalsContact CA-O 3.3Å; A767-I790 WeakPolarHBondContact CA-O 3.49Å; V768-I790 PolarHBondContact N-O 3.13Å; V768-I790 PolarHBondContact O-N 2.89Å; I770-I790 HydrophobicContact CD1-CD1 3.91Å; I770-I790 HydrophobicContact CD1-CG1 3.49Å; I770-I790 VanDerWaalsContact CD1-CG1 3.49Å; I770-I790 HydrophobicContact CG1-CD1 3.97Å; I770-I790 HydrophobicContact CG1-CG1 3.7Å; I790-L885 HydrophobicContact CG2-CD2 3.93Å; I790-T886 WeakPolarHBondContact CA-O 3.39Å; I790-I933 HydrophobicContact CD1-CD1 4.4Å; I790-I963 HydrophobicContact CB-CG2 4.25Å; I790-I963 HydrophobicContact CD1-CD1 3.71Å; I790-I963 HydrophobicContact CG2-CG2 3.83Å
791	Q	86.1	Confident	69.2	Low	6 Å²	6	43.4 Å²	43.4	3%	0.028	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	173.4	179.6	66.4	178.5	9.8	0	0	111.2	V765 A767 T886	V765-Q791 HydrophobicContact CG1-CB 4.01Å; V765-Q791 HydrophobicContact CG1-CG 4.45Å; A767-Q791 HydrophobicContact CB-CB 3.92Å; Q791-T886 PolarHBondContact N-O 3.29Å; Q791-T886 PolarHBondContact O-N 2.83Å; Q791-T886 PolarHBondContact O-OG1 3.08Å
792	W	86	Confident	68.9	Low	3 Å²	3	42 Å²	42	1%	0.011	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	144	172.5	-59.8	-47.8	0	0	0	112.5	P766 L794 F873 P875 G881 R884 N964 L967 F968 V971	P766-W792 HydrophobicContact CG-CZ3 4.31Å; W792-L794 PolarHBondContact O-N 2.79Å; W792-F873 HydrophobicContact CB-CD1 4.42Å; W792-F873 HydrophobicContact CB-CE1 4.28Å; W792-F873 HydrophobicContact CE3-CD1 4.08Å; W792-F873 HydrophobicContact CE3-CE1 4.45Å; W792-P875 HydrophobicContact CD2-CG 3.53Å; W792-P875 VanDerWaalsContact CE2-CG 3.46Å; W792-P875 HydrophobicContact CE3-CG 3.6Å; W792-P875 HydrophobicContact CG-CG 4.25Å; W792-P875 VanDerWaalsContact CH2-CD 3.44Å; W792-P875 HydrophobicContact CH2-CG 3.57Å; W792-P875 HydrophobicContact CZ2-CG 3.5Å; W792-P875 HydrophobicContact CZ3-CG 3.61Å; W792-G881 PolarHBondContact NE1-O 2.68Å; W792-R884 HydrophobicContact CB-CB 4.21Å; W792-N964 PolarHBondContact NE1-OD1 3.08Å; W792-L967 HydrophobicContact CH2-CB 3.98Å; W792-L967 HydrophobicContact CZ2-CB 3.53Å; W792-F968 HydrophobicContact CH2-CB 4.47Å; W792-F968 HydrophobicContact CH2-CD2 4.4Å; W792-F968 HydrophobicContact CZ2-CB 4.23Å; W792-F968 HydrophobicContact CZ2-CD2 4.33Å; W792-V971 HydrophobicContact CH2-CB 4.27Å; W792-V971 HydrophobicContact CH2-CG2 3.77Å; W792-V971 HydrophobicContact CZ3-CB 4.36Å; W792-V971 HydrophobicContact CZ3-CG2 3.51Å
793	T	80.4	Confident	68.1	Low	61 Å²	61	43.4 Å²	43.4	37%	0.374	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-71.9	118.3	167.8	-40.6	0	0	0	0	109.3	R884 T886	T793-R884 PolarHBondContact N-O 3.29Å; T793-R884 PolarHBondContact OG1-O 3.35Å; T793-T886 WeakPolarHBondContact OG1-CG2 3.38Å
794	L	74	Confident	66.7	Low	19 Å²	19	46.6 Å²	46.6	10%	0.099	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-71.3	133.8	173.1	-69.2	172.3	0	0	0	110.3	F756 I758 W763 V765 W792 L798 F873	F756-L794 HydrophobicContact CB-CD1 4.41Å; I758-L794 HydrophobicContact CD1-CB 3.29Å; I758-L794 HydrophobicContact CD1-CD1 3.28Å; I758-L794 HydrophobicContact CD1-CG 3.89Å; I758-L794 HydrophobicContact CG1-CD1 4.1Å; W763-L794 HydrophobicContact CB-CD1 4.03Å; W763-L794 HydrophobicContact CG-CD1 4.28Å; V765-L794 HydrophobicContact CG2-CD1 3.65Å; V765-L794 HydrophobicContact CG2-CD2 4.31Å; V765-L794 HydrophobicContact CG2-CG 4.24Å; W792-L794 PolarHBondContact O-N 2.79Å; L794-L798 HydrophobicContact CB-CD1 3.91Å; L794-L798 HydrophobicContact CD2-CD1 4.08Å; L794-F873 HydrophobicContact CD2-CB 3.27Å; L794-F873 HydrophobicContact CD2-CD1 3.89Å; L794-F873 HydrophobicContact CD2-CD2 4.1Å; L794-F873 HydrophobicContact CD2-CG 3.48Å; L794-F873 VanDerWaalsContact CD2-CG 3.48Å
795	P	68.6	Low	65	Low	37 Å²	37	53.5 Å²	53.5	24%	0.24	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-60	142.1	175.5	-8	9.5	0	0	0	112.8	N797 L798 F873	P795-N797 PolarHBondContact O-N 2.93Å; P795-L798 HydrophobicContact CB-CG 4.13Å; P795-L798 HydrophobicContact CG-CD1 4.36Å; P795-L798 HydrophobicContact CG-CD2 4.01Å; P795-L798 HydrophobicContact CG-CG 3.93Å; P795-L798 WeakPolarHBondContact O-CD1 3.41Å; P795-L798 WeakPolarHBondContact O-CG 3.24Å; P795-L798 PolarHBondContact O-N 3.48Å; P795-F873 VanDerWaalsContact CD-CE2 3.48Å; P795-F873 HydrophobicContact CG-CD2 4.43Å; P795-F873 HydrophobicContact CG-CE2 3.66Å; P795-F873 HydrophobicContact CG-CZ 4.13Å
796	I	61	Low	63.2	Low	139 Å²	139	55.9 Å²	55.9	71%	0.713	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-26.8	177.1	-59.2	168.9	0	0	0	111.5	N759	N759-I796 PolarHBondContact ND2-O 3.41Å
797	N	55.9	Low	60.9	Low	152 Å²	152	58.9 Å²	58.9	81%	0.813	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	28.8	-176.7	-63.6	-14.4	0	0	0	113.6	P795	P795-N797 PolarHBondContact O-N 2.93Å
798	L	57.1	Low	58.5	Low	9 Å²	9	67.5 Å²	67.5	5%	0.047	35%	0.347	C	S	.	.			trans	-65	136.7	171.7	-74.7	160.9	0	0	0	109.9	W763 L794 P795 N800 F873 V985	W763-L798 HydrophobicContact CD2-CD1 4.25Å; W763-L798 HydrophobicContact CE3-CD1 4.39Å; W763-L798 HydrophobicContact CH2-CB 4.03Å; W763-L798 HydrophobicContact CH2-CD1 4.04Å; W763-L798 HydrophobicContact CH2-CD2 3.62Å; W763-L798 HydrophobicContact CH2-CG 4.11Å; W763-L798 HydrophobicContact CZ2-CB 3.64Å; W763-L798 HydrophobicContact CZ2-CD1 3.87Å; W763-L798 HydrophobicContact CZ2-CD2 4.11Å; W763-L798 HydrophobicContact CZ2-CG 4.09Å; W763-L798 HydrophobicContact CZ3-CD1 4.28Å; W763-L798 HydrophobicContact CZ3-CD2 4.05Å; L794-L798 HydrophobicContact CB-CD1 3.91Å; L794-L798 HydrophobicContact CD2-CD1 4.08Å; P795-L798 HydrophobicContact CB-CG 4.13Å; P795-L798 HydrophobicContact CG-CD1 4.36Å; P795-L798 HydrophobicContact CG-CD2 4.01Å; P795-L798 HydrophobicContact CG-CG 3.93Å; P795-L798 WeakPolarHBondContact O-CD1 3.41Å; P795-L798 WeakPolarHBondContact O-CG 3.24Å; P795-L798 PolarHBondContact O-N 3.48Å; L798-N800 PolarHBondContact O-OD1 2.86Å; L798-F873 HydrophobicContact CD2-CD2 4.02Å; L798-F873 HydrophobicContact CD2-CE2 4.4Å; L798-V985 HydrophobicContact CD2-CG2 4.4Å
799	P	53.9	Low	56.2	Low	71 Å²	71	71.7 Å²	71.7	46%	0.461	38%	0.378	S	S	.	.			trans	-63.2	137.9	-179.6	23	-30.9	0	0	0	111.7	S801 V985	P799-S801 PolarHBondContact O-N 3.15Å; P799-V985 HydrophobicContact CG-CG2 4.29Å
800	N	46.7	Very low	53.5	Low	94 Å²	94	75.2 Å²	75.2	50%	0.503	40%	0.402	S	S	.	.	S	Bend	trans	-76.6	-18.9	-172.5	-69.1	-3.1	0	0	0	114.2	N759 S761 L798	N759-N800 WeakPolarHBondContact CB-OD1 3.43Å; S761-N800 PolarHBondContact OG-O 3.13Å; S761-N800 VanDerWaalsContact OG-O 3.08Å; L798-N800 PolarHBondContact O-OD1 2.86Å
801	S	45.6	Very low	50.9	Low	39 Å²	39	80.1 Å²	80.1	27%	0.273	44%	0.437	S	S	.	.	S	Bend	trans	176.6	155	172.5	58.8	0	0	0	0	110.9	P799 T803 Y837	P799-S801 PolarHBondContact O-N 3.15Å; S801-T803 PolarHBondContact O-N 3.47Å; S801-Y837 WeakPolarHBondContact CB-OH 3.25Å; S801-Y837 PolarHBondContact OG-OH 3.02Å
802	L	42.9	Very low	48.3	Very low	18 Å²	18	85 Å²	85	9%	0.094	47%	0.472	C	S	.	.			trans	-48	128.1	170.1	-75.3	145.8	0	0	0	113	E806 L816 V818 Y987	L802-E806 HydrophobicContact CD2-CB 4.36Å; L802-L816 HydrophobicContact CD1-CD1 4.04Å; L802-L816 HydrophobicContact CD2-CB 4.41Å; L802-L816 HydrophobicContact CD2-CD2 4.38Å; L802-V818 HydrophobicContact CD2-CG2 3.63Å; L802-V818 HydrophobicContact CG-CG2 4.35Å; L802-Y987 HydrophobicContact CD1-CD2 4.34Å; L802-Y987 HydrophobicContact CD1-CE2 3.66Å; L802-Y987 HydrophobicContact CG-CE2 4.31Å
803	T	39.9	Very low	45.8	Very low	83 Å²	83	93.2 Å²	93.2	51%	0.509	51%	0.511	S	S	.	.			trans	-74.7	151.5	169.5	37.3	0	0	0	0	111.8	S801 E805 E806	S801-T803 PolarHBondContact O-N 3.47Å; T803-E805 PolarHBondContact O-N 2.82Å; T803-E806 PolarHBondContact O-N 3.39Å; T803-E806 PolarHBondContact OG1-OE2 3Å
804	Q	34.4	Very low	43.7	Very low	156 Å²	156	96.8 Å²	96.8	73%	0.729	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.3	-176.8	-89.9	-176.2	-31.4	0	0	114.5
805	E	34.8	Very low	41.8	Very low	176 Å²	176	98.9 Å²	98.9	82%	0.822	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-25.3	-177.1	-68.3	179.8	162.7	0	0	113.2	T803	T803-E805 PolarHBondContact O-N 2.82Å
806	E	39.4	Very low	40.3	Very low	54 Å²	54	99 Å²	99	25%	0.252	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-8.9	-175.1	-63.6	174.9	142.4	0	0	113.5	L802 T803	L802-E806 HydrophobicContact CD2-CB 4.36Å; T803-E806 PolarHBondContact O-N 3.39Å; T803-E806 PolarHBondContact OG1-OE2 3Å
807	R	35.2	Very low	38.9	Very low	97 Å²	97	95.9 Å²	95.9	37%	0.366	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-11.2	-176.7	-72.8	-176.1	-176.4	169.3	3.1	114.7	L816 P1046	R807-L816 HydrophobicContact CG-CD2 4.37Å; R807-P1046 PolarHBondContact NH1-O 3.3Å
808	Q	33.8	Very low	37.8	Very low	182 Å²	182	90 Å²	90	85%	0.85	50%	0.495	S	S	*	.	S	Bend	trans	-86.6	-3	-172.9	-71.9	-170.6	-11.5	0	0	114.4
809	S	33.2	Very low	36.6	Very low	98 Å²	98	93.7 Å²	93.7	69%	0.685	52%	0.522	S	S	*	.	S	Bend	trans	-120.5	47.7	-169.5	63.9	0	0	0	0	114.9
810	S	29.9	Very low	35.5	Very low	74 Å²	74	93.4 Å²	93.4	52%	0.517	53%	0.532	S	S	.	.			trans	-173.2	96.6	159.4	52.3	0	0	0	0	110.9
811	S	29.5	Very low	34.5	Very low	114 Å²	114	93.5 Å²	93.5	80%	0.797	54%	0.54	S	S	*	.			trans	-66.6	143.5	153.8	47.7	0	0	0	0	108.7
812	S	31.8	Very low	33.7	Very low	109 Å²	109	98.7 Å²	98.7	76%	0.762	57%	0.565	S	S	*	*	S	Bend	trans	76.3	118.9	-179.9	22.7	0	0	0	0	116.8
813	E	34.5	Very low	32.9	Very low	175 Å²	175	104.7 Å²	104.7	82%	0.818	60%	0.603	S	S	*	*	S	Bend	trans	64.1	115.9	175.1	-61.1	-172.2	159.2	0	0	116.6	V815	E813-V815 VanDerWaalsContact C-N 3.33Å; E813-V815 PolarHBondContact O-N 3.2Å
814	L	36.3	Very low	32.3	Very low	136 Å²	136	105.4 Å²	105.4	71%	0.712	61%	0.607	S	S	*	*			trans	-69.7	78	-173.7	-79	156.1	0	0	0	112.1
815	V	34.2	Very low	31.9	Very low	64 Å²	64	102.7 Å²	102.7	39%	0.388	60%	0.601	S	S	.	*			trans	-122.4	98.6	165.2	-176.7	0	0	0	0	107.3	E813 V817 P976	E813-V815 VanDerWaalsContact C-N 3.33Å; E813-V815 PolarHBondContact O-N 3.2Å; V815-V817 HydrophobicContact CG1-CG2 4.33Å; V815-P976 HydrophobicContact CG2-CG 4.22Å
816	L	35.7	Very low	31.5	Very low	39 Å²	39	99.8 Å²	99.8	20%	0.204	60%	0.6	C	S	.	*			trans	-97.9	111.8	177	-83.4	158.1	0	0	0	109.3	L802 R807	L802-L816 HydrophobicContact CD1-CD1 4.04Å; L802-L816 HydrophobicContact CD2-CB 4.41Å; L802-L816 HydrophobicContact CD2-CD2 4.38Å; R807-L816 HydrophobicContact CG-CD2 4.37Å
817	V	31.1	Very low	31	Very low	73 Å²	73	105.2 Å²	105.2	44%	0.442	63%	0.625	S	S	.	*			trans	-96.3	130.7	175.7	-180	0	0	0	0	108.7	V815	V815-V817 HydrophobicContact CG1-CG2 4.33Å
818	V	34.5	Very low	30.8	Very low	28 Å²	28	107.7 Å²	107.7	17%	0.17	64%	0.641	C	S	.	*			trans	-105.2	113.1	172.7	176.6	0	0	0	0	108.2	L802	L802-V818 HydrophobicContact CD2-CG2 3.63Å; L802-V818 HydrophobicContact CG-CG2 4.35Å
819	S	30.7	Very low	30.7	Very low	87 Å²	87	105.6 Å²	105.6	61%	0.608	63%	0.634	S	S	*	*			trans	-84.2	112.9	178.4	50.9	0	0	0	0	110.9
820	G	30.7	Very low	30.5	Very low	65 Å²	65	107 Å²	107	67%	0.67	63%	0.634	S	S	*	*			trans	-101	74.6	174.8	0	0	0	0	0	112.4	S983	G820-S983 PolarHBondContact N-OG 2.82Å
821	S	27	Very low	30.4	Very low	96 Å²	96	110.5 Å²	110.5	67%	0.671	65%	0.647	S	S	*	*			trans	-120.6	100.6	161.8	60.4	0	0	0	0	108.1
822	D	28	Very low	30.3	Very low	149 Å²	149	112.1 Å²	112.1	80%	0.797	65%	0.647	S	S	*	*			trans	-176.9	130.4	136.4	-86.7	-22.1	0	0	0	110.6	V824	D822-V824 PolarHBondContact O-N 3.28Å
823	T	26.1	Very low	30.2	Very low	144 Å²	144	115.6 Å²	115.6	88%	0.883	65%	0.648	S	S	*	*			trans	-62.6	95.5	172.7	45.4	0	0	0	0	110
824	V	26.6	Very low	29.7	Very low	98 Å²	98	114.6 Å²	114.6	59%	0.594	65%	0.648	S	S	*	*			trans	-98.5	112.6	172.2	-175.5	0	0	0	0	109.4	D822	D822-V824 PolarHBondContact O-N 3.28Å
825	T	25.9	Very low	29.3	Very low	99 Å²	99	114.4 Å²	114.4	61%	0.607	65%	0.653	S	S	*	*			trans	-60	149	174.9	47.2	0	0	0	0	111.6	E827	T825-E827 PolarHBondContact O-N 3.12Å
826	S	28	Very low	28.9	Very low	114 Å²	114	118.5 Å²	118.5	80%	0.797	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	11.2	-172.6	42.3	0	0	0	0	117.2
827	E	28.3	Very low	28.7	Very low	169 Å²	169	122.1 Å²	122.1	79%	0.79	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-11.9	-171.8	-72.6	-174.3	153.3	0	0	115.4	T825	T825-E827 PolarHBondContact O-N 3.12Å
828	Q	30	Very low	29.2	Very low	148 Å²	148	124.6 Å²	124.6	69%	0.692	69%	0.687	S	S	*	*	S	Bend	trans	-98.6	-4.4	-177.4	-71.8	-173.6	-19.2	0	0	115.7	N830	Q828-N830 VanDerWaalsContact C-N 3.3Å; Q828-N830 PolarHBondContact O-N 2.93Å
829	I	31.8	Very low	29.4	Very low	139 Å²	139	132 Å²	132	71%	0.713	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-13.3	-176.1	-65.6	172.7	0	0	0	113.1
830	N	29.9	Very low	30.4	Very low	127 Å²	127	131.1 Å²	131.1	68%	0.679	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-7.4	-174.9	-86.3	-27.4	0	0	0	116.2	Q828	Q828-N830 VanDerWaalsContact C-N 3.3Å; Q828-N830 PolarHBondContact O-N 2.93Å
831	N	28.3	Very low	31.9	Very low	147 Å²	147	130.9 Å²	130.9	79%	0.786	69%	0.687	S	S	*	*	S	Bend	trans	-110.8	-2.3	-169.2	-77.3	-18	0	0	0	117
832	N	27.9	Very low	33.6	Very low	149 Å²	149	133 Å²	133	80%	0.797	69%	0.686	S	S	*	*			trans	-117.7	71	177.4	-82.6	-15.9	0	0	0	112.3	N834	N832-N834 VanDerWaalsContact C-N 3.35Å; N832-N834 PolarHBondContact O-N 2.77Å
833	K	28.3	Very low	35.6	Very low	182 Å²	182	131 Å²	131	79%	0.791	67%	0.674	S	S	*	*			trans	-87.1	17.9	177.4	-75.5	-171.1	175	-177.9	0	115.3
834	N	25.4	Very low	38	Very low	154 Å²	154	125 Å²	125	82%	0.824	64%	0.636	S	S	*	*			trans	-120.4	31.1	-165.3	-83.4	-7.6	0	0	0	116.3	N832	N832-N834 VanDerWaalsContact C-N 3.35Å; N832-N834 PolarHBondContact O-N 2.77Å
835	T	26.3	Very low	40.3	Very low	131 Å²	131	121.2 Å²	121.2	80%	0.804	61%	0.612	S	S	*	*	S	Bend	trans	-115	102	170.4	44.7	0	0	0	0	111.4	Y837	T835-Y837 PolarHBondContact O-N 2.91Å; T835-Y837 VanDerWaalsContact O-N 3.12Å
836	N	26.7	Very low	42.6	Very low	150 Å²	150	122.1 Å²	122.1	80%	0.802	61%	0.607	S	S	*	*			trans	-40.2	99.7	-178.9	-64.2	-41.6	0	0	0	116
837	Y	31.6	Very low	45.1	Very low	115 Å²	115	116.9 Å²	116.9	45%	0.451	57%	0.57	S	S	.	*			trans	-121.7	134.7	152	-93.9	-90.2	0	0	0	108.2	S801 T835 E839	S801-Y837 WeakPolarHBondContact CB-OH 3.25Å; S801-Y837 PolarHBondContact OG-OH 3.02Å; T835-Y837 PolarHBondContact O-N 2.91Å; T835-Y837 VanDerWaalsContact O-N 3.12Å; Y837-E839 PolarHBondContact O-N 2.64Å
838	Y	42.2	Very low	47.4	Very low	126 Å²	126	108.9 Å²	108.9	49%	0.494	53%	0.533	S	S	.	.			trans	-60.3	100.4	178.8	-76.4	-91.5	0	0	0	108.9	Y840 L1054	Y838-Y840 PolarHBondContact O-N 3Å; Y838-L1054 HydrophobicContact CE2-CD1 4.24Å
839	E	38.3	Very low	49.4	Very low	182 Å²	182	108 Å²	108	85%	0.85	52%	0.524	S	S	*	.			trans	-51.1	116.2	154.5	-89.1	-178.7	155.1	0	0	106.1	Y837 D841	Y837-E839 PolarHBondContact O-N 2.64Å; E839-D841 PolarHBondContact O-N 2.78Å
840	Y	51.4	Low	51.3	Low	69 Å²	69	108.3 Å²	108.3	27%	0.271	52%	0.522	S	S	.	.			trans	-57.2	109.8	171	-75.9	-91	0	0	0	106.3	Y838 E842	Y838-Y840 PolarHBondContact O-N 3Å; Y840-E842 PolarHBondContact O-N 2.89Å
841	D	61.2	Low	53.2	Low	61 Å²	61	102.5 Å²	102.5	33%	0.326	49%	0.491	S	S	.	.			trans	-57.2	108.3	174.6	179.9	-7.2	0	0	0	107	K652 E839 I843 E844 E845	K652-D841 VanDerWaalsContact NZ-CG 3.32Å; K652-D841 IonicContact NZ-OD2 3.76Å; K652-D841 PolarHBondContact NZ-OD2 3.41Å; E839-D841 PolarHBondContact O-N 2.78Å; D841-I843 PolarHBondContact O-N 2.88Å; D841-I843 VanDerWaalsContact OD1-CB 3.31Å; D841-I843 WeakPolarHBondContact OD1-CB 3.32Å; D841-I843 PolarHBondContact OD1-N 3.3Å; D841-E844 HydrophobicContact CB-CB 4.05Å; D841-E844 WeakPolarHBondContact O-CA 3.21Å; D841-E844 WeakPolarHBondContact O-CB 3.34Å; D841-E844 PolarHBondContact O-N 3.26Å; D841-E845 PolarHBondContact O-N 3.05Å
842	E	64.8	Low	55	Low	139 Å²	139	96.1 Å²	96.1	65%	0.65	46%	0.457	S	S	*	.	H	α-helix	trans	-52.2	-31.2	-175.7	-73.9	-166.5	174.4	0	0	111.5	Y840 K846	Y840-E842 PolarHBondContact O-N 2.89Å; E842-K846 VanDerWaalsContact O-CB 3.32Å; E842-K846 WeakPolarHBondContact O-CB 3.12Å; E842-K846 WeakPolarHBondContact O-CD 3.43Å; E842-K846 WeakPolarHBondContact O-CG 3.2Å; E842-K846 PolarHBondContact O-N 3.47Å; E842-K846 IonicContact OE2-NZ 3.48Å
843	I	68.8	Low	56.7	Low	109 Å²	109	95.2 Å²	95.2	56%	0.559	45%	0.452	S	S	*	.	H	α-helix	trans	-67.7	-45.2	178.1	-56.6	175.1	0	0	0	109.8	D841 K846 I847	D841-I843 PolarHBondContact O-N 2.88Å; D841-I843 VanDerWaalsContact OD1-CB 3.31Å; D841-I843 WeakPolarHBondContact OD1-CB 3.32Å; D841-I843 PolarHBondContact OD1-N 3.3Å; I843-K846 PolarHBondContact O-N 3.41Å; I843-I847 HydrophobicContact CG2-CD1 4.01Å; I843-I847 WeakPolarHBondContact O-CD1 3.22Å; I843-I847 WeakPolarHBondContact O-CG1 3.49Å; I843-I847 PolarHBondContact O-N 3.34Å
844	E	77.6	Confident	57.8	Low	16 Å²	16	94.2 Å²	94.2	8%	0.075	45%	0.45	C	S	.	.	H	α-helix	trans	-65.5	-45.9	176.4	174.9	-179.2	-165.9	0	0	112.2	K652 D841 K846 I847 L848 R1061	K652-E844 HydrophobicContact CD-CB 4.43Å; K652-E844 VanDerWaalsContact CD-CD 3.47Å; K652-E844 HydrophobicContact CD-CG 4.24Å; K652-E844 WeakPolarHBondContact CD-OE2 3.12Å; K652-E844 WeakPolarHBondContact CE-OE2 3.22Å; K652-E844 VanDerWaalsContact NZ-CB 3.28Å; K652-E844 IonicContact NZ-OE2 3.48Å; K652-E844 PolarHBondContact NZ-OE2 3.45Å; D841-E844 HydrophobicContact CB-CB 4.05Å; D841-E844 WeakPolarHBondContact O-CA 3.21Å; D841-E844 WeakPolarHBondContact O-CB 3.34Å; D841-E844 PolarHBondContact O-N 3.26Å; E844-K846 VanDerWaalsContact C-N 3.27Å; E844-K846 PolarHBondContact O-N 3.39Å; E844-I847 CarbonylContact O-C 3.1Å; E844-I847 WeakPolarHBondContact O-CA 3.35Å; E844-I847 WeakPolarHBondContact O-CB 3.31Å; E844-I847 PolarHBondContact O-N 2.74Å; E844-L848 HydrophobicContact CG-CD1 3.9Å; E844-L848 HydrophobicContact CG-CG 4.15Å; E844-L848 WeakPolarHBondContact O-CG 3.26Å; E844-L848 PolarHBondContact O-N 2.73Å; E844-R1061 IonicContact OE1-CZ 2.78Å; E844-R1061 IonicContact OE1-NE 3.47Å; E844-R1061 PolarHBondContact OE1-NE 2.98Å; E844-R1061 IonicContact OE1-NH2 3.64Å; E844-R1061 PolarHBondContact OE1-NH2 3.46Å; E844-R1061 IonicContact OE2-NH2 3.29Å
845	E	74.1	Confident	58.8	Low	19 Å²	19	93.4 Å²	93.4	9%	0.089	45%	0.446	C	S	.	.	H	α-helix	trans	-63.4	-37.4	-179.7	-174.2	58.1	-155.1	0	0	111	D841 R849 R1060	D841-E845 PolarHBondContact O-N 3.05Å; E845-R849 WeakPolarHBondContact O-CB 3.48Å; E845-R849 VanDerWaalsContact O-CG 3.3Å; E845-R849 WeakPolarHBondContact O-CG 3.43Å; E845-R849 PolarHBondContact O-N 2.87Å; E845-R849 VanDerWaalsContact O-N 3.08Å; E845-R849 IonicContact OE1-CZ 3.9Å; E845-R849 IonicContact OE1-NE 3.6Å; E845-R849 PolarHBondContact OE1-NE 3.33Å; E845-R849 IonicContact OE1-NH2 2.72Å; E845-R849 PolarHBondContact OE1-NH2 2.92Å; E845-R1060 IonicContact OE1-CZ 2.72Å; E845-R1060 IonicContact OE1-NH1 2.69Å; E845-R1060 IonicContact OE1-NH2 3.72Å; E845-R1060 PolarHBondContact OE1-NH2 3.4Å; E845-R1060 IonicContact OE2-CZ 2.67Å; E845-R1060 IonicContact OE2-NH1 2.61Å; E845-R1060 PolarHBondContact OE2-NH1 2.84Å; E845-R1060 IonicContact OE2-NH2 3.28Å; E845-R1060 PolarHBondContact OE2-NH2 2.9Å
846	K	75	Confident	60.3	Low	118 Å²	118	89.1 Å²	89.1	51%	0.513	42%	0.421	S	S	.	.	H	α-helix	trans	-60.5	-45.8	168.8	-76.6	168.1	-175.9	159.9	0	111.4	E842 I843 E844 H850	E842-K846 VanDerWaalsContact O-CB 3.32Å; E842-K846 WeakPolarHBondContact O-CB 3.12Å; E842-K846 WeakPolarHBondContact O-CD 3.43Å; E842-K846 WeakPolarHBondContact O-CG 3.2Å; E842-K846 PolarHBondContact O-N 3.47Å; E842-K846 IonicContact OE2-NZ 3.48Å; I843-K846 PolarHBondContact O-N 3.41Å; E844-K846 VanDerWaalsContact C-N 3.27Å; E844-K846 PolarHBondContact O-N 3.39Å; K846-H850 PolarHBondContact O-N 2.99Å; K846-H850 PolarHBondContact O-ND1 3.31Å
847	I	79.2	Confident	61.9	Low	5 Å²	5	83.1 Å²	83.1	3%	0.026	39%	0.388	C	S	.	.	H	α-helix	trans	-61.8	-46.4	179.2	-69	164.3	0	0	0	111.5	H645 V648 L649 I843 E844 H850 S851	H645-I847 HydrophobicContact CB-CD1 4.32Å; H645-I847 HydrophobicContact CB-CG1 4.38Å; H645-I847 HydrophobicContact CB-CG2 3.87Å; V648-I847 HydrophobicContact CG1-CD1 4.32Å; L649-I847 HydrophobicContact CD1-CG2 3.77Å; L649-I847 HydrophobicContact CD2-CG2 4.09Å; L649-I847 HydrophobicContact CG-CG2 3.97Å; I843-I847 HydrophobicContact CG2-CD1 4.01Å; I843-I847 WeakPolarHBondContact O-CD1 3.22Å; I843-I847 WeakPolarHBondContact O-CG1 3.49Å; I843-I847 PolarHBondContact O-N 3.34Å; E844-I847 CarbonylContact O-C 3.1Å; E844-I847 WeakPolarHBondContact O-CA 3.35Å; E844-I847 WeakPolarHBondContact O-CB 3.31Å; E844-I847 PolarHBondContact O-N 2.74Å; I847-H850 PolarHBondContact O-N 3.28Å; I847-S851 WeakPolarHBondContact O-CB 3.35Å; I847-S851 PolarHBondContact O-N 3.37Å; I847-S851 PolarHBondContact O-OG 3.13Å
848	L	77.2	Confident	63.4	Low	1 Å²	1	78 Å²	78	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-62.3	-48.2	-178.7	-68.8	175.8	0	0	0	111.2	L649 E844 H850 S851 I852 R1060 R1061 A1064	L649-L848 HydrophobicContact CD2-CD2 3.83Å; L649-L848 HydrophobicContact CD2-CG 4.44Å; E844-L848 HydrophobicContact CG-CD1 3.9Å; E844-L848 HydrophobicContact CG-CG 4.15Å; E844-L848 WeakPolarHBondContact O-CG 3.26Å; E844-L848 PolarHBondContact O-N 2.73Å; L848-H850 VanDerWaalsContact C-N 3.34Å; L848-H850 PolarHBondContact O-N 3.16Å; L848-S851 PolarHBondContact O-N 3.12Å; L848-S851 VanDerWaalsContact O-N 3.14Å; L848-I852 HydrophobicContact CB-CD1 4.45Å; L848-I852 WeakPolarHBondContact O-CB 3.45Å; L848-I852 WeakPolarHBondContact O-CG1 3.28Å; L848-I852 PolarHBondContact O-N 2.95Å; L848-R1060 HydrophobicContact CD1-CB 4.25Å; L848-R1060 HydrophobicContact CD2-CB 4.25Å; L848-R1061 HydrophobicContact CD2-CG 4.41Å; L848-A1064 HydrophobicContact CD2-CB 3.7Å
849	R	71.4	Confident	64.1	Low	130 Å²	130	72.7 Å²	72.7	49%	0.491	35%	0.35	S	S	.	.	H	α-helix	trans	-60.6	-37.9	178.4	-71.8	179	-173.6	-164.2	1.3	113.7	E845 S851	E845-R849 WeakPolarHBondContact O-CB 3.48Å; E845-R849 VanDerWaalsContact O-CG 3.3Å; E845-R849 WeakPolarHBondContact O-CG 3.43Å; E845-R849 PolarHBondContact O-N 2.87Å; E845-R849 VanDerWaalsContact O-N 3.08Å; E845-R849 IonicContact OE1-CZ 3.9Å; E845-R849 IonicContact OE1-NE 3.6Å; E845-R849 PolarHBondContact OE1-NE 3.33Å; E845-R849 IonicContact OE1-NH2 2.72Å; E845-R849 PolarHBondContact OE1-NH2 2.92Å; R849-S851 VanDerWaalsContact C-N 3.3Å; R849-S851 PolarHBondContact O-N 2.81Å
850	H	72.8	Confident	65.4	Low	145 Å²	145	66.4 Å²	66.4	67%	0.671	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-9.5	178.7	-73.1	83.6	0	0	0	114.2	K846 I847 L848	K846-H850 PolarHBondContact O-N 2.99Å; K846-H850 PolarHBondContact O-ND1 3.31Å; I847-H850 PolarHBondContact O-N 3.28Å; L848-H850 VanDerWaalsContact C-N 3.34Å; L848-H850 PolarHBondContact O-N 3.16Å
851	S	68.4	Low	65.9	Low	5 Å²	5	64.7 Å²	64.7	4%	0.035	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-22.4	-173.4	-51.7	0	0	0	0	112.9	I847 L848 R849 S1067	I847-S851 WeakPolarHBondContact O-CB 3.35Å; I847-S851 PolarHBondContact O-N 3.37Å; I847-S851 PolarHBondContact O-OG 3.13Å; L848-S851 PolarHBondContact O-N 3.12Å; L848-S851 VanDerWaalsContact O-N 3.14Å; R849-S851 VanDerWaalsContact C-N 3.3Å; R849-S851 PolarHBondContact O-N 2.81Å; S851-S1067 VanDerWaalsContact O-CB 3.32Å; S851-S1067 WeakPolarHBondContact O-CB 3.29Å; S851-S1067 PolarHBondContact O-OG 2.6Å
852	I	67.5	Low	66.2	Low	13 Å²	13	63.4 Å²	63.4	7%	0.067	32%	0.316	C	S	.	.	S	Bend	trans	-99.9	132.5	175.5	-59.8	170.6	0	0	0	107	L848 E854 S856 M858 A859 R1060 A1064	L848-I852 HydrophobicContact CB-CD1 4.45Å; L848-I852 WeakPolarHBondContact O-CB 3.45Å; L848-I852 WeakPolarHBondContact O-CG1 3.28Å; L848-I852 PolarHBondContact O-N 2.95Å; I852-E854 PolarHBondContact O-N 3.41Å; I852-S856 VanDerWaalsContact CG2-OG 3.22Å; I852-S856 WeakPolarHBondContact CG2-OG 3.41Å; I852-M858 HydrophobicContact CG2-CB 3.88Å; I852-A859 HydrophobicContact CG2-CB 4.4Å; I852-R1060 HydrophobicContact CD1-CB 4.05Å; I852-R1060 HydrophobicContact CD1-CG 4.3Å; I852-A1064 HydrophobicContact CG1-CB 4.23Å
853	N	63.2	Low	66.4	Low	130 Å²	130	57.2 Å²	57.2	70%	0.695	29%	0.288	S	S	*	.			trans	-52.3	129.5	179.4	-73.4	-8.7	0	0	0	110.8	D855 S856	N853-D855 PolarHBondContact O-N 2.73Å; N853-D855 VanDerWaalsContact O-N 3.1Å; N853-S856 PolarHBondContact O-N 3.1Å; N853-S856 PolarHBondContact O-OG 3.2Å
854	E	51	Low	66.6	Low	160 Å²	160	52.4 Å²	52.4	75%	0.748	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-27.9	-174.4	-67.7	-169.3	161.9	0	0	112.9	I852 S856	I852-E854 PolarHBondContact O-N 3.41Å; E854-S856 VanDerWaalsContact C-N 3.31Å; E854-S856 PolarHBondContact O-N 3.49Å
855	D	46.2	Very low	66.4	Low	138 Å²	138	51.9 Å²	51.9	74%	0.738	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-6.4	-178.9	-64.3	-41	0	0	0	114.3	N853	N853-D855 PolarHBondContact O-N 2.73Å; N853-D855 VanDerWaalsContact O-N 3.1Å
856	S	57.4	Low	66.3	Low	40 Å²	40	51 Å²	51	28%	0.28	26%	0.258	S	S	.	.	S	Bend	trans	-91.3	139.5	179.5	74.1	0	0	0	0	111.6	I852 N853 E854 M858 A859	I852-S856 VanDerWaalsContact CG2-OG 3.22Å; I852-S856 WeakPolarHBondContact CG2-OG 3.41Å; N853-S856 PolarHBondContact O-N 3.1Å; N853-S856 PolarHBondContact O-OG 3.2Å; E854-S856 VanDerWaalsContact C-N 3.31Å; E854-S856 PolarHBondContact O-N 3.49Å; S856-M858 PolarHBondContact O-N 2.9Å; S856-A859 VanDerWaalsContact O-CB 3.25Å; S856-A859 WeakPolarHBondContact O-CB 3.48Å; S856-A859 PolarHBondContact O-N 3.26Å
857	F	60.1	Low	66	Low	24 Å²	24	45.5 Å²	45.5	11%	0.105	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-51.9	-26.6	172.6	175.8	-104.3	0	0	0	112.6	Y721 R724 A859 T860 T862 P864	Y721-F857 HydrophobicContact CD2-CD1 4.12Å; Y721-F857 HydrophobicContact CD2-CE1 4.43Å; Y721-F857 AromaticContact CE2-CD1 3.92Å; Y721-F857 HydrophobicContact CE2-CD1 3.92Å; R724-F857 HydrophobicContact CB-CD1 4.48Å; R724-F857 HydrophobicContact CB-CE1 4.22Å; R724-F857 HydrophobicContact CB-CZ 4.39Å; R724-F857 HydrophobicContact CG-CD1 3.84Å; R724-F857 HydrophobicContact CG-CD2 3.69Å; R724-F857 HydrophobicContact CG-CE1 3.66Å; R724-F857 HydrophobicContact CG-CE2 3.5Å; R724-F857 HydrophobicContact CG-CG 3.89Å; R724-F857 HydrophobicContact CG-CZ 3.51Å; R724-F857 VanDerWaalsContact NE-CE2 3.28Å; F857-A859 PolarHBondContact O-N 3.5Å; F857-T860 PolarHBondContact O-N 3.2Å; F857-T860 VanDerWaalsContact O-N 3.15Å; F857-T860 PolarHBondContact O-OG1 3.29Å; F857-T862 WeakPolarHBondContact CZ-O 3.41Å; F857-P864 HydrophobicContact CE1-CB 4Å; F857-P864 HydrophobicContact CE1-CG 4.16Å; F857-P864 HydrophobicContact CZ-CB 4.2Å
858	M	64.2	Low	65.5	Low	9 Å²	9	46.3 Å²	46.3	4%	0.044	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-66.5	-15.5	175.3	-65.7	-61.6	-159.9	0	0	114.7	Y721 I852 S856 T860 V1059 R1060 L1063	Y721-M858 HydrophobicContact CD1-CE 4.4Å; Y721-M858 HydrophobicContact CD2-CE 3.48Å; Y721-M858 VanDerWaalsContact CD2-CE 3.48Å; Y721-M858 HydrophobicContact CD2-SD 4.09Å; Y721-M858 HydrophobicContact CE1-CE 4.03Å; Y721-M858 HydrophobicContact CE2-CE 3.02Å; Y721-M858 HydrophobicContact CE2-CG 3.98Å; Y721-M858 HydrophobicContact CE2-SD 3.54Å; Y721-M858 VanDerWaalsContact CE2-SD 3.54Å; Y721-M858 HydrophobicContact CG-CE 4.15Å; I852-M858 HydrophobicContact CG2-CB 3.88Å; S856-M858 PolarHBondContact O-N 2.9Å; M858-T860 VanDerWaalsContact C-N 3.27Å; M858-V1059 HydrophobicContact CE-CG1 3.79Å; M858-V1059 HydrophobicContact SD-CG1 4.5Å; M858-R1060 PolarHBondContact O-NE 3.21Å; M858-L1063 HydrophobicContact CB-CD1 4.06Å; M858-L1063 HydrophobicContact CE-CD1 4.05Å; M858-L1063 HydrophobicContact CG-CD1 3.71Å; M858-L1063 HydrophobicContact SD-CD1 4.12Å
859	A	56.7	Low	65	Low	14 Å²	14	47.9 Å²	47.9	12%	0.116	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-70.7	-26.5	172.8	0	0	0	0	0	111.9	I852 S856 F857 R1060	I852-A859 HydrophobicContact CG2-CB 4.4Å; S856-A859 VanDerWaalsContact O-CB 3.25Å; S856-A859 WeakPolarHBondContact O-CB 3.48Å; S856-A859 PolarHBondContact O-N 3.26Å; F857-A859 PolarHBondContact O-N 3.5Å; A859-R1060 PolarHBondContact O-NH2 3.21Å; A859-R1060 VanDerWaalsContact O-NH2 3.08Å
860	T	64.9	Low	65.2	Low	50 Å²	50	41.8 Å²	41.8	31%	0.307	22%	0.223	S	C	.	.	S	Bend	trans	-76.7	148.3	179	70.8	0	0	0	0	111.6	F857 M858 T862 H1056 R1060	F857-T860 PolarHBondContact O-N 3.2Å; F857-T860 VanDerWaalsContact O-N 3.15Å; F857-T860 PolarHBondContact O-OG1 3.29Å; M858-T860 VanDerWaalsContact C-N 3.27Å; T860-T862 VanDerWaalsContact CB-OG1 3.31Å; T860-T862 WeakPolarHBondContact CB-OG1 3.43Å; T860-T862 PolarHBondContact OG1-OG1 3.3Å; T860-H1056 PolarHBondContact O-NE2 3.3Å; T860-R1060 PolarHBondContact O-NE 2.72Å
861	S	62.7	Low	65.1	Low	33 Å²	33	35.3 Å²	35.3	23%	0.231	19%	0.194	C	C	.	.			trans	-81.2	-5.3	170.7	60.1	0	0	0	0	112.7	V863	S861-V863 PolarHBondContact O-N 3.5Å
862	T	66.3	Low	65.3	Low	33 Å²	33	35.1 Å²	35.1	20%	0.202	19%	0.192	C	C	.	.			trans	-75.2	117.4	-177.2	47.7	0	0	0	0	110.1	M757 F857 T860 H1056	M757-T862 HydrophobicContact CE-CG2 4.5Å; M757-T862 HydrophobicContact CG-CG2 3.79Å; M757-T862 HydrophobicContact SD-CG2 4.17Å; F857-T862 WeakPolarHBondContact CZ-O 3.41Å; T860-T862 VanDerWaalsContact CB-OG1 3.31Å; T860-T862 WeakPolarHBondContact CB-OG1 3.43Å; T860-T862 PolarHBondContact OG1-OG1 3.3Å; T862-H1056 PolarHBondContact O-NE2 2.79Å
863	V	70.6	Confident	65.7	Low	10 Å²	10	35 Å²	35	6%	0.061	19%	0.192	C	C	.	.			trans	-70.8	136.5	178.3	-179.1	0	0	0	0	108.4	S861 V865 L1052 N1053 H1056	S861-V863 PolarHBondContact O-N 3.5Å; V863-V865 VanDerWaalsContact C-N 3.29Å; V863-V865 HydrophobicContact CB-CG2 4.3Å; V863-V865 HydrophobicContact CG1-CG2 4.36Å; V863-V865 PolarHBondContact O-N 2.96Å; V863-L1052 HydrophobicContact CG1-CB 4.18Å; V863-N1053 WeakPolarHBondContact CB-OD1 3.46Å; V863-N1053 WeakPolarHBondContact CG1-OD1 3.26Å; V863-N1053 HydrophobicContact CG2-CB 4.29Å; V863-N1053 WeakPolarHBondContact CG2-OD1 3.25Å; V863-H1056 HydrophobicContact CG1-CB 4.18Å; V863-H1056 HydrophobicContact CG2-CB 4Å
864	P	71.9	Confident	66.2	Low	7 Å²	7	29.9 Å²	29.9	5%	0.045	17%	0.165	C	C	.	.			trans	-67.2	94.7	172.1	26.7	-31.3	0	0	0	108.2	Y717 C720 R724 F857	Y717-P864 HydrophobicContact CD2-CG 4.42Å; Y717-P864 HydrophobicContact CE2-CG 3.85Å; C720-P864 HydrophobicContact CB-CB 4.19Å; C720-P864 HydrophobicContact CB-CG 4.33Å; C720-P864 WeakPolarHBondContact CB-O 3.12Å; R724-P864 HydrophobicContact CB-CB 4.21Å; F857-P864 HydrophobicContact CE1-CB 4Å; F857-P864 HydrophobicContact CE1-CG 4.16Å; F857-P864 HydrophobicContact CZ-CB 4.2Å
865	V	73.2	Confident	67.3	Low	6 Å²	6	22.5 Å²	22.5	4%	0.036	13%	0.131	C	C	.	.			trans	-93.3	124.6	176.8	-177.6	0	0	0	0	107.4	V762 V863 L869 M870 L1049	V762-V865 HydrophobicContact CB-CB 4.49Å; V762-V865 HydrophobicContact CB-CG2 4.35Å; V762-V865 HydrophobicContact CG2-CB 4.36Å; V762-V865 HydrophobicContact CG2-CG2 3.83Å; V863-V865 VanDerWaalsContact C-N 3.29Å; V863-V865 HydrophobicContact CB-CG2 4.3Å; V863-V865 HydrophobicContact CG1-CG2 4.36Å; V863-V865 PolarHBondContact O-N 2.96Å; V865-L869 HydrophobicContact CG1-CB 3.65Å; V865-M870 HydrophobicContact CB-CE 4.31Å; V865-M870 HydrophobicContact CB-CG 4.47Å; V865-M870 HydrophobicContact CG1-CG 3.87Å; V865-M870 WeakPolarHBondContact O-CE 3.45Å; V865-L1049 HydrophobicContact CG1-CD1 4.24Å; V865-L1049 HydrophobicContact CG2-CD1 3.79Å
866	P	72.2	Confident	68.5	Low	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.126	C	C	.	.			trans	-72.9	153.4	173.4	29	-32.7	0	0	0	110.5	Y716 H868 L869 L1025	Y716-P866 VanDerWaalsContact OH-CG 3.27Å; Y716-P866 WeakPolarHBondContact OH-CG 3.25Å; P866-H868 VanDerWaalsContact C-N 3.27Å; P866-H868 WeakPolarHBondContact CG-CE1 3.13Å; P866-H868 PolarHBondContact O-N 3.19Å; P866-H868 VanDerWaalsContact O-N 3.1Å; P866-L869 HydrophobicContact CG-CB 4.5Å; P866-L869 HydrophobicContact CG-CD1 3.93Å; P866-L869 HydrophobicContact CG-CG 4.12Å; P866-L869 PolarHBondContact O-N 3.41Å; P866-L1025 HydrophobicContact CB-CB 4.05Å; P866-L1025 HydrophobicContact CB-CD2 4.48Å
867	P	69.4	Low	69.5	Low	2 Å²	2	20.6 Å²	20.6	1%	0.013	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-58.9	-31.2	-169.1	-26.1	34.3	0	0	0	115.5	L869 M870 V897 L990	P867-L869 PolarHBondContact O-N 2.96Å; P867-M870 PolarHBondContact O-N 3.41Å; P867-M870 VanDerWaalsContact O-N 3.14Å; P867-V897 HydrophobicContact CB-CG1 4.22Å; P867-V897 HydrophobicContact CG-CG1 3.67Å; P867-L990 HydrophobicContact CB-CD1 3.31Å; P867-L990 HydrophobicContact CB-CG 4.26Å; P867-L990 HydrophobicContact CG-CD1 4.07Å
868	H	67.4	Low	70.4	Confident	22 Å²	22	23 Å²	23	10%	0.102	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-67.4	-13.5	177.8	67.7	-84.1	0	0	0	114.2	Y716 P866 L1025	Y716-H868 PolarHBondContact OH-CE1 3.19Å; Y716-H868 PolarHBondContact OH-NE2 3.42Å; P866-H868 VanDerWaalsContact C-N 3.27Å; P866-H868 WeakPolarHBondContact CG-CE1 3.13Å; P866-H868 PolarHBondContact O-N 3.19Å; P866-H868 VanDerWaalsContact O-N 3.1Å; H868-L1025 PolarHBondContact CE1-O 3.25Å; H868-L1025 PolarHBondContact ND1-O 2.98Å
869	L	67.9	Low	71	Confident	35 Å²	35	28.8 Å²	28.8	18%	0.183	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-101.9	0.1	175.8	-63.6	-176.1	0	0	0	112.9	Y716 V865 P866 P867 L1048 L1052	Y716-L869 HydrophobicContact CE1-CD1 4.26Å; Y716-L869 WeakPolarHBondContact OH-CD1 3.44Å; V865-L869 HydrophobicContact CG1-CB 3.65Å; P866-L869 HydrophobicContact CG-CB 4.5Å; P866-L869 HydrophobicContact CG-CD1 3.93Å; P866-L869 HydrophobicContact CG-CG 4.12Å; P866-L869 PolarHBondContact O-N 3.41Å; P867-L869 PolarHBondContact O-N 2.96Å; L869-L1048 HydrophobicContact CD1-CD2 3.91Å; L869-L1048 HydrophobicContact CD1-CG 4.35Å; L869-L1048 HydrophobicContact CD2-CD2 4.18Å; L869-L1052 HydrophobicContact CD1-CD1 3.84Å
870	M	74.6	Confident	72	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.01	17%	0.174	C	C	.	.	S	Bend	trans	-91.1	126.1	178.9	-59.8	-175.8	-170.9	0	0	110.8	Q755 V762 L764 V865 P867 V897	Q755-M870 HydrophobicContact CB-CE 4.26Å; Q755-M870 HydrophobicContact CB-SD 4.18Å; V762-M870 HydrophobicContact CG1-CE 4.01Å; V762-M870 HydrophobicContact CG1-CG 4.18Å; V762-M870 HydrophobicContact CG1-SD 3.96Å; L764-M870 HydrophobicContact CB-CB 3.85Å; L764-M870 HydrophobicContact CB-SD 4.22Å; L764-M870 HydrophobicContact CD1-SD 3.97Å; V865-M870 HydrophobicContact CB-CE 4.31Å; V865-M870 HydrophobicContact CB-CG 4.47Å; V865-M870 HydrophobicContact CG1-CG 3.87Å; V865-M870 WeakPolarHBondContact O-CE 3.45Å; P867-M870 PolarHBondContact O-N 3.41Å; P867-M870 VanDerWaalsContact O-N 3.14Å; M870-V897 HydrophobicContact CE-CG2 4.27Å; M870-V897 HydrophobicContact SD-CG2 4.42Å
871	P	70.6	Confident	72.6	Confident	8 Å²	8	27 Å²	27	5%	0.052	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-63.7	140.5	169.1	25.5	-35.3	0	0	0	111.7	V762 W763 L764 V985 Y986 Y987	V762-P871 VanDerWaalsContact O-CD 3.3Å; V762-P871 WeakPolarHBondContact O-CD 3.41Å; W763-P871 HydrophobicContact CD2-CB 4.4Å; W763-P871 HydrophobicContact CD2-CG 3.89Å; W763-P871 HydrophobicContact CE3-CB 3.92Å; W763-P871 HydrophobicContact CE3-CG 3.92Å; W763-P871 HydrophobicContact CG-CG 4.38Å; W763-P871 HydrophobicContact CH2-CB 4.13Å; W763-P871 HydrophobicContact CH2-CG 4.29Å; W763-P871 HydrophobicContact CZ2-CG 4.27Å; W763-P871 HydrophobicContact CZ3-CB 3.8Å; W763-P871 HydrophobicContact CZ3-CG 4.15Å; L764-P871 PolarHBondContact N-O 3.46Å; P871-V985 HydrophobicContact CB-CG1 3.63Å; P871-Y986 WeakPolarHBondContact CA-O 3.44Å; P871-Y987 HydrophobicContact CB-CE1 4.16Å; P871-Y987 HydrophobicContact CG-CE1 4.43Å
872	V	73.6	Confident	73.5	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131	173.7	-177.3	0	0	0	0	109.2	L764 V971 I974 Y986 T988	L764-V872 HydrophobicContact CB-CG2 4.13Å; L764-V872 HydrophobicContact CD2-CG2 3.99Å; V872-V971 HydrophobicContact CG1-CG1 4.27Å; V872-V971 HydrophobicContact CG1-CG2 4.24Å; V872-I974 HydrophobicContact CG2-CG2 4.21Å; V872-Y986 PolarHBondContact N-O 3.37Å; V872-Y986 PolarHBondContact O-N 2.98Å; V872-T988 HydrophobicContact CG2-CG2 3.64Å
873	F	75.2	Confident	73.9	Confident	11 Å²	11	29.9 Å²	29.9	5%	0.048	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	133.1	173.1	175.2	-103.9	0	0	0	111.1	W763 W792 L794 P795 L798 P875	W763-F873 HydrophobicContact CE3-CB 4.28Å; W763-F873 HydrophobicContact CZ3-CB 4.39Å; W792-F873 HydrophobicContact CB-CD1 4.42Å; W792-F873 HydrophobicContact CB-CE1 4.28Å; W792-F873 HydrophobicContact CE3-CD1 4.08Å; W792-F873 HydrophobicContact CE3-CE1 4.45Å; L794-F873 HydrophobicContact CD2-CB 3.27Å; L794-F873 HydrophobicContact CD2-CD1 3.89Å; L794-F873 HydrophobicContact CD2-CD2 4.1Å; L794-F873 HydrophobicContact CD2-CG 3.48Å; L794-F873 VanDerWaalsContact CD2-CG 3.48Å; P795-F873 VanDerWaalsContact CD-CE2 3.48Å; P795-F873 HydrophobicContact CG-CD2 4.43Å; P795-F873 HydrophobicContact CG-CE2 3.66Å; P795-F873 HydrophobicContact CG-CZ 4.13Å; L798-F873 HydrophobicContact CD2-CD2 4.02Å; L798-F873 HydrophobicContact CD2-CE2 4.4Å; F873-P875 HydrophobicContact CE1-CG 4.15Å
874	V	74.4	Confident	74.3	Confident	22 Å²	22	32.7 Å²	32.7	13%	0.133	18%	0.181	C	C	.	.			trans	-124	119.4	179.1	-170.1	0	0	0	0	108.8	V971 V975 Y986	V874-V971 HydrophobicContact CB-CG1 4.05Å; V874-V971 HydrophobicContact CG1-CG1 3.83Å; V874-V971 HydrophobicContact CG2-CG1 3.46Å; V874-V971 VanDerWaalsContact CG2-CG1 3.46Å; V874-V975 HydrophobicContact CG2-CG2 4.1Å; V874-Y986 HydrophobicContact CB-CD2 4.28Å; V874-Y986 HydrophobicContact CB-CE2 4.16Å; V874-Y986 HydrophobicContact CG2-CD2 3.39Å; V874-Y986 HydrophobicContact CG2-CE2 3.71Å
875	P	73.3	Confident	74.8	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.032	18%	0.183	C	C	.	.			trans	-60.8	146.7	172.4	-18.2	28.8	0	0	0	111	W792 F873 S877 D880	W792-P875 HydrophobicContact CD2-CG 3.53Å; W792-P875 VanDerWaalsContact CE2-CG 3.46Å; W792-P875 HydrophobicContact CE3-CG 3.6Å; W792-P875 HydrophobicContact CG-CG 4.25Å; W792-P875 VanDerWaalsContact CH2-CD 3.44Å; W792-P875 HydrophobicContact CH2-CG 3.57Å; W792-P875 HydrophobicContact CZ2-CG 3.5Å; W792-P875 HydrophobicContact CZ3-CG 3.61Å; F873-P875 HydrophobicContact CE1-CG 4.15Å; P875-S877 PolarHBondContact O-N 2.72Å; P875-D880 HydrophobicContact CB-CB 4.4Å
876	S	70.9	Confident	75.1	Confident	92 Å²	92	34.3 Å²	34.3	64%	0.643	19%	0.189	S	C	*	.	S	Bend	trans	-65.8	-24.2	-179.3	54.5	0	0	0	0	113.8	D880	S876-D880 PolarHBondContact N-OD2 3.5Å; S876-D880 WeakPolarHBondContact OG-CB 3.49Å; S876-D880 PolarHBondContact OG-OD2 3.29Å
877	S	79	Confident	75.5	Confident	47 Å²	47	37.5 Å²	37.5	33%	0.329	20%	0.202	S	C	.	.	S	Bend	trans	-157.1	167.6	176.3	59.2	0	0	0	0	109.9	P875 D879 D880 G881	P875-S877 PolarHBondContact O-N 2.72Å; S877-D879 PolarHBondContact O-N 3.25Å; S877-D880 PolarHBondContact O-N 3.43Å; S877-D880 WeakPolarHBondContact OG-CB 3.46Å; S877-D880 PolarHBondContact OG-N 3.49Å; S877-G881 PolarHBondContact O-N 2.69Å
878	L	79.2	Confident	76	Confident	73 Å²	73	41.1 Å²	41.1	38%	0.382	22%	0.218	S	C	.	.	H	α-helix	trans	-56.6	-39.2	169.6	-82.6	159.9	0	0	0	111.1	G881 Y882 N964 L965 F968	L878-G881 PolarHBondContact O-N 3.38Å; L878-Y882 WeakPolarHBondContact O-CB 3.49Å; L878-Y882 PolarHBondContact O-N 3.46Å; L878-N964 PolarHBondContact O-ND2 2.9Å; L878-L965 HydrophobicContact CD2-CD1 4.05Å; L878-F968 HydrophobicContact CD2-CB 3.72Å; L878-F968 HydrophobicContact CD2-CD1 3.78Å; L878-F968 HydrophobicContact CD2-CD2 4.14Å; L878-F968 HydrophobicContact CD2-CE1 4.44Å; L878-F968 HydrophobicContact CD2-CG 3.61Å; L878-F968 HydrophobicContact CG-CD1 3.98Å; L878-F968 HydrophobicContact CG-CD2 4.38Å; L878-F968 HydrophobicContact CG-CE1 4.13Å; L878-F968 HydrophobicContact CG-CG 4.12Å; L878-F968 HydrophobicContact CG-CZ 4.42Å
879	D	76.3	Confident	76.7	Confident	132 Å²	132	42.9 Å²	42.9	71%	0.706	23%	0.233	S	C	*	.	H	α-helix	trans	-66.8	-40.2	178.3	-63.5	-27.1	0	0	0	112.3	S877 Y882 S883	S877-D879 PolarHBondContact O-N 3.25Å; D879-Y882 PolarHBondContact O-N 2.7Å; D879-S883 WeakPolarHBondContact O-CB 3.26Å; D879-S883 PolarHBondContact O-N 3.34Å
880	D	77.7	Confident	77.4	Confident	25 Å²	25	41.5 Å²	41.5	13%	0.134	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-44	172.9	-179.6	45.9	0	0	0	110.8	P875 S876 S877 Y882 S883 R884	P875-D880 HydrophobicContact CB-CB 4.4Å; S876-D880 PolarHBondContact N-OD2 3.5Å; S876-D880 WeakPolarHBondContact OG-CB 3.49Å; S876-D880 PolarHBondContact OG-OD2 3.29Å; S877-D880 PolarHBondContact O-N 3.43Å; S877-D880 WeakPolarHBondContact OG-CB 3.46Å; S877-D880 PolarHBondContact OG-N 3.49Å; D880-Y882 PolarHBondContact O-N 3.3Å; D880-S883 PolarHBondContact O-N 3.34Å; D880-S883 PolarHBondContact O-OG 3.11Å; D880-R884 VanDerWaalsContact CG-NE 3.3Å; D880-R884 VanDerWaalsContact O-CG 3.26Å; D880-R884 WeakPolarHBondContact O-CG 3.48Å; D880-R884 PolarHBondContact O-N 3.06Å; D880-R884 VanDerWaalsContact O-N 3.17Å; D880-R884 IonicContact OD1-CZ 3.34Å; D880-R884 IonicContact OD1-NE 2.76Å; D880-R884 PolarHBondContact OD1-NE 3.08Å; D880-R884 IonicContact OD1-NH2 3.03Å; D880-R884 PolarHBondContact OD1-NH2 3.11Å; D880-R884 IonicContact OD2-CZ 4Å; D880-R884 IonicContact OD2-NE 3.29Å; D880-R884 PolarHBondContact OD2-NE 3.34Å; D880-R884 IonicContact OD2-NH2 3.83Å
881	G	78.8	Confident	77.7	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.4	-45.9	173.6	0	0	0	0	0	112.3	W792 S877 L878 S883 R884 L885 N964	W792-G881 PolarHBondContact NE1-O 2.68Å; S877-G881 PolarHBondContact O-N 2.69Å; L878-G881 PolarHBondContact O-N 3.38Å; G881-S883 VanDerWaalsContact C-N 3.34Å; G881-S883 PolarHBondContact O-N 3.23Å; G881-R884 PolarHBondContact O-N 3.3Å; G881-R884 VanDerWaalsContact O-N 3.15Å; G881-L885 PolarHBondContact O-N 3.4Å; G881-N964 WeakPolarHBondContact CA-OD1 3.18Å; G881-N964 PolarHBondContact O-OD1 3.07Å
882	Y	81.2	Confident	78	Confident	71 Å²	71	41.9 Å²	41.9	28%	0.278	23%	0.229	S	C	.	.	H	α-helix	trans	-62	-43.5	179.3	-172.7	-91.8	0	0	0	111.1	L878 D879 D880 R884 L885 D957 L960 Q961 N964	L878-Y882 WeakPolarHBondContact O-CB 3.49Å; L878-Y882 PolarHBondContact O-N 3.46Å; D879-Y882 PolarHBondContact O-N 2.7Å; D880-Y882 PolarHBondContact O-N 3.3Å; Y882-R884 PolarHBondContact O-N 2.83Å; Y882-L885 HydrophobicContact CD2-CD1 4.21Å; Y882-L885 PolarHBondContact O-N 3.29Å; Y882-D957 VanDerWaalsContact CZ-OD1 3.32Å; Y882-D957 PolarHBondContact OH-OD1 2.61Å; Y882-L960 HydrophobicContact CE2-CB 3.64Å; Y882-Q961 HydrophobicContact CD2-CG 4.1Å; Y882-Q961 HydrophobicContact CE2-CG 3.68Å; Y882-N964 HydrophobicContact CD2-CB 4.29Å; Y882-N964 PolarHBondContact N-ND2 3.12Å; Y882-N964 PolarHBondContact N-OD1 2.99Å
883	S	75.1	Confident	77.8	Confident	57 Å²	57	42.7 Å²	42.7	40%	0.399	23%	0.234	S	C	.	.	H	α-helix	trans	-61.5	-29.9	177.8	80.6	0	0	0	0	113.2	D879 D880 G881 R940	D879-S883 WeakPolarHBondContact O-CB 3.26Å; D879-S883 PolarHBondContact O-N 3.34Å; D880-S883 PolarHBondContact O-N 3.34Å; D880-S883 PolarHBondContact O-OG 3.11Å; G881-S883 VanDerWaalsContact C-N 3.34Å; G881-S883 PolarHBondContact O-N 3.23Å; S883-R940 PolarHBondContact O-NH2 3.2Å
884	R	79	Confident	77.4	Confident	69 Å²	69	45.9 Å²	45.9	26%	0.26	25%	0.252	S	S	.	.	H	α-helix	trans	-89.9	-6.3	-176.4	-70.6	173.7	-171.6	-81.7	-8.6	114.9	W792 T793 D880 G881 Y882 T886	W792-R884 HydrophobicContact CB-CB 4.21Å; T793-R884 PolarHBondContact N-O 3.29Å; T793-R884 PolarHBondContact OG1-O 3.35Å; D880-R884 VanDerWaalsContact CG-NE 3.3Å; D880-R884 VanDerWaalsContact O-CG 3.26Å; D880-R884 WeakPolarHBondContact O-CG 3.48Å; D880-R884 PolarHBondContact O-N 3.06Å; D880-R884 VanDerWaalsContact O-N 3.17Å; D880-R884 IonicContact OD1-CZ 3.34Å; D880-R884 IonicContact OD1-NE 2.76Å; D880-R884 PolarHBondContact OD1-NE 3.08Å; D880-R884 IonicContact OD1-NH2 3.03Å; D880-R884 PolarHBondContact OD1-NH2 3.11Å; D880-R884 IonicContact OD2-CZ 4Å; D880-R884 IonicContact OD2-NE 3.29Å; D880-R884 PolarHBondContact OD2-NE 3.34Å; D880-R884 IonicContact OD2-NH2 3.83Å; G881-R884 PolarHBondContact O-N 3.3Å; G881-R884 VanDerWaalsContact O-N 3.15Å; Y882-R884 PolarHBondContact O-N 2.83Å; R884-T886 PolarHBondContact O-N 3.39Å
885	L	81.8	Confident	77.5	Confident	20 Å²	20	45.7 Å²	45.7	11%	0.105	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	131.1	-179.1	-72.4	177.5	0	0	0	111.7	I790 G881 Y882 L960 N964 L967	I790-L885 HydrophobicContact CG2-CD2 3.93Å; G881-L885 PolarHBondContact O-N 3.4Å; Y882-L885 HydrophobicContact CD2-CD1 4.21Å; Y882-L885 PolarHBondContact O-N 3.29Å; L885-L960 HydrophobicContact CD1-CB 4.34Å; L885-L960 HydrophobicContact CD1-CD2 4.24Å; L885-N964 HydrophobicContact CD1-CB 4.07Å; L885-L967 HydrophobicContact CD2-CD1 3.85Å
886	T	79.7	Confident	77.9	Confident	26 Å²	26	45.7 Å²	45.7	16%	0.16	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154.9	174.6	60.6	0	0	0	0	111.8	I790 Q791 T793 R884	I790-T886 WeakPolarHBondContact CA-O 3.39Å; Q791-T886 PolarHBondContact N-O 3.29Å; Q791-T886 PolarHBondContact O-N 2.83Å; Q791-T886 PolarHBondContact O-OG1 3.08Å; T793-T886 WeakPolarHBondContact OG1-CG2 3.38Å; R884-T886 PolarHBondContact O-N 3.39Å
887	R	79.7	Confident	78.2	Confident	68 Å²	68	41.4 Å²	41.4	26%	0.257	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.6	167.6	175.2	-175.6	173.1	-179.4	5.5	109.6	I770 N788 V789 I933	I770-R887 HydrophobicContact CD1-CG 3.98Å; N788-R887 PolarHBondContact ND2-NH2 2.89Å; N788-R887 VanDerWaalsContact ND2-NH2 3.14Å; V789-R887 WeakPolarHBondContact O-CA 3.2Å; R887-I933 HydrophobicContact CB-CG2 3.87Å
888	Q	80.7	Confident	78.3	Confident	78 Å²	78	40.1 Å²	40.1	36%	0.364	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144.2	172.9	-169.4	165.5	-9.4	0	0	110.9	V789 V890	V789-Q888 WeakPolarHBondContact CG2-O 3.28Å; V789-Q888 PolarHBondContact N-O 3.39Å; V789-Q888 PolarHBondContact O-N 3.01Å; Q888-V890 HydrophobicContact CB-CG2 4.3Å; Q888-V890 HydrophobicContact CG-CG2 4.02Å
889	S	81.6	Confident	78.6	Confident	59 Å²	59	36.9 Å²	36.9	41%	0.413	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.1	168.2	-57.1	0	0	0	0	108.6	L787 N788	L787-S889 CarbonylContact O-C 3.53Å; L787-S889 VanDerWaalsContact O-CA 3.32Å; L787-S889 WeakPolarHBondContact O-CA 3.47Å; N788-S889 PolarHBondContact OD1-OG 3.12Å
890	V	82.6	Confident	79.1	Confident	6 Å²	6	30.6 Å²	30.6	4%	0.036	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.6	-170	-176.4	0	0	0	0	110	L754 F756 L787 V789 Q888	L754-V890 HydrophobicContact CD1-CB 4.45Å; L754-V890 HydrophobicContact CD1-CG1 4.17Å; L754-V890 HydrophobicContact CD1-CG2 4.11Å; L754-V890 HydrophobicContact CD2-CG1 4.27Å; F756-V890 HydrophobicContact CE1-CG2 4.32Å; F756-V890 HydrophobicContact CZ-CG1 4.36Å; F756-V890 HydrophobicContact CZ-CG2 3.83Å; L787-V890 PolarHBondContact N-O 3.4Å; L787-V890 PolarHBondContact O-N 2.88Å; V789-V890 HydrophobicContact CG2-CG2 3.72Å; Q888-V890 HydrophobicContact CB-CG2 4.3Å; Q888-V890 HydrophobicContact CG-CG2 4.02Å
891	S	81.2	Confident	79.3	Confident	13 Å²	13	32.3 Å²	32.3	9%	0.091	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	128	172	152.3	0	0	0	0	110.2	Q784 S893 D894 S895	Q784-S891 PolarHBondContact NE2-OG 3.32Å; S891-S893 PolarHBondContact O-N 3.34Å; S891-S893 PolarHBondContact OG-N 3.32Å; S891-S893 PolarHBondContact OG-OG 3.16Å; S891-D894 VanDerWaalsContact CB-OD2 3.28Å; S891-D894 WeakPolarHBondContact CB-OD2 3.43Å; S891-D894 PolarHBondContact O-N 2.99Å; S891-D894 PolarHBondContact OG-N 3.34Å; S891-D894 PolarHBondContact OG-OD2 3.47Å; S891-S895 PolarHBondContact O-N 2.93Å
892	L	76.9	Confident	79.5	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.026	19%	0.189	C	C	.	.	H	α-helix	trans	-61.8	-42.8	177.4	-80.2	174.3	0	0	0	112.4	I731 F746 I785 L787 D894 L896	I731-L892 HydrophobicContact CD1-CB 4.32Å; I731-L892 VanDerWaalsContact CD1-O 3.23Å; I731-L892 WeakPolarHBondContact CD1-O 3.46Å; I731-L892 HydrophobicContact CG1-CB 4.45Å; I731-L892 HydrophobicContact CG2-CB 4.06Å; F746-L892 HydrophobicContact CE1-CD1 4.18Å; F746-L892 HydrophobicContact CE1-CD2 4.05Å; F746-L892 HydrophobicContact CE2-CD1 3.64Å; F746-L892 HydrophobicContact CZ-CD1 3.39Å; F746-L892 HydrophobicContact CZ-CD2 3.99Å; F746-L892 HydrophobicContact CZ-CG 4.36Å; I785-L892 HydrophobicContact CB-CD1 3.87Å; I785-L892 HydrophobicContact CD1-CD1 4.44Å; I785-L892 HydrophobicContact CG2-CD1 3.53Å; I785-L892 HydrophobicContact CG2-CG 4.38Å; L787-L892 HydrophobicContact CD1-CD2 3.45Å; L787-L892 VanDerWaalsContact CD1-CD2 3.45Å; L787-L892 HydrophobicContact CD1-CG 4.11Å; L787-L892 HydrophobicContact CG-CD1 4.41Å; L787-L892 HydrophobicContact CG-CD2 3.93Å; L787-L892 HydrophobicContact CG-CG 4.01Å; L892-D894 PolarHBondContact O-N 3.2Å; L892-D894 VanDerWaalsContact O-N 3.15Å; L892-L896 HydrophobicContact CD2-CB 4.2Å; L892-L896 HydrophobicContact CD2-CD1 4.1Å; L892-L896 HydrophobicContact CD2-CD2 4.2Å; L892-L896 HydrophobicContact CD2-CG 4.39Å; L892-L896 WeakPolarHBondContact O-CB 3.26Å; L892-L896 PolarHBondContact O-N 2.81Å
893	S	69.3	Low	79.5	Confident	18 Å²	18	37.2 Å²	37.2	13%	0.126	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-25	-176.7	63.1	0	0	0	0	113.5	R724 N728 R777 Q784 S891	R724-S893 PolarHBondContact NH2-O 3.05Å; N728-S893 PolarHBondContact OD1-O 3.45Å; R777-S893 PolarHBondContact NH2-OG 3.33Å; Q784-S893 PolarHBondContact NE2-OG 3.49Å; S891-S893 PolarHBondContact O-N 3.34Å; S891-S893 PolarHBondContact OG-N 3.32Å; S891-S893 PolarHBondContact OG-OG 3.16Å
894	D	67.8	Low	79.6	Confident	78 Å²	78	35.4 Å²	35.4	42%	0.417	18%	0.181	S	C	.	.	H	α-helix	trans	-103.5	-31.4	-170.1	-51.5	-29.7	0	0	0	111.2	R724 Q755 R777 S891 L892	R724-D894 PolarHBondContact NH2-O 3.11Å; Q755-D894 PolarHBondContact NE2-O 3.11Å; R777-D894 IonicContact NH2-OD1 2.64Å; S891-D894 VanDerWaalsContact CB-OD2 3.28Å; S891-D894 WeakPolarHBondContact CB-OD2 3.43Å; S891-D894 PolarHBondContact O-N 2.99Å; S891-D894 PolarHBondContact OG-N 3.34Å; S891-D894 PolarHBondContact OG-OD2 3.47Å; L892-D894 PolarHBondContact O-N 3.2Å; L892-D894 VanDerWaalsContact O-N 3.15Å
895	S	76.1	Confident	79	Confident	17 Å²	17	37.5 Å²	37.5	12%	0.119	20%	0.202	C	C	.	.	H	α-helix	trans	-121.8	-13.4	-167	-65.5	0	0	0	0	116.4	L754 Q755 S891 V897	L754-S895 CarbonylContact C-O 3.6Å; L754-S895 VanDerWaalsContact CA-O 3.25Å; L754-S895 WeakPolarHBondContact CA-O 3.29Å; Q755-S895 WeakPolarHBondContact CG-O 3.46Å; Q755-S895 PolarHBondContact N-O 3.49Å; Q755-S895 PolarHBondContact O-OG 2.92Å; S891-S895 PolarHBondContact O-N 2.93Å; S895-V897 PolarHBondContact O-N 2.96Å
896	L	81.7	Confident	78	Confident	5 Å²	5	38.1 Å²	38.1	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	131.7	-175.7	-173.9	69.6	0	0	0	112.1	I731 L892 I899	I731-L896 HydrophobicContact CD1-CB 4.26Å; I731-L896 HydrophobicContact CD1-CD2 4.19Å; I731-L896 HydrophobicContact CG1-CD2 4.11Å; L892-L896 HydrophobicContact CD2-CB 4.2Å; L892-L896 HydrophobicContact CD2-CD1 4.1Å; L892-L896 HydrophobicContact CD2-CD2 4.2Å; L892-L896 HydrophobicContact CD2-CG 4.39Å; L892-L896 WeakPolarHBondContact O-CB 3.26Å; L892-L896 PolarHBondContact O-N 2.81Å; L896-I899 HydrophobicContact CD1-CG1 3.92Å; L896-I899 HydrophobicContact CD2-CD1 4.34Å; L896-I899 HydrophobicContact CD2-CG1 4.33Å
897	V	77.2	Confident	76.6	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	-51.5	171.4	178.9	0	0	0	0	111.1	Y723 L753 Q755 L764 P867 M870 S895 Y1018	Y723-V897 PolarHBondContact OH-O 2.86Å; L753-V897 HydrophobicContact CB-CB 4.37Å; L753-V897 WeakPolarHBondContact O-CB 3.42Å; L753-V897 PolarHBondContact O-N 2.93Å; Q755-V897 HydrophobicContact CB-CG2 3.67Å; Q755-V897 HydrophobicContact CG-CG2 3.89Å; L764-V897 HydrophobicContact CD1-CB 4.14Å; L764-V897 HydrophobicContact CD1-CG1 4Å; L764-V897 HydrophobicContact CD1-CG2 4.05Å; P867-V897 HydrophobicContact CB-CG1 4.22Å; P867-V897 HydrophobicContact CG-CG1 3.67Å; M870-V897 HydrophobicContact CE-CG2 4.27Å; M870-V897 HydrophobicContact SD-CG2 4.42Å; S895-V897 PolarHBondContact O-N 2.96Å; V897-Y1018 PolarHBondContact O-OH 3.3Å; V897-Y1018 VanDerWaalsContact O-OH 3.12Å
898	R	81.6	Confident	75	Confident	21 Å²	21	47.9 Å²	47.9	8%	0.079	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	138.9	-178.1	-163.6	178.1	-167.7	171.3	5.5	111.7	I752 L753 P994 Q996	I752-R898 WeakPolarHBondContact CA-O 3.31Å; L753-R898 HydrophobicContact CB-CB 4.02Å; L753-R898 HydrophobicContact CD1-CB 4.01Å; L753-R898 HydrophobicContact CG-CB 4.24Å; L753-R898 PolarHBondContact N-O 2.94Å; L753-R898 PolarHBondContact O-N 3.22Å; R898-P994 PolarHBondContact NH1-O 3.11Å; R898-Q996 HydrophobicContact CG-CG 4.43Å
899	I	85.5	Confident	73	Confident	4 Å²	4	49.3 Å²	49.3	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.4	167	-55.1	177.4	0	0	0	107.9	I745 F746 I752 L896 M997 F999	I745-I899 HydrophobicContact CG2-CD1 4.07Å; F746-I899 HydrophobicContact CE1-CD1 3.82Å; F746-I899 HydrophobicContact CZ-CD1 4.32Å; I752-I899 HydrophobicContact CG2-CG2 4.46Å; L896-I899 HydrophobicContact CD1-CG1 3.92Å; L896-I899 HydrophobicContact CD2-CD1 4.34Å; L896-I899 HydrophobicContact CD2-CG1 4.33Å; I899-M997 HydrophobicContact CB-CB 4.4Å; I899-M997 HydrophobicContact CG2-CB 4.07Å; I899-M997 HydrophobicContact CG2-CE 4.32Å; I899-M997 HydrophobicContact CG2-SD 4.04Å; I899-M997 PolarHBondContact O-N 2.98Å; I899-F999 HydrophobicContact CD1-CE1 4.5Å; I899-F999 HydrophobicContact CD1-CZ 4.17Å
900	C	85.4	Confident	70.5	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	152.1	-178.8	-56.2	0	0	0	0	111.1	L751 Q902 P994 K995	L751-C900 HydrophobicContact CB-CB 4.07Å; L751-C900 HydrophobicContact CD2-CB 4.34Å; L751-C900 HydrophobicContact CG-CB 4.36Å; L751-C900 VanDerWaalsContact O-CB 3.23Å; L751-C900 WeakPolarHBondContact O-CB 3.16Å; L751-C900 PolarHBondContact O-N 3.27Å; L751-C900 VanDerWaalsContact O-N 3.08Å; C900-Q902 VanDerWaalsContact C-N 3.28Å; C900-P994 HydrophobicContact CB-CB 3.81Å; C900-K995 WeakPolarHBondContact CA-O 3.19Å
901	D	83.4	Confident	68.1	Low	61 Å²	61	60.8 Å²	60.8	33%	0.326	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	-19.9	175	68.6	-17.7	0	0	0	113.6	K995	D901-K995 PolarHBondContact N-O 3.21Å; D901-K995 WeakPolarHBondContact OD2-CB 3.33Å
902	Q	82.8	Confident	65.5	Low	96 Å²	96	67.5 Å²	67.5	45%	0.449	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	138.7	-178.7	-66.3	-179.9	-7.3	0	0	113.4	L751 C900 P994	L751-Q902 HydrophobicContact CB-CB 4.44Å; L751-Q902 HydrophobicContact CD2-CB 4.43Å; L751-Q902 PolarHBondContact N-O 3.27Å; L751-Q902 VanDerWaalsContact N-O 3.14Å; C900-Q902 VanDerWaalsContact C-N 3.28Å; Q902-P994 HydrophobicContact CG-CB 4.16Å
903	I	80.9	Confident	63.2	Low	78 Å²	78	77.1 Å²	77.1	40%	0.4	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.4	174.5	-55.5	172.9	0	0	0	108.4	T905	I903-T905 PolarHBondContact O-N 2.65Å
904	V	77.1	Confident	61.3	Low	19 Å²	19	82.6 Å²	82.6	12%	0.115	42%	0.42	C	S	.	.			trans	-73.8	113.9	172.2	-175.5	0	0	0	0	108.3	G749 V768 F906 V962 A966	G749-V904 WeakPolarHBondContact O-CB 3.36Å; G749-V904 PolarHBondContact O-N 2.88Å; V768-V904 HydrophobicContact CG1-CG2 4.48Å; V768-V904 HydrophobicContact CG2-CG2 4.12Å; V904-F906 HydrophobicContact CG1-CZ 4.42Å; V904-V962 HydrophobicContact CG1-CG1 3.67Å; V904-A966 HydrophobicContact CB-CB 4.49Å; V904-A966 HydrophobicContact CG1-CB 4.16Å; V904-A966 HydrophobicContact CG2-CB 3.47Å; V904-A966 VanDerWaalsContact CG2-CB 3.47Å
905	T	66.4	Low	59.4	Low	114 Å²	114	85.5 Å²	85.5	70%	0.699	44%	0.435	S	S	*	.			trans	-93.5	142.6	-179.8	52.2	0	0	0	0	110.9	I903	I903-T905 PolarHBondContact O-N 2.65Å
906	F	61.6	Low	57.2	Low	32 Å²	32	91.1 Å²	91.1	14%	0.14	46%	0.464	C	S	.	.			trans	-109.8	135.7	177.7	-56.6	-86.7	0	0	0	108.5	V904 D908 M909 H959 I963	V904-F906 HydrophobicContact CG1-CZ 4.42Å; F906-D908 PolarHBondContact O-N 3.11Å; F906-M909 HydrophobicContact CB-CE 4.44Å; F906-M909 HydrophobicContact CD2-CE 3.4Å; F906-M909 HydrophobicContact CD2-SD 4.29Å; F906-M909 HydrophobicContact CE2-CE 3.99Å; F906-M909 HydrophobicContact CG-CE 4.23Å; F906-M909 PolarHBondContact O-N 3.02Å; F906-H959 HydrophobicContact CD1-CB 3.99Å; F906-H959 AromaticContact CD1-CG 3.87Å; F906-H959 AromaticContact CD1-ND1 3.4Å; F906-H959 WeakPolarHBondContact CD1-ND1 3.48Å; F906-H959 HydrophobicContact CE1-CB 4.11Å; F906-I963 HydrophobicContact CE1-CD1 3.87Å; F906-I963 HydrophobicContact CE1-CG1 3.82Å; F906-I963 HydrophobicContact CZ-CD1 3.95Å; F906-I963 HydrophobicContact CZ-CG1 3.89Å
907	Q	50.2	Low	54.7	Low	182 Å²	182	98.1 Å²	98.1	85%	0.85	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-16	-170	-76.4	178.5	-20.4	0	0	115
908	D	45.5	Very low	52.4	Low	118 Å²	118	105.2 Å²	105.2	63%	0.631	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	4.2	178.5	-70.1	-30.1	0	0	0	115.2	F906 K910	F906-D908 PolarHBondContact O-N 3.11Å; D908-K910 PolarHBondContact O-N 3.13Å
909	M	39.4	Very low	49.9	Very low	108 Å²	108	109.3 Å²	109.3	53%	0.532	57%	0.571	S	S	.	*			trans	-90	64.8	174.4	-73.8	-166	-155.5	0	0	112.5	F906	F906-M909 HydrophobicContact CB-CE 4.44Å; F906-M909 HydrophobicContact CD2-CE 3.4Å; F906-M909 HydrophobicContact CD2-SD 4.29Å; F906-M909 HydrophobicContact CE2-CE 3.99Å; F906-M909 HydrophobicContact CG-CE 4.23Å; F906-M909 PolarHBondContact O-N 3.02Å
910	K	29	Very low	47.3	Very low	201 Å²	201	118.8 Å²	118.8	87%	0.874	61%	0.612	S	S	*	*			trans	-97	83.6	153.6	-80.9	-174.8	178.6	177.5	0	108	D908	D908-K910 PolarHBondContact O-N 3.13Å
911	C	30.8	Very low	44.7	Very low	104 Å²	104	123.1 Å²	123.1	70%	0.703	64%	0.642	S	S	*	*			trans	-125.2	113.5	166.7	-80.5	0	0	0	0	108.4	F913	C911-F913 PolarHBondContact O-N 2.96Å
912	N	27.8	Very low	42.4	Very low	154 Å²	154	128.6 Å²	128.6	82%	0.824	67%	0.665	S	S	*	*			trans	-56.5	123.5	176.8	-68.7	-31.8	0	0	0	110	I914	N912-I914 VanDerWaalsContact C-N 3.28Å; N912-I914 PolarHBondContact O-N 3.16Å; N912-I914 VanDerWaalsContact O-N 3.09Å
913	F	28.4	Very low	40.4	Very low	208 Å²	208	127 Å²	127	91%	0.912	67%	0.665	S	S	*	*			trans	-78	76.3	166.6	-81.7	-89.9	0	0	0	109.1	C911	C911-F913 PolarHBondContact O-N 2.96Å
914	I	29.1	Very low	39	Very low	133 Å²	133	126.5 Å²	126.5	68%	0.682	67%	0.668	S	S	*	*			trans	-146	117.7	169.6	-56.4	-178.6	0	0	0	109.1	N912	N912-I914 VanDerWaalsContact C-N 3.28Å; N912-I914 PolarHBondContact O-N 3.16Å; N912-I914 VanDerWaalsContact O-N 3.09Å
915	D	27.9	Very low	37.6	Very low	139 Å²	139	130.9 Å²	130.9	74%	0.743	69%	0.69	S	S	*	*			trans	66.3	139.6	153.3	-60.3	-21.8	0	0	0	123.3
916	D	29.7	Very low	36.8	Very low	135 Å²	135	128 Å²	128	72%	0.722	67%	0.67	S	S	*	*			trans	80.9	99	150.3	-66.3	-25.6	0	0	0	121.4	N918	D916-N918 PolarHBondContact O-N 3.1Å
917	N	29	Very low	36.2	Very low	151 Å²	151	131.5 Å²	131.5	81%	0.807	69%	0.687	S	S	*	*				32.3	65.2	115.8	-70.4	-30.6	0	0	0	116.6
918	N	29.4	Very low	36.2	Very low	152 Å²	152	126.5 Å²	126.5	81%	0.813	67%	0.666	S	S	*	*			trans	-159.1	103.4	150	-98	-34.8	0	0	0	111.5	D916 K920	D916-N918 PolarHBondContact O-N 3.1Å; N918-K920 PolarHBondContact O-N 3.43Å
919	S	27.9	Very low	36.4	Very low	106 Å²	106	122.3 Å²	122.3	74%	0.741	64%	0.643	S	S	*	*			trans	-58.1	119.7	169.3	53.1	0	0	0	0	111.4
920	K	31.2	Very low	36.9	Very low	204 Å²	204	118.1 Å²	118.1	89%	0.887	62%	0.622	S	S	*	*	S	Bend	trans	161.4	2.3	135	-88.1	170.3	-178.8	-178.8	0	118.1	N918	N918-K920 PolarHBondContact O-N 3.43Å
921	S	31.7	Very low	37.9	Very low	90 Å²	90	114.2 Å²	114.2	63%	0.629	61%	0.607	S	S	*	*	S	Bend	trans	-119.1	-0.1	-166.7	48.8	0	0	0	0	119.1
922	H	34.8	Very low	38.7	Very low	177 Å²	177	111.3 Å²	111.3	82%	0.819	59%	0.588	S	S	*	*			trans	-99.5	15.2	-169.1	-71.6	-75.6	0	0	0	117
923	S	41	Very low	39.8	Very low	63 Å²	63	105 Å²	105	44%	0.441	55%	0.554	S	S	.	*			trans	-90.3	-11.1	-171.6	81	0	0	0	0	116.2	E927	S923-E927 WeakPolarHBondContact CB-OE2 3.42Å; S923-E927 WeakPolarHBondContact O-CB 3.18Å; S923-E927 WeakPolarHBondContact O-CG 3.34Å; S923-E927 PolarHBondContact O-N 3.15Å; S923-E927 PolarHBondContact OG-OE2 2.74Å
924	S	52.3	Low	40.6	Very low	67 Å²	67	101.8 Å²	101.8	47%	0.469	54%	0.54	S	S	.	.	H	α-helix	trans	-72	-49.4	-159.1	62	0	0	0	0	116.2	L928	S924-L928 WeakPolarHBondContact O-CB 3.2Å; S924-L928 WeakPolarHBondContact O-CD1 3.47Å; S924-L928 WeakPolarHBondContact O-CG 3.28Å; S924-L928 PolarHBondContact O-N 3.36Å
925	I	46.8	Very low	41.5	Very low	110 Å²	110	102.7 Å²	102.7	56%	0.564	54%	0.541	S	S	*	.	H	α-helix	trans	-75.6	-39	-169.8	-68.1	169.5	0	0	0	113	L928 L929	I925-L928 PolarHBondContact O-N 2.97Å; I925-L929 HydrophobicContact CG2-CD1 4.46Å; I925-L929 PolarHBondContact O-N 3.07Å
926	L	49.3	Very low	42.3	Very low	55 Å²	55	98.5 Å²	98.5	29%	0.288	52%	0.518	S	S	.	.	H	α-helix	trans	-73.5	-38.9	176.5	-135.5	90.6	0	0	0	110.8	I770 L928 L929 L930	I770-L926 HydrophobicContact CG2-CD2 3.54Å; I770-L926 HydrophobicContact CG2-CG 4.15Å; L926-L928 VanDerWaalsContact C-N 3.31Å; L926-L928 PolarHBondContact O-N 3.22Å; L926-L929 PolarHBondContact O-N 2.95Å; L926-L930 WeakPolarHBondContact O-CB 3.47Å; L926-L930 WeakPolarHBondContact O-CD1 3.2Å; L926-L930 WeakPolarHBondContact O-CG 3.13Å; L926-L930 PolarHBondContact O-N 3.1Å
927	E	49.9	Very low	43	Very low	104 Å²	104	95.3 Å²	95.3	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-64.7	-35	172.4	-75.4	-176.1	142.7	0	0	112.4	S923 L930 Q931	S923-E927 WeakPolarHBondContact CB-OE2 3.42Å; S923-E927 WeakPolarHBondContact O-CB 3.18Å; S923-E927 WeakPolarHBondContact O-CG 3.34Å; S923-E927 PolarHBondContact O-N 3.15Å; S923-E927 PolarHBondContact OG-OE2 2.74Å; E927-L930 CarbonylContact O-C 3.58Å; E927-L930 PolarHBondContact O-N 3.16Å; E927-Q931 WeakPolarHBondContact O-CG 3.26Å; E927-Q931 PolarHBondContact O-N 3.41Å
928	L	48.8	Very low	44	Very low	78 Å²	78	94.4 Å²	94.4	41%	0.408	50%	0.495	S	S	.	.	H	α-helix	trans	-65.6	-46.9	173.7	-75.5	164	0	0	0	111.5	S924 I925 L926 L930 Q931 S932 F956	S924-L928 WeakPolarHBondContact O-CB 3.2Å; S924-L928 WeakPolarHBondContact O-CD1 3.47Å; S924-L928 WeakPolarHBondContact O-CG 3.28Å; S924-L928 PolarHBondContact O-N 3.36Å; I925-L928 PolarHBondContact O-N 2.97Å; L926-L928 VanDerWaalsContact C-N 3.31Å; L926-L928 PolarHBondContact O-N 3.22Å; L928-L930 PolarHBondContact O-N 3.13Å; L928-Q931 PolarHBondContact O-N 2.88Å; L928-Q931 VanDerWaalsContact O-N 3.16Å; L928-S932 PolarHBondContact O-N 3.36Å; L928-S932 VanDerWaalsContact O-N 3.1Å; L928-S932 PolarHBondContact O-OG 3.33Å; L928-F956 HydrophobicContact CB-CE1 4.42Å; L928-F956 HydrophobicContact CB-CZ 4.34Å
929	L	50.7	Low	44.7	Very low	30 Å²	30	90.6 Å²	90.6	16%	0.157	48%	0.48	C	S	.	.	H	α-helix	trans	-55.5	-38	170.4	-88.7	158.5	0	0	0	112.1	I925 L926 I933 F956	I925-L929 HydrophobicContact CG2-CD1 4.46Å; I925-L929 PolarHBondContact O-N 3.07Å; L926-L929 PolarHBondContact O-N 2.95Å; L929-I933 WeakPolarHBondContact O-CG1 3.23Å; L929-I933 PolarHBondContact O-N 3.08Å; L929-F956 HydrophobicContact CD2-CD1 3.8Å; L929-F956 HydrophobicContact CG-CD1 3.88Å; L929-F956 HydrophobicContact CG-CE1 4.13Å
930	L	50.1	Low	45.4	Very low	19 Å²	19	91 Å²	91	10%	0.099	47%	0.465	C	S	.	.	H	α-helix	trans	-76.2	-27	179.7	-68.9	170.8	0	0	0	113.9	I770 L926 E927 L928	I770-L930 HydrophobicContact CD1-CD2 3.78Å; I770-L930 HydrophobicContact CG2-CD1 4.3Å; I770-L930 HydrophobicContact CG2-CD2 3.86Å; I770-L930 HydrophobicContact CG2-CG 4.39Å; L926-L930 WeakPolarHBondContact O-CB 3.47Å; L926-L930 WeakPolarHBondContact O-CD1 3.2Å; L926-L930 WeakPolarHBondContact O-CG 3.13Å; L926-L930 PolarHBondContact O-N 3.1Å; E927-L930 CarbonylContact O-C 3.58Å; E927-L930 PolarHBondContact O-N 3.16Å; L928-L930 PolarHBondContact O-N 3.13Å
931	Q	49.6	Very low	46.1	Very low	120 Å²	120	89.8 Å²	89.8	56%	0.561	46%	0.46	S	S	*	.	H	α-helix	trans	-74	-38.1	172.7	-79.7	178.5	-6.2	0	0	111.4	E927 L928 K934 Q935	E927-Q931 WeakPolarHBondContact O-CG 3.26Å; E927-Q931 PolarHBondContact O-N 3.41Å; L928-Q931 PolarHBondContact O-N 2.88Å; L928-Q931 VanDerWaalsContact O-N 3.16Å; Q931-K934 WeakPolarHBondContact O-CB 3.43Å; Q931-K934 PolarHBondContact O-N 2.96Å; Q931-Q935 PolarHBondContact O-N 3.47Å; Q931-Q935 VanDerWaalsContact O-N 3.11Å
932	S	48.3	Very low	46.5	Very low	42 Å²	42	92.9 Å²	92.9	29%	0.294	47%	0.47	S	S	.	.	H	α-helix	trans	-68.5	-41.4	179.1	-48.4	0	0	0	0	112.7	L928 K934 Q935 I936	L928-S932 PolarHBondContact O-N 3.36Å; L928-S932 VanDerWaalsContact O-N 3.1Å; L928-S932 PolarHBondContact O-OG 3.33Å; S932-K934 VanDerWaalsContact C-N 3.26Å; S932-K934 PolarHBondContact O-N 3.04Å; S932-Q935 PolarHBondContact O-N 2.98Å; S932-Q935 VanDerWaalsContact O-N 3.14Å; S932-I936 WeakPolarHBondContact O-CG1 3.47Å; S932-I936 PolarHBondContact O-N 2.64Å
933	I	49.5	Very low	46.7	Very low	21 Å²	21	90.3 Å²	90.3	11%	0.108	46%	0.462	C	S	.	.	H	α-helix	trans	-64.7	-31.2	174.8	-64.5	167.7	0	0	0	111.4	I790 R887 L929 N937	I790-I933 HydrophobicContact CD1-CD1 4.4Å; R887-I933 HydrophobicContact CB-CG2 3.87Å; L929-I933 WeakPolarHBondContact O-CG1 3.23Å; L929-I933 PolarHBondContact O-N 3.08Å; I933-N937 PolarHBondContact O-N 2.94Å; I933-N937 VanDerWaalsContact O-N 3.17Å
934	K	45.8	Very low	46.4	Very low	142 Å²	142	93.4 Å²	93.4	62%	0.617	48%	0.48	S	S	*	.	H	α-helix	trans	-67.3	-40.5	172.1	-91.5	-178	174.5	-179.2	0	112	Q931 S932 I938	Q931-K934 WeakPolarHBondContact O-CB 3.43Å; Q931-K934 PolarHBondContact O-N 2.96Å; S932-K934 VanDerWaalsContact C-N 3.26Å; S932-K934 PolarHBondContact O-N 3.04Å; K934-I938 VanDerWaalsContact O-CD1 3.29Å; K934-I938 WeakPolarHBondContact O-CD1 3.41Å; K934-I938 WeakPolarHBondContact O-CG1 3.5Å; K934-I938 PolarHBondContact O-N 3.24Å
935	Q	48	Very low	45.5	Very low	151 Å²	151	98.4 Å²	98.4	71%	0.706	49%	0.494	S	S	*	.	H	α-helix	trans	-67.3	-39	176	-73.5	-167.3	-7.1	0	0	112.4	Q931 S932 N937 I938 S939	Q931-Q935 PolarHBondContact O-N 3.47Å; Q931-Q935 VanDerWaalsContact O-N 3.11Å; S932-Q935 PolarHBondContact O-N 2.98Å; S932-Q935 VanDerWaalsContact O-N 3.14Å; Q935-N937 PolarHBondContact O-N 3.43Å; Q935-I938 PolarHBondContact O-N 3.49Å; Q935-S939 PolarHBondContact O-N 3.35Å
936	I	45.6	Very low	44.9	Very low	52 Å²	52	101.1 Å²	101.1	27%	0.267	51%	0.508	S	S	.	.	H	α-helix	trans	-64.3	-36.2	177.1	-66	164.5	0	0	0	112.1	S932 S939 R940	S932-I936 WeakPolarHBondContact O-CG1 3.47Å; S932-I936 PolarHBondContact O-N 2.64Å; I936-S939 PolarHBondContact O-OG 3.11Å; I936-R940 WeakPolarHBondContact O-CD 3.44Å; I936-R940 VanDerWaalsContact O-CG 3.27Å; I936-R940 WeakPolarHBondContact O-CG 3.24Å
937	N	44.4	Very low	44.1	Very low	67 Å²	67	104.3 Å²	104.3	36%	0.358	53%	0.525	S	S	.	.	H	α-helix	trans	-81.9	-18.2	178.6	-79.7	-22.2	0	0	0	114.2	I933 Q935	I933-N937 PolarHBondContact O-N 2.94Å; I933-N937 VanDerWaalsContact O-N 3.17Å; Q935-N937 PolarHBondContact O-N 3.43Å
938	I	48.5	Very low	43.4	Very low	133 Å²	133	104.2 Å²	104.2	68%	0.682	53%	0.534	S	S	*	.	H	α-helix	trans	-80	-31.5	175.2	-68.8	164.1	0	0	0	111	K934 Q935	K934-I938 VanDerWaalsContact O-CD1 3.29Å; K934-I938 WeakPolarHBondContact O-CD1 3.41Å; K934-I938 WeakPolarHBondContact O-CG1 3.5Å; K934-I938 PolarHBondContact O-N 3.24Å; Q935-I938 PolarHBondContact O-N 3.49Å
939	S	43.7	Very low	42.7	Very low	71 Å²	71	106.9 Å²	106.9	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-82.2	-13.2	178.4	73	0	0	0	0	114.6	Q935 I936 K941	Q935-S939 PolarHBondContact O-N 3.35Å; I936-S939 PolarHBondContact O-OG 3.11Å; S939-K941 VanDerWaalsContact C-N 3.32Å; S939-K941 PolarHBondContact O-N 3.03Å
940	R	44.1	Very low	41.8	Very low	114 Å²	114	113.1 Å²	113.1	43%	0.43	59%	0.586	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.3	6.5	-176.1	-82.6	174.5	171.6	-168.2	-8.1	115.4	S883 I936	S883-R940 PolarHBondContact O-NH2 3.2Å; I936-R940 WeakPolarHBondContact O-CD 3.44Å; I936-R940 VanDerWaalsContact O-CG 3.27Å; I936-R940 WeakPolarHBondContact O-CG 3.24Å
941	K	45	Very low	41	Very low	179 Å²	179	115.6 Å²	115.6	78%	0.778	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-18.5	-175.9	-97	-176	175	-177.8	0	115.5	S939	S939-K941 VanDerWaalsContact C-N 3.32Å; S939-K941 PolarHBondContact O-N 3.03Å
942	D	40.1	Very low	40.5	Very low	156 Å²	156	117.8 Å²	117.8	83%	0.834	63%	0.632	S	S	*	*	S	Bend	trans	-130.1	-10.5	-168.9	-67.1	-46.8	0	0	0	117.1
943	D	38.4	Very low	40.2	Very low	123 Å²	123	119.4 Å²	119.4	66%	0.658	64%	0.637	S	S	*	*			trans	-164.7	130	171.6	-137	-25.2	0	0	0	112.5	K945	D943-K945 VanDerWaalsContact C-N 3.28Å; D943-K945 PolarHBondContact O-N 2.98Å
944	P	35.5	Very low	40.1	Very low	127 Å²	127	126.4 Å²	126.4	83%	0.825	67%	0.669	S	S	*	*	S	Bend	trans	-83.9	14.2	-172.9	15	-0.9	0	0	0	115.1
945	K	33.9	Very low	40.1	Very low	173 Å²	173	127.5 Å²	127.5	75%	0.752	67%	0.669	S	S	*	*	S	Bend	trans	-138.9	85.3	-177	-68.9	-179.2	179.5	178.3	0	110.4	D943	D943-K945 VanDerWaalsContact C-N 3.28Å; D943-K945 PolarHBondContact O-N 2.98Å
946	L	33	Very low	40.3	Very low	166 Å²	166	122.6 Å²	122.6	87%	0.869	65%	0.646	S	S	*	*			trans	165.4	108	156.1	-90.3	146.6	0	0	0	109.3
947	L	33	Very low	41.1	Very low	122 Å²	122	123.5 Å²	123.5	64%	0.639	65%	0.651	S	S	*	*			trans	-85.4	124.6	156.5	-86.4	155.5	0	0	0	106.8	V949	L947-V949 PolarHBondContact O-N 3.23Å
948	P	35.5	Very low	42	Very low	103 Å²	103	124.1 Å²	124.1	67%	0.669	65%	0.654	S	S	*	*			trans	-72.7	104.5	170.3	29.3	-29.9	0	0	0	108.4	N950	P948-N950 VanDerWaalsContact C-N 3.34Å; P948-N950 PolarHBondContact O-N 2.93Å; P948-N950 VanDerWaalsContact O-N 3.08Å
949	V	34.4	Very low	42.9	Very low	134 Å²	134	118.8 Å²	118.8	81%	0.812	63%	0.626	S	S	*	*			trans	-68.4	93.4	161.7	178.7	0	0	0	0	106.5	L947	L947-V949 PolarHBondContact O-N 3.23Å
950	N	31	Very low	44.3	Very low	161 Å²	161	116.6 Å²	116.6	86%	0.861	61%	0.608	S	S	*	*			trans	-157.7	109.4	165.5	-86.4	-32.4	0	0	0	109.1	P948	P948-N950 VanDerWaalsContact C-N 3.34Å; P948-N950 PolarHBondContact O-N 2.93Å; P948-N950 VanDerWaalsContact O-N 3.08Å
951	G	34.3	Very low	45.9	Very low	70 Å²	70	116 Å²	116	72%	0.722	61%	0.61	S	S	*	*	S	Bend	trans	125.9	76.1	165.2	0	0	0	0	0	116.8	D953	G951-D953 PolarHBondContact O-N 3.45Å; G951-D953 VanDerWaalsContact O-N 3.13Å
952	D	37.8	Very low	47.5	Very low	167 Å²	167	110 Å²	110	89%	0.893	59%	0.588	S	S	*	*	S	Bend	trans	56.8	20	133.7	-63	-14.4	0	0	0	124.2
953	D	43	Very low	49.5	Very low	75 Å²	75	103 Å²	103	40%	0.401	55%	0.551	S	S	.	*			trans	-143.2	79.4	173.6	-128.4	-15.2	0	0	0	115.7	G951 R955 F956	G951-D953 PolarHBondContact O-N 3.45Å; G951-D953 VanDerWaalsContact O-N 3.13Å; D953-R955 PolarHBondContact O-N 2.71Å; D953-R955 IonicContact OD1-NE 3.34Å; D953-R955 PolarHBondContact OD1-NE 3.39Å; D953-F956 HydrophobicContact CB-CD2 3.64Å; D953-F956 HydrophobicContact CB-CE2 3.54Å; D953-F956 PolarHBondContact O-N 3.36Å; D953-F956 WeakPolarHBondContact OD2-CE2 3.42Å
954	H	46.3	Very low	51.7	Low	169 Å²	169	97.3 Å²	97.3	78%	0.782	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-14.5	174.3	-79.6	-69.8	0	0	0	115.2
955	R	45.7	Very low	54.1	Low	164 Å²	164	95.1 Å²	95.1	62%	0.619	50%	0.502	S	S	*	.	H	α-helix	trans	-71.9	-30	-177.1	-63.7	-179.3	-120.5	-157.3	-7	113.3	D953 H959	D953-R955 PolarHBondContact O-N 2.71Å; D953-R955 IonicContact OD1-NE 3.34Å; D953-R955 PolarHBondContact OD1-NE 3.39Å; R955-H959 PolarHBondContact O-CD2 2.9Å
956	F	52.8	Low	56.4	Low	49 Å²	49	87.8 Å²	87.8	22%	0.215	47%	0.474	C	S	.	.	H	α-helix	trans	-75.5	-33.3	-175.3	-63.9	-65	0	0	0	113.7	L928 L929 D953 I958 H959 L960	L928-F956 HydrophobicContact CB-CE1 4.42Å; L928-F956 HydrophobicContact CB-CZ 4.34Å; L929-F956 HydrophobicContact CD2-CD1 3.8Å; L929-F956 HydrophobicContact CG-CD1 3.88Å; L929-F956 HydrophobicContact CG-CE1 4.13Å; D953-F956 HydrophobicContact CB-CD2 3.64Å; D953-F956 HydrophobicContact CB-CE2 3.54Å; D953-F956 PolarHBondContact O-N 3.36Å; D953-F956 WeakPolarHBondContact OD2-CE2 3.42Å; F956-I958 VanDerWaalsContact C-N 3.34Å; F956-H959 PolarHBondContact O-N 3.08Å; F956-L960 PolarHBondContact O-N 2.55Å
957	D	62.3	Low	58.9	Low	71 Å²	71	79.9 Å²	79.9	38%	0.38	43%	0.432	S	S	.	.	H	α-helix	trans	-65.7	-39.6	179.2	-161.6	-0.2	0	0	0	111	Y882 H959 L960 Q961	Y882-D957 VanDerWaalsContact CZ-OD1 3.32Å; Y882-D957 PolarHBondContact OH-OD1 2.61Å; D957-H959 VanDerWaalsContact C-N 3.35Å; D957-H959 PolarHBondContact O-N 3.12Å; D957-L960 PolarHBondContact O-N 3.25Å; D957-Q961 VanDerWaalsContact CG-NE2 3.29Å; D957-Q961 WeakPolarHBondContact O-CB 3.47Å; D957-Q961 VanDerWaalsContact O-CG 3.23Å; D957-Q961 WeakPolarHBondContact O-CG 3.47Å; D957-Q961 PolarHBondContact O-N 3.25Å; D957-Q961 PolarHBondContact OD1-NE2 3.25Å; D957-Q961 PolarHBondContact OD2-NE2 2.96Å
958	I	64.7	Low	61.3	Low	80 Å²	80	75.7 Å²	75.7	41%	0.41	41%	0.409	S	S	.	.	H	α-helix	trans	-58.4	-44.6	176.9	-61	170.2	0	0	0	111.2	F956 Q961 V962	F956-I958 VanDerWaalsContact C-N 3.34Å; I958-Q961 PolarHBondContact O-N 3.47Å; I958-V962 VanDerWaalsContact O-CG2 3.29Å; I958-V962 WeakPolarHBondContact O-CG2 3.45Å; I958-V962 PolarHBondContact O-N 3.38Å
959	H	66.3	Low	63.5	Low	21 Å²	21	74.9 Å²	74.9	10%	0.097	40%	0.399	C	S	.	.	H	α-helix	trans	-68	-39.7	-178.7	-66.2	-40.4	0	0	0	113.1	F906 R955 F956 D957 V962 I963	F906-H959 HydrophobicContact CD1-CB 3.99Å; F906-H959 AromaticContact CD1-CG 3.87Å; F906-H959 AromaticContact CD1-ND1 3.4Å; F906-H959 WeakPolarHBondContact CD1-ND1 3.48Å; F906-H959 HydrophobicContact CE1-CB 4.11Å; R955-H959 PolarHBondContact O-CD2 2.9Å; F956-H959 PolarHBondContact O-N 3.08Å; D957-H959 VanDerWaalsContact C-N 3.35Å; D957-H959 PolarHBondContact O-N 3.12Å; H959-V962 PolarHBondContact O-N 2.97Å; H959-I963 WeakPolarHBondContact O-CD1 3.42Å; H959-I963 WeakPolarHBondContact O-CG1 3.49Å; H959-I963 PolarHBondContact O-N 3.34Å; H959-I963 VanDerWaalsContact O-N 3.08Å
960	L	73.3	Confident	65.7	Low	25 Å²	25	68.6 Å²	68.6	13%	0.131	36%	0.361	C	S	.	.	H	α-helix	trans	-68.7	-36.1	176.1	-73	171.8	0	0	0	112	Y882 L885 F956 D957 I963 N964	Y882-L960 HydrophobicContact CE2-CB 3.64Å; L885-L960 HydrophobicContact CD1-CB 4.34Å; L885-L960 HydrophobicContact CD1-CD2 4.24Å; F956-L960 PolarHBondContact O-N 2.55Å; D957-L960 PolarHBondContact O-N 3.25Å; L960-I963 PolarHBondContact O-N 3.42Å; L960-N964 WeakPolarHBondContact O-CB 3.29Å; L960-N964 PolarHBondContact O-N 3.4Å
961	Q	76.9	Confident	67.8	Low	100 Å²	100	61 Å²	61	47%	0.467	32%	0.32	S	S	.	.	H	α-helix	trans	-63.4	-42.4	173.8	-71.8	172.5	17.9	0	0	111.5	Y882 D957 I958 N964 L965	Y882-Q961 HydrophobicContact CD2-CG 4.1Å; Y882-Q961 HydrophobicContact CE2-CG 3.68Å; D957-Q961 VanDerWaalsContact CG-NE2 3.29Å; D957-Q961 WeakPolarHBondContact O-CB 3.47Å; D957-Q961 VanDerWaalsContact O-CG 3.23Å; D957-Q961 WeakPolarHBondContact O-CG 3.47Å; D957-Q961 PolarHBondContact O-N 3.25Å; D957-Q961 PolarHBondContact OD1-NE2 3.25Å; D957-Q961 PolarHBondContact OD2-NE2 2.96Å; I958-Q961 PolarHBondContact O-N 3.47Å; Q961-N964 PolarHBondContact O-N 2.9Å; Q961-L965 VanDerWaalsContact O-CB 3.31Å; Q961-L965 WeakPolarHBondContact O-CB 3.33Å; Q961-L965 PolarHBondContact O-N 2.89Å
962	V	79.9	Confident	69.6	Low	53 Å²	53	60.9 Å²	60.9	32%	0.321	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-43.2	175.2	170.5	0	0	0	0	111.6	V904 I958 H959 L965 A966	V904-V962 HydrophobicContact CG1-CG1 3.67Å; I958-V962 VanDerWaalsContact O-CG2 3.29Å; I958-V962 WeakPolarHBondContact O-CG2 3.45Å; I958-V962 PolarHBondContact O-N 3.38Å; H959-V962 PolarHBondContact O-N 2.97Å; V962-L965 PolarHBondContact O-N 3.34Å; V962-A966 WeakPolarHBondContact O-CB 3.25Å; V962-A966 PolarHBondContact O-N 3.01Å
963	I	81.5	Confident	71.2	Confident	9 Å²	9	54.9 Å²	54.9	5%	0.046	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-47.2	176.7	-69	158	0	0	0	110.8	V768 I790 F906 H959 L960 L965 A966 L967	V768-I963 HydrophobicContact CB-CG2 4.4Å; V768-I963 HydrophobicContact CG2-CG2 4.17Å; I790-I963 HydrophobicContact CB-CG2 4.25Å; I790-I963 HydrophobicContact CD1-CD1 3.71Å; I790-I963 HydrophobicContact CG2-CG2 3.83Å; F906-I963 HydrophobicContact CE1-CD1 3.87Å; F906-I963 HydrophobicContact CE1-CG1 3.82Å; F906-I963 HydrophobicContact CZ-CD1 3.95Å; F906-I963 HydrophobicContact CZ-CG1 3.89Å; H959-I963 WeakPolarHBondContact O-CD1 3.42Å; H959-I963 WeakPolarHBondContact O-CG1 3.49Å; H959-I963 PolarHBondContact O-N 3.34Å; H959-I963 VanDerWaalsContact O-N 3.08Å; L960-I963 PolarHBondContact O-N 3.42Å; I963-L965 VanDerWaalsContact C-N 3.3Å; I963-L965 PolarHBondContact O-N 3.35Å; I963-A966 PolarHBondContact O-N 3.23Å; I963-L967 HydrophobicContact CG2-CD1 4.17Å; I963-L967 HydrophobicContact CG2-CG 4.45Å; I963-L967 WeakPolarHBondContact O-CG 3.32Å; I963-L967 PolarHBondContact O-N 3.14Å
964	N	85.2	Confident	72.4	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.027	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-43.6	178.2	-170.9	46.9	0	0	0	111.7	W792 L878 G881 Y882 L885 L960 Q961 A966 L967 F968	W792-N964 PolarHBondContact NE1-OD1 3.08Å; L878-N964 PolarHBondContact O-ND2 2.9Å; G881-N964 WeakPolarHBondContact CA-OD1 3.18Å; G881-N964 PolarHBondContact O-OD1 3.07Å; Y882-N964 HydrophobicContact CD2-CB 4.29Å; Y882-N964 PolarHBondContact N-ND2 3.12Å; Y882-N964 PolarHBondContact N-OD1 2.99Å; L885-N964 HydrophobicContact CD1-CB 4.07Å; L960-N964 WeakPolarHBondContact O-CB 3.29Å; L960-N964 PolarHBondContact O-N 3.4Å; Q961-N964 PolarHBondContact O-N 2.9Å; N964-A966 PolarHBondContact O-N 3Å; N964-L967 PolarHBondContact O-N 3.2Å; N964-F968 VanDerWaalsContact O-CB 3.29Å; N964-F968 WeakPolarHBondContact O-CB 3.27Å; N964-F968 PolarHBondContact O-N 3.41Å
965	L	85.3	Confident	73.3	Confident	80 Å²	80	44 Å²	44	42%	0.419	22%	0.222	S	C	.	.	H	α-helix	trans	-62.5	-41.6	176.6	-177	63.5	0	0	0	111.7	L878 Q961 V962 I963 F968 N969	L878-L965 HydrophobicContact CD2-CD1 4.05Å; Q961-L965 VanDerWaalsContact O-CB 3.31Å; Q961-L965 WeakPolarHBondContact O-CB 3.33Å; Q961-L965 PolarHBondContact O-N 2.89Å; V962-L965 PolarHBondContact O-N 3.34Å; I963-L965 VanDerWaalsContact C-N 3.3Å; I963-L965 PolarHBondContact O-N 3.35Å; L965-F968 PolarHBondContact O-N 3.15Å; L965-N969 VanDerWaalsContact O-CB 3.3Å; L965-N969 WeakPolarHBondContact O-CB 3.44Å; L965-N969 PolarHBondContact O-N 3.46Å; L965-N969 PolarHBondContact O-ND2 3.34Å
966	A	82.9	Confident	73.8	Confident	20 Å²	20	38.6 Å²	38.6	17%	0.165	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-43.1	176.6	0	0	0	0	0	112.5	V904 V962 I963 N964 N969 C970	V904-A966 HydrophobicContact CB-CB 4.49Å; V904-A966 HydrophobicContact CG1-CB 4.16Å; V904-A966 HydrophobicContact CG2-CB 3.47Å; V904-A966 VanDerWaalsContact CG2-CB 3.47Å; V962-A966 WeakPolarHBondContact O-CB 3.25Å; V962-A966 PolarHBondContact O-N 3.01Å; I963-A966 PolarHBondContact O-N 3.23Å; N964-A966 PolarHBondContact O-N 3Å; A966-N969 PolarHBondContact O-N 3.12Å; A966-C970 WeakPolarHBondContact O-CB 3.43Å; A966-C970 PolarHBondContact O-N 3.07Å
967	L	84.4	Confident	73.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.1	-44.5	174.6	-67.6	176.8	0	0	0	111.3	L751 P766 V768 W792 L885 I963 N964 C970 V971	L751-L967 HydrophobicContact CD1-CD2 4.16Å; P766-L967 HydrophobicContact CB-CD2 3.99Å; P766-L967 HydrophobicContact CG-CD2 4.31Å; P766-L967 WeakPolarHBondContact O-CD2 3.33Å; V768-L967 HydrophobicContact CG2-CD2 3.98Å; V768-L967 HydrophobicContact CG2-CG 4.37Å; W792-L967 HydrophobicContact CH2-CB 3.98Å; W792-L967 HydrophobicContact CZ2-CB 3.53Å; L885-L967 HydrophobicContact CD2-CD1 3.85Å; I963-L967 HydrophobicContact CG2-CD1 4.17Å; I963-L967 HydrophobicContact CG2-CG 4.45Å; I963-L967 WeakPolarHBondContact O-CG 3.32Å; I963-L967 PolarHBondContact O-N 3.14Å; N964-L967 PolarHBondContact O-N 3.2Å; L967-C970 WeakPolarHBondContact O-CB 3.4Å; L967-C970 PolarHBondContact O-N 3.06Å; L967-V971 PolarHBondContact O-N 2.79Å
968	F	83.3	Confident	73.1	Confident	34 Å²	34	51.5 Å²	51.5	15%	0.149	27%	0.267	C	S	.	.	H	α-helix	trans	-62.5	-43.8	177.7	-160.1	-98.1	0	0	0	111.9	W792 L878 N964 L965 V971 N972	W792-F968 HydrophobicContact CH2-CB 4.47Å; W792-F968 HydrophobicContact CH2-CD2 4.4Å; W792-F968 HydrophobicContact CZ2-CB 4.23Å; W792-F968 HydrophobicContact CZ2-CD2 4.33Å; L878-F968 HydrophobicContact CD2-CB 3.72Å; L878-F968 HydrophobicContact CD2-CD1 3.78Å; L878-F968 HydrophobicContact CD2-CD2 4.14Å; L878-F968 HydrophobicContact CD2-CE1 4.44Å; L878-F968 HydrophobicContact CD2-CG 3.61Å; L878-F968 HydrophobicContact CG-CD1 3.98Å; L878-F968 HydrophobicContact CG-CD2 4.38Å; L878-F968 HydrophobicContact CG-CE1 4.13Å; L878-F968 HydrophobicContact CG-CG 4.12Å; L878-F968 HydrophobicContact CG-CZ 4.42Å; N964-F968 VanDerWaalsContact O-CB 3.29Å; N964-F968 WeakPolarHBondContact O-CB 3.27Å; N964-F968 PolarHBondContact O-N 3.41Å; L965-F968 PolarHBondContact O-N 3.15Å; F968-V971 PolarHBondContact O-N 2.88Å; F968-N972 WeakPolarHBondContact CD1-ND2 3.47Å; F968-N972 WeakPolarHBondContact CE1-ND2 3.42Å; F968-N972 WeakPolarHBondContact O-CB 3.45Å; F968-N972 VanDerWaalsContact O-CG 3.25Å; F968-N972 PolarHBondContact O-N 2.81Å; F968-N972 PolarHBondContact O-ND2 3.04Å
969	N	82.7	Confident	72.1	Confident	86 Å²	86	49.3 Å²	49.3	46%	0.46	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-39.5	175.4	-72.3	-17.5	0	0	0	112.5	L965 A966 V971 N972 S973	L965-N969 VanDerWaalsContact O-CB 3.3Å; L965-N969 WeakPolarHBondContact O-CB 3.44Å; L965-N969 PolarHBondContact O-N 3.46Å; L965-N969 PolarHBondContact O-ND2 3.34Å; A966-N969 PolarHBondContact O-N 3.12Å; N969-V971 VanDerWaalsContact C-N 3.33Å; N969-N972 PolarHBondContact O-N 2.89Å; N969-S973 WeakPolarHBondContact O-CB 3.41Å; N969-S973 PolarHBondContact O-N 2.83Å
970	C	80.4	Confident	70.9	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.014	29%	0.288	C	S	.	.	H	α-helix	trans	-60.3	-44.4	174.2	-180	0	0	0	0	111.1	L751 P766 A966 L967 S973 I974	L751-C970 HydrophobicContact CD1-CB 4.4Å; L751-C970 HydrophobicContact CD2-CB 3.95Å; P766-C970 HydrophobicContact CB-CB 4.48Å; A966-C970 WeakPolarHBondContact O-CB 3.43Å; A966-C970 PolarHBondContact O-N 3.07Å; L967-C970 WeakPolarHBondContact O-CB 3.4Å; L967-C970 PolarHBondContact O-N 3.06Å; C970-S973 PolarHBondContact O-N 3.32Å; C970-S973 PolarHBondContact O-OG 3.07Å; C970-S973 VanDerWaalsContact O-OG 3.07Å; C970-I974 WeakPolarHBondContact O-CD1 3.26Å; C970-I974 WeakPolarHBondContact O-CG1 3.46Å; C970-I974 PolarHBondContact O-N 3.36Å; C970-I974 VanDerWaalsContact O-N 3.12Å
971	V	74.7	Confident	69.2	Low	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.5	-42	177.9	170.5	0	0	0	0	111.9	P766 W792 V872 V874 L967 F968 N969 S973 I974 V975	P766-V971 HydrophobicContact CG-CG2 3.61Å; W792-V971 HydrophobicContact CH2-CB 4.27Å; W792-V971 HydrophobicContact CH2-CG2 3.77Å; W792-V971 HydrophobicContact CZ3-CB 4.36Å; W792-V971 HydrophobicContact CZ3-CG2 3.51Å; V872-V971 HydrophobicContact CG1-CG1 4.27Å; V872-V971 HydrophobicContact CG1-CG2 4.24Å; V874-V971 HydrophobicContact CB-CG1 4.05Å; V874-V971 HydrophobicContact CG1-CG1 3.83Å; V874-V971 HydrophobicContact CG2-CG1 3.46Å; V874-V971 VanDerWaalsContact CG2-CG1 3.46Å; L967-V971 PolarHBondContact O-N 2.79Å; F968-V971 PolarHBondContact O-N 2.88Å; N969-V971 VanDerWaalsContact C-N 3.33Å; V971-S973 PolarHBondContact O-N 2.94Å; V971-I974 CarbonylContact O-C 3.55Å; V971-I974 PolarHBondContact O-N 3.09Å; V971-V975 HydrophobicContact CG1-CG2 4.13Å; V971-V975 WeakPolarHBondContact O-CG2 3.44Å; V971-V975 PolarHBondContact O-N 2.91Å
972	N	73.1	Confident	67.4	Low	68 Å²	68	60 Å²	60	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-66.2	-25.6	176	-70.4	-20.3	0	0	0	113.4	F968 N969	F968-N972 WeakPolarHBondContact CD1-ND2 3.47Å; F968-N972 WeakPolarHBondContact CE1-ND2 3.42Å; F968-N972 WeakPolarHBondContact O-CB 3.45Å; F968-N972 VanDerWaalsContact O-CG 3.25Å; F968-N972 PolarHBondContact O-N 2.81Å; F968-N972 PolarHBondContact O-ND2 3.04Å; N969-N972 PolarHBondContact O-N 2.89Å
973	S	70.7	Confident	65.3	Low	41 Å²	41	60.2 Å²	60.2	29%	0.287	33%	0.334	S	S	.	.	H	α-helix	trans	-74.7	-35.7	172.2	92.3	0	0	0	0	110.5	N969 C970 V971 N992	N969-S973 WeakPolarHBondContact O-CB 3.41Å; N969-S973 PolarHBondContact O-N 2.83Å; C970-S973 PolarHBondContact O-N 3.32Å; C970-S973 PolarHBondContact O-OG 3.07Å; C970-S973 VanDerWaalsContact O-OG 3.07Å; V971-S973 PolarHBondContact O-N 2.94Å; S973-N992 CarbonylContact C-O 3.54Å; S973-N992 WeakPolarHBondContact CB-O 3.5Å; S973-N992 WeakPolarHBondContact O-CB 3.17Å; S973-N992 PolarHBondContact OG-O 2.88Å
974	I	68.3	Low	63.8	Low	2 Å²	2	61.6 Å²	61.6	1%	0.01	35%	0.347	C	S	.	.	H	α-helix	trans	-74	-36.9	178.8	-67.5	165.9	0	0	0	111	L753 V872 C970 V971 T988 L990 A993	L753-I974 HydrophobicContact CD2-CD1 4.21Å; V872-I974 HydrophobicContact CG2-CG2 4.21Å; C970-I974 WeakPolarHBondContact O-CD1 3.26Å; C970-I974 WeakPolarHBondContact O-CG1 3.46Å; C970-I974 PolarHBondContact O-N 3.36Å; C970-I974 VanDerWaalsContact O-N 3.12Å; V971-I974 CarbonylContact O-C 3.55Å; V971-I974 PolarHBondContact O-N 3.09Å; I974-T988 HydrophobicContact CG2-CG2 3.23Å; I974-T988 PolarHBondContact O-OG1 3.08Å; I974-L990 HydrophobicContact CD1-CD2 4.44Å; I974-L990 HydrophobicContact CG1-CD2 4.41Å; I974-L990 HydrophobicContact CG2-CD2 4.42Å; I974-A993 HydrophobicContact CD1-CB 4.42Å; I974-A993 HydrophobicContact CG1-CB 3.85Å
975	V	63.9	Low	62.1	Low	13 Å²	13	61.9 Å²	61.9	8%	0.079	35%	0.349	C	S	.	.	S	Bend	trans	-94.6	128.1	-176	178.6	0	0	0	0	111.1	V874 V971 Y986	V874-V975 HydrophobicContact CG2-CG2 4.1Å; V971-V975 HydrophobicContact CG1-CG2 4.13Å; V971-V975 WeakPolarHBondContact O-CG2 3.44Å; V971-V975 PolarHBondContact O-N 2.91Å; V975-Y986 HydrophobicContact CG1-CD1 3.45Å; V975-Y986 VanDerWaalsContact CG1-CD1 3.45Å; V975-Y986 HydrophobicContact CG1-CD2 3.97Å; V975-Y986 HydrophobicContact CG1-CE1 3.58Å; V975-Y986 HydrophobicContact CG1-CE2 4.08Å; V975-Y986 HydrophobicContact CG1-CG 3.63Å; V975-Y986 HydrophobicContact CG2-CD2 4.12Å; V975-Y986 HydrophobicContact CG2-CG 4Å
976	P	56.2	Low	60.5	Low	52 Å²	52	59.3 Å²	59.3	34%	0.338	33%	0.334	S	S	.	.			trans	-63.8	139.1	-179.7	20.9	-28.9	0	0	0	113.5	V815 E978	V815-P976 HydrophobicContact CG2-CG 4.22Å; P976-E978 PolarHBondContact O-N 3.35Å; P976-E978 VanDerWaalsContact O-N 3.09Å
977	Q	52.1	Low	59.1	Low	194 Å²	194	61.4 Å²	61.4	91%	0.907	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-3.3	-170.7	-73.5	-174.8	-17.1	0	0	115.9	S979	Q977-S979 PolarHBondContact O-N 3.46Å
978	E	48.9	Very low	57.5	Low	197 Å²	197	62.1 Å²	62.1	92%	0.921	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	13.9	-173.3	-66	-172.8	168.3	0	0	114.9	P976	P976-E978 PolarHBondContact O-N 3.35Å; P976-E978 VanDerWaalsContact O-N 3.09Å
979	S	44.4	Very low	56	Low	33 Å²	33	62.8 Å²	62.8	23%	0.231	35%	0.349	C	S	.	.	S	Bend	trans	-107.1	117.7	179.7	60	0	0	0	0	112.4	Q977 Y986	Q977-S979 PolarHBondContact O-N 3.46Å; S979-Y986 VanDerWaalsContact OG-CE1 3.26Å; S979-Y986 WeakPolarHBondContact OG-CE1 3.18Å; S979-Y986 PolarHBondContact OG-OH 3.47Å; S979-Y986 VanDerWaalsContact OG-OH 3.04Å
980	S	41.5	Very low	54.8	Low	102 Å²	102	58.9 Å²	58.9	71%	0.713	33%	0.329	S	S	*	.			trans	-58.6	137.4	175.2	49.5	0	0	0	0	112.1	T982	S980-T982 VanDerWaalsContact C-N 3.3Å; S980-T982 PolarHBondContact O-N 3.4Å
981	L	36	Very low	53.7	Low	173 Å²	173	68.2 Å²	68.2	91%	0.906	36%	0.363	S	S	*	.	S	Bend	trans	-55.9	56.7	-171.6	-74.9	144.3	0	0	0	117.5
982	T	39.3	Very low	53.1	Low	97 Å²	97	72.9 Å²	72.9	60%	0.595	39%	0.389	S	S	*	.			trans	-139.8	90.1	174.3	54	0	0	0	0	113.3	S980	S980-T982 VanDerWaalsContact C-N 3.3Å; S980-T982 PolarHBondContact O-N 3.4Å
983	S	36	Very low	52.7	Low	56 Å²	56	70.2 Å²	70.2	39%	0.392	38%	0.376	S	S	.	.			trans	59.2	150.7	159.7	68.4	0	0	0	0	119.2	G820	G820-S983 PolarHBondContact N-OG 2.82Å
984	A	50.7	Low	52.7	Low	39 Å²	39	68.5 Å²	68.5	32%	0.322	36%	0.364	S	S	.	.	S	Bend	cis	-153.8	0.7	-23.4	0	0	0	0	0	112
985	V	50.3	Low	53.1	Low	11 Å²	11	75.8 Å²	75.8	7%	0.067	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	125.6	-172.7	-175	0	0	0	0	109.8	W763 L798 P799 P871	W763-V985 HydrophobicContact CH2-CB 4.37Å; W763-V985 HydrophobicContact CH2-CG1 3.75Å; W763-V985 HydrophobicContact CH2-CG2 3.68Å; W763-V985 HydrophobicContact CZ3-CG1 3.9Å; W763-V985 HydrophobicContact CZ3-CG2 4.11Å; L798-V985 HydrophobicContact CD2-CG2 4.4Å; P799-V985 HydrophobicContact CG-CG2 4.29Å; P871-V985 HydrophobicContact CB-CG1 3.63Å
986	Y	51.3	Low	53.7	Low	25 Å²	25	76.4 Å²	76.4	10%	0.098	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.4	177.5	-65.3	-94.2	0	0	0	111.3	P871 V872 V874 V975 S979	P871-Y986 WeakPolarHBondContact CA-O 3.44Å; V872-Y986 PolarHBondContact N-O 3.37Å; V872-Y986 PolarHBondContact O-N 2.98Å; V874-Y986 HydrophobicContact CB-CD2 4.28Å; V874-Y986 HydrophobicContact CB-CE2 4.16Å; V874-Y986 HydrophobicContact CG2-CD2 3.39Å; V874-Y986 HydrophobicContact CG2-CE2 3.71Å; V975-Y986 HydrophobicContact CG1-CD1 3.45Å; V975-Y986 VanDerWaalsContact CG1-CD1 3.45Å; V975-Y986 HydrophobicContact CG1-CD2 3.97Å; V975-Y986 HydrophobicContact CG1-CE1 3.58Å; V975-Y986 HydrophobicContact CG1-CE2 4.08Å; V975-Y986 HydrophobicContact CG1-CG 3.63Å; V975-Y986 HydrophobicContact CG2-CD2 4.12Å; V975-Y986 HydrophobicContact CG2-CG 4Å; S979-Y986 VanDerWaalsContact OG-CE1 3.26Å; S979-Y986 WeakPolarHBondContact OG-CE1 3.18Å; S979-Y986 PolarHBondContact OG-OH 3.47Å; S979-Y986 VanDerWaalsContact OG-OH 3.04Å
987	Y	52.8	Low	54.9	Low	65 Å²	65	74 Å²	74	26%	0.255	38%	0.382	S	S	.	.			trans	-96.3	131.7	162.9	-65.6	-87.3	0	0	0	107.5	L802 P871	L802-Y987 HydrophobicContact CD1-CD2 4.34Å; L802-Y987 HydrophobicContact CD1-CE2 3.66Å; L802-Y987 HydrophobicContact CG-CE2 4.31Å; P871-Y987 HydrophobicContact CB-CE1 4.16Å; P871-Y987 HydrophobicContact CG-CE1 4.43Å
988	T	51.7	Low	56.1	Low	14 Å²	14	69 Å²	69	9%	0.086	36%	0.361	C	S	.	.			trans	-149.5	152.9	-162.9	-179.1	0	0	0	0	114.6	V872 I974	V872-T988 HydrophobicContact CG2-CG2 3.64Å; I974-T988 HydrophobicContact CG2-CG2 3.23Å; I974-T988 PolarHBondContact O-OG1 3.08Å
989	T	51.1	Low	57.4	Low	48 Å²	48	60.1 Å²	60.1	29%	0.294	32%	0.32	S	S	.	.			trans	-75.6	122.8	167.9	62.5	0	0	0	0	110.5	R991 P1028	T989-R991 PolarHBondContact O-N 3.1Å; T989-P1028 HydrophobicContact CG2-CB 4.24Å; T989-P1028 HydrophobicContact CG2-CG 3.59Å
990	L	57.2	Low	58.8	Low	5 Å²	5	61.7 Å²	61.7	3%	0.026	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-72.8	12	169.3	-77.4	-176.4	0	0	0	113.3	L753 L764 P867 I974 N992 A993 T1026	L753-L990 HydrophobicContact CD1-CD2 4.01Å; L764-L990 HydrophobicContact CD2-CD2 4.11Å; P867-L990 HydrophobicContact CB-CD1 3.31Å; P867-L990 HydrophobicContact CB-CG 4.26Å; P867-L990 HydrophobicContact CG-CD1 4.07Å; I974-L990 HydrophobicContact CD1-CD2 4.44Å; I974-L990 HydrophobicContact CG1-CD2 4.41Å; I974-L990 HydrophobicContact CG2-CD2 4.42Å; L990-N992 PolarHBondContact O-N 3.24Å; L990-A993 HydrophobicContact CB-CB 4.08Å; L990-A993 HydrophobicContact CD2-CB 3.55Å; L990-A993 HydrophobicContact CG-CB 4.39Å; L990-A993 WeakPolarHBondContact O-CB 3.4Å; L990-A993 PolarHBondContact O-N 3.4Å; L990-A993 VanDerWaalsContact O-N 3.1Å; L990-T1026 HydrophobicContact CB-CG2 3.23Å; L990-T1026 HydrophobicContact CD1-CG2 3.77Å; L990-T1026 HydrophobicContact CG-CG2 4.14Å
991	R	56.8	Low	60.4	Low	197 Å²	197	63.9 Å²	63.9	74%	0.743	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-57.7	-30.8	177.9	-148.2	179.5	-163.7	-174.1	4.3	112	T989	T989-R991 PolarHBondContact O-N 3.1Å
992	N	62.6	Low	61.9	Low	99 Å²	99	58.7 Å²	58.7	53%	0.529	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-108.2	8.9	179.7	-63.1	-12.9	0	0	0	113.4	S973 L990	S973-N992 CarbonylContact C-O 3.54Å; S973-N992 WeakPolarHBondContact CB-O 3.5Å; S973-N992 WeakPolarHBondContact O-CB 3.17Å; S973-N992 PolarHBondContact OG-O 2.88Å; L990-N992 PolarHBondContact O-N 3.24Å
993	A	65.2	Low	63.5	Low	12 Å²	12	54.2 Å²	54.2	10%	0.099	26%	0.26	C	S	.	.	S	Bend	trans	-70	155.4	174.3	0	0	0	0	0	110.9	I974 L990 K995	I974-A993 HydrophobicContact CD1-CB 4.42Å; I974-A993 HydrophobicContact CG1-CB 3.85Å; L990-A993 HydrophobicContact CB-CB 4.08Å; L990-A993 HydrophobicContact CD2-CB 3.55Å; L990-A993 HydrophobicContact CG-CB 4.39Å; L990-A993 WeakPolarHBondContact O-CB 3.4Å; L990-A993 PolarHBondContact O-N 3.4Å; L990-A993 VanDerWaalsContact O-N 3.1Å; A993-K995 PolarHBondContact O-N 3.14Å
994	P	71.4	Confident	64.5	Low	5 Å²	5	57.2 Å²	57.2	3%	0.032	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-49.5	138.9	172.1	-27.1	35	0	0	0	111.6	L751 R898 C900 Q902	L751-P994 HydrophobicContact CD2-CB 4.29Å; L751-P994 HydrophobicContact CD2-CG 3.72Å; R898-P994 PolarHBondContact NH1-O 3.11Å; C900-P994 HydrophobicContact CB-CB 3.81Å; Q902-P994 HydrophobicContact CG-CB 4.16Å
995	K	76.1	Confident	64.7	Low	154 Å²	154	63.7 Å²	63.7	67%	0.67	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-58.7	144.5	-175.7	-76.3	-175.6	178.9	-176.8	0	110	C900 D901 A993	C900-K995 WeakPolarHBondContact CA-O 3.19Å; D901-K995 PolarHBondContact N-O 3.21Å; D901-K995 WeakPolarHBondContact OD2-CB 3.33Å; A993-K995 PolarHBondContact O-N 3.14Å
996	Q	77.1	Confident	65.3	Low	27 Å²	27	66.5 Å²	66.5	13%	0.126	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-64.9	140.4	173.3	-174.4	166.4	-23.8	0	0	109.3	R898 D998 N1022	R898-Q996 HydrophobicContact CG-CG 4.43Å; Q996-D998 PolarHBondContact O-N 2.64Å; Q996-N1022 PolarHBondContact OE1-ND2 2.68Å
997	M	80.1	Confident	66	Low	2 Å²	2	66.9 Å²	66.9	1%	0.01	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-59.1	122	171.8	-169	-174.9	72.1	0	0	109.8	I745 R750 I899 F999 Y1002	I745-M997 HydrophobicContact CB-CE 4.44Å; I745-M997 HydrophobicContact CG1-CE 4.14Å; I745-M997 HydrophobicContact CG2-CE 3.9Å; R750-M997 PolarHBondContact NH1-SD 3.03Å; R750-M997 VanDerWaalsContact NH1-SD 3.44Å; I899-M997 HydrophobicContact CB-CB 4.4Å; I899-M997 HydrophobicContact CG2-CB 4.07Å; I899-M997 HydrophobicContact CG2-CE 4.32Å; I899-M997 HydrophobicContact CG2-SD 4.04Å; I899-M997 PolarHBondContact O-N 2.98Å; M997-F999 HydrophobicContact CE-CD1 3.43Å; M997-F999 VanDerWaalsContact CE-CD1 3.43Å; M997-F999 HydrophobicContact CE-CE1 3.28Å; M997-F999 HydrophobicContact CE-CG 4.15Å; M997-F999 HydrophobicContact CE-CZ 3.9Å; M997-F999 PolarHBondContact O-N 2.95Å; M997-F999 VanDerWaalsContact O-N 3.16Å; M997-Y1002 HydrophobicContact CG-CD2 3.43Å; M997-Y1002 VanDerWaalsContact CG-CD2 3.43Å; M997-Y1002 HydrophobicContact CG-CE2 3.31Å; M997-Y1002 HydrophobicContact CG-CG 4.33Å; M997-Y1002 HydrophobicContact SD-CD2 3.88Å; M997-Y1002 HydrophobicContact SD-CE2 4.06Å; M997-Y1002 HydrophobicContact SD-CG 4.21Å
998	D	78.4	Confident	67	Low	87 Å²	87	67.9 Å²	67.9	47%	0.465	33%	0.33	S	S	.	.			trans	-75.3	99.1	173.2	175.9	6.6	0	0	0	109.6	Q996 K1000 K1001 Y1002	Q996-D998 PolarHBondContact O-N 2.64Å; D998-K1000 PolarHBondContact O-N 3.07Å; D998-K1000 WeakPolarHBondContact OD1-CB 3.5Å; D998-K1000 PolarHBondContact OD1-N 2.87Å; D998-K1001 HydrophobicContact CB-CB 4.04Å; D998-K1001 WeakPolarHBondContact O-CB 3.49Å; D998-K1001 PolarHBondContact O-N 2.73Å; D998-Y1002 VanDerWaalsContact O-CD2 3.27Å; D998-Y1002 WeakPolarHBondContact O-CD2 3.31Å; D998-Y1002 PolarHBondContact O-N 3.41Å
999	F	76.4	Confident	68	Low	12 Å²	12	75.5 Å²	75.5	5%	0.053	37%	0.365	C	S	.	.	H	α-helix	trans	-55.5	-33.9	-179.4	-72	-81.2	0	0	0	112.6	I730 L734 I899 M997 K1001 Y1002 L1003 F1015 Y1018	I730-F999 HydrophobicContact CG2-CZ 4.32Å; L734-F999 HydrophobicContact CD1-CE1 4.29Å; L734-F999 HydrophobicContact CD2-CE1 4.41Å; I899-F999 HydrophobicContact CD1-CE1 4.5Å; I899-F999 HydrophobicContact CD1-CZ 4.17Å; M997-F999 HydrophobicContact CE-CD1 3.43Å; M997-F999 VanDerWaalsContact CE-CD1 3.43Å; M997-F999 HydrophobicContact CE-CE1 3.28Å; M997-F999 HydrophobicContact CE-CG 4.15Å; M997-F999 HydrophobicContact CE-CZ 3.9Å; M997-F999 PolarHBondContact O-N 2.95Å; M997-F999 VanDerWaalsContact O-N 3.16Å; F999-K1001 PolarHBondContact O-N 3.28Å; F999-Y1002 PolarHBondContact O-N 3.33Å; F999-L1003 HydrophobicContact CB-CD1 4.36Å; F999-L1003 HydrophobicContact CD1-CD1 4.21Å; F999-L1003 VanDerWaalsContact O-CB 3.3Å; F999-L1003 WeakPolarHBondContact O-CB 3.41Å; F999-L1003 PolarHBondContact O-N 2.73Å; F999-F1015 HydrophobicContact CB-CD1 3.76Å; F999-F1015 HydrophobicContact CB-CE1 4.05Å; F999-F1015 HydrophobicContact CB-CG 4.13Å; F999-F1015 AromaticContact CD1-CD1 3.96Å; F999-F1015 HydrophobicContact CD1-CD1 3.96Å; F999-F1015 AromaticContact CD1-CE1 3.49Å; F999-F1015 HydrophobicContact CD1-CE1 3.49Å; F999-F1015 VanDerWaalsContact CD1-CE1 3.49Å; F999-F1015 HydrophobicContact CD1-CZ 4.21Å; F999-F1015 AromaticContact CD2-CD1 3.36Å; F999-F1015 HydrophobicContact CD2-CD1 3.36Å; F999-F1015 AromaticContact CD2-CE1 3.73Å; F999-F1015 HydrophobicContact CD2-CE1 3.73Å; F999-F1015 HydrophobicContact CD2-CG 4.36Å; F999-F1015 HydrophobicContact CE1-CD1 4.39Å; F999-F1015 AromaticContact CE1-CE1 3.75Å; F999-F1015 HydrophobicContact CE1-CE1 3.75Å; F999-F1015 AromaticContact CE2-CD1 3.84Å; F999-F1015 HydrophobicContact CE2-CD1 3.84Å; F999-F1015 AromaticContact CE2-CE1 3.96Å; F999-F1015 HydrophobicContact CE2-CE1 3.96Å; F999-F1015 AromaticContact CG-CD1 3.42Å; F999-F1015 HydrophobicContact CG-CD1 3.42Å; F999-F1015 VanDerWaalsContact CG-CD1 3.42Å; F999-F1015 AromaticContact CG-CE1 3.48Å; F999-F1015 HydrophobicContact CG-CE1 3.48Å; F999-F1015 VanDerWaalsContact CG-CE1 3.48Å; F999-F1015 HydrophobicContact CG-CG 4.28Å; F999-F1015 HydrophobicContact CG-CZ 4.4Å; F999-F1015 HydrophobicContact CZ-CD1 4.33Å; F999-F1015 AromaticContact CZ-CE1 3.97Å; F999-F1015 HydrophobicContact CZ-CE1 3.97Å; F999-Y1018 HydrophobicContact CE2-CE1 4.41Å
1000	K	73.6	Confident	69	Low	66 Å²	66	77.3 Å²	77.3	29%	0.287	37%	0.37	S	S	.	.	H	α-helix	trans	-59.9	-48.6	176.9	-62.9	-179.6	178.3	176.7	0	109.8	D998 Y1002 L1003 N1004 D1016	D998-K1000 PolarHBondContact O-N 3.07Å; D998-K1000 WeakPolarHBondContact OD1-CB 3.5Å; D998-K1000 PolarHBondContact OD1-N 2.87Å; K1000-Y1002 PolarHBondContact O-N 3.09Å; K1000-Y1002 VanDerWaalsContact O-N 3.14Å; K1000-L1003 PolarHBondContact O-N 3.23Å; K1000-N1004 WeakPolarHBondContact O-CA 3.29Å; K1000-N1004 WeakPolarHBondContact O-CB 3.37Å; K1000-N1004 PolarHBondContact O-N 2.59Å; K1000-N1004 PolarHBondContact O-OD1 3.01Å; K1000-D1016 WeakPolarHBondContact CE-OD1 3.04Å; K1000-D1016 IonicContact NZ-OD1 2.94Å; K1000-D1016 PolarHBondContact NZ-OD1 3.22Å; K1000-D1016 IonicContact NZ-OD2 2.95Å; K1000-D1016 PolarHBondContact NZ-OD2 3.33Å
1001	K	73.8	Confident	69.9	Low	148 Å²	148	77.5 Å²	77.5	64%	0.643	37%	0.371	S	S	*	.	H	α-helix	trans	-55.9	-34.7	178.1	-171.2	178.5	179.6	-178.6	0	113.9	D998 F999	D998-K1001 HydrophobicContact CB-CB 4.04Å; D998-K1001 WeakPolarHBondContact O-CB 3.49Å; D998-K1001 PolarHBondContact O-N 2.73Å; F999-K1001 PolarHBondContact O-N 3.28Å
1002	Y	69	Low	70.7	Confident	64 Å²	64	71 Å²	71	25%	0.251	35%	0.35	S	S	.	.	H	α-helix	trans	-94.1	-21.8	-176.9	-70	-88.3	0	0	0	114.1	Q744 M997 D998 F999 K1000	Q744-Y1002 PolarHBondContact OE1-O 3.41Å; M997-Y1002 HydrophobicContact CG-CD2 3.43Å; M997-Y1002 VanDerWaalsContact CG-CD2 3.43Å; M997-Y1002 HydrophobicContact CG-CE2 3.31Å; M997-Y1002 HydrophobicContact CG-CG 4.33Å; M997-Y1002 HydrophobicContact SD-CD2 3.88Å; M997-Y1002 HydrophobicContact SD-CE2 4.06Å; M997-Y1002 HydrophobicContact SD-CG 4.21Å; D998-Y1002 VanDerWaalsContact O-CD2 3.27Å; D998-Y1002 WeakPolarHBondContact O-CD2 3.31Å; D998-Y1002 PolarHBondContact O-N 3.41Å; F999-Y1002 PolarHBondContact O-N 3.33Å; K1000-Y1002 PolarHBondContact O-N 3.09Å; K1000-Y1002 VanDerWaalsContact O-N 3.14Å
1003	L	71.6	Confident	71.5	Confident	3 Å²	3	72.9 Å²	72.9	2%	0.016	35%	0.351	C	S	.	.	H	α-helix	trans	-115.7	9.4	-176.7	-63.8	173.3	0	0	0	113.2	Y738 H741 I745 F999 K1000 L1005 V1006 M1007 F1015	Y738-L1003 HydrophobicContact CD1-CD1 4.28Å; Y738-L1003 HydrophobicContact CD1-CD2 3.85Å; Y738-L1003 HydrophobicContact CD2-CD1 4.45Å; Y738-L1003 HydrophobicContact CE1-CD1 4.41Å; Y738-L1003 HydrophobicContact CE1-CD2 4.42Å; Y738-L1003 HydrophobicContact CG-CD1 4.3Å; Y738-L1003 HydrophobicContact CG-CD2 4.26Å; H741-L1003 HydrophobicContact CB-CD2 3.7Å; I745-L1003 HydrophobicContact CD1-CD1 4.35Å; I745-L1003 HydrophobicContact CD1-CD2 4.15Å; I745-L1003 HydrophobicContact CD1-CG 4.47Å; F999-L1003 HydrophobicContact CB-CD1 4.36Å; F999-L1003 HydrophobicContact CD1-CD1 4.21Å; F999-L1003 VanDerWaalsContact O-CB 3.3Å; F999-L1003 WeakPolarHBondContact O-CB 3.41Å; F999-L1003 PolarHBondContact O-N 2.73Å; K1000-L1003 PolarHBondContact O-N 3.23Å; L1003-L1005 PolarHBondContact O-N 3.31Å; L1003-V1006 PolarHBondContact O-N 3.2Å; L1003-M1007 HydrophobicContact CB-CG 3.64Å; L1003-M1007 HydrophobicContact CB-SD 3.57Å; L1003-M1007 VanDerWaalsContact CB-SD 3.57Å; L1003-M1007 HydrophobicContact CD1-CG 4.47Å; L1003-M1007 HydrophobicContact CD1-SD 4.21Å; L1003-F1015 HydrophobicContact CD1-CZ 4.32Å
1004	N	57.6	Low	72.2	Confident	119 Å²	119	73.6 Å²	73.6	64%	0.636	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-1.4	-164	-118.4	-2.5	0	0	0	118.1	K1000	K1000-N1004 WeakPolarHBondContact O-CA 3.29Å; K1000-N1004 WeakPolarHBondContact O-CB 3.37Å; K1000-N1004 PolarHBondContact O-N 2.59Å; K1000-N1004 PolarHBondContact O-OD1 3.01Å
1005	L	55.7	Low	72.4	Confident	175 Å²	175	73.7 Å²	73.7	92%	0.916	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	-0.5	-179.3	-68.9	168.6	0	0	0	113.9	L1003	L1003-L1005 PolarHBondContact O-N 3.31Å
1006	V	62.2	Low	72.5	Confident	69 Å²	69	69.4 Å²	69.4	42%	0.418	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	-2.2	-166.5	-165.8	0	0	0	0	113.2	Y738 L1003	Y738-V1006 HydrophobicContact CD1-CG1 4.44Å; Y738-V1006 HydrophobicContact CE1-CB 4.27Å; Y738-V1006 HydrophobicContact CE1-CG1 4.14Å; L1003-V1006 PolarHBondContact O-N 3.2Å
1007	M	66.1	Low	72.6	Confident	33 Å²	33	70.2 Å²	70.2	16%	0.163	34%	0.341	C	S	.	.			trans	-89.6	131.2	-173	-60.8	179.9	64.6	0	0	114	Y738 L1003 D1011 I1012 F1015	Y738-M1007 HydrophobicContact CE1-CG 4.17Å; Y738-M1007 VanDerWaalsContact OH-CA 3.3Å; Y738-M1007 WeakPolarHBondContact OH-CA 3.45Å; Y738-M1007 WeakPolarHBondContact OH-CG 3.36Å; L1003-M1007 HydrophobicContact CB-CG 3.64Å; L1003-M1007 HydrophobicContact CB-SD 3.57Å; L1003-M1007 VanDerWaalsContact CB-SD 3.57Å; L1003-M1007 HydrophobicContact CD1-CG 4.47Å; L1003-M1007 HydrophobicContact CD1-SD 4.21Å; M1007-D1011 HydrophobicContact CE-CB 4.22Å; M1007-I1012 HydrophobicContact CB-CG1 4.03Å; M1007-I1012 HydrophobicContact CE-CG1 4.03Å; M1007-F1015 HydrophobicContact CE-CB 4.36Å; M1007-F1015 HydrophobicContact CE-CD2 3.2Å; M1007-F1015 HydrophobicContact CE-CE2 3.7Å; M1007-F1015 HydrophobicContact CE-CG 4.04Å
1008	D	73.8	Confident	72.5	Confident	87 Å²	87	70.4 Å²	70.4	47%	0.465	34%	0.342	S	S	.	.			trans	-73.1	155.7	168	-57.4	-37.7	0	0	0	110.9	K737 E1010 D1011 I1012	K737-D1008 IonicContact NZ-OD2 3.82Å; K737-D1008 PolarHBondContact NZ-OD2 2.88Å; D1008-E1010 PolarHBondContact O-N 3.42Å; D1008-D1011 PolarHBondContact O-N 2.73Å; D1008-I1012 WeakPolarHBondContact O-CG1 3.47Å; D1008-I1012 PolarHBondContact O-N 3.22Å
1009	E	73.2	Confident	72.2	Confident	174 Å²	174	68.1 Å²	68.1	81%	0.813	33%	0.332	S	S	*	.	H	α-helix	trans	-55.1	-36.5	176.6	-72.4	-172.8	166.5	0	0	112.8	I1012 Y1013	E1009-I1012 WeakPolarHBondContact O-CB 3.47Å; E1009-I1012 PolarHBondContact O-N 3.25Å; E1009-Y1013 PolarHBondContact O-N 3.13Å; E1009-Y1013 VanDerWaalsContact O-N 3.11Å
1010	E	71.8	Confident	72.2	Confident	86 Å²	86	71 Å²	71	40%	0.402	35%	0.351	S	S	.	.	H	α-helix	trans	-64.6	-39.2	177.4	-64.7	178	176.2	0	0	112.2	Y681 D1008 L1014	Y681-E1010 WeakPolarHBondContact CD2-OE1 3.44Å; Y681-E1010 WeakPolarHBondContact CD2-OE2 3.4Å; Y681-E1010 WeakPolarHBondContact CE2-OE1 3.18Å; Y681-E1010 WeakPolarHBondContact CE2-OE2 3.43Å; D1008-E1010 PolarHBondContact O-N 3.42Å; E1010-L1014 PolarHBondContact O-N 2.65Å; E1010-L1014 VanDerWaalsContact O-N 3.13Å
1011	D	75.7	Confident	72.2	Confident	9 Å²	9	68.3 Å²	68.3	5%	0.048	34%	0.34	C	S	.	.	H	α-helix	trans	-72	-40.3	178.1	-66	-19.2	0	0	0	109.8	K737 Y738 M1007 D1008 Y1013 L1014 F1015	K737-D1011 WeakPolarHBondContact CD-OD2 3.22Å; K737-D1011 IonicContact NZ-OD1 3.52Å; K737-D1011 PolarHBondContact NZ-OD1 2.68Å; K737-D1011 IonicContact NZ-OD2 3.44Å; K737-D1011 PolarHBondContact NZ-OD2 2.8Å; K737-D1011 VanDerWaalsContact NZ-OD2 3.08Å; Y738-D1011 PolarHBondContact OH-OD2 3.31Å; M1007-D1011 HydrophobicContact CE-CB 4.22Å; D1008-D1011 PolarHBondContact O-N 2.73Å; D1011-Y1013 VanDerWaalsContact C-N 3.28Å; D1011-Y1013 PolarHBondContact O-N 2.98Å; D1011-L1014 WeakPolarHBondContact O-CB 3.31Å; D1011-L1014 PolarHBondContact O-N 2.99Å; D1011-L1014 VanDerWaalsContact O-N 3.13Å; D1011-F1015 HydrophobicContact CB-CD2 4.34Å; D1011-F1015 HydrophobicContact CB-CE2 4.29Å; D1011-F1015 WeakPolarHBondContact O-CD2 3.39Å; D1011-F1015 PolarHBondContact O-N 3.3Å
1012	I	74.3	Confident	72.1	Confident	61 Å²	61	61.3 Å²	61.3	31%	0.313	31%	0.309	S	S	.	.	H	α-helix	trans	-53.6	-47.4	174.6	-69.1	170.7	0	0	0	110.8	M1007 D1008 E1009 F1015 D1016	M1007-I1012 HydrophobicContact CB-CG1 4.03Å; M1007-I1012 HydrophobicContact CE-CG1 4.03Å; D1008-I1012 WeakPolarHBondContact O-CG1 3.47Å; D1008-I1012 PolarHBondContact O-N 3.22Å; E1009-I1012 WeakPolarHBondContact O-CB 3.47Å; E1009-I1012 PolarHBondContact O-N 3.25Å; I1012-F1015 PolarHBondContact O-N 3.34Å; I1012-D1016 WeakPolarHBondContact O-CB 3.5Å; I1012-D1016 PolarHBondContact O-N 3.1Å
1013	Y	78.4	Confident	72	Confident	137 Å²	137	63.5 Å²	63.5	54%	0.537	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-45.6	177	-177.6	-94.8	0	0	0	112.3	E1009 D1011 F1015 D1016 E1017	E1009-Y1013 PolarHBondContact O-N 3.13Å; E1009-Y1013 VanDerWaalsContact O-N 3.11Å; D1011-Y1013 VanDerWaalsContact C-N 3.28Å; D1011-Y1013 PolarHBondContact O-N 2.98Å; Y1013-F1015 PolarHBondContact O-N 3.04Å; Y1013-D1016 PolarHBondContact O-N 3.36Å; Y1013-E1017 VanDerWaalsContact O-CB 3.3Å; Y1013-E1017 WeakPolarHBondContact O-CB 3.4Å; Y1013-E1017 PolarHBondContact O-N 3.19Å
1014	L	78.9	Confident	71.8	Confident	28 Å²	28	67.2 Å²	67.2	15%	0.147	34%	0.339	C	S	.	.	H	α-helix	trans	-58.9	-46.1	178	178.2	70.1	0	0	0	112.3	L726 I730 E1010 D1011 Y1018	L726-L1014 HydrophobicContact CD2-CD1 3.68Å; I730-L1014 HydrophobicContact CG1-CD2 4.3Å; I730-L1014 HydrophobicContact CG1-CG 4.25Å; E1010-L1014 PolarHBondContact O-N 2.65Å; E1010-L1014 VanDerWaalsContact O-N 3.13Å; D1011-L1014 WeakPolarHBondContact O-CB 3.31Å; D1011-L1014 PolarHBondContact O-N 2.99Å; D1011-L1014 VanDerWaalsContact O-N 3.13Å; L1014-Y1018 WeakPolarHBondContact O-CB 3.49Å; L1014-Y1018 PolarHBondContact O-N 3.25Å
1015	F	77	Confident	72.3	Confident	6 Å²	6	62 Å²	62	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-69.4	-38.3	179.6	-76.7	-75.1	0	0	0	112.3	I730 L734 Y738 F999 L1003 M1007 D1011 I1012 Y1013 Y1018 S1019	I730-F1015 HydrophobicContact CB-CE1 4.44Å; I730-F1015 HydrophobicContact CD1-CD1 3.95Å; I730-F1015 HydrophobicContact CD1-CE1 4.26Å; I730-F1015 HydrophobicContact CG1-CD1 4.08Å; I730-F1015 HydrophobicContact CG1-CE1 4.01Å; I730-F1015 HydrophobicContact CG2-CD1 4.44Å; I730-F1015 HydrophobicContact CG2-CE1 3.72Å; I730-F1015 HydrophobicContact CG2-CZ 4.41Å; L734-F1015 HydrophobicContact CD2-CZ 4.37Å; Y738-F1015 HydrophobicContact CE2-CE2 4.19Å; F999-F1015 HydrophobicContact CB-CD1 3.76Å; F999-F1015 HydrophobicContact CB-CE1 4.05Å; F999-F1015 HydrophobicContact CB-CG 4.13Å; F999-F1015 AromaticContact CD1-CD1 3.96Å; F999-F1015 HydrophobicContact CD1-CD1 3.96Å; F999-F1015 AromaticContact CD1-CE1 3.49Å; F999-F1015 HydrophobicContact CD1-CE1 3.49Å; F999-F1015 VanDerWaalsContact CD1-CE1 3.49Å; F999-F1015 HydrophobicContact CD1-CZ 4.21Å; F999-F1015 AromaticContact CD2-CD1 3.36Å; F999-F1015 HydrophobicContact CD2-CD1 3.36Å; F999-F1015 AromaticContact CD2-CE1 3.73Å; F999-F1015 HydrophobicContact CD2-CE1 3.73Å; F999-F1015 HydrophobicContact CD2-CG 4.36Å; F999-F1015 HydrophobicContact CE1-CD1 4.39Å; F999-F1015 AromaticContact CE1-CE1 3.75Å; F999-F1015 HydrophobicContact CE1-CE1 3.75Å; F999-F1015 AromaticContact CE2-CD1 3.84Å; F999-F1015 HydrophobicContact CE2-CD1 3.84Å; F999-F1015 AromaticContact CE2-CE1 3.96Å; F999-F1015 HydrophobicContact CE2-CE1 3.96Å; F999-F1015 AromaticContact CG-CD1 3.42Å; F999-F1015 HydrophobicContact CG-CD1 3.42Å; F999-F1015 VanDerWaalsContact CG-CD1 3.42Å; F999-F1015 AromaticContact CG-CE1 3.48Å; F999-F1015 HydrophobicContact CG-CE1 3.48Å; F999-F1015 VanDerWaalsContact CG-CE1 3.48Å; F999-F1015 HydrophobicContact CG-CG 4.28Å; F999-F1015 HydrophobicContact CG-CZ 4.4Å; F999-F1015 HydrophobicContact CZ-CD1 4.33Å; F999-F1015 AromaticContact CZ-CE1 3.97Å; F999-F1015 HydrophobicContact CZ-CE1 3.97Å; L1003-F1015 HydrophobicContact CD1-CZ 4.32Å; M1007-F1015 HydrophobicContact CE-CB 4.36Å; M1007-F1015 HydrophobicContact CE-CD2 3.2Å; M1007-F1015 HydrophobicContact CE-CE2 3.7Å; M1007-F1015 HydrophobicContact CE-CG 4.04Å; D1011-F1015 HydrophobicContact CB-CD2 4.34Å; D1011-F1015 HydrophobicContact CB-CE2 4.29Å; D1011-F1015 WeakPolarHBondContact O-CD2 3.39Å; D1011-F1015 PolarHBondContact O-N 3.3Å; I1012-F1015 PolarHBondContact O-N 3.34Å; Y1013-F1015 PolarHBondContact O-N 3.04Å; F1015-Y1018 PolarHBondContact O-N 2.92Å; F1015-S1019 WeakPolarHBondContact O-CB 3.27Å; F1015-S1019 PolarHBondContact O-N 3.17Å
1016	D	78.4	Confident	72.6	Confident	64 Å²	64	54 Å²	54	34%	0.342	27%	0.27	S	S	.	.	H	α-helix	trans	-66	-43	174.8	-79.3	-18.1	0	0	0	111.9	K1000 I1012 Y1013 Y1018 S1019 T1020	K1000-D1016 WeakPolarHBondContact CE-OD1 3.04Å; K1000-D1016 IonicContact NZ-OD1 2.94Å; K1000-D1016 PolarHBondContact NZ-OD1 3.22Å; K1000-D1016 IonicContact NZ-OD2 2.95Å; K1000-D1016 PolarHBondContact NZ-OD2 3.33Å; I1012-D1016 WeakPolarHBondContact O-CB 3.5Å; I1012-D1016 PolarHBondContact O-N 3.1Å; Y1013-D1016 PolarHBondContact O-N 3.36Å; D1016-Y1018 PolarHBondContact O-N 3.22Å; D1016-S1019 PolarHBondContact O-N 3.2Å; D1016-T1020 WeakPolarHBondContact O-CB 3.43Å; D1016-T1020 PolarHBondContact O-N 3.43Å; D1016-T1020 PolarHBondContact O-OG1 3.42Å
1017	E	78.8	Confident	72.4	Confident	45 Å²	45	53.5 Å²	53.5	21%	0.21	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-43.3	176.6	-168.3	179.9	-163.1	0	0	111.1	K722 L726 Y1013 L1021	K722-E1017 WeakPolarHBondContact CE-OE1 3.4Å; K722-E1017 IonicContact NZ-OE1 3.67Å; K722-E1017 PolarHBondContact NZ-OE1 2.89Å; L726-E1017 HydrophobicContact CD1-CB 4.44Å; L726-E1017 HydrophobicContact CD1-CG 3.85Å; L726-E1017 HydrophobicContact CD2-CG 4.49Å; Y1013-E1017 VanDerWaalsContact O-CB 3.3Å; Y1013-E1017 WeakPolarHBondContact O-CB 3.4Å; Y1013-E1017 PolarHBondContact O-N 3.19Å; E1017-L1021 VanDerWaalsContact O-CB 3.29Å; E1017-L1021 WeakPolarHBondContact O-CB 3.47Å; E1017-L1021 PolarHBondContact O-N 2.81Å
1018	Y	77.9	Confident	71.7	Confident	6 Å²	6	53.9 Å²	53.9	2%	0.024	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-44.4	173.6	171.1	-109.3	0	0	0	112.5	Y723 L726 I730 V897 F999 L1014 F1015 D1016 T1020 L1021 N1022	Y723-Y1018 HydrophobicContact CD2-CE2 4.48Å; Y723-Y1018 AromaticContact CE2-CE2 3.93Å; Y723-Y1018 HydrophobicContact CE2-CE2 3.93Å; L726-Y1018 HydrophobicContact CB-CD2 4.2Å; I730-Y1018 HydrophobicContact CD1-CD1 3.2Å; I730-Y1018 HydrophobicContact CD1-CD2 3.74Å; I730-Y1018 HydrophobicContact CD1-CE1 3.87Å; I730-Y1018 HydrophobicContact CD1-CE2 4.37Å; I730-Y1018 HydrophobicContact CD1-CG 3.11Å; V897-Y1018 PolarHBondContact O-OH 3.3Å; V897-Y1018 VanDerWaalsContact O-OH 3.12Å; F999-Y1018 HydrophobicContact CE2-CE1 4.41Å; L1014-Y1018 WeakPolarHBondContact O-CB 3.49Å; L1014-Y1018 PolarHBondContact O-N 3.25Å; F1015-Y1018 PolarHBondContact O-N 2.92Å; D1016-Y1018 PolarHBondContact O-N 3.22Å; Y1018-T1020 VanDerWaalsContact C-N 3.34Å; Y1018-T1020 PolarHBondContact O-N 3.35Å; Y1018-L1021 PolarHBondContact O-N 3.19Å; Y1018-N1022 WeakPolarHBondContact O-CB 3.32Å; Y1018-N1022 PolarHBondContact O-N 2.95Å
1019	S	72.4	Confident	70.7	Confident	38 Å²	38	51.5 Å²	51.5	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-62.7	-43.8	179.4	-163.8	0	0	0	0	111.1	F1015 D1016 N1022 E1023	F1015-S1019 WeakPolarHBondContact O-CB 3.27Å; F1015-S1019 PolarHBondContact O-N 3.17Å; D1016-S1019 PolarHBondContact O-N 3.2Å; S1019-N1022 PolarHBondContact O-N 2.79Å; S1019-E1023 WeakPolarHBondContact O-CB 3.42Å; S1019-E1023 WeakPolarHBondContact O-CG 3.44Å; S1019-E1023 PolarHBondContact O-N 3.44Å
1020	T	75	Confident	69.4	Low	73 Å²	73	45.4 Å²	45.4	45%	0.448	23%	0.233	S	C	.	.	H	α-helix	trans	-63.4	-48.6	178.6	-53.8	0	0	0	0	111.1	D1016 Y1018 E1023 Q1024	D1016-T1020 WeakPolarHBondContact O-CB 3.43Å; D1016-T1020 PolarHBondContact O-N 3.43Å; D1016-T1020 PolarHBondContact O-OG1 3.42Å; Y1018-T1020 VanDerWaalsContact C-N 3.34Å; Y1018-T1020 PolarHBondContact O-N 3.35Å; T1020-E1023 PolarHBondContact O-N 2.99Å; T1020-Q1024 VanDerWaalsContact O-CG 3.27Å; T1020-Q1024 WeakPolarHBondContact O-CG 3.49Å; T1020-Q1024 PolarHBondContact O-N 2.97Å
1021	L	74.3	Confident	67.9	Low	9 Å²	9	49.9 Å²	49.9	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-70.8	-35.9	-178.9	-170	66	0	0	0	112	L719 K722 L726 E1017 Y1018 Q1024 L1025	L719-L1021 HydrophobicContact CD2-CD1 4.16Å; K722-L1021 HydrophobicContact CB-CD2 4.13Å; K722-L1021 HydrophobicContact CD-CD2 4.29Å; K722-L1021 HydrophobicContact CG-CD2 3.97Å; L726-L1021 HydrophobicContact CD1-CB 4.41Å; L726-L1021 HydrophobicContact CD1-CD2 3.73Å; E1017-L1021 VanDerWaalsContact O-CB 3.29Å; E1017-L1021 WeakPolarHBondContact O-CB 3.47Å; E1017-L1021 PolarHBondContact O-N 2.81Å; Y1018-L1021 PolarHBondContact O-N 3.19Å; L1021-Q1024 PolarHBondContact O-N 3.03Å; L1021-L1025 HydrophobicContact CD1-CD1 4.1Å; L1021-L1025 HydrophobicContact CD1-CG 4.36Å; L1021-L1025 HydrophobicContact CD2-CD1 4.49Å; L1021-L1025 HydrophobicContact CG-CD1 3.93Å; L1021-L1025 HydrophobicContact CG-CG 4.5Å; L1021-L1025 WeakPolarHBondContact O-CB 3.39Å; L1021-L1025 WeakPolarHBondContact O-CG 3.37Å; L1021-L1025 PolarHBondContact O-N 3.33Å
1022	N	71	Confident	66.3	Low	2 Å²	2	55.9 Å²	55.9	1%	0.011	28%	0.283	C	S	.	.	H	α-helix	trans	-61.1	-47.5	173.1	-167.6	44.3	0	0	0	109.5	Y723 Q996 Y1018 S1019 Q1024 L1025 T1026	Y723-N1022 HydrophobicContact CE2-CB 3.89Å; Y723-N1022 WeakPolarHBondContact CE2-OD1 3.49Å; Y723-N1022 PolarHBondContact OH-OD1 2.94Å; Y723-N1022 VanDerWaalsContact OH-OD1 3.05Å; Q996-N1022 PolarHBondContact OE1-ND2 2.68Å; Y1018-N1022 WeakPolarHBondContact O-CB 3.32Å; Y1018-N1022 PolarHBondContact O-N 2.95Å; S1019-N1022 PolarHBondContact O-N 2.79Å; N1022-Q1024 PolarHBondContact O-N 2.95Å; N1022-L1025 CarbonylContact O-C 3.55Å; N1022-L1025 PolarHBondContact O-N 3.36Å; N1022-T1026 WeakPolarHBondContact O-CB 3.49Å; N1022-T1026 PolarHBondContact O-N 3.38Å; N1022-T1026 PolarHBondContact O-OG1 3.17Å
1023	E	68.4	Low	64.8	Low	109 Å²	109	55.8 Å²	55.8	51%	0.509	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-46	175	-75.6	-178.1	-179.6	0	0	112.6	S1019 T1020 L1025 T1026 I1027	S1019-E1023 WeakPolarHBondContact O-CB 3.42Å; S1019-E1023 WeakPolarHBondContact O-CG 3.44Å; S1019-E1023 PolarHBondContact O-N 3.44Å; T1020-E1023 PolarHBondContact O-N 2.99Å; E1023-L1025 VanDerWaalsContact C-N 3.33Å; E1023-L1025 PolarHBondContact O-N 3.04Å; E1023-T1026 PolarHBondContact O-N 3.19Å; E1023-I1027 WeakPolarHBondContact O-CG1 3.2Å; E1023-I1027 PolarHBondContact O-N 3Å
1024	Q	67.3	Low	62.6	Low	82 Å²	82	56.5 Å²	56.5	38%	0.383	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-38.3	177.9	-74	175.5	-1.8	0	0	113.2	T1020 L1021 N1022	T1020-Q1024 VanDerWaalsContact O-CG 3.27Å; T1020-Q1024 WeakPolarHBondContact O-CG 3.49Å; T1020-Q1024 PolarHBondContact O-N 2.97Å; L1021-Q1024 PolarHBondContact O-N 3.03Å; N1022-Q1024 PolarHBondContact O-N 2.95Å
1025	L	68.2	Low	60.8	Low	8 Å²	8	60 Å²	60	4%	0.042	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	7.8	-179.9	-66.1	173	0	0	0	113.5	Y716 L719 Y723 P866 H868 L1021 N1022 E1023	Y716-L1025 HydrophobicContact CE2-CD2 4.29Å; L719-L1025 HydrophobicContact CB-CD2 4.24Å; Y723-L1025 VanDerWaalsContact CB-CD1 3.44Å; Y723-L1025 HydrophobicContact CD2-CD1 4.24Å; Y723-L1025 HydrophobicContact CG-CD1 3.86Å; P866-L1025 HydrophobicContact CB-CB 4.05Å; P866-L1025 HydrophobicContact CB-CD2 4.48Å; H868-L1025 PolarHBondContact CE1-O 3.25Å; H868-L1025 PolarHBondContact ND1-O 2.98Å; L1021-L1025 HydrophobicContact CD1-CD1 4.1Å; L1021-L1025 HydrophobicContact CD1-CG 4.36Å; L1021-L1025 HydrophobicContact CD2-CD1 4.49Å; L1021-L1025 HydrophobicContact CG-CD1 3.93Å; L1021-L1025 HydrophobicContact CG-CG 4.5Å; L1021-L1025 WeakPolarHBondContact O-CB 3.39Å; L1021-L1025 WeakPolarHBondContact O-CG 3.37Å; L1021-L1025 PolarHBondContact O-N 3.33Å; N1022-L1025 CarbonylContact O-C 3.55Å; N1022-L1025 PolarHBondContact O-N 3.36Å; E1023-L1025 VanDerWaalsContact C-N 3.33Å; E1023-L1025 PolarHBondContact O-N 3.04Å
1026	T	61.4	Low	59.5	Low	8 Å²	8	65.2 Å²	65.2	5%	0.049	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-22.1	-178.4	-74.3	0	0	0	0	111.2	L990 N1022 E1023	L990-T1026 HydrophobicContact CB-CG2 3.23Å; L990-T1026 HydrophobicContact CD1-CG2 3.77Å; L990-T1026 HydrophobicContact CG-CG2 4.14Å; N1022-T1026 WeakPolarHBondContact O-CB 3.49Å; N1022-T1026 PolarHBondContact O-N 3.38Å; N1022-T1026 PolarHBondContact O-OG1 3.17Å; E1023-T1026 PolarHBondContact O-N 3.19Å
1027	I	57.9	Low	58.2	Low	58 Å²	58	64 Å²	64	30%	0.297	36%	0.355	S	S	.	.	S	Bend	trans	-88	133.5	174.3	-60.7	166.3	0	0	0	108.6	E1023	E1023-I1027 WeakPolarHBondContact O-CG1 3.2Å; E1023-I1027 PolarHBondContact O-N 3Å
1028	P	52.1	Low	57	Low	41 Å²	41	66.4 Å²	66.4	27%	0.266	37%	0.37	S	S	.	.			trans	-58.6	146.9	177.3	25.7	-35.5	0	0	0	110.9	T989 S1030	T989-P1028 HydrophobicContact CG2-CB 4.24Å; T989-P1028 HydrophobicContact CG2-CG 3.59Å; P1028-S1030 PolarHBondContact O-N 3.18Å
1029	L	52.1	Low	56	Low	37 Å²	37	66.6 Å²	66.6	19%	0.194	37%	0.372	C	S	.	.			trans	-56.3	78.1	176.2	-67.1	163.8	0	0	0	111.2	Y716 F1037 P1039 L1043 L1048	Y716-L1029 HydrophobicContact CE2-CD2 4.29Å; L1029-F1037 HydrophobicContact CD2-CE1 3.98Å; L1029-P1039 HydrophobicContact CB-CB 3.95Å; L1029-P1039 HydrophobicContact CD2-CB 3.57Å; L1029-P1039 HydrophobicContact CG-CB 4.29Å; L1029-L1043 HydrophobicContact CB-CD2 4.02Å; L1029-L1043 HydrophobicContact CB-CG 4.39Å; L1029-L1043 HydrophobicContact CD1-CD2 4.48Å; L1029-L1048 HydrophobicContact CD1-CD2 4.43Å
1030	S	45.7	Very low	55	Low	46 Å²	46	67 Å²	67	32%	0.322	37%	0.373	S	S	.	.			trans	-100.1	153.3	173.9	74.6	0	0	0	0	110	P1028 D1032 T1033	P1028-S1030 PolarHBondContact O-N 3.18Å; S1030-D1032 PolarHBondContact O-N 2.65Å; S1030-T1033 PolarHBondContact O-N 3.2Å; S1030-T1033 PolarHBondContact O-OG1 3.44Å; S1030-T1033 PolarHBondContact OG-OG1 3.3Å
1031	K	41.9	Very low	54.1	Low	180 Å²	180	66 Å²	66	78%	0.783	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-14.3	-179	-77.4	-178.3	175.5	178.9	0	114.1
1032	D	41.7	Very low	53.4	Low	136 Å²	136	65.7 Å²	65.7	73%	0.727	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	1.1	-169	-55.7	-37.5	0	0	0	113.9	S1030 I1034	S1030-D1032 PolarHBondContact O-N 2.65Å; D1032-I1034 PolarHBondContact O-N 3.11Å
1033	T	43.2	Very low	52.8	Low	59 Å²	59	69.9 Å²	69.9	36%	0.362	39%	0.385	S	S	.	.			trans	-88.4	90.2	-175.6	-26.8	0	0	0	0	110.9	S1030 T1035	S1030-T1033 PolarHBondContact O-N 3.2Å; S1030-T1033 PolarHBondContact O-OG1 3.44Å; S1030-T1033 PolarHBondContact OG-OG1 3.3Å; T1033-T1035 PolarHBondContact O-N 3.45Å
1034	I	30.4	Very low	52.4	Low	151 Å²	151	70 Å²	70	77%	0.774	38%	0.384	S	S	*	.			trans	-76.8	107.8	-177.3	-61.2	168.1	0	0	0	110.8	D1032	D1032-I1034 PolarHBondContact O-N 3.11Å
1035	T	43	Very low	52.2	Low	103 Å²	103	66.7 Å²	66.7	63%	0.632	37%	0.37	S	S	*	.	S	Bend		168.3	122.4	121.6	38.2	0	0	0	0	110.7	T1033 F1037	T1033-T1035 PolarHBondContact O-N 3.45Å; T1035-F1037 PolarHBondContact O-N 3.46Å
1036	A	48.6	Very low	52	Low	115 Å²	115	69.9 Å²	69.9	95%	0.95	39%	0.39	S	S	*	.	S	Bend	trans	75.4	-19.5	172.9	0	0	0	0	0	121.4
1037	F	52	Low	52.3	Low	37 Å²	37	70.3 Å²	70.3	16%	0.162	39%	0.393	C	S	.	.			trans	-126.5	124.1	-178.1	176.8	-101.8	0	0	0	111.8	Q715 Y716 L719 L1029 T1035 P1039 L1042	Q715-F1037 HydrophobicContact CB-CD2 4.03Å; Q715-F1037 HydrophobicContact CB-CE2 3.97Å; Y716-F1037 AromaticContact CD2-CE1 4Å; Y716-F1037 HydrophobicContact CD2-CE1 4Å; Y716-F1037 AromaticContact CD2-CZ 3.71Å; Y716-F1037 HydrophobicContact CD2-CZ 3.71Å; Y716-F1037 HydrophobicContact CG-CZ 4.01Å; L719-F1037 HydrophobicContact CD1-CB 4.49Å; L719-F1037 HydrophobicContact CD1-CD2 4.5Å; L719-F1037 HydrophobicContact CD1-CG 4.35Å; L1029-F1037 HydrophobicContact CD2-CE1 3.98Å; T1035-F1037 PolarHBondContact O-N 3.46Å; F1037-P1039 HydrophobicContact CD1-CB 4.49Å; F1037-P1039 HydrophobicContact CE1-CB 4.2Å; F1037-P1039 VanDerWaalsContact O-CD 3.28Å; F1037-P1039 WeakPolarHBondContact O-CD 3.33Å; F1037-L1042 HydrophobicContact CE1-CD1 3.89Å; F1037-L1042 HydrophobicContact CE2-CD1 3.73Å; F1037-L1042 HydrophobicContact CZ-CD1 3.11Å; F1037-L1042 HydrophobicContact CZ-CD2 4Å; F1037-L1042 HydrophobicContact CZ-CG 4.15Å
1038	D	52.8	Low	52.9	Low	96 Å²	96	68.8 Å²	68.8	51%	0.513	39%	0.385	S	S	.	.			trans	-92.9	105	176.9	-173.4	-10.2	0	0	0	110.2	T1040	D1038-T1040 PolarHBondContact O-N 2.94Å; D1038-T1040 VanDerWaalsContact OD1-CB 3.27Å; D1038-T1040 WeakPolarHBondContact OD1-CB 3.17Å; D1038-T1040 WeakPolarHBondContact OD1-CG2 3.38Å; D1038-T1040 PolarHBondContact OD1-N 3.35Å; D1038-T1040 VanDerWaalsContact OD1-N 3.11Å; D1038-T1040 PolarHBondContact OD1-OG1 2.99Å; D1038-T1040 PolarHBondContact OD2-OG1 3.23Å
1039	P	55.9	Low	53.8	Low	11 Å²	11	69.6 Å²	69.6	7%	0.071	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-73.5	-7	-175	31	-36.3	0	0	0	113.9	L1029 F1037 N1041 L1042 L1043	L1029-P1039 HydrophobicContact CB-CB 3.95Å; L1029-P1039 HydrophobicContact CD2-CB 3.57Å; L1029-P1039 HydrophobicContact CG-CB 4.29Å; F1037-P1039 HydrophobicContact CD1-CB 4.49Å; F1037-P1039 HydrophobicContact CE1-CB 4.2Å; F1037-P1039 VanDerWaalsContact O-CD 3.28Å; F1037-P1039 WeakPolarHBondContact O-CD 3.33Å; P1039-N1041 PolarHBondContact O-N 3.3Å; P1039-N1041 VanDerWaalsContact O-N 3.14Å; P1039-L1042 PolarHBondContact O-N 2.94Å; P1039-L1042 VanDerWaalsContact O-N 3.09Å; P1039-L1043 WeakPolarHBondContact O-CG 3.36Å; P1039-L1043 PolarHBondContact O-N 3.46Å
1040	T	51.9	Low	54.7	Low	46 Å²	46	69.1 Å²	69.1	28%	0.282	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-59.8	-28.6	-171.2	54.6	0	0	0	0	114.2	D1038	D1038-T1040 PolarHBondContact O-N 2.94Å; D1038-T1040 VanDerWaalsContact OD1-CB 3.27Å; D1038-T1040 WeakPolarHBondContact OD1-CB 3.17Å; D1038-T1040 WeakPolarHBondContact OD1-CG2 3.38Å; D1038-T1040 PolarHBondContact OD1-N 3.35Å; D1038-T1040 VanDerWaalsContact OD1-N 3.11Å; D1038-T1040 PolarHBondContact OD1-OG1 2.99Å; D1038-T1040 PolarHBondContact OD2-OG1 3.23Å
1041	N	56.8	Low	56.1	Low	52 Å²	52	67 Å²	67	28%	0.278	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-87.2	-24.1	178.2	-75	-24.6	0	0	0	113.9	S712 P1039	S712-N1041 WeakPolarHBondContact OG-CB 3.2Å; P1039-N1041 PolarHBondContact O-N 3.3Å; P1039-N1041 VanDerWaalsContact O-N 3.14Å
1042	L	60.1	Low	57.7	Low	3 Å²	3	58.4 Å²	58.4	2%	0.016	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-76.3	-33.9	175.9	-78.6	97	0	0	0	112.7	I713 Y716 F1037 P1039 K1044 C1045 L1048	I713-L1042 HydrophobicContact CD1-CD2 4.06Å; Y716-L1042 VanDerWaalsContact CB-CD2 3.47Å; Y716-L1042 HydrophobicContact CD1-CD2 3.58Å; Y716-L1042 HydrophobicContact CD2-CD2 4.14Å; Y716-L1042 HydrophobicContact CE1-CD2 4.35Å; Y716-L1042 HydrophobicContact CG-CD2 3.46Å; Y716-L1042 VanDerWaalsContact CG-CD2 3.46Å; F1037-L1042 HydrophobicContact CE1-CD1 3.89Å; F1037-L1042 HydrophobicContact CE2-CD1 3.73Å; F1037-L1042 HydrophobicContact CZ-CD1 3.11Å; F1037-L1042 HydrophobicContact CZ-CD2 4Å; F1037-L1042 HydrophobicContact CZ-CG 4.15Å; P1039-L1042 PolarHBondContact O-N 2.94Å; P1039-L1042 VanDerWaalsContact O-N 3.09Å; L1042-K1044 PolarHBondContact O-N 2.98Å; L1042-C1045 WeakPolarHBondContact O-CB 3.4Å; L1042-C1045 PolarHBondContact O-N 3.37Å; L1042-L1048 HydrophobicContact CD2-CD1 3.88Å
1043	L	57.2	Low	59.3	Low	90 Å²	90	53.7 Å²	53.7	47%	0.471	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-61.2	-14.8	177.4	-71	165.1	0	0	0	112.9	L1029 P1039	L1029-L1043 HydrophobicContact CB-CD2 4.02Å; L1029-L1043 HydrophobicContact CB-CG 4.39Å; L1029-L1043 HydrophobicContact CD1-CD2 4.48Å; P1039-L1043 WeakPolarHBondContact O-CG 3.36Å; P1039-L1043 PolarHBondContact O-N 3.46Å
1044	K	60.3	Low	60.9	Low	112 Å²	112	51.1 Å²	51.1	49%	0.487	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-88.2	-9.3	176.8	-58	-178.9	-176.7	170.3	0	113.7	E708 L1042 P1046	E708-K1044 HydrophobicContact CB-CD 4.39Å; E708-K1044 WeakPolarHBondContact OE2-CD 3.32Å; E708-K1044 WeakPolarHBondContact OE2-CE 3.43Å; E708-K1044 IonicContact OE2-NZ 3.89Å; E708-K1044 PolarHBondContact OE2-NZ 3.46Å; L1042-K1044 PolarHBondContact O-N 2.98Å; K1044-P1046 WeakPolarHBondContact O-CD 3.47Å
1045	C	63.9	Low	63.2	Low	12 Å²	12	44 Å²	44	8%	0.081	25%	0.253	C	S	.	.			trans	-75.9	118.8	178.4	-168.6	0	0	0	0	109.9	C709 L1042 N1047	C709-C1045 HydrophobicContact CB-CB 3.83Å; L1042-C1045 WeakPolarHBondContact O-CB 3.4Å; L1042-C1045 PolarHBondContact O-N 3.37Å; C1045-N1047 PolarHBondContact O-N 3.41Å; C1045-N1047 VanDerWaalsContact O-N 3.14Å
1046	P	64	Low	64.9	Low	74 Å²	74	39.1 Å²	39.1	48%	0.481	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.9	-177.5	-17.6	29.4	0	0	0	113.1	H704 R807 K1044	H704-P1046 HydrophobicContact CB-CG 3.98Å; R807-P1046 PolarHBondContact NH1-O 3.3Å; K1044-P1046 WeakPolarHBondContact O-CD 3.47Å
1047	N	67	Low	66.4	Low	18 Å²	18	34.2 Å²	34.2	10%	0.096	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-145.3	74.1	-178.7	-164.8	-13.1	0	0	0	111	H704 C1045 L1049 Q1050 H1051	H704-N1047 WeakPolarHBondContact NE2-CB 3.42Å; C1045-N1047 PolarHBondContact O-N 3.41Å; C1045-N1047 VanDerWaalsContact O-N 3.14Å; N1047-L1049 VanDerWaalsContact C-N 3.3Å; N1047-L1049 PolarHBondContact O-N 3.08Å; N1047-Q1050 HydrophobicContact CB-CB 4.19Å; N1047-Q1050 VanDerWaalsContact CG-CB 3.44Å; N1047-Q1050 PolarHBondContact ND2-OE1 3.46Å; N1047-Q1050 PolarHBondContact O-N 2.99Å; N1047-Q1050 WeakPolarHBondContact OD1-CB 3.24Å; N1047-Q1050 PolarHBondContact OD1-N 3.23Å; N1047-H1051 PolarHBondContact O-N 2.76Å; N1047-H1051 VanDerWaalsContact O-N 3.11Å
1048	L	71.2	Confident	67.7	Low	26 Å²	26	32.4 Å²	32.4	14%	0.136	17%	0.173	C	C	.	.	H	α-helix	trans	-55.3	-41.7	-178	179.2	60.9	0	0	0	113	I713 Y716 L869 L1029 L1042 H1051 L1052	I713-L1048 HydrophobicContact CD1-CD1 3.45Å; I713-L1048 VanDerWaalsContact CD1-CD1 3.45Å; Y716-L1048 HydrophobicContact CD1-CD1 4.43Å; Y716-L1048 HydrophobicContact CE1-CD1 4.38Å; Y716-L1048 HydrophobicContact CE1-CD2 4.2Å; L869-L1048 HydrophobicContact CD1-CD2 3.91Å; L869-L1048 HydrophobicContact CD1-CG 4.35Å; L869-L1048 HydrophobicContact CD2-CD2 4.18Å; L1029-L1048 HydrophobicContact CD1-CD2 4.43Å; L1042-L1048 HydrophobicContact CD2-CD1 3.88Å; L1048-H1051 PolarHBondContact O-N 3.31Å; L1048-L1052 HydrophobicContact CG-CD1 4.39Å; L1048-L1052 WeakPolarHBondContact O-CG 3.39Å; L1048-L1052 PolarHBondContact O-N 2.68Å
1049	L	70.5	Confident	68.9	Low	58 Å²	58	28.1 Å²	28.1	30%	0.304	15%	0.15	S	C	.	.	H	α-helix	trans	-64.8	-43	-179.1	-173.3	66.4	0	0	0	112.1	V865 N1047 H1051 L1052 N1053	V865-L1049 HydrophobicContact CG1-CD1 4.24Å; V865-L1049 HydrophobicContact CG2-CD1 3.79Å; N1047-L1049 VanDerWaalsContact C-N 3.3Å; N1047-L1049 PolarHBondContact O-N 3.08Å; L1049-H1051 VanDerWaalsContact C-N 3.3Å; L1049-H1051 PolarHBondContact O-N 3.2Å; L1049-L1052 PolarHBondContact O-N 2.95Å; L1049-N1053 VanDerWaalsContact O-CG 3.24Å; L1049-N1053 PolarHBondContact O-N 2.98Å; L1049-N1053 PolarHBondContact O-OD1 2.94Å
1050	Q	69.8	Low	70.2	Confident	27 Å²	27	27.7 Å²	27.7	13%	0.126	15%	0.147	C	C	.	.	H	α-helix	trans	-66.9	-34.2	176.2	-168.3	175.3	19.6	0	0	111.8	P703 N1047 N1053 L1054	P703-Q1050 HydrophobicContact CB-CG 4.31Å; P703-Q1050 HydrophobicContact CG-CB 4.41Å; P703-Q1050 HydrophobicContact CG-CG 3.99Å; N1047-Q1050 HydrophobicContact CB-CB 4.19Å; N1047-Q1050 VanDerWaalsContact CG-CB 3.44Å; N1047-Q1050 PolarHBondContact ND2-OE1 3.46Å; N1047-Q1050 PolarHBondContact O-N 2.99Å; N1047-Q1050 WeakPolarHBondContact OD1-CB 3.24Å; N1047-Q1050 PolarHBondContact OD1-N 3.23Å; Q1050-N1053 PolarHBondContact O-N 3.39Å; Q1050-L1054 PolarHBondContact O-N 2.83Å; Q1050-L1054 VanDerWaalsContact O-N 3.12Å
1051	H	75.8	Confident	71.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-67.8	-44.6	175.3	-159.7	176.3	0	0	0	111.5	C709 I713 N1047 L1048 L1049 N1053 L1054 V1055	C709-H1051 PolarHBondContact SG-CE1 2.9Å; I713-H1051 HydrophobicContact CD1-CB 4.32Å; I713-H1051 HydrophobicContact CG1-CB 4.48Å; N1047-H1051 PolarHBondContact O-N 2.76Å; N1047-H1051 VanDerWaalsContact O-N 3.11Å; L1048-H1051 PolarHBondContact O-N 3.31Å; L1049-H1051 VanDerWaalsContact C-N 3.3Å; L1049-H1051 PolarHBondContact O-N 3.2Å; H1051-N1053 VanDerWaalsContact C-N 3.29Å; H1051-N1053 PolarHBondContact O-N 3.09Å; H1051-L1054 PolarHBondContact O-N 3.18Å; H1051-V1055 WeakPolarHBondContact O-CG2 3.32Å; H1051-V1055 PolarHBondContact O-N 3.39Å
1052	L	75.2	Confident	72.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-56.8	-42	171.6	-77.3	171.9	0	0	0	112.2	I713 Y716 Y717 V863 L869 L1048 L1049 L1054 V1055 H1056	I713-L1052 HydrophobicContact CD1-CD2 4.07Å; I713-L1052 HydrophobicContact CD1-CG 4.23Å; Y716-L1052 HydrophobicContact CD1-CD1 4.44Å; Y716-L1052 HydrophobicContact CD1-CD2 3.74Å; Y716-L1052 HydrophobicContact CD1-CG 4.43Å; Y716-L1052 HydrophobicContact CE1-CD1 3.92Å; Y716-L1052 HydrophobicContact CE1-CD2 4.05Å; Y716-L1052 HydrophobicContact CE1-CG 4.38Å; Y717-L1052 HydrophobicContact CD2-CD2 4.42Å; V863-L1052 HydrophobicContact CG1-CB 4.18Å; L869-L1052 HydrophobicContact CD1-CD1 3.84Å; L1048-L1052 HydrophobicContact CG-CD1 4.39Å; L1048-L1052 WeakPolarHBondContact O-CG 3.39Å; L1048-L1052 PolarHBondContact O-N 2.68Å; L1049-L1052 PolarHBondContact O-N 2.95Å; L1052-L1054 VanDerWaalsContact C-N 3.32Å; L1052-L1054 PolarHBondContact O-N 3.43Å; L1052-V1055 PolarHBondContact O-N 2.79Å; L1052-H1056 WeakPolarHBondContact O-CB 3.36Å; L1052-H1056 PolarHBondContact O-N 3.44Å
1053	N	76.1	Confident	73.8	Confident	37 Å²	37	27.4 Å²	27.4	20%	0.198	14%	0.141	C	C	.	.	H	α-helix	trans	-59.8	-43.8	176.6	-71.2	-12.7	0	0	0	112.2	V863 L1049 Q1050 H1051 H1056 Q1057	V863-N1053 WeakPolarHBondContact CB-OD1 3.46Å; V863-N1053 WeakPolarHBondContact CG1-OD1 3.26Å; V863-N1053 HydrophobicContact CG2-CB 4.29Å; V863-N1053 WeakPolarHBondContact CG2-OD1 3.25Å; L1049-N1053 VanDerWaalsContact O-CG 3.24Å; L1049-N1053 PolarHBondContact O-N 2.98Å; L1049-N1053 PolarHBondContact O-OD1 2.94Å; Q1050-N1053 PolarHBondContact O-N 3.39Å; H1051-N1053 VanDerWaalsContact C-N 3.29Å; H1051-N1053 PolarHBondContact O-N 3.09Å; N1053-H1056 PolarHBondContact O-N 3.47Å; N1053-Q1057 WeakPolarHBondContact O-CG 3.39Å; N1053-Q1057 PolarHBondContact O-N 2.98Å
1054	L	76.7	Confident	75	Confident	6 Å²	6	23.1 Å²	23.1	3%	0.031	12%	0.118	C	C	.	.	H	α-helix	trans	-67.4	-37.8	178.2	-166.2	65.2	0	0	0	112.2	T656 V700 K701 P703 Y838 Q1050 H1051 L1052 T1058	T656-L1054 HydrophobicContact CG2-CD1 3.66Å; V700-L1054 HydrophobicContact CG1-CB 4Å; V700-L1054 HydrophobicContact CG1-CD2 3.49Å; V700-L1054 VanDerWaalsContact CG1-CD2 3.49Å; V700-L1054 HydrophobicContact CG1-CG 3.51Å; K701-L1054 WeakPolarHBondContact O-CD2 3.3Å; P703-L1054 HydrophobicContact CG-CD2 4.35Å; Y838-L1054 HydrophobicContact CE2-CD1 4.24Å; Q1050-L1054 PolarHBondContact O-N 2.83Å; Q1050-L1054 VanDerWaalsContact O-N 3.12Å; H1051-L1054 PolarHBondContact O-N 3.18Å; L1052-L1054 VanDerWaalsContact C-N 3.32Å; L1052-L1054 PolarHBondContact O-N 3.43Å; L1054-T1058 WeakPolarHBondContact O-CB 3.39Å; L1054-T1058 PolarHBondContact O-N 3.46Å; L1054-T1058 PolarHBondContact O-OG1 3.07Å
1055	V	78	Confident	76.1	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-63.6	-48.1	173.5	176.5	0	0	0	0	111	V700 I713 Y717 H1051 L1052 Q1057 T1058 V1059	V700-V1055 HydrophobicContact CB-CG2 3.95Å; V700-V1055 HydrophobicContact CG1-CG2 4.19Å; V700-V1055 HydrophobicContact CG2-CB 4.3Å; V700-V1055 HydrophobicContact CG2-CG2 3.69Å; I713-V1055 HydrophobicContact CG1-CG2 3.84Å; I713-V1055 HydrophobicContact CG2-CG2 3.98Å; Y717-V1055 HydrophobicContact CD1-CG1 3.82Å; Y717-V1055 HydrophobicContact CD2-CB 4.41Å; Y717-V1055 HydrophobicContact CD2-CG1 3.92Å; Y717-V1055 HydrophobicContact CE1-CG1 4.46Å; Y717-V1055 HydrophobicContact CG-CB 4.42Å; Y717-V1055 HydrophobicContact CG-CG1 3.52Å; H1051-V1055 WeakPolarHBondContact O-CG2 3.32Å; H1051-V1055 PolarHBondContact O-N 3.39Å; L1052-V1055 PolarHBondContact O-N 2.79Å; V1055-Q1057 VanDerWaalsContact C-N 3.34Å; V1055-Q1057 PolarHBondContact O-N 3.42Å; V1055-T1058 WeakPolarHBondContact O-CB 3.3Å; V1055-T1058 PolarHBondContact O-N 2.95Å; V1055-T1058 VanDerWaalsContact O-N 3.11Å; V1055-V1059 HydrophobicContact CG1-CG2 4.41Å; V1055-V1059 WeakPolarHBondContact O-CG2 3.5Å; V1055-V1059 PolarHBondContact O-N 3.29Å
1056	H	79.5	Confident	77	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-56.7	-47.5	177.1	-175.4	65.2	0	0	0	111.7	Y717 T860 T862 V863 L1052 N1053 T1058 V1059 R1060	Y717-H1056 HydrophobicContact CE2-CB 3.65Å; Y717-H1056 AromaticContact CE2-ND1 3.68Å; Y717-H1056 AromaticContact CZ-ND1 3.7Å; Y717-H1056 PolarHBondContact OH-ND1 2.98Å; T860-H1056 PolarHBondContact O-NE2 3.3Å; T862-H1056 PolarHBondContact O-NE2 2.79Å; V863-H1056 HydrophobicContact CG1-CB 4.18Å; V863-H1056 HydrophobicContact CG2-CB 4Å; L1052-H1056 WeakPolarHBondContact O-CB 3.36Å; L1052-H1056 PolarHBondContact O-N 3.44Å; N1053-H1056 PolarHBondContact O-N 3.47Å; H1056-T1058 PolarHBondContact O-N 3.28Å; H1056-V1059 PolarHBondContact O-N 2.98Å; H1056-R1060 WeakPolarHBondContact NE2-CD 3.26Å; H1056-R1060 WeakPolarHBondContact O-CG 3.47Å; H1056-R1060 PolarHBondContact O-N 3.01Å
1057	Q	79	Confident	77.8	Confident	12 Å²	12	17.9 Å²	17.9	6%	0.056	9%	0.093	C	C	.	.	H	α-helix	trans	-60.3	-43.1	174.8	-73.3	-178.2	1.9	0	0	112.3	N1053 V1055 V1059 R1060 R1061	N1053-Q1057 WeakPolarHBondContact O-CG 3.39Å; N1053-Q1057 PolarHBondContact O-N 2.98Å; V1055-Q1057 VanDerWaalsContact C-N 3.34Å; V1055-Q1057 PolarHBondContact O-N 3.42Å; Q1057-V1059 VanDerWaalsContact C-N 3.35Å; Q1057-V1059 PolarHBondContact O-N 3.1Å; Q1057-R1060 PolarHBondContact O-N 3.3Å; Q1057-R1061 VanDerWaalsContact O-CG 3.3Å; Q1057-R1061 WeakPolarHBondContact O-CG 3.37Å; Q1057-R1061 PolarHBondContact O-N 3.29Å
1058	T	80.8	Confident	78.5	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-62.2	-42.2	179.2	-59.1	0	0	0	0	111.8	L653 T657 V698 V700 L1054 V1055 H1056 R1061 K1062	L653-T1058 HydrophobicContact CD1-CG2 3.76Å; T657-T1058 HydrophobicContact CG2-CG2 4Å; V698-T1058 HydrophobicContact CG1-CG2 3.76Å; V700-T1058 HydrophobicContact CG2-CG2 4.17Å; L1054-T1058 WeakPolarHBondContact O-CB 3.39Å; L1054-T1058 PolarHBondContact O-N 3.46Å; L1054-T1058 PolarHBondContact O-OG1 3.07Å; V1055-T1058 WeakPolarHBondContact O-CB 3.3Å; V1055-T1058 PolarHBondContact O-N 2.95Å; V1055-T1058 VanDerWaalsContact O-N 3.11Å; H1056-T1058 PolarHBondContact O-N 3.28Å; T1058-R1061 PolarHBondContact O-N 3Å; T1058-K1062 PolarHBondContact O-N 2.69Å
1059	V	77.9	Confident	79.2	Confident	6 Å²	6	20 Å²	20	4%	0.036	10%	0.102	C	C	.	.	H	α-helix	trans	-65.5	-44.9	176.1	173	0	0	0	0	110.9	L696 V698 Y717 M858 V1055 H1056 Q1057 R1061 K1062 L1063	L696-V1059 HydrophobicContact CD2-CG2 4.23Å; V698-V1059 HydrophobicContact CG2-CG2 4.43Å; Y717-V1059 HydrophobicContact CD1-CG2 4.33Å; Y717-V1059 HydrophobicContact CE1-CB 4.22Å; Y717-V1059 HydrophobicContact CE1-CG1 4.29Å; Y717-V1059 HydrophobicContact CE1-CG2 3.79Å; M858-V1059 HydrophobicContact CE-CG1 3.79Å; M858-V1059 HydrophobicContact SD-CG1 4.5Å; V1055-V1059 HydrophobicContact CG1-CG2 4.41Å; V1055-V1059 WeakPolarHBondContact O-CG2 3.5Å; V1055-V1059 PolarHBondContact O-N 3.29Å; H1056-V1059 PolarHBondContact O-N 2.98Å; Q1057-V1059 VanDerWaalsContact C-N 3.35Å; Q1057-V1059 PolarHBondContact O-N 3.1Å; V1059-R1061 VanDerWaalsContact C-N 3.33Å; V1059-R1061 PolarHBondContact O-N 3.24Å; V1059-K1062 PolarHBondContact O-N 2.85Å; V1059-L1063 HydrophobicContact CG1-CD1 4.12Å; V1059-L1063 WeakPolarHBondContact O-CG 3.36Å; V1059-L1063 PolarHBondContact O-N 3.02Å
1060	R	82.2	Confident	79.5	Confident	1 Å²	1	20.7 Å²	20.7	0%	0.004	11%	0.106	C	C	.	.	H	α-helix	trans	-57.9	-43.5	174.3	-71.4	176.8	77.9	-148.6	9.9	111.9	E845 L848 I852 M858 A859 T860 H1056 Q1057 L1063 A1064	E845-R1060 IonicContact OE1-CZ 2.72Å; E845-R1060 IonicContact OE1-NH1 2.69Å; E845-R1060 IonicContact OE1-NH2 3.72Å; E845-R1060 PolarHBondContact OE1-NH2 3.4Å; E845-R1060 IonicContact OE2-CZ 2.67Å; E845-R1060 IonicContact OE2-NH1 2.61Å; E845-R1060 PolarHBondContact OE2-NH1 2.84Å; E845-R1060 IonicContact OE2-NH2 3.28Å; E845-R1060 PolarHBondContact OE2-NH2 2.9Å; L848-R1060 HydrophobicContact CD1-CB 4.25Å; L848-R1060 HydrophobicContact CD2-CB 4.25Å; I852-R1060 HydrophobicContact CD1-CB 4.05Å; I852-R1060 HydrophobicContact CD1-CG 4.3Å; M858-R1060 PolarHBondContact O-NE 3.21Å; A859-R1060 PolarHBondContact O-NH2 3.21Å; A859-R1060 VanDerWaalsContact O-NH2 3.08Å; T860-R1060 PolarHBondContact O-NE 2.72Å; H1056-R1060 WeakPolarHBondContact NE2-CD 3.26Å; H1056-R1060 WeakPolarHBondContact O-CG 3.47Å; H1056-R1060 PolarHBondContact O-N 3.01Å; Q1057-R1060 PolarHBondContact O-N 3.3Å; R1060-L1063 PolarHBondContact O-N 3.42Å; R1060-A1064 WeakPolarHBondContact O-CB 3.49Å; R1060-A1064 PolarHBondContact O-N 3.06Å
1061	R	83.6	Confident	80	Confident	6 Å²	6	22.9 Å²	22.9	2%	0.023	12%	0.118	C	C	.	.	H	α-helix	trans	-59	-49	175.3	-72.6	170.1	-174.2	147.6	10.9	112.1	L649 L653 T656 E844 L848 Q1057 T1058 V1059 L1063 A1064 I1065	L649-R1061 HydrophobicContact CD2-CG 4.26Å; L653-R1061 HydrophobicContact CD1-CB 4.39Å; T656-R1061 PolarHBondContact OG1-NH1 3.45Å; E844-R1061 IonicContact OE1-CZ 2.78Å; E844-R1061 IonicContact OE1-NE 3.47Å; E844-R1061 PolarHBondContact OE1-NE 2.98Å; E844-R1061 IonicContact OE1-NH2 3.64Å; E844-R1061 PolarHBondContact OE1-NH2 3.46Å; E844-R1061 IonicContact OE2-NH2 3.29Å; L848-R1061 HydrophobicContact CD2-CG 4.41Å; Q1057-R1061 VanDerWaalsContact O-CG 3.3Å; Q1057-R1061 WeakPolarHBondContact O-CG 3.37Å; Q1057-R1061 PolarHBondContact O-N 3.29Å; T1058-R1061 PolarHBondContact O-N 3Å; V1059-R1061 VanDerWaalsContact C-N 3.33Å; V1059-R1061 PolarHBondContact O-N 3.24Å; R1061-L1063 PolarHBondContact O-N 3.33Å; R1061-A1064 PolarHBondContact O-N 2.89Å; R1061-I1065 WeakPolarHBondContact O-CB 3.32Å; R1061-I1065 WeakPolarHBondContact O-CD1 3.19Å; R1061-I1065 VanDerWaalsContact O-CG1 3.25Å; R1061-I1065 WeakPolarHBondContact O-CG1 3.34Å; R1061-I1065 PolarHBondContact O-N 2.92Å
1062	K	81.4	Confident	80.2	Confident	55 Å²	55	24.1 Å²	24.1	24%	0.239	13%	0.125	C	C	.	.	H	α-helix	trans	-60.6	-43.9	178.8	-76.5	-172.7	172.8	-171.9	0	112.2	L653 T1058 V1059 I1065 N1066	L653-K1062 HydrophobicContact CD1-CG 3.99Å; L653-K1062 HydrophobicContact CD2-CG 4.26Å; T1058-K1062 PolarHBondContact O-N 2.69Å; V1059-K1062 PolarHBondContact O-N 2.85Å; K1062-I1065 PolarHBondContact O-N 3.33Å; K1062-N1066 WeakPolarHBondContact O-CB 3.47Å; K1062-N1066 PolarHBondContact O-N 3.48Å
1063	L	79	Confident	80.2	Confident	35 Å²	35	27.9 Å²	27.9	18%	0.183	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-46.3	175.9	-74.7	170.6	0	0	0	111.8	L692 M858 V1059 R1060 R1061 N1066 S1067	L692-L1063 HydrophobicContact CD1-CD2 3.82Å; L692-L1063 HydrophobicContact CD2-CD2 3.51Å; L692-L1063 HydrophobicContact CD2-CG 4.13Å; L692-L1063 HydrophobicContact CG-CD2 4.33Å; M858-L1063 HydrophobicContact CB-CD1 4.06Å; M858-L1063 HydrophobicContact CE-CD1 4.05Å; M858-L1063 HydrophobicContact CG-CD1 3.71Å; M858-L1063 HydrophobicContact SD-CD1 4.12Å; V1059-L1063 HydrophobicContact CG1-CD1 4.12Å; V1059-L1063 WeakPolarHBondContact O-CG 3.36Å; V1059-L1063 PolarHBondContact O-N 3.02Å; R1060-L1063 PolarHBondContact O-N 3.42Å; R1061-L1063 PolarHBondContact O-N 3.33Å; L1063-N1066 PolarHBondContact O-N 2.95Å; L1063-S1067 WeakPolarHBondContact O-CB 3.42Å; L1063-S1067 PolarHBondContact O-N 3.16Å
1064	A	82.3	Confident	79.9	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-41.5	177.1	0	0	0	0	0	112.1	L649 L848 I852 R1060 R1061 S1067 I1068	L649-A1064 HydrophobicContact CD1-CB 3.8Å; L848-A1064 HydrophobicContact CD2-CB 3.7Å; I852-A1064 HydrophobicContact CG1-CB 4.23Å; R1060-A1064 WeakPolarHBondContact O-CB 3.49Å; R1060-A1064 PolarHBondContact O-N 3.06Å; R1061-A1064 PolarHBondContact O-N 2.89Å; A1064-S1067 PolarHBondContact O-N 3.48Å; A1064-I1068 WeakPolarHBondContact O-CB 3.39Å; A1064-I1068 WeakPolarHBondContact O-CD1 3.38Å; A1064-I1068 WeakPolarHBondContact O-CG1 3.48Å; A1064-I1068 PolarHBondContact O-N 3.45Å
1065	I	84.9	Confident	79.5	Confident	11 Å²	11	34.8 Å²	34.8	6%	0.056	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-52.5	176	-71.9	162.2	0	0	0	110.4	L649 L653 R1061 K1062 S1067 I1068 E1069	L649-I1065 HydrophobicContact CB-CD1 4.01Å; L649-I1065 HydrophobicContact CB-CG1 3.76Å; L649-I1065 HydrophobicContact CD1-CG1 4.15Å; L653-I1065 HydrophobicContact CB-CD1 4.4Å; L653-I1065 HydrophobicContact CD2-CD1 3.78Å; R1061-I1065 WeakPolarHBondContact O-CB 3.32Å; R1061-I1065 WeakPolarHBondContact O-CD1 3.19Å; R1061-I1065 VanDerWaalsContact O-CG1 3.25Å; R1061-I1065 WeakPolarHBondContact O-CG1 3.34Å; R1061-I1065 PolarHBondContact O-N 2.92Å; K1062-I1065 PolarHBondContact O-N 3.33Å; I1065-S1067 VanDerWaalsContact C-N 3.33Å; I1065-S1067 PolarHBondContact O-N 2.79Å; I1065-I1068 PolarHBondContact O-N 3.19Å; I1065-I1068 VanDerWaalsContact O-N 3.15Å; I1065-E1069 HydrophobicContact CG2-CG 4.22Å; I1065-E1069 WeakPolarHBondContact O-CB 3.24Å; I1065-E1069 WeakPolarHBondContact O-CG 3.13Å; I1065-E1069 PolarHBondContact O-N 2.96Å
1066	N	81.5	Confident	79.2	Confident	44 Å²	44	41.4 Å²	41.4	24%	0.235	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-42.1	-179.4	-169.2	7.5	0	0	0	111.6	K1062 L1063 E1069 N1070	K1062-N1066 WeakPolarHBondContact O-CB 3.47Å; K1062-N1066 PolarHBondContact O-N 3.48Å; L1063-N1066 PolarHBondContact O-N 2.95Å; N1066-E1069 PolarHBondContact O-N 2.97Å; N1066-N1070 WeakPolarHBondContact O-CB 3.31Å; N1066-N1070 VanDerWaalsContact O-CG 3.25Å; N1066-N1070 PolarHBondContact O-N 3.12Å; N1066-N1070 PolarHBondContact O-ND2 2.94Å; N1066-N1070 VanDerWaalsContact O-ND2 3.1Å; N1066-N1070 PolarHBondContact OD1-ND2 3.28Å
1067	S	80.9	Confident	79	Confident	32 Å²	32	42.5 Å²	42.5	22%	0.224	23%	0.225	C	C	.	.	H	α-helix	trans	-59.1	-47.7	173.5	174	0	0	0	0	112.2	S851 L1063 A1064 I1065 N1070 N1071	S851-S1067 VanDerWaalsContact O-CB 3.32Å; S851-S1067 WeakPolarHBondContact O-CB 3.29Å; S851-S1067 PolarHBondContact O-OG 2.6Å; L1063-S1067 WeakPolarHBondContact O-CB 3.42Å; L1063-S1067 PolarHBondContact O-N 3.16Å; A1064-S1067 PolarHBondContact O-N 3.48Å; I1065-S1067 VanDerWaalsContact C-N 3.33Å; I1065-S1067 PolarHBondContact O-N 2.79Å; S1067-N1070 PolarHBondContact O-N 3.33Å; S1067-N1071 WeakPolarHBondContact O-CB 3.26Å; S1067-N1071 VanDerWaalsContact O-CG 3.25Å; S1067-N1071 PolarHBondContact O-N 3.31Å; S1067-N1071 PolarHBondContact O-ND2 3.17Å
1068	I	82.8	Confident	79	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.8	-42.3	178.3	-67.2	165	0	0	0	111	K642 H645 L646 L649 A1064 I1065 N1071 L1072	K642-I1068 HydrophobicContact CB-CG2 4.09Å; K642-I1068 HydrophobicContact CD-CG1 4.32Å; K642-I1068 HydrophobicContact CD-CG2 4.4Å; H645-I1068 HydrophobicContact CB-CD1 4.25Å; L646-I1068 HydrophobicContact CB-CG2 4.2Å; L646-I1068 HydrophobicContact CD1-CG2 4.1Å; L649-I1068 HydrophobicContact CD1-CD1 3.77Å; A1064-I1068 WeakPolarHBondContact O-CB 3.39Å; A1064-I1068 WeakPolarHBondContact O-CD1 3.38Å; A1064-I1068 WeakPolarHBondContact O-CG1 3.48Å; A1064-I1068 PolarHBondContact O-N 3.45Å; I1065-I1068 PolarHBondContact O-N 3.19Å; I1065-I1068 VanDerWaalsContact O-N 3.15Å; I1068-N1071 PolarHBondContact O-N 3.1Å; I1068-L1072 HydrophobicContact CG2-CD1 3.83Å; I1068-L1072 HydrophobicContact CG2-CG 4.3Å; I1068-L1072 WeakPolarHBondContact O-CB 3.49Å; I1068-L1072 VanDerWaalsContact O-CG 3.31Å; I1068-L1072 WeakPolarHBondContact O-CG 3.43Å; I1068-L1072 PolarHBondContact O-N 3.02Å
1069	E	84.6	Confident	79.1	Confident	90 Å²	90	49.1 Å²	49.1	42%	0.421	26%	0.257	S	S	.	.	H	α-helix	trans	-62.7	-44.6	178.2	-75.1	180	159.1	0	0	112	L646 I1065 N1066 L1072 A1073	L646-E1069 HydrophobicContact CD1-CG 3.59Å; I1065-E1069 HydrophobicContact CG2-CG 4.22Å; I1065-E1069 WeakPolarHBondContact O-CB 3.24Å; I1065-E1069 WeakPolarHBondContact O-CG 3.13Å; I1065-E1069 PolarHBondContact O-N 2.96Å; N1066-E1069 PolarHBondContact O-N 2.97Å; E1069-L1072 PolarHBondContact O-N 3.06Å; E1069-A1073 VanDerWaalsContact O-CB 3.31Å; E1069-A1073 WeakPolarHBondContact O-CB 3.27Å; E1069-A1073 PolarHBondContact O-N 3.49Å
1070	N	77.3	Confident	79.4	Confident	71 Å²	71	50.1 Å²	50.1	38%	0.38	26%	0.264	S	S	.	.	H	α-helix	trans	-63.5	-42.1	175.7	-71	-31.9	0	0	0	111.9	N1066 S1067 L1072 A1073 N1074	N1066-N1070 WeakPolarHBondContact O-CB 3.31Å; N1066-N1070 VanDerWaalsContact O-CG 3.25Å; N1066-N1070 PolarHBondContact O-N 3.12Å; N1066-N1070 PolarHBondContact O-ND2 2.94Å; N1066-N1070 VanDerWaalsContact O-ND2 3.1Å; N1066-N1070 PolarHBondContact OD1-ND2 3.28Å; S1067-N1070 PolarHBondContact O-N 3.33Å; N1070-L1072 PolarHBondContact O-N 3.35Å; N1070-A1073 PolarHBondContact O-N 2.62Å; N1070-N1074 WeakPolarHBondContact O-CB 3.27Å; N1070-N1074 PolarHBondContact O-N 3.23Å; N1070-N1074 PolarHBondContact O-ND2 3.44Å
1071	N	80	Confident	79.6	Confident	73 Å²	73	55.5 Å²	55.5	39%	0.39	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-39.5	175.5	-74.3	-43.9	0	0	0	112.3	W638 S1067 I1068 Y1075	W638-N1071 HydrophobicContact CH2-CB 3.9Å; W638-N1071 HydrophobicContact CZ2-CB 4.08Å; S1067-N1071 WeakPolarHBondContact O-CB 3.26Å; S1067-N1071 VanDerWaalsContact O-CG 3.25Å; S1067-N1071 PolarHBondContact O-N 3.31Å; S1067-N1071 PolarHBondContact O-ND2 3.17Å; I1068-N1071 PolarHBondContact O-N 3.1Å; N1071-Y1075 PolarHBondContact O-N 2.97Å
1072	L	81.4	Confident	79.8	Confident	26 Å²	26	56 Å²	56	14%	0.136	30%	0.296	C	S	.	.	H	α-helix	trans	-71.1	-32.9	175.2	-73.5	171.5	0	0	0	112.5	W638 E639 K642 R643 L646 I1068 E1069 N1070 Y1075	W638-L1072 HydrophobicContact CH2-CD2 4.4Å; W638-L1072 HydrophobicContact CZ3-CD2 3.98Å; E639-L1072 HydrophobicContact CG-CD2 3.8Å; K642-L1072 HydrophobicContact CB-CD2 4.26Å; R643-L1072 HydrophobicContact CG-CD1 4.26Å; L646-L1072 HydrophobicContact CD1-CD1 4.16Å; I1068-L1072 HydrophobicContact CG2-CD1 3.83Å; I1068-L1072 HydrophobicContact CG2-CG 4.3Å; I1068-L1072 WeakPolarHBondContact O-CB 3.49Å; I1068-L1072 VanDerWaalsContact O-CG 3.31Å; I1068-L1072 WeakPolarHBondContact O-CG 3.43Å; I1068-L1072 PolarHBondContact O-N 3.02Å; E1069-L1072 PolarHBondContact O-N 3.06Å; N1070-L1072 PolarHBondContact O-N 3.35Å; L1072-Y1075 WeakPolarHBondContact O-CB 3.19Å
1073	A	73.9	Confident	80.2	Confident	79 Å²	79	54.1 Å²	54.1	65%	0.653	29%	0.287	S	S	*	.	H	α-helix	trans	-71.7	-36.4	177.8	0	0	0	0	0	112.3	E1069 N1070 Y1075	E1069-A1073 VanDerWaalsContact O-CB 3.31Å; E1069-A1073 WeakPolarHBondContact O-CB 3.27Å; E1069-A1073 PolarHBondContact O-N 3.49Å; N1070-A1073 PolarHBondContact O-N 2.62Å; A1073-Y1075 VanDerWaalsContact C-N 3.28Å
1074	N	70.8	Confident	80.8	Confident	128 Å²	128	55.8 Å²	55.8	68%	0.684	30%	0.299	S	S	*	.	S	Bend	trans	-81.6	-5.8	177	-69.8	-23.6	0	0	0	113.5	N1070 Q1076	N1070-N1074 WeakPolarHBondContact O-CB 3.27Å; N1070-N1074 PolarHBondContact O-N 3.23Å; N1070-N1074 PolarHBondContact O-ND2 3.44Å; N1074-Q1076 PolarHBondContact O-N 3.17Å
1075	Y	68.4	Low	81.2	Confident	60 Å²	60	56 Å²	56	24%	0.235	30%	0.302	C	S	.	.			trans	-65.6	119.4	179.2	177.6	-110.1	0	0	0	111.2	E632 S635 W638 N1071 L1072 A1073 L1077	E632-Y1075 PolarHBondContact OE2-OH 3.48Å; S635-Y1075 WeakPolarHBondContact CB-OH 3.29Å; W638-Y1075 HydrophobicContact CZ3-CD2 4.32Å; N1071-Y1075 PolarHBondContact O-N 2.97Å; L1072-Y1075 WeakPolarHBondContact O-CB 3.19Å; A1073-Y1075 VanDerWaalsContact C-N 3.28Å; Y1075-L1077 HydrophobicContact CE1-CD2 4.36Å
1076	Q	70.8	Confident	81.5	Confident	139 Å²	139	56.5 Å²	56.5	65%	0.65	30%	0.303	S	S	*	.			trans	-123.6	141.6	174.6	-65.4	-176.3	-8.4	0	0	109.6	N1074	N1074-Q1076 PolarHBondContact O-N 3.17Å
1077	L	76.3	Confident	82	Confident	24 Å²	24	54.9 Å²	54.9	13%	0.126	29%	0.294	C	S	.	.			trans	-61.9	139.3	172.3	-58.4	171.8	0	0	0	109.1	M626 K627 E632 Y1075 L1079 S1080	M626-L1077 HydrophobicContact CB-CD1 4.26Å; M626-L1077 HydrophobicContact CE-CD1 4.33Å; K627-L1077 HydrophobicContact CG-CD1 3.99Å; K627-L1077 HydrophobicContact CG-CD2 3.98Å; E632-L1077 HydrophobicContact CG-CD2 4.08Å; E632-L1077 WeakPolarHBondContact OE1-CA 3.26Å; Y1075-L1077 HydrophobicContact CE1-CD2 4.36Å; L1077-L1079 PolarHBondContact O-N 3.38Å; L1077-S1080 WeakPolarHBondContact O-CB 2.99Å; L1077-S1080 PolarHBondContact O-N 3.25Å; L1077-S1080 PolarHBondContact O-OG 3.39Å
1078	Q	79.4	Confident	82.5	Confident	126 Å²	126	55.1 Å²	55.1	59%	0.589	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-37.1	179.4	-62.8	-175.8	-7.2	0	0	111.8	E632	E632-Q1078 WeakPolarHBondContact OE1-CB 3.4Å; E632-Q1078 PolarHBondContact OE1-N 2.98Å
1079	L	82.6	Confident	82.9	Confident	26 Å²	26	55.1 Å²	55.1	14%	0.136	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	8.3	179.1	-67.5	175.3	0	0	0	114.9	F604 V606 M626 M631 L1077 N1081 E1082 Y1083	F604-L1079 HydrophobicContact CD1-CD1 3.53Å; F604-L1079 HydrophobicContact CE1-CD1 3.98Å; V606-L1079 HydrophobicContact CG2-CB 4.1Å; V606-L1079 HydrophobicContact CG2-CD1 4.05Å; M626-L1079 HydrophobicContact CE-CB 3.62Å; M626-L1079 WeakPolarHBondContact CE-O 3.36Å; M631-L1079 HydrophobicContact CE-CD1 3.17Å; M631-L1079 HydrophobicContact CE-CD2 3.85Å; M631-L1079 HydrophobicContact CE-CG 3.26Å; L1077-L1079 PolarHBondContact O-N 3.38Å; L1079-N1081 PolarHBondContact O-N 3.44Å; L1079-E1082 HydrophobicContact CD2-CB 4.38Å; L1079-E1082 HydrophobicContact CD2-CG 4.46Å; L1079-E1082 PolarHBondContact O-N 2.89Å; L1079-Y1083 WeakPolarHBondContact O-CB 3.35Å; L1079-Y1083 PolarHBondContact O-N 3.2Å
1080	S	83	Confident	83.3	Confident	26 Å²	26	50.9 Å²	50.9	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-62	-43.4	-177.3	56.7	0	0	0	0	112.9	L1077 Y1083 T1084	L1077-S1080 WeakPolarHBondContact O-CB 2.99Å; L1077-S1080 PolarHBondContact O-N 3.25Å; L1077-S1080 PolarHBondContact O-OG 3.39Å; S1080-Y1083 PolarHBondContact O-N 3.21Å; S1080-T1084 WeakPolarHBondContact O-CB 3.41Å; S1080-T1084 VanDerWaalsContact O-CG2 3.31Å; S1080-T1084 WeakPolarHBondContact O-CG2 3.44Å; S1080-T1084 PolarHBondContact O-N 3.37Å; S1080-T1084 PolarHBondContact O-OG1 3.47Å
1081	N	86.4	Confident	84	Confident	114 Å²	114	50.3 Å²	50.3	61%	0.61	27%	0.27	S	S	*	.	H	α-helix	trans	-62.2	-44.5	176.3	-69	-21.2	0	0	0	111.5	L1079 Y1083 T1084 G1085	L1079-N1081 PolarHBondContact O-N 3.44Å; N1081-Y1083 PolarHBondContact O-N 3.34Å; N1081-T1084 WeakPolarHBondContact CA-OG1 3.37Å; N1081-T1084 PolarHBondContact O-N 3.22Å; N1081-T1084 PolarHBondContact O-OG1 3Å; N1081-G1085 PolarHBondContact O-N 3.36Å
1082	E	88.3	Confident	84.5	Confident	17 Å²	17	54.3 Å²	54.3	8%	0.079	28%	0.284	C	S	.	.	H	α-helix	trans	-67	-38	-178.3	-173.9	66.8	-174.3	0	0	111.7	L1079 R1086 T1216	L1079-E1082 HydrophobicContact CD2-CB 4.38Å; L1079-E1082 HydrophobicContact CD2-CG 4.46Å; L1079-E1082 PolarHBondContact O-N 2.89Å; E1082-R1086 PolarHBondContact O-N 3Å; E1082-R1086 IonicContact OE1-CZ 3.27Å; E1082-R1086 IonicContact OE1-NH1 3.92Å; E1082-R1086 PolarHBondContact OE1-NH1 3.46Å; E1082-R1086 IonicContact OE1-NH2 3.21Å; E1082-R1086 PolarHBondContact OE1-NH2 3.09Å; E1082-T1216 PolarHBondContact OE1-N 2.87Å; E1082-T1216 PolarHBondContact OE1-OG1 3.36Å; E1082-T1216 PolarHBondContact OE2-N 2.91Å; E1082-T1216 PolarHBondContact OE2-OG1 3.17Å
1083	Y	90.4	Very high	85	Confident	15 Å²	15	54.7 Å²	54.7	6%	0.059	29%	0.286	C	S	.	.	H	α-helix	trans	-67.3	-48.8	172.2	171	-106.8	0	0	0	112.6	V606 I611 P622 Q623 M626 L1079 S1080 N1081 G1085 R1086 L1087	V606-Y1083 HydrophobicContact CG1-CD2 4.24Å; I611-Y1083 HydrophobicContact CD1-CD2 4.03Å; I611-Y1083 HydrophobicContact CD1-CE2 4.25Å; I611-Y1083 HydrophobicContact CG1-CD2 4.15Å; I611-Y1083 HydrophobicContact CG1-CE2 4.11Å; P622-Y1083 HydrophobicContact CB-CD2 4.33Å; P622-Y1083 HydrophobicContact CB-CE2 3.63Å; P622-Y1083 HydrophobicContact CG-CE2 4.17Å; Q623-Y1083 HydrophobicContact CG-CE1 4.09Å; M626-Y1083 HydrophobicContact CE-CG 4.28Å; M626-Y1083 HydrophobicContact SD-CD2 4.08Å; M626-Y1083 HydrophobicContact SD-CG 3.95Å; L1079-Y1083 WeakPolarHBondContact O-CB 3.35Å; L1079-Y1083 PolarHBondContact O-N 3.2Å; S1080-Y1083 PolarHBondContact O-N 3.21Å; N1081-Y1083 PolarHBondContact O-N 3.34Å; Y1083-G1085 VanDerWaalsContact C-N 3.32Å; Y1083-G1085 PolarHBondContact O-N 2.56Å; Y1083-R1086 PolarHBondContact O-N 3.43Å; Y1083-L1087 HydrophobicContact CE1-CD2 4.38Å; Y1083-L1087 WeakPolarHBondContact O-CB 3.32Å; Y1083-L1087 PolarHBondContact O-N 2.81Å
1084	T	90.1	Very high	85.8	Confident	71 Å²	71	52.6 Å²	52.6	44%	0.436	27%	0.271	S	S	.	.	H	α-helix	trans	-65.8	-36	-179	53	0	0	0	0	111.9	S1080 N1081 S1088	S1080-T1084 WeakPolarHBondContact O-CB 3.41Å; S1080-T1084 VanDerWaalsContact O-CG2 3.31Å; S1080-T1084 WeakPolarHBondContact O-CG2 3.44Å; S1080-T1084 PolarHBondContact O-N 3.37Å; S1080-T1084 PolarHBondContact O-OG1 3.47Å; N1081-T1084 WeakPolarHBondContact CA-OG1 3.37Å; N1081-T1084 PolarHBondContact O-N 3.22Å; N1081-T1084 PolarHBondContact O-OG1 3Å; T1084-S1088 WeakPolarHBondContact O-CB 3.4Å; T1084-S1088 PolarHBondContact O-N 3.45Å; T1084-S1088 PolarHBondContact O-OG 2.87Å
1085	G	91.2	Very high	86.9	Confident	5 Å²	5	46.5 Å²	46.5	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-60.9	-50.8	172.4	0	0	0	0	0	112.3	N1081 Y1083 L1087 S1088 V1089	N1081-G1085 PolarHBondContact O-N 3.36Å; Y1083-G1085 VanDerWaalsContact C-N 3.32Å; Y1083-G1085 PolarHBondContact O-N 2.56Å; G1085-L1087 VanDerWaalsContact C-N 3.35Å; G1085-L1087 PolarHBondContact O-N 2.89Å; G1085-S1088 WeakPolarHBondContact O-CB 3.49Å; G1085-S1088 PolarHBondContact O-N 3.18Å; G1085-S1088 VanDerWaalsContact O-N 3.14Å; G1085-V1089 PolarHBondContact O-N 3.29Å
1086	R	92.4	Very high	87.9	Confident	21 Å²	21	43.7 Å²	43.7	8%	0.079	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-40.6	178.8	-78.2	-164.4	-179.4	77.4	5.9	112	V606 Y608 I611 E1082 Y1083 S1088 V1089 L1090 L1215	V606-R1086 PolarHBondContact O-NE 2.86Å; V606-R1086 VanDerWaalsContact O-NE 3.16Å; V606-R1086 PolarHBondContact O-NH1 3.37Å; V606-R1086 PolarHBondContact O-NH2 3.04Å; Y608-R1086 HydrophobicContact CD1-CB 4.13Å; Y608-R1086 HydrophobicContact CD1-CG 4.28Å; Y608-R1086 HydrophobicContact CE1-CB 3.65Å; Y608-R1086 HydrophobicContact CE1-CG 3.72Å; I611-R1086 HydrophobicContact CD1-CB 3.66Å; E1082-R1086 PolarHBondContact O-N 3Å; E1082-R1086 IonicContact OE1-CZ 3.27Å; E1082-R1086 IonicContact OE1-NH1 3.92Å; E1082-R1086 PolarHBondContact OE1-NH1 3.46Å; E1082-R1086 IonicContact OE1-NH2 3.21Å; E1082-R1086 PolarHBondContact OE1-NH2 3.09Å; Y1083-R1086 PolarHBondContact O-N 3.43Å; R1086-S1088 VanDerWaalsContact C-N 3.26Å; R1086-S1088 PolarHBondContact O-N 2.88Å; R1086-V1089 PolarHBondContact O-N 2.85Å; R1086-L1090 WeakPolarHBondContact O-CG 3.25Å; R1086-L1090 PolarHBondContact O-N 3.31Å; R1086-L1215 HydrophobicContact CG-CD1 3.78Å; R1086-L1215 HydrophobicContact CG-CD2 3.87Å
1087	L	90.7	Very high	88.4	Confident	9 Å²	9	39.9 Å²	39.9	5%	0.047	21%	0.212	C	C	.	.	H	α-helix	trans	-60.7	-38.3	175.6	-170.4	71.9	0	0	0	111.4	I611 Y1083 G1085 L1090 K1091 I1096 Y1103	I611-L1087 HydrophobicContact CG2-CD1 4.39Å; Y1083-L1087 HydrophobicContact CE1-CD2 4.38Å; Y1083-L1087 WeakPolarHBondContact O-CB 3.32Å; Y1083-L1087 PolarHBondContact O-N 2.81Å; G1085-L1087 VanDerWaalsContact C-N 3.35Å; G1085-L1087 PolarHBondContact O-N 2.89Å; L1087-L1090 PolarHBondContact O-N 3.27Å; L1087-K1091 HydrophobicContact CG-CD 4.39Å; L1087-K1091 WeakPolarHBondContact O-CB 3.38Å; L1087-K1091 VanDerWaalsContact O-CG 3.22Å; L1087-K1091 WeakPolarHBondContact O-CG 3.36Å; L1087-K1091 PolarHBondContact O-N 3.07Å; L1087-I1096 HydrophobicContact CD1-CD1 3.54Å; L1087-Y1103 HydrophobicContact CD2-CE1 4.26Å
1088	S	91.1	Very high	88.1	Confident	38 Å²	38	43.4 Å²	43.4	27%	0.266	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-40	176.7	-58.1	0	0	0	0	112.3	T1084 G1085 R1086 K1091 K1092 H1213	T1084-S1088 WeakPolarHBondContact O-CB 3.4Å; T1084-S1088 PolarHBondContact O-N 3.45Å; T1084-S1088 PolarHBondContact O-OG 2.87Å; G1085-S1088 WeakPolarHBondContact O-CB 3.49Å; G1085-S1088 PolarHBondContact O-N 3.18Å; G1085-S1088 VanDerWaalsContact O-N 3.14Å; R1086-S1088 VanDerWaalsContact C-N 3.26Å; R1086-S1088 PolarHBondContact O-N 2.88Å; S1088-K1091 PolarHBondContact O-N 3.28Å; S1088-K1092 WeakPolarHBondContact O-CB 3.48Å; S1088-K1092 PolarHBondContact O-N 2.82Å; S1088-H1213 WeakPolarHBondContact CB-CE1 3.39Å
1089	V	92.5	Very high	87.2	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.4	-49.3	172.8	176.3	0	0	0	0	110.9	Y608 G1085 R1086 K1091 K1092 L1093 L1206 L1209 Q1210 H1213 L1215	Y608-V1089 HydrophobicContact CE1-CB 4.33Å; Y608-V1089 HydrophobicContact CE1-CG1 4.37Å; Y608-V1089 WeakPolarHBondContact OH-CG1 3.32Å; G1085-V1089 PolarHBondContact O-N 3.29Å; R1086-V1089 PolarHBondContact O-N 2.85Å; V1089-K1091 VanDerWaalsContact C-N 3.31Å; V1089-K1091 PolarHBondContact O-N 3.43Å; V1089-K1092 PolarHBondContact O-N 3.23Å; V1089-L1093 HydrophobicContact CG1-CD1 3.7Å; V1089-L1093 HydrophobicContact CG1-CG 4.4Å; V1089-L1093 WeakPolarHBondContact O-CB 3.27Å; V1089-L1093 WeakPolarHBondContact O-CG 3.32Å; V1089-L1093 PolarHBondContact O-N 2.92Å; V1089-L1206 HydrophobicContact CG1-CD1 3.99Å; V1089-L1209 HydrophobicContact CG1-CB 4.49Å; V1089-L1209 HydrophobicContact CG2-CB 4.42Å; V1089-Q1210 HydrophobicContact CG2-CG 4.44Å; V1089-H1213 HydrophobicContact CG2-CB 4.4Å; V1089-L1215 HydrophobicContact CG2-CD1 4.27Å
1090	L	93.1	Very high	85.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.3	-39.8	178.6	-70.9	177.6	0	0	0	112.5	Y608 I611 L612 R1086 L1087 G1094 F1095 I1096 V1120	Y608-L1090 HydrophobicContact CD1-CD1 3.93Å; Y608-L1090 HydrophobicContact CD1-CD2 3.67Å; Y608-L1090 HydrophobicContact CD1-CG 3.68Å; Y608-L1090 HydrophobicContact CE1-CD2 4.12Å; Y608-L1090 HydrophobicContact CE1-CG 3.93Å; Y608-L1090 HydrophobicContact CG-CD2 4.43Å; I611-L1090 HydrophobicContact CB-CD1 4.27Å; I611-L1090 HydrophobicContact CG2-CD1 3.83Å; L612-L1090 HydrophobicContact CD2-CD1 4.13Å; L612-L1090 HydrophobicContact CD2-CD2 4.38Å; L612-L1090 HydrophobicContact CG-CD1 4.31Å; R1086-L1090 WeakPolarHBondContact O-CG 3.25Å; R1086-L1090 PolarHBondContact O-N 3.31Å; L1087-L1090 PolarHBondContact O-N 3.27Å; L1090-G1094 PolarHBondContact O-N 3.17Å; L1090-G1094 VanDerWaalsContact O-N 3.16Å; L1090-F1095 HydrophobicContact CB-CB 4.2Å; L1090-F1095 HydrophobicContact CD2-CB 3.87Å; L1090-F1095 HydrophobicContact CD2-CD1 4.47Å; L1090-F1095 HydrophobicContact CD2-CD2 4.31Å; L1090-F1095 HydrophobicContact CD2-CG 3.98Å; L1090-F1095 PolarHBondContact O-N 3.3Å; L1090-I1096 HydrophobicContact CB-CD1 3.89Å; L1090-I1096 HydrophobicContact CB-CG1 4.25Å; L1090-I1096 HydrophobicContact CD1-CD1 3.8Å; L1090-V1120 HydrophobicContact CD2-CG2 3.88Å
1091	K	90.7	Very high	84.6	Confident	60 Å²	60	50.7 Å²	50.7	26%	0.261	29%	0.289	S	S	.	.	H	α-helix	trans	-63	-48.8	173.8	-75.4	167.6	177.7	177	0	111.7	L1087 S1088 V1089 L1093 G1094 Y1103	L1087-K1091 HydrophobicContact CG-CD 4.39Å; L1087-K1091 WeakPolarHBondContact O-CB 3.38Å; L1087-K1091 VanDerWaalsContact O-CG 3.22Å; L1087-K1091 WeakPolarHBondContact O-CG 3.36Å; L1087-K1091 PolarHBondContact O-N 3.07Å; S1088-K1091 PolarHBondContact O-N 3.28Å; V1089-K1091 VanDerWaalsContact C-N 3.31Å; V1089-K1091 PolarHBondContact O-N 3.43Å; K1091-L1093 PolarHBondContact O-N 3.41Å; K1091-G1094 PolarHBondContact O-N 3.03Å; K1091-G1094 VanDerWaalsContact O-N 3.08Å; K1091-Y1103 PolarHBondContact NZ-OH 3.34Å
1092	K	91.4	Very high	83.4	Confident	157 Å²	157	48.4 Å²	48.4	68%	0.683	28%	0.282	S	S	*	.	H	α-helix	trans	-63.3	-33.6	-177.2	-170.5	62.9	174.8	-178.1	0	112.3	S1088 V1089 L1209	S1088-K1092 WeakPolarHBondContact O-CB 3.48Å; S1088-K1092 PolarHBondContact O-N 2.82Å; V1089-K1092 PolarHBondContact O-N 3.23Å; K1092-L1209 HydrophobicContact CG-CD1 4.45Å; K1092-L1209 HydrophobicContact CG-CD2 4.04Å
1093	L	92.3	Very high	82.5	Confident	34 Å²	34	52.2 Å²	52.2	18%	0.178	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-2.1	178	-64.2	175.7	0	0	0	113.9	V1089 K1091 F1095 V1120 Q1124 L1206 L1209	V1089-L1093 HydrophobicContact CG1-CD1 3.7Å; V1089-L1093 HydrophobicContact CG1-CG 4.4Å; V1089-L1093 WeakPolarHBondContact O-CB 3.27Å; V1089-L1093 WeakPolarHBondContact O-CG 3.32Å; V1089-L1093 PolarHBondContact O-N 2.92Å; K1091-L1093 PolarHBondContact O-N 3.41Å; L1093-F1095 HydrophobicContact CB-CD2 3.62Å; L1093-F1095 HydrophobicContact CB-CE2 3.69Å; L1093-F1095 HydrophobicContact CD1-CE2 4.33Å; L1093-V1120 HydrophobicContact CD1-CG1 3.59Å; L1093-Q1124 VanDerWaalsContact CD1-NE2 3.34Å; L1093-L1206 HydrophobicContact CD1-CD1 3.91Å; L1093-L1209 HydrophobicContact CD1-CD1 4.32Å; L1093-L1209 HydrophobicContact CD2-CD1 3.47Å; L1093-L1209 VanDerWaalsContact CD2-CD1 3.47Å; L1093-L1209 HydrophobicContact CG-CD1 3.88Å
1094	G	90.7	Very high	82.2	Confident	34 Å²	34	54.6 Å²	54.6	35%	0.351	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.1	25.5	176	0	0	0	0	0	115.2	L1090 K1091 S1106	L1090-G1094 PolarHBondContact O-N 3.17Å; L1090-G1094 VanDerWaalsContact O-N 3.16Å; K1091-G1094 PolarHBondContact O-N 3.03Å; K1091-G1094 VanDerWaalsContact O-N 3.08Å; G1094-S1106 WeakPolarHBondContact O-CB 3.4Å; G1094-S1106 PolarHBondContact O-OG 2.94Å
1095	F	92.9	Very high	82.1	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-79.8	-25.1	172.7	-73.6	-102.4	0	0	0	112.6	L612 L1090 L1093 S1106 K1108 G1109 A1112 V1120 T1123 Q1124	L612-F1095 HydrophobicContact CD2-CB 4.43Å; L1090-F1095 HydrophobicContact CB-CB 4.2Å; L1090-F1095 HydrophobicContact CD2-CB 3.87Å; L1090-F1095 HydrophobicContact CD2-CD1 4.47Å; L1090-F1095 HydrophobicContact CD2-CD2 4.31Å; L1090-F1095 HydrophobicContact CD2-CG 3.98Å; L1090-F1095 PolarHBondContact O-N 3.3Å; L1093-F1095 HydrophobicContact CB-CD2 3.62Å; L1093-F1095 HydrophobicContact CB-CE2 3.69Å; L1093-F1095 HydrophobicContact CD1-CE2 4.33Å; F1095-S1106 VanDerWaalsContact C-OG 3.3Å; F1095-S1106 WeakPolarHBondContact CA-OG 3.25Å; F1095-S1106 PolarHBondContact O-N 3.39Å; F1095-S1106 PolarHBondContact O-OG 2.75Å; F1095-S1106 VanDerWaalsContact O-OG 3.13Å; F1095-K1108 HydrophobicContact CD1-CB 3.88Å; F1095-K1108 WeakPolarHBondContact CD1-O 3.33Å; F1095-K1108 HydrophobicContact CE1-CB 4.05Å; F1095-K1108 HydrophobicContact CG-CB 4.11Å; F1095-K1108 HydrophobicContact CZ-CB 4.44Å; F1095-G1109 VanDerWaalsContact O-CA 3.31Å; F1095-G1109 WeakPolarHBondContact O-CA 3.45Å; F1095-G1109 PolarHBondContact O-N 3.03Å; F1095-A1112 HydrophobicContact CD1-CB 3.9Å; F1095-A1112 HydrophobicContact CE1-CB 3.77Å; F1095-V1120 HydrophobicContact CE2-CG1 3.82Å; F1095-V1120 HydrophobicContact CZ-CB 4.32Å; F1095-V1120 HydrophobicContact CZ-CG1 3.88Å; F1095-V1120 WeakPolarHBondContact CZ-O 3.49Å; F1095-T1123 HydrophobicContact CE1-CG2 3.63Å; F1095-T1123 HydrophobicContact CZ-CG2 3.98Å; F1095-Q1124 HydrophobicContact CE2-CG 4.48Å; F1095-Q1124 HydrophobicContact CZ-CG 4.4Å
1096	I	88.8	Confident	82.1	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-125.9	133	177.3	-62.6	172.5	0	0	0	107	I611 L1087 L1090 S1098 Y1103 C1104 L1105	I611-I1096 HydrophobicContact CG2-CD1 4.44Å; L1087-I1096 HydrophobicContact CD1-CD1 3.54Å; L1090-I1096 HydrophobicContact CB-CD1 3.89Å; L1090-I1096 HydrophobicContact CB-CG1 4.25Å; L1090-I1096 HydrophobicContact CD1-CD1 3.8Å; I1096-S1098 PolarHBondContact O-N 3.47Å; I1096-Y1103 HydrophobicContact CG2-CD1 4.22Å; I1096-C1104 WeakPolarHBondContact CA-O 3.3Å; I1096-L1105 HydrophobicContact CG1-CD2 4.38Å
1097	D	81.3	Confident	82	Confident	58 Å²	58	57.5 Å²	57.5	31%	0.31	32%	0.324	S	S	.	.			trans	-68.3	128.3	-179.8	179.8	24.9	0	0	0	111.1	A1099 T1100 C1104	D1097-A1099 WeakPolarHBondContact OD1-CB 3.47Å; D1097-A1099 PolarHBondContact OD1-N 3.19Å; D1097-T1100 WeakPolarHBondContact OD2-CG2 3.32Å; D1097-T1100 PolarHBondContact OD2-OG1 3.2Å; D1097-C1104 PolarHBondContact N-O 3.45Å
1098	S	70.1	Confident	82.1	Confident	98 Å²	98	60 Å²	60	69%	0.685	34%	0.335	S	S	*	.	S	Bend	trans	-83.6	-20.9	175.2	53.3	0	0	0	0	113.2	I1096	I1096-S1098 PolarHBondContact O-N 3.47Å
1099	A	60.2	Low	82.1	Confident	84 Å²	84	58.2 Å²	58.2	69%	0.694	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-30.4	-168.4	0	0	0	0	0	113.5	D1097	D1097-A1099 WeakPolarHBondContact OD1-CB 3.47Å; D1097-A1099 PolarHBondContact OD1-N 3.19Å
1100	T	54.8	Low	82	Confident	75 Å²	75	62.4 Å²	62.4	46%	0.46	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-1.7	-166.4	41.6	0	0	0	0	115	D1097 S1102	D1097-T1100 WeakPolarHBondContact OD2-CG2 3.32Å; D1097-T1100 PolarHBondContact OD2-OG1 3.2Å; T1100-S1102 WeakPolarHBondContact CB-OG 3.44Å; T1100-S1102 PolarHBondContact O-N 2.67Å; T1100-S1102 PolarHBondContact OG1-OG 2.88Å
1101	Q	57.5	Low	82	Confident	173 Å²	173	62.7 Å²	62.7	81%	0.808	34%	0.342	S	S	*	.	S	Bend	trans	50.5	-4.2	-167.3	-71.1	-162.8	-11.8	0	0	115.4	Y1103	Q1101-Y1103 VanDerWaalsContact C-N 3.34Å
1102	S	60.2	Low	82.1	Confident	65 Å²	65	59.9 Å²	59.9	46%	0.455	33%	0.33	S	S	.	.	S	Bend	trans	-89	0.5	-173.4	57.6	0	0	0	0	113.3	T1100 C1104	T1100-S1102 WeakPolarHBondContact CB-OG 3.44Å; T1100-S1102 PolarHBondContact O-N 2.67Å; T1100-S1102 PolarHBondContact OG1-OG 2.88Å; S1102-C1104 PolarHBondContact O-N 3.29Å; S1102-C1104 VanDerWaalsContact O-N 3.15Å; S1102-C1104 PolarHBondContact OG-SG 3.04Å
1103	Y	70.2	Confident	82.1	Confident	98 Å²	98	52.9 Å²	52.9	38%	0.384	30%	0.301	S	S	.	.			trans	50.6	35.6	-178.1	-58.4	-55.3	0	0	0	113.6	H615 L1087 K1091 I1096 Q1101	H615-Y1103 PolarHBondContact CD2-O 3.2Å; L1087-Y1103 HydrophobicContact CD2-CE1 4.26Å; K1091-Y1103 PolarHBondContact NZ-OH 3.34Å; I1096-Y1103 HydrophobicContact CG2-CD1 4.22Å; Q1101-Y1103 VanDerWaalsContact C-N 3.34Å
1104	C	83	Confident	81.8	Confident	64 Å²	64	53.3 Å²	53.3	43%	0.432	30%	0.302	S	S	.	.			trans	-67.1	143.9	176.8	-67.4	0	0	0	0	111.1	I1096 D1097 S1102	I1096-C1104 WeakPolarHBondContact CA-O 3.3Å; D1097-C1104 PolarHBondContact N-O 3.45Å; S1102-C1104 PolarHBondContact O-N 3.29Å; S1102-C1104 VanDerWaalsContact O-N 3.15Å; S1102-C1104 PolarHBondContact OG-SG 3.04Å
1105	L	88.3	Confident	81.7	Confident	17 Å²	17	51.9 Å²	51.9	9%	0.089	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-65.7	133	173.6	-65.7	175.9	0	0	0	110.5	L612 H615 R616 I1096 F1110	L612-L1105 HydrophobicContact CD2-CD2 3.63Å; H615-L1105 HydrophobicContact CB-CD1 4.48Å; H615-L1105 HydrophobicContact CB-CD2 3.97Å; H615-L1105 HydrophobicContact CB-CG 4.03Å; R616-L1105 HydrophobicContact CB-CD1 3.76Å; R616-L1105 HydrophobicContact CG-CD1 4.12Å; I1096-L1105 HydrophobicContact CG1-CD2 4.38Å; L1105-F1110 HydrophobicContact CB-CD2 3.88Å; L1105-F1110 HydrophobicContact CB-CE2 3.73Å; L1105-F1110 HydrophobicContact CB-CG 4.33Å; L1105-F1110 HydrophobicContact CB-CZ 4.07Å; L1105-F1110 HydrophobicContact CD1-CD1 4.22Å; L1105-F1110 HydrophobicContact CD1-CE1 4.13Å; L1105-F1110 HydrophobicContact CD1-CZ 4.4Å; L1105-F1110 WeakPolarHBondContact O-CE2 3.45Å
1106	S	90.8	Very high	81.1	Confident	29 Å²	29	54.8 Å²	54.8	20%	0.203	30%	0.304	C	S	.	.			trans	-79.3	177.2	167.8	80.2	0	0	0	0	110.5	G1094 F1095 K1108 G1109 F1110	G1094-S1106 WeakPolarHBondContact O-CB 3.4Å; G1094-S1106 PolarHBondContact O-OG 2.94Å; F1095-S1106 VanDerWaalsContact C-OG 3.3Å; F1095-S1106 WeakPolarHBondContact CA-OG 3.25Å; F1095-S1106 PolarHBondContact O-N 3.39Å; F1095-S1106 PolarHBondContact O-OG 2.75Å; F1095-S1106 VanDerWaalsContact O-OG 3.13Å; S1106-K1108 PolarHBondContact O-N 3.39Å; S1106-K1108 PolarHBondContact OG-N 3.2Å; S1106-G1109 WeakPolarHBondContact O-CA 3.44Å; S1106-G1109 PolarHBondContact O-N 2.88Å; S1106-G1109 PolarHBondContact OG-N 3.45Å; S1106-F1110 VanDerWaalsContact O-CD2 3.29Å; S1106-F1110 WeakPolarHBondContact O-CD2 3.22Å; S1106-F1110 PolarHBondContact O-N 3.06Å
1107	F	90.7	Very high	80.8	Confident	113 Å²	113	56 Å²	56	50%	0.496	31%	0.313	S	S	.	.	H	α-helix	trans	-53.3	-42.1	170.4	-179.9	-93.1	0	0	0	112.5	G1109 F1110 F1111 L1127 F1276	F1107-G1109 VanDerWaalsContact C-N 3.31Å; F1107-G1109 PolarHBondContact O-N 3Å; F1107-F1110 PolarHBondContact O-N 2.7Å; F1107-F1111 WeakPolarHBondContact O-CB 3.5Å; F1107-F1111 PolarHBondContact O-N 3.14Å; F1107-L1127 HydrophobicContact CD1-CD1 4.26Å; F1107-L1127 HydrophobicContact CE1-CD1 4.22Å; F1107-L1127 HydrophobicContact CE1-CD2 3.79Å; F1107-F1276 AromaticContact CD2-CD1 3.98Å; F1107-F1276 HydrophobicContact CD2-CD1 3.98Å; F1107-F1276 HydrophobicContact CD2-CE1 4.49Å; F1107-F1276 HydrophobicContact CE2-CB 3.9Å; F1107-F1276 AromaticContact CE2-CD1 3.44Å; F1107-F1276 HydrophobicContact CE2-CD1 3.44Å; F1107-F1276 VanDerWaalsContact CE2-CD1 3.44Å; F1107-F1276 HydrophobicContact CE2-CE1 4.35Å; F1107-F1276 AromaticContact CE2-CG 3.98Å; F1107-F1276 HydrophobicContact CE2-CG 3.98Å; F1107-F1276 HydrophobicContact CZ-CB 3.73Å; F1107-F1276 AromaticContact CZ-CD1 3.98Å; F1107-F1276 HydrophobicContact CZ-CD1 3.98Å; F1107-F1276 HydrophobicContact CZ-CG 4.07Å
1108	K	92.9	Very high	81	Confident	62 Å²	62	54 Å²	54	27%	0.27	30%	0.301	S	S	.	.	H	α-helix	trans	-61.7	-40.8	174.6	-61	-160.9	173.4	-171.1	0	111.2	F1095 S1106 F1111 A1112 T1123 L1127	F1095-K1108 HydrophobicContact CD1-CB 3.88Å; F1095-K1108 WeakPolarHBondContact CD1-O 3.33Å; F1095-K1108 HydrophobicContact CE1-CB 4.05Å; F1095-K1108 HydrophobicContact CG-CB 4.11Å; F1095-K1108 HydrophobicContact CZ-CB 4.44Å; S1106-K1108 PolarHBondContact O-N 3.39Å; S1106-K1108 PolarHBondContact OG-N 3.2Å; K1108-F1111 PolarHBondContact O-N 3.33Å; K1108-A1112 WeakPolarHBondContact O-CB 3.48Å; K1108-A1112 PolarHBondContact O-N 2.92Å; K1108-T1123 HydrophobicContact CB-CG2 4.15Å; K1108-L1127 HydrophobicContact CB-CD1 4.32Å; K1108-L1127 HydrophobicContact CD-CD1 4.28Å; K1108-L1127 HydrophobicContact CG-CD1 3.68Å
1109	G	92	Very high	82	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-45.6	176.3	0	0	0	0	0	113.1	F1095 S1106 F1107 A1112 C1113	F1095-G1109 VanDerWaalsContact O-CA 3.31Å; F1095-G1109 WeakPolarHBondContact O-CA 3.45Å; F1095-G1109 PolarHBondContact O-N 3.03Å; S1106-G1109 WeakPolarHBondContact O-CA 3.44Å; S1106-G1109 PolarHBondContact O-N 2.88Å; S1106-G1109 PolarHBondContact OG-N 3.45Å; F1107-G1109 VanDerWaalsContact C-N 3.31Å; F1107-G1109 PolarHBondContact O-N 3Å; G1109-A1112 PolarHBondContact O-N 2.76Å; G1109-C1113 PolarHBondContact O-N 2.93Å; G1109-C1113 VanDerWaalsContact O-N 3.17Å; G1109-C1113 PolarHBondContact O-SG 3.38Å
1110	F	90.4	Very high	83.5	Confident	88 Å²	88	45.6 Å²	45.6	39%	0.386	24%	0.237	S	C	.	.	H	α-helix	trans	-65.6	-41.8	176.1	-79.7	-72.1	0	0	0	112.4	R616 L1105 S1106 F1107 A1112 C1113 F1276	R616-F1110 HydrophobicContact CG-CD1 4.37Å; R616-F1110 HydrophobicContact CG-CE1 3.98Å; L1105-F1110 HydrophobicContact CB-CD2 3.88Å; L1105-F1110 HydrophobicContact CB-CE2 3.73Å; L1105-F1110 HydrophobicContact CB-CG 4.33Å; L1105-F1110 HydrophobicContact CB-CZ 4.07Å; L1105-F1110 HydrophobicContact CD1-CD1 4.22Å; L1105-F1110 HydrophobicContact CD1-CE1 4.13Å; L1105-F1110 HydrophobicContact CD1-CZ 4.4Å; L1105-F1110 WeakPolarHBondContact O-CE2 3.45Å; S1106-F1110 VanDerWaalsContact O-CD2 3.29Å; S1106-F1110 WeakPolarHBondContact O-CD2 3.22Å; S1106-F1110 PolarHBondContact O-N 3.06Å; F1107-F1110 PolarHBondContact O-N 2.7Å; F1110-A1112 VanDerWaalsContact C-N 3.32Å; F1110-A1112 PolarHBondContact O-N 2.97Å; F1110-C1113 WeakPolarHBondContact O-CB 3.34Å; F1110-C1113 PolarHBondContact O-N 3.41Å; F1110-F1276 VanDerWaalsContact C-CZ 3.45Å; F1110-F1276 HydrophobicContact CB-CE1 3.76Å; F1110-F1276 HydrophobicContact CB-CZ 3.66Å
1111	F	92.6	Very high	85.3	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-59.8	-44.2	175.3	-167.3	-80.3	0	0	0	111.6	F1107 K1108 C1113 E1114 L1115 T1123 L1126 L1127 A1272 F1276	F1107-F1111 WeakPolarHBondContact O-CB 3.5Å; F1107-F1111 PolarHBondContact O-N 3.14Å; K1108-F1111 PolarHBondContact O-N 3.33Å; F1111-C1113 VanDerWaalsContact C-N 3.29Å; F1111-C1113 PolarHBondContact O-N 2.87Å; F1111-E1114 PolarHBondContact O-N 2.93Å; F1111-L1115 HydrophobicContact CD1-CD1 4.33Å; F1111-L1115 HydrophobicContact CE1-CD1 4.18Å; F1111-T1123 HydrophobicContact CB-CG2 4.16Å; F1111-T1123 HydrophobicContact CD1-CG2 3.82Å; F1111-T1123 HydrophobicContact CG-CG2 4.29Å; F1111-L1126 HydrophobicContact CE1-CB 4.29Å; F1111-L1126 HydrophobicContact CE1-CD1 3.64Å; F1111-L1126 HydrophobicContact CZ-CB 4.32Å; F1111-L1126 HydrophobicContact CZ-CD1 3.95Å; F1111-L1127 HydrophobicContact CD2-CD2 4.3Å; F1111-L1127 HydrophobicContact CE2-CD2 4.45Å; F1111-A1272 HydrophobicContact CD2-CB 4.34Å; F1111-A1272 HydrophobicContact CE1-CB 4.19Å; F1111-A1272 HydrophobicContact CE2-CB 3.9Å; F1111-A1272 HydrophobicContact CZ-CB 3.81Å; F1111-F1276 VanDerWaalsContact CA-CE2 3.5Å; F1111-F1276 HydrophobicContact CB-CD2 4.27Å; F1111-F1276 HydrophobicContact CB-CE2 4.15Å; F1111-F1276 HydrophobicContact CD2-CB 4.24Å; F1111-F1276 AromaticContact CD2-CD2 3.42Å; F1111-F1276 HydrophobicContact CD2-CD2 3.42Å; F1111-F1276 VanDerWaalsContact CD2-CD2 3.42Å; F1111-F1276 HydrophobicContact CD2-CE2 4.07Å; F1111-F1276 AromaticContact CD2-CG 3.97Å; F1111-F1276 HydrophobicContact CD2-CG 3.97Å; F1111-F1276 HydrophobicContact CE2-CD2 4.1Å; F1111-F1276 HydrophobicContact CG-CD2 4.18Å; F1111-F1276 HydrophobicContact CG-CE2 4.41Å
1112	A	93	Very high	87	Confident	1 Å²	1	34 Å²	34	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-27.3	179	0	0	0	0	0	114	L612 F1095 K1108 G1109 F1110 E1114 L1115 E1119 T1123	L612-A1112 HydrophobicContact CD1-CB 3.59Å; F1095-A1112 HydrophobicContact CD1-CB 3.9Å; F1095-A1112 HydrophobicContact CE1-CB 3.77Å; K1108-A1112 WeakPolarHBondContact O-CB 3.48Å; K1108-A1112 PolarHBondContact O-N 2.92Å; G1109-A1112 PolarHBondContact O-N 2.76Å; F1110-A1112 VanDerWaalsContact C-N 3.32Å; F1110-A1112 PolarHBondContact O-N 2.97Å; A1112-E1114 PolarHBondContact O-N 3.07Å; A1112-L1115 PolarHBondContact O-N 3.03Å; A1112-L1115 VanDerWaalsContact O-N 3.17Å; A1112-E1119 HydrophobicContact CB-CB 4.19Å; A1112-T1123 WeakPolarHBondContact CA-OG1 3.41Å; A1112-T1123 WeakPolarHBondContact CB-OG1 3.34Å
1113	C	90.6	Very high	88.6	Confident	10 Å²	10	30.9 Å²	30.9	7%	0.068	16%	0.156	C	C	.	.	H	α-helix	trans	-63.3	-27.3	175.4	-66.8	0	0	0	0	112.7	G1109 F1110 F1111 L1115	G1109-C1113 PolarHBondContact O-N 2.93Å; G1109-C1113 VanDerWaalsContact O-N 3.17Å; G1109-C1113 PolarHBondContact O-SG 3.38Å; F1110-C1113 WeakPolarHBondContact O-CB 3.34Å; F1110-C1113 PolarHBondContact O-N 3.41Å; F1111-C1113 VanDerWaalsContact C-N 3.29Å; F1111-C1113 PolarHBondContact O-N 2.87Å; C1113-L1115 VanDerWaalsContact C-N 3.28Å
1114	E	87.4	Confident	89.6	Confident	43 Å²	43	27 Å²	27	20%	0.201	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-8.4	179.4	-59.4	-55.4	141.1	0	0	112.7	R616 F1111 A1112 A1272 Q1275 F1276	R616-E1114 IonicContact NH1-OE1 3.04Å; R616-E1114 PolarHBondContact NH1-OE1 3.23Å; F1111-E1114 PolarHBondContact O-N 2.93Å; A1112-E1114 PolarHBondContact O-N 3.07Å; E1114-A1272 HydrophobicContact CB-CB 3.73Å; E1114-A1272 HydrophobicContact CG-CB 4.38Å; E1114-Q1275 VanDerWaalsContact CD-OE1 3.3Å; E1114-F1276 HydrophobicContact CG-CE2 4.02Å
1115	L	88.8	Confident	89.9	Confident	3 Å²	3	24.4 Å²	24.4	2%	0.016	12%	0.123	C	C	.	.			trans	-97.5	142.5	178.7	-57.8	-178.4	0	0	0	111.2	F1111 A1112 C1113 E1119 L1122 T1123 I1269	F1111-L1115 HydrophobicContact CD1-CD1 4.33Å; F1111-L1115 HydrophobicContact CE1-CD1 4.18Å; A1112-L1115 PolarHBondContact O-N 3.03Å; A1112-L1115 VanDerWaalsContact O-N 3.17Å; C1113-L1115 VanDerWaalsContact C-N 3.28Å; L1115-E1119 HydrophobicContact CB-CB 3.82Å; L1115-E1119 HydrophobicContact CD1-CB 4.45Å; L1115-L1122 HydrophobicContact CD1-CB 3.77Å; L1115-T1123 WeakPolarHBondContact CD1-OG1 3.16Å; L1115-I1269 HydrophobicContact CD2-CG1 3.74Å
1116	T	79	Confident	90	Very high	61 Å²	61	24 Å²	24	37%	0.374	12%	0.121	S	C	.	.	S	Bend	trans	-96.6	-18.5	-176.4	47.8	0	0	0	0	115	H1268	T1116-H1268 WeakPolarHBondContact CG2-CE1 3.36Å; T1116-H1268 VanDerWaalsContact CG2-ND1 3.27Å; T1116-H1268 WeakPolarHBondContact CG2-ND1 3.41Å; T1116-H1268 PolarHBondContact OG1-ND1 2.75Å
1117	S	82.2	Confident	90	Very high	29 Å²	29	25.5 Å²	25.5	20%	0.203	13%	0.126	C	C	.	.	S	Bend	trans	-152.5	141.8	-174.2	59.8	0	0	0	0	110.6	E1119 L1122	S1117-E1119 PolarHBondContact O-N 3.36Å; S1117-E1119 VanDerWaalsContact O-N 3.17Å; S1117-L1122 WeakPolarHBondContact O-CD1 3.29Å
1118	K	86.8	Confident	89.9	Confident	14 Å²	14	24 Å²	24	6%	0.061	12%	0.123	C	C	.	.	S	Bend	trans	51.7	35.3	179.2	-61.2	175.7	-175	155.4	0	111.9	V1120 L1121 L1122 F1146 N1148 R1223	K1118-V1120 VanDerWaalsContact C-N 3.26Å; K1118-V1120 PolarHBondContact O-N 3.35Å; K1118-L1121 PolarHBondContact O-N 2.97Å; K1118-L1121 VanDerWaalsContact O-N 3.16Å; K1118-L1122 HydrophobicContact CB-CD1 4.4Å; K1118-L1122 HydrophobicContact CB-CG 4.4Å; K1118-L1122 WeakPolarHBondContact O-CB 3.34Å; K1118-L1122 PolarHBondContact O-N 3.15Å; K1118-F1146 HydrophobicContact CD-CB 4.15Å; K1118-F1146 HydrophobicContact CD-CD1 4.01Å; K1118-F1146 PolarHBondContact NZ-O 3.21Å; K1118-N1148 PolarHBondContact NZ-O 3.3Å; K1118-R1223 WeakPolarHBondContact CE-O 3.48Å; K1118-R1223 PolarHBondContact NZ-O 2.75Å
1119	E	90.6	Very high	89.6	Confident	6 Å²	6	22.1 Å²	22.1	3%	0.028	12%	0.122	C	C	.	.	H	α-helix	trans	-58.5	-36.4	-169.6	55.7	-84.3	-165.3	0	0	112.4	Y608 S609 L612 A1112 L1115 S1117 T1123	Y608-E1119 VanDerWaalsContact CB-OE1 3.25Å; Y608-E1119 WeakPolarHBondContact CB-OE1 3.39Å; S609-E1119 WeakPolarHBondContact CA-OE1 3.11Å; S609-E1119 WeakPolarHBondContact CB-OE1 3.26Å; S609-E1119 PolarHBondContact N-OE1 3.03Å; L612-E1119 HydrophobicContact CD1-CG 4.18Å; A1112-E1119 HydrophobicContact CB-CB 4.19Å; L1115-E1119 HydrophobicContact CB-CB 3.82Å; L1115-E1119 HydrophobicContact CD1-CB 4.45Å; S1117-E1119 PolarHBondContact O-N 3.36Å; S1117-E1119 VanDerWaalsContact O-N 3.17Å; E1119-T1123 WeakPolarHBondContact O-CB 3.49Å; E1119-T1123 PolarHBondContact O-N 3.06Å; E1119-T1123 PolarHBondContact O-OG1 3.03Å
1120	V	92.9	Very high	89.4	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-68.3	-49.8	177.9	-179.6	0	0	0	0	110.8	Y608 L1090 L1093 F1095 K1118 Q1124 L1206	Y608-V1120 HydrophobicContact CD1-CG2 4.09Å; Y608-V1120 HydrophobicContact CD2-CG2 3.74Å; Y608-V1120 HydrophobicContact CE2-CG2 4.25Å; Y608-V1120 HydrophobicContact CG-CG2 3.65Å; L1090-V1120 HydrophobicContact CD2-CG2 3.88Å; L1093-V1120 HydrophobicContact CD1-CG1 3.59Å; F1095-V1120 HydrophobicContact CE2-CG1 3.82Å; F1095-V1120 HydrophobicContact CZ-CB 4.32Å; F1095-V1120 HydrophobicContact CZ-CG1 3.88Å; F1095-V1120 WeakPolarHBondContact CZ-O 3.49Å; K1118-V1120 VanDerWaalsContact C-N 3.26Å; K1118-V1120 PolarHBondContact O-N 3.35Å; V1120-Q1124 WeakPolarHBondContact O-CG 3.4Å; V1120-Q1124 PolarHBondContact O-N 3.13Å; V1120-L1206 HydrophobicContact CG1-CD1 3.89Å; V1120-L1206 HydrophobicContact CG1-CD2 4.39Å
1121	L	92.1	Very high	89.3	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-68.1	-47.1	-177.6	-178.8	58.7	0	0	0	111.5	K1118 T1123 Q1124 L1125 F1146 C1202 A1203 L1206 L1224	K1118-L1121 PolarHBondContact O-N 2.97Å; K1118-L1121 VanDerWaalsContact O-N 3.16Å; L1121-T1123 PolarHBondContact O-N 3.13Å; L1121-Q1124 PolarHBondContact O-N 3.14Å; L1121-L1125 HydrophobicContact CD1-CD1 4.28Å; L1121-L1125 HydrophobicContact CD1-CG 4.47Å; L1121-L1125 HydrophobicContact CG-CD1 4.11Å; L1121-L1125 WeakPolarHBondContact O-CG 3.49Å; L1121-L1125 PolarHBondContact O-N 2.84Å; L1121-L1125 VanDerWaalsContact O-N 3.09Å; L1121-F1146 HydrophobicContact CD2-CD1 4.28Å; L1121-F1146 HydrophobicContact CD2-CE1 3.73Å; L1121-F1146 HydrophobicContact CG-CE1 4.02Å; L1121-C1202 HydrophobicContact CD1-CB 3.61Å; L1121-A1203 HydrophobicContact CD1-CB 4.28Å; L1121-A1203 HydrophobicContact CD2-CB 4.08Å; L1121-L1206 HydrophobicContact CB-CD2 4.09Å; L1121-L1224 HydrophobicContact CD2-CD2 4.37Å
1122	L	92.5	Very high	89.1	Confident	2 Å²	2	23.8 Å²	23.8	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-63.2	-40.8	178.5	-77.8	174.1	0	0	0	112.1	L1115 S1117 K1118 Q1124 L1125 L1126 L1143 F1146 L1265	L1115-L1122 HydrophobicContact CD1-CB 3.77Å; S1117-L1122 WeakPolarHBondContact O-CD1 3.29Å; K1118-L1122 HydrophobicContact CB-CD1 4.4Å; K1118-L1122 HydrophobicContact CB-CG 4.4Å; K1118-L1122 WeakPolarHBondContact O-CB 3.34Å; K1118-L1122 PolarHBondContact O-N 3.15Å; L1122-Q1124 VanDerWaalsContact C-N 3.3Å; L1122-Q1124 PolarHBondContact O-N 3.32Å; L1122-L1125 PolarHBondContact O-N 3.49Å; L1122-L1126 HydrophobicContact CB-CD1 4.42Å; L1122-L1126 VanDerWaalsContact O-CB 3.31Å; L1122-L1126 WeakPolarHBondContact O-CB 3.34Å; L1122-L1126 WeakPolarHBondContact O-CD1 3.4Å; L1122-L1126 WeakPolarHBondContact O-CG 3.41Å; L1122-L1126 PolarHBondContact O-N 3.27Å; L1122-L1143 HydrophobicContact CD2-CD2 4.29Å; L1122-F1146 HydrophobicContact CD1-CB 4.43Å; L1122-F1146 HydrophobicContact CD2-CB 4.08Å; L1122-F1146 HydrophobicContact CD2-CD1 3.7Å; L1122-F1146 HydrophobicContact CD2-CD2 3.88Å; L1122-F1146 HydrophobicContact CD2-CE1 4.09Å; L1122-F1146 HydrophobicContact CD2-CE2 4.26Å; L1122-F1146 HydrophobicContact CD2-CG 3.59Å; L1122-F1146 HydrophobicContact CD2-CZ 4.36Å; L1122-F1146 HydrophobicContact CG-CB 4.49Å; L1122-F1146 HydrophobicContact CG-CD1 4.06Å; L1122-F1146 HydrophobicContact CG-CG 4.26Å; L1122-L1265 HydrophobicContact CD1-CD1 3.67Å; L1122-L1265 HydrophobicContact CD1-CD2 4.24Å; L1122-L1265 HydrophobicContact CD1-CG 4.44Å
1123	T	93.8	Very high	88.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-38.3	177.3	-60.7	0	0	0	0	111.7	F1095 K1108 F1111 A1112 L1115 E1119 L1121 L1127	F1095-T1123 HydrophobicContact CE1-CG2 3.63Å; F1095-T1123 HydrophobicContact CZ-CG2 3.98Å; K1108-T1123 HydrophobicContact CB-CG2 4.15Å; F1111-T1123 HydrophobicContact CB-CG2 4.16Å; F1111-T1123 HydrophobicContact CD1-CG2 3.82Å; F1111-T1123 HydrophobicContact CG-CG2 4.29Å; A1112-T1123 WeakPolarHBondContact CA-OG1 3.41Å; A1112-T1123 WeakPolarHBondContact CB-OG1 3.34Å; L1115-T1123 WeakPolarHBondContact CD1-OG1 3.16Å; E1119-T1123 WeakPolarHBondContact O-CB 3.49Å; E1119-T1123 PolarHBondContact O-N 3.06Å; E1119-T1123 PolarHBondContact O-OG1 3.03Å; L1121-T1123 PolarHBondContact O-N 3.13Å; T1123-L1127 HydrophobicContact CG2-CD1 3.59Å; T1123-L1127 HydrophobicContact CG2-CG 4.18Å; T1123-L1127 VanDerWaalsContact O-CB 3.3Å; T1123-L1127 WeakPolarHBondContact O-CB 3.36Å; T1123-L1127 WeakPolarHBondContact O-CG 3.31Å; T1123-L1127 PolarHBondContact O-N 2.87Å; T1123-L1127 VanDerWaalsContact O-N 3.1Å
1124	Q	91.1	Very high	88.9	Confident	18 Å²	18	31.9 Å²	31.9	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-61.6	-52.3	173.4	-72.1	-179.1	3.3	0	0	111	L1093 F1095 V1120 L1121 L1122 L1126 L1127 D1128	L1093-Q1124 VanDerWaalsContact CD1-NE2 3.34Å; F1095-Q1124 HydrophobicContact CE2-CG 4.48Å; F1095-Q1124 HydrophobicContact CZ-CG 4.4Å; V1120-Q1124 WeakPolarHBondContact O-CG 3.4Å; V1120-Q1124 PolarHBondContact O-N 3.13Å; L1121-Q1124 PolarHBondContact O-N 3.14Å; L1122-Q1124 VanDerWaalsContact C-N 3.3Å; L1122-Q1124 PolarHBondContact O-N 3.32Å; Q1124-L1126 VanDerWaalsContact C-N 3.31Å; Q1124-L1126 PolarHBondContact O-N 3.45Å; Q1124-L1127 PolarHBondContact O-N 3.46Å; Q1124-D1128 WeakPolarHBondContact O-CB 3.42Å; Q1124-D1128 PolarHBondContact O-N 3.02Å
1125	L	89.6	Confident	89.3	Confident	8 Å²	8	35.6 Å²	35.6	4%	0.042	20%	0.195	C	C	.	.	H	α-helix	trans	-61.8	-38.6	-175.9	-66	170.1	0	0	0	113.4	L1121 L1122 F1130 F1146 V1199 C1202	L1121-L1125 HydrophobicContact CD1-CD1 4.28Å; L1121-L1125 HydrophobicContact CD1-CG 4.47Å; L1121-L1125 HydrophobicContact CG-CD1 4.11Å; L1121-L1125 WeakPolarHBondContact O-CG 3.49Å; L1121-L1125 PolarHBondContact O-N 2.84Å; L1121-L1125 VanDerWaalsContact O-N 3.09Å; L1122-L1125 PolarHBondContact O-N 3.49Å; L1125-F1130 HydrophobicContact CD2-CD2 3.76Å; L1125-F1130 HydrophobicContact CD2-CE2 4.17Å; L1125-F1146 HydrophobicContact CD1-CE1 3.55Å; L1125-F1146 HydrophobicContact CD1-CE2 4.23Å; L1125-F1146 HydrophobicContact CD1-CZ 3.23Å; L1125-V1199 HydrophobicContact CD1-CG1 4.39Å; L1125-V1199 HydrophobicContact CD1-CG2 4.11Å; L1125-V1199 HydrophobicContact CD2-CB 4.48Å; L1125-V1199 HydrophobicContact CD2-CG2 4.04Å; L1125-C1202 HydrophobicContact CD2-CB 3.94Å
1126	L	91	Very high	89.5	Confident	9 Å²	9	35.7 Å²	35.7	5%	0.047	20%	0.196	C	C	.	.	H	α-helix	trans	-73.2	-37.8	-180	-69.1	167.3	0	0	0	112.3	F1111 L1122 Q1124 I1131 I1269 L1281	F1111-L1126 HydrophobicContact CE1-CB 4.29Å; F1111-L1126 HydrophobicContact CE1-CD1 3.64Å; F1111-L1126 HydrophobicContact CZ-CB 4.32Å; F1111-L1126 HydrophobicContact CZ-CD1 3.95Å; L1122-L1126 HydrophobicContact CB-CD1 4.42Å; L1122-L1126 VanDerWaalsContact O-CB 3.31Å; L1122-L1126 WeakPolarHBondContact O-CB 3.34Å; L1122-L1126 WeakPolarHBondContact O-CD1 3.4Å; L1122-L1126 WeakPolarHBondContact O-CG 3.41Å; L1122-L1126 PolarHBondContact O-N 3.27Å; Q1124-L1126 VanDerWaalsContact C-N 3.31Å; Q1124-L1126 PolarHBondContact O-N 3.45Å; L1126-I1131 HydrophobicContact CD2-CD1 3.34Å; L1126-I1131 HydrophobicContact CD2-CG1 4.15Å; L1126-I1269 HydrophobicContact CD1-CD1 4.36Å; L1126-I1269 HydrophobicContact CD1-CG1 4.12Å; L1126-I1269 HydrophobicContact CD1-CG2 3.63Å; L1126-I1269 HydrophobicContact CD2-CG2 3.83Å; L1126-I1269 HydrophobicContact CG-CG2 4.41Å; L1126-L1281 HydrophobicContact CD2-CD2 4.41Å
1127	L	90.2	Very high	90.3	Very high	60 Å²	60	34 Å²	34	31%	0.314	19%	0.186	S	C	.	.	H	α-helix	trans	-83.2	-22.6	-178.4	-64.8	-178.4	0	0	0	113.5	F1107 K1108 F1111 T1123 Q1124 G1129	F1107-L1127 HydrophobicContact CD1-CD1 4.26Å; F1107-L1127 HydrophobicContact CE1-CD1 4.22Å; F1107-L1127 HydrophobicContact CE1-CD2 3.79Å; K1108-L1127 HydrophobicContact CB-CD1 4.32Å; K1108-L1127 HydrophobicContact CD-CD1 4.28Å; K1108-L1127 HydrophobicContact CG-CD1 3.68Å; F1111-L1127 HydrophobicContact CD2-CD2 4.3Å; F1111-L1127 HydrophobicContact CE2-CD2 4.45Å; T1123-L1127 HydrophobicContact CG2-CD1 3.59Å; T1123-L1127 HydrophobicContact CG2-CG 4.18Å; T1123-L1127 VanDerWaalsContact O-CB 3.3Å; T1123-L1127 WeakPolarHBondContact O-CB 3.36Å; T1123-L1127 WeakPolarHBondContact O-CG 3.31Å; T1123-L1127 PolarHBondContact O-N 2.87Å; T1123-L1127 VanDerWaalsContact O-N 3.1Å; Q1124-L1127 PolarHBondContact O-N 3.46Å; L1127-G1129 PolarHBondContact O-N 2.95Å
1128	D	88.1	Confident	90.9	Very high	81 Å²	81	33.1 Å²	33.1	43%	0.433	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-2.5	174.4	-65.2	-15	0	0	0	112.3	Q1124 F1130	Q1124-D1128 WeakPolarHBondContact O-CB 3.42Å; Q1124-D1128 PolarHBondContact O-N 3.02Å; D1128-F1130 HydrophobicContact CB-CD2 3.79Å; D1128-F1130 HydrophobicContact CB-CE1 4.36Å; D1128-F1130 HydrophobicContact CB-CE2 3.39Å; D1128-F1130 HydrophobicContact CB-CG 4.43Å; D1128-F1130 HydrophobicContact CB-CZ 3.72Å; D1128-F1130 PolarHBondContact O-N 3.47Å
1129	G	88.2	Confident	91.3	Very high	24 Å²	24	32.4 Å²	32.4	25%	0.247	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	13.9	173	0	0	0	0	0	115.3	L1127 I1131 D1132	L1127-G1129 PolarHBondContact O-N 2.95Å; G1129-I1131 PolarHBondContact O-N 3.3Å; G1129-I1131 VanDerWaalsContact O-N 3.09Å; G1129-D1132 PolarHBondContact O-N 3.4Å
1130	F	86.4	Confident	91.5	Very high	64 Å²	64	32.1 Å²	32.1	28%	0.281	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.1	-173.3	-63.9	-49.9	0	0	0	115.3	L1125 D1128 N1198	L1125-F1130 HydrophobicContact CD2-CD2 3.76Å; L1125-F1130 HydrophobicContact CD2-CE2 4.17Å; D1128-F1130 HydrophobicContact CB-CD2 3.79Å; D1128-F1130 HydrophobicContact CB-CE1 4.36Å; D1128-F1130 HydrophobicContact CB-CE2 3.39Å; D1128-F1130 HydrophobicContact CB-CG 4.43Å; D1128-F1130 HydrophobicContact CB-CZ 3.72Å; D1128-F1130 PolarHBondContact O-N 3.47Å; F1130-N1198 HydrophobicContact CD1-CB 4.01Å; F1130-N1198 VanDerWaalsContact CD1-ND2 3.32Å; F1130-N1198 WeakPolarHBondContact CD1-ND2 3.39Å; F1130-N1198 HydrophobicContact CD2-CB 4.22Å; F1130-N1198 HydrophobicContact CE1-CB 4.01Å; F1130-N1198 HydrophobicContact CE2-CB 4.23Å; F1130-N1198 HydrophobicContact CG-CB 4.12Å; F1130-N1198 HydrophobicContact CZ-CB 4.13Å
1131	I	88.6	Confident	91.6	Very high	8 Å²	8	32.1 Å²	32.1	4%	0.041	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-1.7	-179	66.3	163.4	0	0	0	113.3	L1126 G1129 D1133 L1134 V1142 L1281 I1285	L1126-I1131 HydrophobicContact CD2-CD1 3.34Å; L1126-I1131 HydrophobicContact CD2-CG1 4.15Å; G1129-I1131 PolarHBondContact O-N 3.3Å; G1129-I1131 VanDerWaalsContact O-N 3.09Å; I1131-D1133 VanDerWaalsContact C-N 3.28Å; I1131-D1133 PolarHBondContact O-N 3.16Å; I1131-L1134 HydrophobicContact CB-CD1 4.11Å; I1131-L1134 HydrophobicContact CG2-CD1 4.09Å; I1131-L1134 WeakPolarHBondContact O-CB 3.35Å; I1131-L1134 PolarHBondContact O-N 2.91Å; I1131-V1142 HydrophobicContact CG2-CG1 4.43Å; I1131-L1281 HydrophobicContact CD1-CD1 4Å; I1131-L1281 HydrophobicContact CG1-CD1 4.09Å; I1131-I1285 HydrophobicContact CD1-CD1 4.47Å
1132	D	87.7	Confident	91.6	Very high	56 Å²	56	32.1 Å²	32.1	30%	0.299	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-33.7	-170.4	-73	-3.5	0	0	0	112.3	G1129 K1284	G1129-D1132 PolarHBondContact O-N 3.4Å; D1132-K1284 PolarHBondContact O-NZ 3.13Å
1133	D	88.9	Confident	91.7	Very high	158 Å²	158	32.2 Å²	32.2	85%	0.845	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.1	-178.9	-66.4	-35.7	0	0	0	114.1	I1131	I1131-D1133 VanDerWaalsContact C-N 3.28Å; I1131-D1133 PolarHBondContact O-N 3.16Å
1134	L	92.3	Very high	91.6	Very high	24 Å²	24	32.3 Å²	32.3	13%	0.126	18%	0.176	C	C	.	.			trans	-76.2	151.2	-177.8	-66.1	-178.9	0	0	0	112.4	I1131 D1138 I1139 V1142 V1195	I1131-L1134 HydrophobicContact CB-CD1 4.11Å; I1131-L1134 HydrophobicContact CG2-CD1 4.09Å; I1131-L1134 WeakPolarHBondContact O-CB 3.35Å; I1131-L1134 PolarHBondContact O-N 2.91Å; L1134-D1138 HydrophobicContact CB-CB 4.05Å; L1134-D1138 HydrophobicContact CD1-CB 4.48Å; L1134-D1138 HydrophobicContact CD2-CB 4.22Å; L1134-D1138 HydrophobicContact CG-CB 4.49Å; L1134-I1139 HydrophobicContact CB-CD1 4.42Å; L1134-I1139 HydrophobicContact CB-CG1 3.66Å; L1134-V1142 HydrophobicContact CD1-CG2 4.06Å; L1134-V1195 HydrophobicContact CD1-CG1 4.3Å; L1134-V1195 HydrophobicContact CD1-CG2 4.17Å; L1134-V1195 HydrophobicContact CD2-CG2 4.03Å; L1134-V1195 HydrophobicContact CG-CG2 4.47Å
1135	L	93.9	Very high	91.6	Very high	121 Å²	121	31.4 Å²	31.4	63%	0.634	17%	0.172	S	C	*	.			trans	-75.7	156.7	170.4	-60.5	175.4	0	0	0	110.4	P1137 D1138 I1139	L1135-P1137 VanDerWaalsContact C-CD 3.47Å; L1135-D1138 WeakPolarHBondContact O-CA 3.5Å; L1135-D1138 WeakPolarHBondContact O-CB 3.39Å; L1135-D1138 PolarHBondContact O-N 2.95Å; L1135-I1139 WeakPolarHBondContact O-CG1 3.35Å; L1135-I1139 PolarHBondContact O-N 3.35Å
1136	A	94.7	Very high	91.6	Very high	5 Å²	5	31.2 Å²	31.2	4%	0.041	17%	0.171	C	C	.	.	H	α-helix	trans	-52.2	-42	-180	0	0	0	0	0	114.8	D1138 I1139 A1140 E1287 A1288 L1291	A1136-D1138 VanDerWaalsContact C-N 3.31Å; A1136-D1138 PolarHBondContact O-N 3.24Å; A1136-I1139 PolarHBondContact O-N 3Å; A1136-A1140 WeakPolarHBondContact O-CB 3.32Å; A1136-A1140 PolarHBondContact O-N 2.97Å; A1136-E1287 HydrophobicContact CB-CB 3.99Å; A1136-E1287 HydrophobicContact CB-CG 3.69Å; A1136-A1288 HydrophobicContact CB-CB 4.2Å; A1136-A1288 VanDerWaalsContact O-CB 3.27Å; A1136-A1288 WeakPolarHBondContact O-CB 3.46Å; A1136-L1291 HydrophobicContact CB-CD1 3.8Å
1137	P	94.9	Very high	91.1	Very high	24 Å²	24	31.3 Å²	31.3	16%	0.156	17%	0.173	C	C	.	.	H	α-helix	trans	-65	-32.1	174.7	-19	30.7	0	0	0	114	L1135 A1141 Y1233 A1236 L1291	L1135-P1137 VanDerWaalsContact C-CD 3.47Å; P1137-A1141 WeakPolarHBondContact O-CB 3.1Å; P1137-A1141 PolarHBondContact O-N 3.14Å; P1137-A1141 VanDerWaalsContact O-N 3.1Å; P1137-Y1233 HydrophobicContact CB-CE2 4.4Å; P1137-A1236 HydrophobicContact CB-CB 3.93Å; P1137-L1291 HydrophobicContact CB-CD1 4.42Å; P1137-L1291 HydrophobicContact CG-CD1 3.78Å
1138	D	95.4	Very high	90.2	Very high	11 Å²	11	29.9 Å²	29.9	6%	0.059	17%	0.165	C	C	.	.	H	α-helix	trans	-73.9	-42.8	179.1	-65.8	-33.3	0	0	0	110.7	L1134 L1135 A1136 A1140 A1141 V1142 H1191 L1192 Y1233	L1134-D1138 HydrophobicContact CB-CB 4.05Å; L1134-D1138 HydrophobicContact CD1-CB 4.48Å; L1134-D1138 HydrophobicContact CD2-CB 4.22Å; L1134-D1138 HydrophobicContact CG-CB 4.49Å; L1135-D1138 WeakPolarHBondContact O-CA 3.5Å; L1135-D1138 WeakPolarHBondContact O-CB 3.39Å; L1135-D1138 PolarHBondContact O-N 2.95Å; A1136-D1138 VanDerWaalsContact C-N 3.31Å; A1136-D1138 PolarHBondContact O-N 3.24Å; D1138-A1140 VanDerWaalsContact C-N 3.35Å; D1138-A1140 PolarHBondContact O-N 3.26Å; D1138-A1141 PolarHBondContact O-N 2.89Å; D1138-V1142 WeakPolarHBondContact O-CG2 3.26Å; D1138-V1142 PolarHBondContact O-N 3.15Å; D1138-H1191 IonicContact OD1-CD2 3.9Å; D1138-H1191 IonicContact OD1-CE1 2.96Å; D1138-H1191 IonicContact OD1-NE2 3.63Å; D1138-H1191 PolarHBondContact OD1-NE2 3.37Å; D1138-H1191 IonicContact OD2-CD2 3.06Å; D1138-H1191 IonicContact OD2-NE2 2.57Å; D1138-L1192 HydrophobicContact CB-CD2 3.7Å; D1138-Y1233 WeakPolarHBondContact OD1-CE2 3.44Å
1139	I	94.8	Very high	89	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-57.3	-49.4	173.2	-65.6	171.8	0	0	0	110.1	L1134 L1135 A1136 A1141 V1142 L1143 K1284 I1285 A1288	L1134-I1139 HydrophobicContact CB-CD1 4.42Å; L1134-I1139 HydrophobicContact CB-CG1 3.66Å; L1135-I1139 WeakPolarHBondContact O-CG1 3.35Å; L1135-I1139 PolarHBondContact O-N 3.35Å; A1136-I1139 PolarHBondContact O-N 3Å; I1139-A1141 VanDerWaalsContact C-N 3.31Å; I1139-A1141 PolarHBondContact O-N 2.84Å; I1139-V1142 PolarHBondContact O-N 3.28Å; I1139-L1143 HydrophobicContact CG2-CD1 3.72Å; I1139-L1143 HydrophobicContact CG2-CG 4.24Å; I1139-L1143 WeakPolarHBondContact O-CB 3.14Å; I1139-L1143 WeakPolarHBondContact O-CG 3.42Å; I1139-L1143 PolarHBondContact O-N 3.18Å; I1139-K1284 HydrophobicContact CD1-CB 3.89Å; I1139-K1284 HydrophobicContact CD1-CD 4.43Å; I1139-I1285 HydrophobicContact CG2-CG1 4.2Å; I1139-A1288 HydrophobicContact CB-CB 4.32Å; I1139-A1288 HydrophobicContact CG2-CB 4.2Å
1140	A	94.7	Very high	87.7	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-54	-46.3	175.1	0	0	0	0	0	112.2	A1136 D1138 S1144 V1232 A1236 A1288 I1292	A1136-A1140 WeakPolarHBondContact O-CB 3.32Å; A1136-A1140 PolarHBondContact O-N 2.97Å; D1138-A1140 VanDerWaalsContact C-N 3.35Å; D1138-A1140 PolarHBondContact O-N 3.26Å; A1140-S1144 PolarHBondContact O-N 3.15Å; A1140-S1144 VanDerWaalsContact O-N 3.17Å; A1140-V1232 HydrophobicContact CB-CG1 4.15Å; A1140-V1232 WeakPolarHBondContact O-CG1 3.4Å; A1140-A1236 HydrophobicContact CB-CB 4.02Å; A1140-A1288 HydrophobicContact CB-CB 4.27Å; A1140-I1292 HydrophobicContact CB-CD1 3.48Å; A1140-I1292 VanDerWaalsContact CB-CD1 3.48Å; A1140-I1292 HydrophobicContact CB-CG1 3.98Å
1141	A	94.5	Very high	86.3	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.7	-45.8	179.9	0	0	0	0	0	112.4	P1137 D1138 I1139 S1144 L1192 V1229 Y1233	P1137-A1141 WeakPolarHBondContact O-CB 3.1Å; P1137-A1141 PolarHBondContact O-N 3.14Å; P1137-A1141 VanDerWaalsContact O-N 3.1Å; D1138-A1141 PolarHBondContact O-N 2.89Å; I1139-A1141 VanDerWaalsContact C-N 3.31Å; I1139-A1141 PolarHBondContact O-N 2.84Å; A1141-S1144 WeakPolarHBondContact O-CB 3.49Å; A1141-S1144 PolarHBondContact O-N 3.08Å; A1141-S1144 PolarHBondContact O-OG 3.36Å; A1141-L1192 HydrophobicContact CB-CD1 3.95Å; A1141-V1229 HydrophobicContact CB-CG1 4.24Å; A1141-Y1233 HydrophobicContact CB-CD2 4.08Å; A1141-Y1233 HydrophobicContact CB-CG 4.41Å
1142	V	93.2	Very high	84.4	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	20%	0.197	C	C	.	.	H	α-helix	trans	-64.9	-47.2	179.3	172.9	0	0	0	0	111	I1131 L1134 D1138 I1139 S1144 A1145 F1146 L1192 V1195 F1196	I1131-V1142 HydrophobicContact CG2-CG1 4.43Å; L1134-V1142 HydrophobicContact CD1-CG2 4.06Å; D1138-V1142 WeakPolarHBondContact O-CG2 3.26Å; D1138-V1142 PolarHBondContact O-N 3.15Å; I1139-V1142 PolarHBondContact O-N 3.28Å; V1142-S1144 PolarHBondContact O-N 2.81Å; V1142-A1145 WeakPolarHBondContact O-CB 3.44Å; V1142-A1145 PolarHBondContact O-N 3.4Å; V1142-F1146 HydrophobicContact CG1-CE2 4.42Å; V1142-F1146 WeakPolarHBondContact O-CE2 3.35Å; V1142-L1192 HydrophobicContact CG2-CD2 4.37Å; V1142-V1195 HydrophobicContact CG1-CG1 4.18Å; V1142-V1195 HydrophobicContact CG2-CG1 4.18Å; V1142-F1196 HydrophobicContact CG2-CE2 4.19Å
1143	L	93.4	Very high	82.5	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-25.3	180	-68.8	-179.9	0	0	0	112.8	L1122 I1139 A1145 F1146 A1147 L1262 I1266 I1269	L1122-L1143 HydrophobicContact CD2-CD2 4.29Å; I1139-L1143 HydrophobicContact CG2-CD1 3.72Å; I1139-L1143 HydrophobicContact CG2-CG 4.24Å; I1139-L1143 WeakPolarHBondContact O-CB 3.14Å; I1139-L1143 WeakPolarHBondContact O-CG 3.42Å; I1139-L1143 PolarHBondContact O-N 3.18Å; L1143-A1145 PolarHBondContact O-N 3.02Å; L1143-F1146 PolarHBondContact O-N 3.18Å; L1143-A1147 PolarHBondContact O-N 3.23Å; L1143-L1262 HydrophobicContact CB-CD1 3.74Å; L1143-I1266 HydrophobicContact CD1-CG1 3.89Å; L1143-I1269 HydrophobicContact CD1-CD1 4Å; L1143-I1269 HydrophobicContact CD2-CD1 3.77Å
1144	S	92.4	Very high	80.8	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.007	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-25.9	176.6	78.7	0	0	0	0	114.2	A1140 A1141 V1142 F1146 A1147 V1229	A1140-S1144 PolarHBondContact O-N 3.15Å; A1140-S1144 VanDerWaalsContact O-N 3.17Å; A1141-S1144 WeakPolarHBondContact O-CB 3.49Å; A1141-S1144 PolarHBondContact O-N 3.08Å; A1141-S1144 PolarHBondContact O-OG 3.36Å; V1142-S1144 PolarHBondContact O-N 2.81Å; S1144-F1146 PolarHBondContact O-N 3.43Å; S1144-A1147 PolarHBondContact O-N 2.99Å; S1144-V1229 WeakPolarHBondContact OG-CA 3.22Å
1145	A	90.3	Very high	79.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64	-22.7	175.7	0	0	0	0	0	112.7	V1142 L1143 F1196 D1225 L1226 V1229	V1142-A1145 WeakPolarHBondContact O-CB 3.44Å; V1142-A1145 PolarHBondContact O-N 3.4Å; L1143-A1145 PolarHBondContact O-N 3.02Å; A1145-F1196 HydrophobicContact CB-CE1 3.97Å; A1145-F1196 HydrophobicContact CB-CZ 4.35Å; A1145-D1225 PolarHBondContact O-N 2.91Å; A1145-L1226 HydrophobicContact CB-CD2 4.29Å; A1145-V1229 HydrophobicContact CB-CG2 4Å
1146	F	89.4	Confident	77.4	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-95.8	-27.3	-177.5	-56.8	-89.6	0	0	0	113	K1118 L1121 L1122 L1125 V1142 L1143 S1144 N1148 V1199 L1224 L1265	K1118-F1146 HydrophobicContact CD-CB 4.15Å; K1118-F1146 HydrophobicContact CD-CD1 4.01Å; K1118-F1146 PolarHBondContact NZ-O 3.21Å; L1121-F1146 HydrophobicContact CD2-CD1 4.28Å; L1121-F1146 HydrophobicContact CD2-CE1 3.73Å; L1121-F1146 HydrophobicContact CG-CE1 4.02Å; L1122-F1146 HydrophobicContact CD1-CB 4.43Å; L1122-F1146 HydrophobicContact CD2-CB 4.08Å; L1122-F1146 HydrophobicContact CD2-CD1 3.7Å; L1122-F1146 HydrophobicContact CD2-CD2 3.88Å; L1122-F1146 HydrophobicContact CD2-CE1 4.09Å; L1122-F1146 HydrophobicContact CD2-CE2 4.26Å; L1122-F1146 HydrophobicContact CD2-CG 3.59Å; L1122-F1146 HydrophobicContact CD2-CZ 4.36Å; L1122-F1146 HydrophobicContact CG-CB 4.49Å; L1122-F1146 HydrophobicContact CG-CD1 4.06Å; L1122-F1146 HydrophobicContact CG-CG 4.26Å; L1125-F1146 HydrophobicContact CD1-CE1 3.55Å; L1125-F1146 HydrophobicContact CD1-CE2 4.23Å; L1125-F1146 HydrophobicContact CD1-CZ 3.23Å; V1142-F1146 HydrophobicContact CG1-CE2 4.42Å; V1142-F1146 WeakPolarHBondContact O-CE2 3.35Å; L1143-F1146 PolarHBondContact O-N 3.18Å; S1144-F1146 PolarHBondContact O-N 3.43Å; F1146-N1148 PolarHBondContact O-N 3.37Å; F1146-V1199 HydrophobicContact CE1-CG1 4.29Å; F1146-V1199 HydrophobicContact CE2-CG1 4.48Å; F1146-V1199 HydrophobicContact CZ-CG1 3.62Å; F1146-V1199 HydrophobicContact CZ-CG2 4.24Å; F1146-L1224 HydrophobicContact CD1-CD2 3.81Å; F1146-L1224 HydrophobicContact CE1-CD2 3.58Å; F1146-L1224 HydrophobicContact CG-CD2 4.48Å; F1146-L1224 HydrophobicContact CZ-CD2 4.08Å; F1146-L1265 HydrophobicContact CB-CD2 3.95Å
1147	A	81.1	Confident	75.6	Confident	11 Å²	11	38.6 Å²	38.6	9%	0.091	21%	0.209	C	C	.	.	H	α-helix	trans	-66.9	-30.2	-170.8	0	0	0	0	0	114.6	L1143 S1144 Q1261 L1262 L1265	L1143-A1147 PolarHBondContact O-N 3.23Å; S1144-A1147 PolarHBondContact O-N 2.99Å; A1147-Q1261 HydrophobicContact CB-CB 4.35Å; A1147-L1262 HydrophobicContact CB-CB 3.83Å; A1147-L1262 HydrophobicContact CB-CD1 4.22Å; A1147-L1265 HydrophobicContact CB-CD2 4.41Å
1148	N	70.6	Confident	73.9	Confident	30 Å²	30	44.2 Å²	44.2	16%	0.16	23%	0.233	C	C	.	.			trans	-95.2	125.6	-176.3	-145.7	19.6	0	0	0	111.2	K1118 F1146 L1150 D1225 S1258	K1118-N1148 PolarHBondContact NZ-O 3.3Å; F1146-N1148 PolarHBondContact O-N 3.37Å; N1148-L1150 PolarHBondContact O-N 2.91Å; N1148-D1225 HydrophobicContact CB-CB 4.01Å; N1148-D1225 PolarHBondContact ND2-OD2 3.26Å; N1148-S1258 PolarHBondContact ND2-OG 3.32Å; N1148-S1258 PolarHBondContact OD1-OG 3.27Å
1149	E	64.1	Low	72.2	Confident	132 Å²	132	45.9 Å²	45.9	62%	0.617	24%	0.24	S	C	*	.			trans	-80	101.1	165.8	-72	179.5	174.5	0	0	108.2	R1151	E1149-R1151 PolarHBondContact O-N 3.12Å; E1149-R1151 VanDerWaalsContact O-N 3.09Å
1150	L	60.4	Low	70.4	Confident	16 Å²	16	48.5 Å²	48.5	8%	0.084	26%	0.256	C	S	.	.			trans	-64.2	111.2	168.2	-71.8	170.6	0	0	0	108.1	N1148 L1155 L1224 D1225	N1148-L1150 PolarHBondContact O-N 2.91Å; L1150-L1155 HydrophobicContact CB-CD1 4.41Å; L1150-L1155 HydrophobicContact CB-CD2 4.08Å; L1150-L1155 HydrophobicContact CB-CG 4.23Å; L1150-L1155 HydrophobicContact CD1-CD2 3.81Å; L1150-L1155 HydrophobicContact CG-CD2 4.45Å; L1150-L1224 WeakPolarHBondContact CD1-O 3.39Å; L1150-D1225 HydrophobicContact CD1-CB 3.98Å; L1150-D1225 HydrophobicContact CD2-CB 4.12Å; L1150-D1225 HydrophobicContact CG-CB 3.96Å
1151	R	56.8	Low	68.8	Low	124 Å²	124	50.3 Å²	50.3	47%	0.468	27%	0.269	S	S	.	.			trans	-61.3	145.5	171.4	-66.5	176.6	170.4	161.8	-6	108	E1149 Q1153 D1154	E1149-R1151 PolarHBondContact O-N 3.12Å; E1149-R1151 VanDerWaalsContact O-N 3.09Å; R1151-Q1153 HydrophobicContact CB-CB 4.42Å; R1151-Q1153 PolarHBondContact O-N 2.91Å; R1151-D1154 PolarHBondContact O-N 2.93Å
1152	A	48.5	Very low	67.3	Low	60 Å²	60	50.9 Å²	50.9	50%	0.496	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-51.3	-31.1	173.2	0	0	0	0	0	112.1	D1154 L1155	A1152-D1154 VanDerWaalsContact C-N 3.32Å; A1152-D1154 PolarHBondContact O-N 3.45Å; A1152-L1155 PolarHBondContact O-N 3.34Å
1153	Q	48.1	Very low	66.3	Low	105 Å²	105	58.1 Å²	58.1	49%	0.491	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-69.5	-24.4	178.7	-45.3	-175.8	-12.2	0	0	114.1	D535 G536 R1151	D535-Q1153 PolarHBondContact O-NE2 3.05Å; G536-Q1153 VanDerWaalsContact CA-CD 3.45Å; R1151-Q1153 HydrophobicContact CB-CB 4.42Å; R1151-Q1153 PolarHBondContact O-N 2.91Å
1154	D	54.1	Low	65.6	Low	92 Å²	92	59 Å²	59	49%	0.492	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-91.4	-7.6	-179.6	-63.1	-38.8	0	0	0	111.8	R1151 A1152	R1151-D1154 PolarHBondContact O-N 2.93Å; A1152-D1154 VanDerWaalsContact C-N 3.32Å; A1152-D1154 PolarHBondContact O-N 3.45Å
1155	L	55.3	Low	65	Low	20 Å²	20	59.3 Å²	59.3	11%	0.105	31%	0.307	C	S	.	.	S	Bend	trans	-93	131.1	-179.7	-66.2	165.9	0	0	0	109.4	L1150 A1152 K1159 T1160 R1223	L1150-L1155 HydrophobicContact CB-CD1 4.41Å; L1150-L1155 HydrophobicContact CB-CD2 4.08Å; L1150-L1155 HydrophobicContact CB-CG 4.23Å; L1150-L1155 HydrophobicContact CD1-CD2 3.81Å; L1150-L1155 HydrophobicContact CG-CD2 4.45Å; A1152-L1155 PolarHBondContact O-N 3.34Å; L1155-K1159 HydrophobicContact CB-CB 4.21Å; L1155-K1159 HydrophobicContact CD2-CB 3.71Å; L1155-K1159 HydrophobicContact CD2-CD 4.09Å; L1155-T1160 HydrophobicContact CB-CG2 3.95Å; L1155-T1160 HydrophobicContact CD1-CG2 4.11Å; L1155-R1223 HydrophobicContact CD1-CG 4.45Å
1156	T	59.4	Low	64.4	Low	64 Å²	64	63.5 Å²	63.5	39%	0.393	33%	0.325	S	S	.	.			trans	-66.4	152.7	166	52.6	0	0	0	0	109	E1158 K1159 T1160	T1156-E1158 PolarHBondContact O-N 3.48Å; T1156-K1159 PolarHBondContact O-N 3.37Å; T1156-K1159 WeakPolarHBondContact OG1-CG 3.47Å; T1156-T1160 PolarHBondContact O-N 3.07Å
1157	P	56.8	Low	64.1	Low	110 Å²	110	67.8 Å²	67.8	71%	0.714	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-50	-33.1	175.9	-27.5	34.1	0	0	0	113.2	K1159 T1160 S1161	P1157-K1159 PolarHBondContact O-N 3.43Å; P1157-T1160 WeakPolarHBondContact CA-OG1 3.47Å; P1157-T1160 PolarHBondContact O-N 3.14Å; P1157-T1160 PolarHBondContact O-OG1 2.83Å; P1157-S1161 PolarHBondContact O-N 3.43Å
1158	E	58.3	Low	64.2	Low	143 Å²	143	67.3 Å²	67.3	67%	0.668	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-56.9	-45	173.3	-63.3	169.7	174.6	0	0	112.4	T1156 T1160 S1161	T1156-E1158 PolarHBondContact O-N 3.48Å; E1158-T1160 VanDerWaalsContact C-N 3.27Å; E1158-T1160 PolarHBondContact O-N 3.33Å; E1158-S1161 VanDerWaalsContact O-CB 3.29Å; E1158-S1161 WeakPolarHBondContact O-CB 3.48Å; E1158-S1161 PolarHBondContact O-N 3.08Å; E1158-S1161 VanDerWaalsContact O-N 3.16Å; E1158-S1161 PolarHBondContact O-OG 2.93Å
1159	K	60.5	Low	64.7	Low	45 Å²	45	68.4 Å²	68.4	20%	0.196	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-76.1	-12.3	-179.9	-63.3	-172.5	175.8	-163.6	0	114	L1155 T1156 P1157 Y1164 D1184	L1155-K1159 HydrophobicContact CB-CB 4.21Å; L1155-K1159 HydrophobicContact CD2-CB 3.71Å; L1155-K1159 HydrophobicContact CD2-CD 4.09Å; T1156-K1159 PolarHBondContact O-N 3.37Å; T1156-K1159 WeakPolarHBondContact OG1-CG 3.47Å; P1157-K1159 PolarHBondContact O-N 3.43Å; K1159-Y1164 HydrophobicContact CB-CD2 4.42Å; K1159-Y1164 HydrophobicContact CB-CE2 4.46Å; K1159-Y1164 HydrophobicContact CB-CG 4.46Å; K1159-Y1164 HydrophobicContact CD-CE2 4.32Å; K1159-Y1164 HydrophobicContact CG-CD2 4.04Å; K1159-Y1164 HydrophobicContact CG-CE1 4.43Å; K1159-Y1164 HydrophobicContact CG-CE2 3.7Å; K1159-D1184 WeakPolarHBondContact CE-OD2 3.33Å; K1159-D1184 IonicContact NZ-OD1 3.97Å; K1159-D1184 PolarHBondContact NZ-OD1 2.86Å; K1159-D1184 IonicContact NZ-OD2 2.7Å; K1159-D1184 PolarHBondContact NZ-OD2 3.25Å
1160	T	55.8	Low	65.6	Low	56 Å²	56	65.2 Å²	65.2	34%	0.344	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-94.6	-3.9	170.7	49.1	0	0	0	0	112.9	L1155 T1156 P1157 E1158	L1155-T1160 HydrophobicContact CB-CG2 3.95Å; L1155-T1160 HydrophobicContact CD1-CG2 4.11Å; T1156-T1160 PolarHBondContact O-N 3.07Å; P1157-T1160 WeakPolarHBondContact CA-OG1 3.47Å; P1157-T1160 PolarHBondContact O-N 3.14Å; P1157-T1160 PolarHBondContact O-OG1 2.83Å; E1158-T1160 VanDerWaalsContact C-N 3.27Å; E1158-T1160 PolarHBondContact O-N 3.33Å
1161	S	61	Low	66.7	Low	38 Å²	38	65.4 Å²	65.4	27%	0.266	33%	0.334	S	S	.	.	S	Bend	trans	-68.7	138.9	174.5	76.5	0	0	0	0	109.6	P1157 E1158 Y1163 Y1164	P1157-S1161 PolarHBondContact O-N 3.43Å; E1158-S1161 VanDerWaalsContact O-CB 3.29Å; E1158-S1161 WeakPolarHBondContact O-CB 3.48Å; E1158-S1161 PolarHBondContact O-N 3.08Å; E1158-S1161 VanDerWaalsContact O-N 3.16Å; E1158-S1161 PolarHBondContact O-OG 2.93Å; S1161-Y1163 PolarHBondContact O-N 3.32Å; S1161-Y1164 PolarHBondContact O-N 3.44Å; S1161-Y1164 VanDerWaalsContact O-N 3.09Å; S1161-Y1164 PolarHBondContact OG-N 2.91Å
1162	G	63.5	Low	68	Low	11 Å²	11	60.2 Å²	60.2	11%	0.113	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	8.8	173.2	0	0	0	0	0	115	R1211	G1162-R1211 VanDerWaalsContact C-NH2 3.32Å; G1162-R1211 PolarHBondContact O-NH2 3.16Å
1163	Y	72.3	Confident	69.5	Low	154 Å²	154	59.3 Å²	59.3	60%	0.604	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-13.4	176.8	-59.3	-76.4	0	0	0	112.3	S1161 L1165 K1166 E1167	S1161-Y1163 PolarHBondContact O-N 3.32Å; Y1163-L1165 PolarHBondContact O-N 3.38Å; Y1163-K1166 CarbonylContact O-C 3.56Å; Y1163-K1166 WeakPolarHBondContact O-CA 3.48Å; Y1163-K1166 WeakPolarHBondContact O-CB 3.45Å; Y1163-K1166 PolarHBondContact O-N 3.17Å; Y1163-E1167 WeakPolarHBondContact O-CG 3.31Å; Y1163-E1167 PolarHBondContact O-N 3.23Å
1164	Y	79.4	Confident	70.9	Confident	23 Å²	23	57.9 Å²	57.9	9%	0.09	30%	0.298	C	S	.	.	H	α-helix	trans	-55.7	-50.3	-174.4	175.7	-111	0	0	0	113.9	K1159 S1161 K1166 E1167 L1168 D1184	K1159-Y1164 HydrophobicContact CB-CD2 4.42Å; K1159-Y1164 HydrophobicContact CB-CE2 4.46Å; K1159-Y1164 HydrophobicContact CB-CG 4.46Å; K1159-Y1164 HydrophobicContact CD-CE2 4.32Å; K1159-Y1164 HydrophobicContact CG-CD2 4.04Å; K1159-Y1164 HydrophobicContact CG-CE1 4.43Å; K1159-Y1164 HydrophobicContact CG-CE2 3.7Å; S1161-Y1164 PolarHBondContact O-N 3.44Å; S1161-Y1164 VanDerWaalsContact O-N 3.09Å; S1161-Y1164 PolarHBondContact OG-N 2.91Å; Y1164-K1166 VanDerWaalsContact C-N 3.25Å; Y1164-K1166 PolarHBondContact O-N 3.06Å; Y1164-E1167 PolarHBondContact O-N 2.61Å; Y1164-L1168 HydrophobicContact CD1-CD1 4.22Å; Y1164-L1168 HydrophobicContact CE1-CD1 3.61Å; Y1164-L1168 HydrophobicContact CE1-CG 4.39Å; Y1164-L1168 HydrophobicContact CE2-CD1 4.16Å; Y1164-L1168 HydrophobicContact CE2-CD2 4.23Å; Y1164-L1168 HydrophobicContact CE2-CG 4.14Å; Y1164-L1168 WeakPolarHBondContact O-CG 3.5Å; Y1164-L1168 PolarHBondContact O-N 2.87Å; Y1164-D1184 PolarHBondContact OH-OD2 2.96Å; Y1164-D1184 VanDerWaalsContact OH-OD2 3.06Å
1165	L	78.6	Confident	71.6	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.037	29%	0.291	C	S	.	.	H	α-helix	trans	-63.5	-34.2	177.2	-68	-176.8	0	0	0	112.3	Y1163 L1168 F1169 L1200 A1203 E1207	Y1163-L1165 PolarHBondContact O-N 3.38Å; L1165-L1168 HydrophobicContact CD2-CD1 4.47Å; L1165-F1169 VanDerWaalsContact O-CB 3.3Å; L1165-F1169 WeakPolarHBondContact O-CB 3.4Å; L1165-F1169 PolarHBondContact O-N 3.16Å; L1165-L1200 HydrophobicContact CD2-CD2 3.84Å; L1165-A1203 HydrophobicContact CD1-CB 3.8Å; L1165-E1207 VanDerWaalsContact CD1-OE2 3.22Å; L1165-E1207 WeakPolarHBondContact CD1-OE2 3.46Å
1166	K	79.4	Confident	72	Confident	89 Å²	89	62.1 Å²	62.1	39%	0.387	32%	0.32	S	S	.	.	H	α-helix	trans	-68.1	-43.4	176.2	-173.3	-177.9	175.6	-173.5	0	110.9	Y1163 Y1164 L1168 F1169 D1170 Y1204	Y1163-K1166 CarbonylContact O-C 3.56Å; Y1163-K1166 WeakPolarHBondContact O-CA 3.48Å; Y1163-K1166 WeakPolarHBondContact O-CB 3.45Å; Y1163-K1166 PolarHBondContact O-N 3.17Å; Y1164-K1166 VanDerWaalsContact C-N 3.25Å; Y1164-K1166 PolarHBondContact O-N 3.06Å; K1166-L1168 PolarHBondContact O-N 3.37Å; K1166-F1169 PolarHBondContact O-N 3.43Å; K1166-D1170 WeakPolarHBondContact O-CB 3.41Å; K1166-D1170 PolarHBondContact O-N 2.98Å; K1166-Y1204 HydrophobicContact CB-CD2 4.46Å; K1166-Y1204 HydrophobicContact CB-CE2 4.09Å
1167	E	82.1	Confident	71.9	Confident	93 Å²	93	63.9 Å²	63.9	44%	0.435	33%	0.327	S	S	.	.	H	α-helix	trans	-60.7	-43.3	175.3	-72.2	174.3	-178.9	0	0	111.7	Y1163 Y1164 S1171	Y1163-E1167 WeakPolarHBondContact O-CG 3.31Å; Y1163-E1167 PolarHBondContact O-N 3.23Å; Y1164-E1167 PolarHBondContact O-N 2.61Å; E1167-S1171 VanDerWaalsContact O-CB 3.24Å; E1167-S1171 WeakPolarHBondContact O-CB 3.47Å; E1167-S1171 PolarHBondContact O-N 2.96Å
1168	L	83.2	Confident	71.7	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-61.4	-46.7	173.5	-67.8	-178.7	0	0	0	111.5	Y1164 L1165 K1166 S1171 I1172 H1182 L1185 L1200 L1226	Y1164-L1168 HydrophobicContact CD1-CD1 4.22Å; Y1164-L1168 HydrophobicContact CE1-CD1 3.61Å; Y1164-L1168 HydrophobicContact CE1-CG 4.39Å; Y1164-L1168 HydrophobicContact CE2-CD1 4.16Å; Y1164-L1168 HydrophobicContact CE2-CD2 4.23Å; Y1164-L1168 HydrophobicContact CE2-CG 4.14Å; Y1164-L1168 WeakPolarHBondContact O-CG 3.5Å; Y1164-L1168 PolarHBondContact O-N 2.87Å; L1165-L1168 HydrophobicContact CD2-CD1 4.47Å; K1166-L1168 PolarHBondContact O-N 3.37Å; L1168-S1171 WeakPolarHBondContact O-CB 3.29Å; L1168-S1171 PolarHBondContact O-N 2.92Å; L1168-I1172 WeakPolarHBondContact O-CG1 3.4Å; L1168-I1172 PolarHBondContact O-N 3.42Å; L1168-H1182 HydrophobicContact CD2-CB 3.87Å; L1168-H1182 VanDerWaalsContact CD2-ND1 3.28Å; L1168-H1182 WeakPolarHBondContact CD2-ND1 3.45Å; L1168-L1185 HydrophobicContact CB-CD1 4.31Å; L1168-L1185 HydrophobicContact CD2-CD1 3.98Å; L1168-L1185 HydrophobicContact CD2-CG 4.05Å; L1168-L1200 HydrophobicContact CB-CD1 3.82Å; L1168-L1200 HydrophobicContact CB-CD2 4.18Å; L1168-L1200 HydrophobicContact CD1-CD2 3.96Å; L1168-L1226 HydrophobicContact CD1-CD1 3.89Å
1169	F	81.8	Confident	71.9	Confident	53 Å²	53	66.4 Å²	66.4	23%	0.232	33%	0.333	C	S	.	.	H	α-helix	trans	-62.4	-47.4	179.2	175.5	-107.7	0	0	0	112.3	L1165 K1166 S1171 I1172 N1173 K1197 I1201	L1165-F1169 VanDerWaalsContact O-CB 3.3Å; L1165-F1169 WeakPolarHBondContact O-CB 3.4Å; L1165-F1169 PolarHBondContact O-N 3.16Å; K1166-F1169 PolarHBondContact O-N 3.43Å; F1169-S1171 VanDerWaalsContact C-N 3.28Å; F1169-S1171 PolarHBondContact O-N 3.05Å; F1169-I1172 PolarHBondContact O-N 3.31Å; F1169-N1173 WeakPolarHBondContact CD1-ND2 3.29Å; F1169-N1173 WeakPolarHBondContact CE1-ND2 3.36Å; F1169-N1173 VanDerWaalsContact CE2-ND2 3.33Å; F1169-N1173 WeakPolarHBondContact CE2-ND2 3.1Å; F1169-N1173 WeakPolarHBondContact CZ-ND2 3.36Å; F1169-N1173 PolarHBondContact O-N 3.49Å; F1169-N1173 PolarHBondContact O-ND2 3.17Å; F1169-K1197 HydrophobicContact CD2-CG 4.38Å; F1169-K1197 HydrophobicContact CE2-CG 4.03Å; F1169-I1201 HydrophobicContact CD2-CG1 3.89Å; F1169-I1201 HydrophobicContact CE2-CD1 3.7Å; F1169-I1201 HydrophobicContact CE2-CG1 3.32Å; F1169-I1201 HydrophobicContact CZ-CD1 4.27Å; F1169-I1201 HydrophobicContact CZ-CG1 3.96Å
1170	D	82.5	Confident	72.4	Confident	65 Å²	65	71.8 Å²	71.8	35%	0.348	36%	0.363	S	S	.	.	H	α-helix	trans	-61.6	-39.5	177.4	-70.3	-16.9	0	0	0	110.4	K1166 N1173 N1174	K1166-D1170 WeakPolarHBondContact O-CB 3.41Å; K1166-D1170 PolarHBondContact O-N 2.98Å; D1170-N1173 PolarHBondContact O-N 3.24Å; D1170-N1174 WeakPolarHBondContact O-CB 3.42Å; D1170-N1174 PolarHBondContact O-N 3.39Å; D1170-N1174 PolarHBondContact O-ND2 3.36Å; D1170-N1174 VanDerWaalsContact O-ND2 3.09Å
1171	S	83.3	Confident	73.4	Confident	20 Å²	20	70.2 Å²	70.2	14%	0.14	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-43.8	174.6	-175.9	0	0	0	0	112.9	E1167 L1168 F1169 N1174 Y1175 H1182	E1167-S1171 VanDerWaalsContact O-CB 3.24Å; E1167-S1171 WeakPolarHBondContact O-CB 3.47Å; E1167-S1171 PolarHBondContact O-N 2.96Å; L1168-S1171 WeakPolarHBondContact O-CB 3.29Å; L1168-S1171 PolarHBondContact O-N 2.92Å; F1169-S1171 VanDerWaalsContact C-N 3.28Å; F1169-S1171 PolarHBondContact O-N 3.05Å; S1171-N1174 PolarHBondContact O-N 3.39Å; S1171-Y1175 PolarHBondContact O-N 2.9Å; S1171-Y1175 VanDerWaalsContact O-N 3.15Å; S1171-H1182 PolarHBondContact OG-N 3.16Å
1172	I	83.7	Confident	74.3	Confident	15 Å²	15	71 Å²	71	8%	0.077	35%	0.352	C	S	.	.	H	α-helix	trans	-65.6	-40.2	176.1	-64.6	-177.6	0	0	0	111.3	L1168 F1169 Y1175 L1181 L1185 F1196 K1197 L1200	L1168-I1172 WeakPolarHBondContact O-CG1 3.4Å; L1168-I1172 PolarHBondContact O-N 3.42Å; F1169-I1172 PolarHBondContact O-N 3.31Å; I1172-Y1175 WeakPolarHBondContact O-CB 3.47Å; I1172-Y1175 PolarHBondContact O-N 3.17Å; I1172-L1181 HydrophobicContact CG1-CD1 4.45Å; I1172-L1185 HydrophobicContact CD1-CD1 3.77Å; I1172-L1185 HydrophobicContact CD1-CD2 3.8Å; I1172-L1185 HydrophobicContact CD1-CG 4.44Å; I1172-L1185 HydrophobicContact CG1-CD1 3.34Å; I1172-L1185 HydrophobicContact CG1-CD2 4.28Å; I1172-L1185 HydrophobicContact CG1-CG 4.41Å; I1172-F1196 HydrophobicContact CD1-CB 4.32Å; I1172-K1197 HydrophobicContact CG2-CB 4.03Å; I1172-K1197 HydrophobicContact CG2-CD 4.46Å; I1172-K1197 HydrophobicContact CG2-CG 4.44Å; I1172-L1200 HydrophobicContact CD1-CD1 3.52Å; I1172-L1200 HydrophobicContact CG1-CD1 4.45Å
1173	N	80.5	Confident	75.1	Confident	42 Å²	42	78.7 Å²	78.7	23%	0.225	38%	0.383	C	S	.	.	H	α-helix	trans	-67.4	-37.4	179.1	-75	-36	0	0	0	112.8	F1169 D1170 Y1175 T1176 K1197	F1169-N1173 WeakPolarHBondContact CD1-ND2 3.29Å; F1169-N1173 WeakPolarHBondContact CE1-ND2 3.36Å; F1169-N1173 VanDerWaalsContact CE2-ND2 3.33Å; F1169-N1173 WeakPolarHBondContact CE2-ND2 3.1Å; F1169-N1173 WeakPolarHBondContact CZ-ND2 3.36Å; F1169-N1173 PolarHBondContact O-N 3.49Å; F1169-N1173 PolarHBondContact O-ND2 3.17Å; D1170-N1173 PolarHBondContact O-N 3.24Å; N1173-Y1175 VanDerWaalsContact C-N 3.3Å; N1173-T1176 PolarHBondContact O-OG1 3.41Å; N1173-K1197 WeakPolarHBondContact OD1-CE 3.39Å; N1173-K1197 PolarHBondContact OD1-NZ 2.74Å
1174	N	76.9	Confident	75.4	Confident	74 Å²	74	72.8 Å²	72.8	40%	0.396	36%	0.362	S	S	.	.	H	α-helix	trans	-81	-9.6	-179.7	-67.9	-29.8	0	0	0	113.3	D1170 S1171 T1176 N1177 F1179	D1170-N1174 WeakPolarHBondContact O-CB 3.42Å; D1170-N1174 PolarHBondContact O-N 3.39Å; D1170-N1174 PolarHBondContact O-ND2 3.36Å; D1170-N1174 VanDerWaalsContact O-ND2 3.09Å; S1171-N1174 PolarHBondContact O-N 3.39Å; N1174-T1176 PolarHBondContact O-N 3.2Å; N1174-N1177 WeakPolarHBondContact O-CA 3.39Å; N1174-N1177 WeakPolarHBondContact O-CB 3.11Å; N1174-N1177 PolarHBondContact O-N 3.32Å; N1174-F1179 HydrophobicContact CB-CB 4.43Å; N1174-F1179 HydrophobicContact CB-CD2 4.33Å
1175	Y	70.3	Confident	75.6	Confident	85 Å²	85	71.7 Å²	71.7	33%	0.333	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-61.3	-26.5	180	-177.7	-111.5	0	0	0	113.1	S1171 I1172 N1173 N1177 L1181 R1190 L1193	S1171-Y1175 PolarHBondContact O-N 2.9Å; S1171-Y1175 VanDerWaalsContact O-N 3.15Å; I1172-Y1175 WeakPolarHBondContact O-CB 3.47Å; I1172-Y1175 PolarHBondContact O-N 3.17Å; N1173-Y1175 VanDerWaalsContact C-N 3.3Å; Y1175-N1177 PolarHBondContact O-N 3.25Å; Y1175-L1181 HydrophobicContact CD2-CB 4.14Å; Y1175-L1181 HydrophobicContact CD2-CD1 3.72Å; Y1175-L1181 HydrophobicContact CD2-CG 4.41Å; Y1175-L1181 HydrophobicContact CE2-CB 4.4Å; Y1175-L1181 HydrophobicContact CE2-CD1 4.49Å; Y1175-L1181 HydrophobicContact CG-CD1 3.79Å; Y1175-R1190 PolarHBondContact OH-NE 3.33Å; Y1175-L1193 HydrophobicContact CD1-CD1 4.4Å; Y1175-L1193 HydrophobicContact CE1-CD1 4.23Å
1176	T	62.8	Low	75.8	Confident	116 Å²	116	78 Å²	78	71%	0.712	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-67.4	-13.1	172.8	57.2	0	0	0	0	113.2	N1173 N1174	N1173-T1176 PolarHBondContact O-OG1 3.41Å; N1174-T1176 PolarHBondContact O-N 3.2Å
1177	N	57.1	Low	75.9	Confident	102 Å²	102	78 Å²	78	55%	0.545	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-113.7	32.2	-171.4	-62.1	-17.9	0	0	0	113.9	N1174 Y1175 F1179	N1174-N1177 WeakPolarHBondContact O-CA 3.39Å; N1174-N1177 WeakPolarHBondContact O-CB 3.11Å; N1174-N1177 PolarHBondContact O-N 3.32Å; Y1175-N1177 PolarHBondContact O-N 3.25Å; N1177-F1179 HydrophobicContact CB-CD2 4.24Å; N1177-F1179 WeakPolarHBondContact O-CD2 3.12Å; N1177-F1179 PolarHBondContact O-N 2.97Å
1178	N	52.9	Low	76.1	Confident	169 Å²	169	73.8 Å²	73.8	90%	0.904	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	25	178.1	-72	-22.6	0	0	0	116.3
1179	F	61.7	Low	76.3	Confident	136 Å²	136	74.9 Å²	74.9	60%	0.596	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-93.5	147.5	171.3	-74.6	-86	0	0	0	112.4	N1174 N1177 L1181	N1174-F1179 HydrophobicContact CB-CB 4.43Å; N1174-F1179 HydrophobicContact CB-CD2 4.33Å; N1177-F1179 HydrophobicContact CB-CD2 4.24Å; N1177-F1179 WeakPolarHBondContact O-CD2 3.12Å; N1177-F1179 PolarHBondContact O-N 2.97Å; F1179-L1181 PolarHBondContact O-N 3.45Å
1180	N	71	Confident	76.6	Confident	158 Å²	158	81.6 Å²	81.6	85%	0.845	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-63.6	132	174.4	-71.8	-25.6	0	0	0	110.3
1181	L	76.9	Confident	76.9	Confident	24 Å²	24	83 Å²	83	13%	0.126	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-67.8	147.2	174.7	-154.3	69.8	0	0	0	109.6	I1172 Y1175 F1179 K1183 L1185 L1193	I1172-L1181 HydrophobicContact CG1-CD1 4.45Å; Y1175-L1181 HydrophobicContact CD2-CB 4.14Å; Y1175-L1181 HydrophobicContact CD2-CD1 3.72Å; Y1175-L1181 HydrophobicContact CD2-CG 4.41Å; Y1175-L1181 HydrophobicContact CE2-CB 4.4Å; Y1175-L1181 HydrophobicContact CE2-CD1 4.49Å; Y1175-L1181 HydrophobicContact CG-CD1 3.79Å; F1179-L1181 PolarHBondContact O-N 3.45Å; L1181-K1183 PolarHBondContact O-N 3.43Å; L1181-L1185 HydrophobicContact CD1-CB 4.49Å; L1181-L1185 HydrophobicContact CD1-CD1 4.45Å; L1181-L1185 HydrophobicContact CD2-CB 3.58Å; L1181-L1185 WeakPolarHBondContact CD2-O 3.38Å; L1181-L1185 HydrophobicContact CG-CB 3.66Å; L1181-L1185 HydrophobicContact CG-CD1 4.34Å; L1181-L1193 HydrophobicContact CD2-CD1 3.99Å; L1181-L1193 HydrophobicContact CD2-CD2 3.95Å
1182	H	80.5	Confident	77.3	Confident	54 Å²	54	82 Å²	82	25%	0.25	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-55.9	142.1	175.9	-171.2	-89.6	0	0	0	110	L1168 S1171 D1184 L1185 E1186	L1168-H1182 HydrophobicContact CD2-CB 3.87Å; L1168-H1182 VanDerWaalsContact CD2-ND1 3.28Å; L1168-H1182 WeakPolarHBondContact CD2-ND1 3.45Å; S1171-H1182 PolarHBondContact OG-N 3.16Å; H1182-D1184 IonicContact CE1-OD2 3.71Å; H1182-D1184 PolarHBondContact CE1-OD2 3.44Å; H1182-D1184 VanDerWaalsContact CE1-OD2 3.3Å; H1182-D1184 PolarHBondContact ND1-N 3.47Å; H1182-D1184 IonicContact ND1-OD2 3.74Å; H1182-D1184 PolarHBondContact O-N 3.13Å; H1182-D1184 VanDerWaalsContact O-N 3.09Å; H1182-L1185 HydrophobicContact CB-CD1 4.07Å; H1182-L1185 HydrophobicContact CB-CG 4.46Å; H1182-L1185 WeakPolarHBondContact O-CA 3.22Å; H1182-L1185 WeakPolarHBondContact O-CB 3.4Å; H1182-L1185 PolarHBondContact O-N 3.39Å; H1182-E1186 PolarHBondContact O-N 2.95Å
1183	K	81.1	Confident	77.6	Confident	172 Å²	172	81.8 Å²	81.8	75%	0.748	41%	0.405	S	S	*	.	H	α-helix	trans	-52.4	-38.9	-174	-67	179.7	-179.6	174.8	0	113.3	L1181 L1185	L1181-K1183 PolarHBondContact O-N 3.43Å; K1183-L1185 VanDerWaalsContact C-N 3.28Å; K1183-L1185 PolarHBondContact O-N 2.96Å
1184	D	77.6	Confident	78	Confident	31 Å²	31	83.7 Å²	83.7	17%	0.166	42%	0.419	C	S	.	.	H	α-helix	trans	-69.7	-21.1	178.4	-70.7	-51.5	0	0	0	113.7	K1159 Y1164 H1182 L1226	K1159-D1184 WeakPolarHBondContact CE-OD2 3.33Å; K1159-D1184 IonicContact NZ-OD1 3.97Å; K1159-D1184 PolarHBondContact NZ-OD1 2.86Å; K1159-D1184 IonicContact NZ-OD2 2.7Å; K1159-D1184 PolarHBondContact NZ-OD2 3.25Å; Y1164-D1184 PolarHBondContact OH-OD2 2.96Å; Y1164-D1184 VanDerWaalsContact OH-OD2 3.06Å; H1182-D1184 IonicContact CE1-OD2 3.71Å; H1182-D1184 PolarHBondContact CE1-OD2 3.44Å; H1182-D1184 VanDerWaalsContact CE1-OD2 3.3Å; H1182-D1184 PolarHBondContact ND1-N 3.47Å; H1182-D1184 IonicContact ND1-OD2 3.74Å; H1182-D1184 PolarHBondContact O-N 3.13Å; H1182-D1184 VanDerWaalsContact O-N 3.09Å; D1184-L1226 HydrophobicContact CB-CD1 4.4Å
1185	L	83.8	Confident	78.6	Confident	0 Å²	0	81 Å²	81	0%	0	41%	0.405	C	S	.	.	H	α-helix	trans	-96.6	-25.8	178.2	-68.9	168.7	0	0	0	112.6	L1168 I1172 L1181 H1182 K1183 C1187 I1188 L1226	L1168-L1185 HydrophobicContact CB-CD1 4.31Å; L1168-L1185 HydrophobicContact CD2-CD1 3.98Å; L1168-L1185 HydrophobicContact CD2-CG 4.05Å; I1172-L1185 HydrophobicContact CD1-CD1 3.77Å; I1172-L1185 HydrophobicContact CD1-CD2 3.8Å; I1172-L1185 HydrophobicContact CD1-CG 4.44Å; I1172-L1185 HydrophobicContact CG1-CD1 3.34Å; I1172-L1185 HydrophobicContact CG1-CD2 4.28Å; I1172-L1185 HydrophobicContact CG1-CG 4.41Å; L1181-L1185 HydrophobicContact CD1-CB 4.49Å; L1181-L1185 HydrophobicContact CD1-CD1 4.45Å; L1181-L1185 HydrophobicContact CD2-CB 3.58Å; L1181-L1185 WeakPolarHBondContact CD2-O 3.38Å; L1181-L1185 HydrophobicContact CG-CB 3.66Å; L1181-L1185 HydrophobicContact CG-CD1 4.34Å; H1182-L1185 HydrophobicContact CB-CD1 4.07Å; H1182-L1185 HydrophobicContact CB-CG 4.46Å; H1182-L1185 WeakPolarHBondContact O-CA 3.22Å; H1182-L1185 WeakPolarHBondContact O-CB 3.4Å; H1182-L1185 PolarHBondContact O-N 3.39Å; K1183-L1185 VanDerWaalsContact C-N 3.28Å; K1183-L1185 PolarHBondContact O-N 2.96Å; L1185-C1187 PolarHBondContact O-N 3.34Å; L1185-C1187 VanDerWaalsContact O-N 3.13Å; L1185-I1188 HydrophobicContact CD2-CD1 3.75Å; L1185-I1188 WeakPolarHBondContact O-CB 3.42Å; L1185-I1188 PolarHBondContact O-N 2.92Å; L1185-L1226 HydrophobicContact CD2-CD1 3.89Å; L1185-L1226 HydrophobicContact CG-CD1 4.48Å
1186	E	83.2	Confident	79.6	Confident	139 Å²	139	76.9 Å²	76.9	65%	0.65	39%	0.389	S	S	*	.	H	α-helix	trans	-55.6	-32.4	-177.7	-167.7	178.8	-174.4	0	0	112.8	H1182	H1182-E1186 PolarHBondContact O-N 2.95Å
1187	C	81.9	Confident	80.8	Confident	88 Å²	88	75 Å²	75	60%	0.595	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-12.4	179.2	-65.3	0	0	0	0	113.9	L1185 P1230	L1185-C1187 PolarHBondContact O-N 3.34Å; L1185-C1187 VanDerWaalsContact O-N 3.13Å; C1187-P1230 HydrophobicContact CB-CG 4.07Å; C1187-P1230 WeakPolarHBondContact O-CB 3.28Å
1188	I	86	Confident	82.4	Confident	6 Å²	6	72.6 Å²	72.6	3%	0.031	36%	0.358	C	S	.	.	S	Bend	trans	-76.3	136.4	-178.3	-59.8	-176.5	0	0	0	109.6	L1185 R1190 L1192 L1193 F1196 L1226 V1229	L1185-I1188 HydrophobicContact CD2-CD1 3.75Å; L1185-I1188 WeakPolarHBondContact O-CB 3.42Å; L1185-I1188 PolarHBondContact O-N 2.92Å; I1188-R1190 PolarHBondContact O-N 2.98Å; I1188-L1192 HydrophobicContact CG2-CB 4.02Å; I1188-L1193 HydrophobicContact CB-CD2 4.28Å; I1188-L1193 HydrophobicContact CG2-CD2 4.29Å; I1188-F1196 HydrophobicContact CD1-CD1 4.39Å; I1188-F1196 HydrophobicContact CD1-CD2 4.07Å; I1188-F1196 HydrophobicContact CD1-CE1 4.4Å; I1188-F1196 HydrophobicContact CD1-CE2 4.08Å; I1188-F1196 HydrophobicContact CD1-CG 4.24Å; I1188-F1196 HydrophobicContact CD1-CZ 4.25Å; I1188-F1196 HydrophobicContact CG2-CD2 3.83Å; I1188-F1196 HydrophobicContact CG2-CE2 3.82Å; I1188-L1226 HydrophobicContact CD1-CB 4.36Å; I1188-L1226 HydrophobicContact CD1-CD1 4.46Å; I1188-L1226 HydrophobicContact CD1-CD2 4.22Å; I1188-V1229 HydrophobicContact CG1-CG1 4.39Å; I1188-V1229 HydrophobicContact CG2-CG1 4.31Å
1189	P	87.5	Confident	84.2	Confident	24 Å²	24	64.7 Å²	64.7	16%	0.156	32%	0.316	C	S	.	.			trans	-52.3	129.7	173.2	-25.6	32.9	0	0	0	112.2	H1191 L1192 Y1233	P1189-H1191 WeakPolarHBondContact CB-CE1 3.34Å; P1189-H1191 WeakPolarHBondContact CB-ND1 3.48Å; P1189-H1191 PolarHBondContact O-N 3.44Å; P1189-H1191 VanDerWaalsContact O-N 3.11Å; P1189-L1192 HydrophobicContact CB-CD1 4.14Å; P1189-L1192 HydrophobicContact CB-CG 4.2Å; P1189-L1192 HydrophobicContact CG-CD1 4.01Å; P1189-L1192 WeakPolarHBondContact O-CB 3.45Å; P1189-L1192 PolarHBondContact O-N 2.97Å; P1189-Y1233 HydrophobicContact CB-CE1 4.39Å; P1189-Y1233 HydrophobicContact CG-CD1 3.59Å; P1189-Y1233 HydrophobicContact CG-CD2 4.38Å; P1189-Y1233 HydrophobicContact CG-CE1 3.91Å; P1189-Y1233 HydrophobicContact CG-CG 3.83Å
1190	R	87	Confident	85.5	Confident	193 Å²	193	58.2 Å²	58.2	73%	0.728	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-56.3	-34.3	-171	-70.9	-178	178.4	171.2	-0.2	113.8	Y1175 I1188 L1192 L1193	Y1175-R1190 PolarHBondContact OH-NE 3.33Å; I1188-R1190 PolarHBondContact O-N 2.98Å; R1190-L1192 PolarHBondContact O-N 2.88Å; R1190-L1193 WeakPolarHBondContact O-CB 3.42Å; R1190-L1193 PolarHBondContact O-N 3.49Å
1191	H	89.2	Confident	86.4	Confident	94 Å²	94	53.7 Å²	53.7	44%	0.435	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-70.2	-16.4	179	67.7	-73.9	0	0	0	113.5	D1138 P1189 P1194 Y1233	D1138-H1191 IonicContact OD1-CD2 3.9Å; D1138-H1191 IonicContact OD1-CE1 2.96Å; D1138-H1191 IonicContact OD1-NE2 3.63Å; D1138-H1191 PolarHBondContact OD1-NE2 3.37Å; D1138-H1191 IonicContact OD2-CD2 3.06Å; D1138-H1191 IonicContact OD2-NE2 2.57Å; P1189-H1191 WeakPolarHBondContact CB-CE1 3.34Å; P1189-H1191 WeakPolarHBondContact CB-ND1 3.48Å; P1189-H1191 PolarHBondContact O-N 3.44Å; P1189-H1191 VanDerWaalsContact O-N 3.11Å; H1191-P1194 WeakPolarHBondContact O-CD 3.5Å; H1191-Y1233 AromaticContact CE1-CZ 3.76Å; H1191-Y1233 PolarHBondContact CE1-OH 3.3Å
1192	L	91.4	Very high	87	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-89.3	-14.6	176.2	-59.2	-178.4	0	0	0	113.3	D1138 A1141 V1142 I1188 P1189 R1190 P1194 V1195 F1196	D1138-L1192 HydrophobicContact CB-CD2 3.7Å; A1141-L1192 HydrophobicContact CB-CD1 3.95Å; V1142-L1192 HydrophobicContact CG2-CD2 4.37Å; I1188-L1192 HydrophobicContact CG2-CB 4.02Å; P1189-L1192 HydrophobicContact CB-CD1 4.14Å; P1189-L1192 HydrophobicContact CB-CG 4.2Å; P1189-L1192 HydrophobicContact CG-CD1 4.01Å; P1189-L1192 WeakPolarHBondContact O-CB 3.45Å; P1189-L1192 PolarHBondContact O-N 2.97Å; R1190-L1192 PolarHBondContact O-N 2.88Å; L1192-P1194 VanDerWaalsContact C-CD 3.44Å; L1192-V1195 PolarHBondContact O-N 3.27Å; L1192-V1195 VanDerWaalsContact O-N 3.08Å; L1192-F1196 HydrophobicContact CB-CD2 4.11Å; L1192-F1196 HydrophobicContact CB-CE2 4.22Å; L1192-F1196 WeakPolarHBondContact O-CD2 3.5Å; L1192-F1196 PolarHBondContact O-N 3.24Å
1193	L	90.2	Very high	87.4	Confident	11 Å²	11	50.6 Å²	50.6	6%	0.058	25%	0.249	C	C	.	.	H	α-helix	trans	-56	-39.5	-179.4	-64.1	175.5	0	0	0	113.8	Y1175 L1181 I1188 R1190 V1195 F1196 K1197	Y1175-L1193 HydrophobicContact CD1-CD1 4.4Å; Y1175-L1193 HydrophobicContact CE1-CD1 4.23Å; L1181-L1193 HydrophobicContact CD2-CD1 3.99Å; L1181-L1193 HydrophobicContact CD2-CD2 3.95Å; I1188-L1193 HydrophobicContact CB-CD2 4.28Å; I1188-L1193 HydrophobicContact CG2-CD2 4.29Å; R1190-L1193 WeakPolarHBondContact O-CB 3.42Å; R1190-L1193 PolarHBondContact O-N 3.49Å; L1193-V1195 VanDerWaalsContact C-N 3.32Å; L1193-V1195 PolarHBondContact O-N 2.75Å; L1193-F1196 PolarHBondContact O-N 3.01Å; L1193-K1197 PolarHBondContact O-N 2.87Å
1194	P	88.6	Confident	87.8	Confident	82 Å²	82	45.7 Å²	45.7	53%	0.532	23%	0.226	S	C	.	.	H	α-helix	trans	-60.1	-38.2	175	-24.9	35.7	0	0	0	113.5	H1191 L1192 K1197	H1191-P1194 WeakPolarHBondContact O-CD 3.5Å; L1192-P1194 VanDerWaalsContact C-CD 3.44Å; P1194-K1197 WeakPolarHBondContact O-CB 3.43Å; P1194-K1197 PolarHBondContact O-N 2.87Å
1195	V	90.2	Very high	88.3	Confident	16 Å²	16	48 Å²	48	10%	0.097	24%	0.236	C	C	.	.	H	α-helix	trans	-71.2	-42.9	177.3	179.7	0	0	0	0	110.5	L1134 V1142 L1192 L1193 K1197 N1198 V1199	L1134-V1195 HydrophobicContact CD1-CG1 4.3Å; L1134-V1195 HydrophobicContact CD1-CG2 4.17Å; L1134-V1195 HydrophobicContact CD2-CG2 4.03Å; L1134-V1195 HydrophobicContact CG-CG2 4.47Å; V1142-V1195 HydrophobicContact CG1-CG1 4.18Å; V1142-V1195 HydrophobicContact CG2-CG1 4.18Å; L1192-V1195 PolarHBondContact O-N 3.27Å; L1192-V1195 VanDerWaalsContact O-N 3.08Å; L1193-V1195 VanDerWaalsContact C-N 3.32Å; L1193-V1195 PolarHBondContact O-N 2.75Å; V1195-K1197 PolarHBondContact O-N 2.89Å; V1195-N1198 PolarHBondContact O-N 3.35Å; V1195-V1199 HydrophobicContact CG1-CG2 4.44Å; V1195-V1199 WeakPolarHBondContact O-CG2 3.43Å; V1195-V1199 PolarHBondContact O-N 3.16Å
1196	F	90.5	Very high	88.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-31.3	175.5	-86.3	-75.7	0	0	0	112.8	V1142 A1145 I1172 I1188 L1192 L1193 N1198 V1199 L1200 L1226 V1229	V1142-F1196 HydrophobicContact CG2-CE2 4.19Å; A1145-F1196 HydrophobicContact CB-CE1 3.97Å; A1145-F1196 HydrophobicContact CB-CZ 4.35Å; I1172-F1196 HydrophobicContact CD1-CB 4.32Å; I1188-F1196 HydrophobicContact CD1-CD1 4.39Å; I1188-F1196 HydrophobicContact CD1-CD2 4.07Å; I1188-F1196 HydrophobicContact CD1-CE1 4.4Å; I1188-F1196 HydrophobicContact CD1-CE2 4.08Å; I1188-F1196 HydrophobicContact CD1-CG 4.24Å; I1188-F1196 HydrophobicContact CD1-CZ 4.25Å; I1188-F1196 HydrophobicContact CG2-CD2 3.83Å; I1188-F1196 HydrophobicContact CG2-CE2 3.82Å; L1192-F1196 HydrophobicContact CB-CD2 4.11Å; L1192-F1196 HydrophobicContact CB-CE2 4.22Å; L1192-F1196 WeakPolarHBondContact O-CD2 3.5Å; L1192-F1196 PolarHBondContact O-N 3.24Å; L1193-F1196 PolarHBondContact O-N 3.01Å; F1196-N1198 VanDerWaalsContact C-N 3.34Å; F1196-N1198 PolarHBondContact O-N 2.91Å; F1196-V1199 PolarHBondContact O-N 3.26Å; F1196-L1200 WeakPolarHBondContact O-CB 3.4Å; F1196-L1200 VanDerWaalsContact O-CG 3.22Å; F1196-L1200 WeakPolarHBondContact O-CG 3.34Å; F1196-L1200 PolarHBondContact O-N 3.38Å; F1196-L1226 HydrophobicContact CD1-CD2 3.86Å; F1196-L1226 HydrophobicContact CE1-CD2 3.47Å; F1196-L1226 VanDerWaalsContact CE1-CD2 3.47Å; F1196-L1226 HydrophobicContact CZ-CD2 4.34Å; F1196-V1229 HydrophobicContact CE1-CG2 4.36Å; F1196-V1229 HydrophobicContact CE2-CG1 3.85Å; F1196-V1229 HydrophobicContact CZ-CB 4.37Å; F1196-V1229 HydrophobicContact CZ-CG1 3.75Å; F1196-V1229 HydrophobicContact CZ-CG2 3.73Å
1197	K	89.5	Confident	88.9	Confident	77 Å²	77	41.8 Å²	41.8	34%	0.335	21%	0.207	S	C	.	.	H	α-helix	trans	-56.1	-48.3	170.4	-178.5	174.9	166	163	0	111.4	F1169 I1172 N1173 L1193 P1194 V1195 L1200 I1201	F1169-K1197 HydrophobicContact CD2-CG 4.38Å; F1169-K1197 HydrophobicContact CE2-CG 4.03Å; I1172-K1197 HydrophobicContact CG2-CB 4.03Å; I1172-K1197 HydrophobicContact CG2-CD 4.46Å; I1172-K1197 HydrophobicContact CG2-CG 4.44Å; N1173-K1197 WeakPolarHBondContact OD1-CE 3.39Å; N1173-K1197 PolarHBondContact OD1-NZ 2.74Å; L1193-K1197 PolarHBondContact O-N 2.87Å; P1194-K1197 WeakPolarHBondContact O-CB 3.43Å; P1194-K1197 PolarHBondContact O-N 2.87Å; V1195-K1197 PolarHBondContact O-N 2.89Å; K1197-L1200 PolarHBondContact O-N 2.86Å; K1197-I1201 HydrophobicContact CG-CD1 4.32Å; K1197-I1201 WeakPolarHBondContact O-CG1 3.16Å; K1197-I1201 PolarHBondContact O-N 2.98Å; K1197-I1201 VanDerWaalsContact O-N 3.09Å
1198	N	89.4	Confident	89.3	Confident	50 Å²	50	42.8 Å²	42.8	27%	0.267	20%	0.201	S	C	.	.	H	α-helix	trans	-66.5	-42	178.3	-64.4	-21	0	0	0	111.7	F1130 V1195 F1196 L1200 I1201 C1202	F1130-N1198 HydrophobicContact CD1-CB 4.01Å; F1130-N1198 VanDerWaalsContact CD1-ND2 3.32Å; F1130-N1198 WeakPolarHBondContact CD1-ND2 3.39Å; F1130-N1198 HydrophobicContact CD2-CB 4.22Å; F1130-N1198 HydrophobicContact CE1-CB 4.01Å; F1130-N1198 HydrophobicContact CE2-CB 4.23Å; F1130-N1198 HydrophobicContact CG-CB 4.12Å; F1130-N1198 HydrophobicContact CZ-CB 4.13Å; V1195-N1198 PolarHBondContact O-N 3.35Å; F1196-N1198 VanDerWaalsContact C-N 3.34Å; F1196-N1198 PolarHBondContact O-N 2.91Å; N1198-L1200 VanDerWaalsContact C-N 3.31Å; N1198-L1200 PolarHBondContact O-N 3.09Å; N1198-I1201 PolarHBondContact O-N 3.3Å; N1198-C1202 PolarHBondContact O-N 3.16Å; N1198-C1202 PolarHBondContact O-SG 3.35Å
1199	V	90.3	Very high	89.5	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.018	21%	0.206	C	C	.	.	H	α-helix	trans	-56	-45.4	174.8	171.1	0	0	0	0	111.7	L1125 F1146 V1195 F1196 C1202 A1203 L1224	L1125-V1199 HydrophobicContact CD1-CG1 4.39Å; L1125-V1199 HydrophobicContact CD1-CG2 4.11Å; L1125-V1199 HydrophobicContact CD2-CB 4.48Å; L1125-V1199 HydrophobicContact CD2-CG2 4.04Å; F1146-V1199 HydrophobicContact CE1-CG1 4.29Å; F1146-V1199 HydrophobicContact CE2-CG1 4.48Å; F1146-V1199 HydrophobicContact CZ-CG1 3.62Å; F1146-V1199 HydrophobicContact CZ-CG2 4.24Å; V1195-V1199 HydrophobicContact CG1-CG2 4.44Å; V1195-V1199 WeakPolarHBondContact O-CG2 3.43Å; V1195-V1199 PolarHBondContact O-N 3.16Å; F1196-V1199 PolarHBondContact O-N 3.26Å; V1199-C1202 PolarHBondContact O-N 3.12Å; V1199-A1203 WeakPolarHBondContact O-CB 3.31Å; V1199-A1203 PolarHBondContact O-N 3.23Å; V1199-L1224 HydrophobicContact CG1-CD1 3.63Å; V1199-L1224 HydrophobicContact CG1-CD2 4.37Å
1200	L	89.7	Confident	89.7	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-67.4	-36.9	179.1	-69.4	172.2	0	0	0	112.4	L1165 L1168 I1172 F1196 K1197 N1198 A1203 Y1204 L1224	L1165-L1200 HydrophobicContact CD2-CD2 3.84Å; L1168-L1200 HydrophobicContact CB-CD1 3.82Å; L1168-L1200 HydrophobicContact CB-CD2 4.18Å; L1168-L1200 HydrophobicContact CD1-CD2 3.96Å; I1172-L1200 HydrophobicContact CD1-CD1 3.52Å; I1172-L1200 HydrophobicContact CG1-CD1 4.45Å; F1196-L1200 WeakPolarHBondContact O-CB 3.4Å; F1196-L1200 VanDerWaalsContact O-CG 3.22Å; F1196-L1200 WeakPolarHBondContact O-CG 3.34Å; F1196-L1200 PolarHBondContact O-N 3.38Å; K1197-L1200 PolarHBondContact O-N 2.86Å; N1198-L1200 VanDerWaalsContact C-N 3.31Å; N1198-L1200 PolarHBondContact O-N 3.09Å; L1200-A1203 PolarHBondContact O-N 3.31Å; L1200-Y1204 VanDerWaalsContact O-CB 3.25Å; L1200-Y1204 WeakPolarHBondContact O-CB 3.42Å; L1200-Y1204 PolarHBondContact O-N 3.34Å; L1200-L1224 HydrophobicContact CD2-CD1 4.06Å
1201	I	89.2	Confident	89.8	Confident	62 Å²	62	37.7 Å²	37.7	32%	0.318	18%	0.18	S	C	.	.	H	α-helix	trans	-60.8	-51.4	174.7	-68.2	165	0	0	0	110.3	F1169 K1197 N1198 A1203 Y1204 E1205	F1169-I1201 HydrophobicContact CD2-CG1 3.89Å; F1169-I1201 HydrophobicContact CE2-CD1 3.7Å; F1169-I1201 HydrophobicContact CE2-CG1 3.32Å; F1169-I1201 HydrophobicContact CZ-CD1 4.27Å; F1169-I1201 HydrophobicContact CZ-CG1 3.96Å; K1197-I1201 HydrophobicContact CG-CD1 4.32Å; K1197-I1201 WeakPolarHBondContact O-CG1 3.16Å; K1197-I1201 PolarHBondContact O-N 2.98Å; K1197-I1201 VanDerWaalsContact O-N 3.09Å; N1198-I1201 PolarHBondContact O-N 3.3Å; I1201-A1203 VanDerWaalsContact C-N 3.33Å; I1201-A1203 PolarHBondContact O-N 3Å; I1201-Y1204 PolarHBondContact O-N 3.44Å; I1201-E1205 PolarHBondContact O-N 2.71Å
1202	C	90.1	Very high	89.9	Confident	13 Å²	13	39.1 Å²	39.1	9%	0.088	19%	0.191	C	C	.	.	H	α-helix	trans	-61.2	-43	-180	-64.5	0	0	0	0	111.6	L1121 L1125 N1198 V1199 Y1204 E1205 L1206	L1121-C1202 HydrophobicContact CD1-CB 3.61Å; L1125-C1202 HydrophobicContact CD2-CB 3.94Å; N1198-C1202 PolarHBondContact O-N 3.16Å; N1198-C1202 PolarHBondContact O-SG 3.35Å; V1199-C1202 PolarHBondContact O-N 3.12Å; C1202-Y1204 PolarHBondContact O-N 2.58Å; C1202-E1205 PolarHBondContact O-N 3.3Å; C1202-L1206 WeakPolarHBondContact O-CB 3.34Å; C1202-L1206 PolarHBondContact O-N 2.94Å
1203	A	89.6	Confident	89.8	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.1	-42	177.7	0	0	0	0	0	112	L1121 L1165 V1199 L1200 I1201 E1207 S1222 L1224	L1121-A1203 HydrophobicContact CD1-CB 4.28Å; L1121-A1203 HydrophobicContact CD2-CB 4.08Å; L1165-A1203 HydrophobicContact CD1-CB 3.8Å; V1199-A1203 WeakPolarHBondContact O-CB 3.31Å; V1199-A1203 PolarHBondContact O-N 3.23Å; L1200-A1203 PolarHBondContact O-N 3.31Å; I1201-A1203 VanDerWaalsContact C-N 3.33Å; I1201-A1203 PolarHBondContact O-N 3Å; A1203-E1207 WeakPolarHBondContact O-CB 3.47Å; A1203-E1207 PolarHBondContact O-N 3.23Å; A1203-S1222 WeakPolarHBondContact O-CB 3.42Å; A1203-L1224 HydrophobicContact CB-CD1 4.49Å
1204	Y	88.9	Confident	89.7	Confident	69 Å²	69	48.2 Å²	48.2	27%	0.271	24%	0.237	S	C	.	.	H	α-helix	trans	-67.7	-42.6	178.2	179	-103.8	0	0	0	112.9	K1166 L1200 I1201 C1202 E1207 K1208	K1166-Y1204 HydrophobicContact CB-CD2 4.46Å; K1166-Y1204 HydrophobicContact CB-CE2 4.09Å; L1200-Y1204 VanDerWaalsContact O-CB 3.25Å; L1200-Y1204 WeakPolarHBondContact O-CB 3.42Å; L1200-Y1204 PolarHBondContact O-N 3.34Å; I1201-Y1204 PolarHBondContact O-N 3.44Å; C1202-Y1204 PolarHBondContact O-N 2.58Å; Y1204-E1207 PolarHBondContact O-N 3.22Å; Y1204-K1208 WeakPolarHBondContact O-CB 3.43Å; Y1204-K1208 PolarHBondContact O-N 3.02Å
1205	E	89.1	Confident	89.6	Confident	81 Å²	81	44.9 Å²	44.9	38%	0.379	22%	0.215	S	C	.	.	H	α-helix	trans	-66.2	-38.7	176.7	-75	-60.8	145.2	0	0	111.9	I1201 C1202 K1208 L1209	I1201-E1205 PolarHBondContact O-N 2.71Å; C1202-E1205 PolarHBondContact O-N 3.3Å; E1205-K1208 PolarHBondContact O-N 3.32Å; E1205-K1208 IonicContact OE1-NZ 3.91Å; E1205-K1208 IonicContact OE2-NZ 2.93Å; E1205-L1209 WeakPolarHBondContact O-CG 3.46Å; E1205-L1209 PolarHBondContact O-N 3.22Å
1206	L	91	Very high	88.9	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-59.7	-49.2	172	178.9	60	0	0	0	110.8	V1089 L1093 V1120 L1121 C1202 K1208 L1209 Q1210 E1221	V1089-L1206 HydrophobicContact CG1-CD1 3.99Å; L1093-L1206 HydrophobicContact CD1-CD1 3.91Å; V1120-L1206 HydrophobicContact CG1-CD1 3.89Å; V1120-L1206 HydrophobicContact CG1-CD2 4.39Å; L1121-L1206 HydrophobicContact CB-CD2 4.09Å; C1202-L1206 WeakPolarHBondContact O-CB 3.34Å; C1202-L1206 PolarHBondContact O-N 2.94Å; L1206-K1208 VanDerWaalsContact C-N 3.33Å; L1206-K1208 PolarHBondContact O-N 2.61Å; L1206-L1209 PolarHBondContact O-N 3.06Å; L1206-Q1210 HydrophobicContact CD1-CG 4.23Å; L1206-Q1210 HydrophobicContact CG-CG 4.47Å; L1206-Q1210 VanDerWaalsContact O-CG 3.26Å; L1206-Q1210 WeakPolarHBondContact O-CG 3.26Å; L1206-Q1210 PolarHBondContact O-N 3.17Å; L1206-E1221 HydrophobicContact CD2-CB 4.27Å
1207	E	88.6	Confident	88.3	Confident	6 Å²	6	52 Å²	52	3%	0.028	26%	0.257	C	S	.	.	H	α-helix	trans	-58.6	-42.1	178.1	-173.6	169.9	138.2	0	0	112.9	L1165 A1203 Y1204 Q1210 R1211 Y1219 S1222	L1165-E1207 VanDerWaalsContact CD1-OE2 3.22Å; L1165-E1207 WeakPolarHBondContact CD1-OE2 3.46Å; A1203-E1207 WeakPolarHBondContact O-CB 3.47Å; A1203-E1207 PolarHBondContact O-N 3.23Å; Y1204-E1207 PolarHBondContact O-N 3.22Å; E1207-Q1210 PolarHBondContact O-N 3.3Å; E1207-R1211 WeakPolarHBondContact O-CG 3.44Å; E1207-R1211 PolarHBondContact O-N 3.4Å; E1207-R1211 IonicContact OE1-CZ 3.69Å; E1207-R1211 IonicContact OE1-NE 3.84Å; E1207-R1211 IonicContact OE1-NH2 2.89Å; E1207-R1211 PolarHBondContact OE1-NH2 2.78Å; E1207-Y1219 HydrophobicContact CG-CD1 3.99Å; E1207-Y1219 HydrophobicContact CG-CE1 4.21Å; E1207-Y1219 WeakPolarHBondContact OE1-CD1 3.47Å; E1207-Y1219 WeakPolarHBondContact OE1-CE1 3.33Å; E1207-S1222 PolarHBondContact OE2-OG 3.42Å
1208	K	89.5	Confident	87.8	Confident	108 Å²	108	49.1 Å²	49.1	47%	0.47	25%	0.246	S	C	.	.	H	α-helix	trans	-62.3	-43.8	175.8	-178.5	-175.9	173.4	-168	0	112.2	Y1204 E1205 L1206 R1211 L1212	Y1204-K1208 WeakPolarHBondContact O-CB 3.43Å; Y1204-K1208 PolarHBondContact O-N 3.02Å; E1205-K1208 PolarHBondContact O-N 3.32Å; E1205-K1208 IonicContact OE1-NZ 3.91Å; E1205-K1208 IonicContact OE2-NZ 2.93Å; L1206-K1208 VanDerWaalsContact C-N 3.33Å; L1206-K1208 PolarHBondContact O-N 2.61Å; K1208-R1211 PolarHBondContact O-N 2.93Å; K1208-L1212 PolarHBondContact O-N 2.93Å
1209	L	90.7	Very high	87.3	Confident	26 Å²	26	49.8 Å²	49.8	14%	0.136	25%	0.245	C	C	.	.	H	α-helix	trans	-65	-39.9	175.6	-73.1	174.7	0	0	0	112	V1089 K1092 L1093 E1205 L1206 L1212 H1213	V1089-L1209 HydrophobicContact CG1-CB 4.49Å; V1089-L1209 HydrophobicContact CG2-CB 4.42Å; K1092-L1209 HydrophobicContact CG-CD1 4.45Å; K1092-L1209 HydrophobicContact CG-CD2 4.04Å; L1093-L1209 HydrophobicContact CD1-CD1 4.32Å; L1093-L1209 HydrophobicContact CD2-CD1 3.47Å; L1093-L1209 VanDerWaalsContact CD2-CD1 3.47Å; L1093-L1209 HydrophobicContact CG-CD1 3.88Å; E1205-L1209 WeakPolarHBondContact O-CG 3.46Å; E1205-L1209 PolarHBondContact O-N 3.22Å; L1206-L1209 PolarHBondContact O-N 3.06Å; L1209-L1212 WeakPolarHBondContact O-CB 3.36Å; L1209-L1212 PolarHBondContact O-N 3.38Å; L1209-H1213 PolarHBondContact O-CD2 3.32Å; L1209-H1213 VanDerWaalsContact O-CD2 3.3Å; L1209-H1213 PolarHBondContact O-N 3.04Å
1210	Q	91.1	Very high	86.6	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.019	26%	0.26	C	S	.	.	H	α-helix	trans	-64.3	-39.7	177.4	-68.6	-176.7	114.7	0	0	111.9	Y608 V1089 L1206 E1207 H1213 N1214 L1215 P1218	Y608-Q1210 PolarHBondContact OH-OE1 3.01Å; V1089-Q1210 HydrophobicContact CG2-CG 4.44Å; L1206-Q1210 HydrophobicContact CD1-CG 4.23Å; L1206-Q1210 HydrophobicContact CG-CG 4.47Å; L1206-Q1210 VanDerWaalsContact O-CG 3.26Å; L1206-Q1210 WeakPolarHBondContact O-CG 3.26Å; L1206-Q1210 PolarHBondContact O-N 3.17Å; E1207-Q1210 PolarHBondContact O-N 3.3Å; Q1210-H1213 PolarHBondContact O-N 3.31Å; Q1210-N1214 PolarHBondContact O-N 3.02Å; Q1210-L1215 HydrophobicContact CB-CB 4.47Å; Q1210-L1215 HydrophobicContact CB-CD1 3.93Å; Q1210-L1215 HydrophobicContact CG-CD1 3.82Å; Q1210-L1215 PolarHBondContact O-N 2.69Å; Q1210-P1218 HydrophobicContact CB-CB 3.79Å; Q1210-P1218 PolarHBondContact NE2-O 3.06Å
1211	R	89.2	Confident	86.2	Confident	86 Å²	86	54.1 Å²	54.1	33%	0.325	27%	0.267	S	S	.	.	H	α-helix	trans	-65.6	-42.1	172.7	-69.8	-177.3	-153.7	163.5	2.9	112.8	G1162 E1207 K1208 H1213 N1214 P1218	G1162-R1211 VanDerWaalsContact C-NH2 3.32Å; G1162-R1211 PolarHBondContact O-NH2 3.16Å; E1207-R1211 WeakPolarHBondContact O-CG 3.44Å; E1207-R1211 PolarHBondContact O-N 3.4Å; E1207-R1211 IonicContact OE1-CZ 3.69Å; E1207-R1211 IonicContact OE1-NE 3.84Å; E1207-R1211 IonicContact OE1-NH2 2.89Å; E1207-R1211 PolarHBondContact OE1-NH2 2.78Å; K1208-R1211 PolarHBondContact O-N 2.93Å; R1211-H1213 PolarHBondContact O-N 2.85Å; R1211-N1214 PolarHBondContact O-N 2.9Å; R1211-P1218 HydrophobicContact CG-CB 3.8Å; R1211-P1218 HydrophobicContact CG-CG 3.75Å
1212	L	91.5	Very high	85.8	Confident	124 Å²	124	51.3 Å²	51.3	65%	0.649	25%	0.252	S	S	*	.	H	α-helix	trans	-57.2	-31.8	178.1	-179	65.5	0	0	0	112.1	K1208 L1209	K1208-L1212 PolarHBondContact O-N 2.93Å; L1209-L1212 WeakPolarHBondContact O-CB 3.36Å; L1209-L1212 PolarHBondContact O-N 3.38Å
1213	H	89.8	Confident	85.5	Confident	57 Å²	57	52.1 Å²	52.1	26%	0.264	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	17.3	178.9	-69.4	-63.3	0	0	0	114.1	S1088 V1089 L1209 Q1210 R1211 L1215	S1088-H1213 WeakPolarHBondContact CB-CE1 3.39Å; V1089-H1213 HydrophobicContact CG2-CB 4.4Å; L1209-H1213 PolarHBondContact O-CD2 3.32Å; L1209-H1213 VanDerWaalsContact O-CD2 3.3Å; L1209-H1213 PolarHBondContact O-N 3.04Å; Q1210-H1213 PolarHBondContact O-N 3.31Å; R1211-H1213 PolarHBondContact O-N 2.85Å; H1213-L1215 VanDerWaalsContact C-N 3.27Å; H1213-L1215 PolarHBondContact O-N 3.24Å
1214	N	86.9	Confident	85.2	Confident	145 Å²	145	52.5 Å²	52.5	78%	0.775	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.9	37.8	174.3	-61.7	-41.9	0	0	0	114.7	Q1210 R1211	Q1210-N1214 PolarHBondContact O-N 3.02Å; R1211-N1214 PolarHBondContact O-N 2.9Å
1215	L	86.1	Confident	85	Confident	12 Å²	12	49.3 Å²	49.3	6%	0.063	24%	0.243	C	C	.	.			trans	-70.9	147.9	178.6	-65.7	-174.7	0	0	0	112.6	R1086 V1089 Q1210 H1213	R1086-L1215 HydrophobicContact CG-CD1 3.78Å; R1086-L1215 HydrophobicContact CG-CD2 3.87Å; V1089-L1215 HydrophobicContact CG2-CD1 4.27Å; Q1210-L1215 HydrophobicContact CB-CB 4.47Å; Q1210-L1215 HydrophobicContact CB-CD1 3.93Å; Q1210-L1215 HydrophobicContact CG-CD1 3.82Å; Q1210-L1215 PolarHBondContact O-N 2.69Å; H1213-L1215 VanDerWaalsContact C-N 3.27Å; H1213-L1215 PolarHBondContact O-N 3.24Å
1216	T	76.7	Confident	84.9	Confident	98 Å²	98	45.8 Å²	45.8	60%	0.601	23%	0.227	S	C	*	.	S	Bend	trans	-69.4	129	171.8	60.5	0	0	0	0	111.6	E1082	E1082-T1216 PolarHBondContact OE1-N 2.87Å; E1082-T1216 PolarHBondContact OE1-OG1 3.36Å; E1082-T1216 PolarHBondContact OE2-N 2.91Å; E1082-T1216 PolarHBondContact OE2-OG1 3.17Å
1217	D	77.2	Confident	84.5	Confident	69 Å²	69	50.3 Å²	50.3	37%	0.369	24%	0.244	S	C	.	.	S	Bend	trans	46.5	72.7	-173.5	-167	-1.2	0	0	0	113.5	Y1219 L1220 R1223	D1217-Y1219 PolarHBondContact O-N 2.84Å; D1217-Y1219 WeakPolarHBondContact OD1-CB 3.25Å; D1217-Y1219 WeakPolarHBondContact OD1-CD2 3.38Å; D1217-Y1219 PolarHBondContact OD1-N 3.1Å; D1217-L1220 PolarHBondContact O-N 3.27Å; D1217-R1223 IonicContact OD1-NH2 2.75Å; D1217-R1223 PolarHBondContact OD1-NH2 3.35Å; D1217-R1223 VanDerWaalsContact OD1-NH2 3.16Å; D1217-R1223 IonicContact OD2-CZ 2.58Å; D1217-R1223 IonicContact OD2-NH2 3.58Å; D1217-R1223 PolarHBondContact OD2-NH2 3.21Å
1218	P	79.1	Confident	84.4	Confident	16 Å²	16	50.2 Å²	50.2	10%	0.104	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-3.6	-177.5	29.7	-36.6	0	0	0	113.6	Q1210 R1211	Q1210-P1218 HydrophobicContact CB-CB 3.79Å; Q1210-P1218 PolarHBondContact NE2-O 3.06Å; R1211-P1218 HydrophobicContact CG-CB 3.8Å; R1211-P1218 HydrophobicContact CG-CG 3.75Å
1219	Y	78.1	Confident	84.4	Confident	64 Å²	64	45.1 Å²	45.1	25%	0.251	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-20.3	-178.3	-46.2	-70.4	0	0	0	112.5	E1207 D1217 E1221 S1222 R1223	E1207-Y1219 HydrophobicContact CG-CD1 3.99Å; E1207-Y1219 HydrophobicContact CG-CE1 4.21Å; E1207-Y1219 WeakPolarHBondContact OE1-CD1 3.47Å; E1207-Y1219 WeakPolarHBondContact OE1-CE1 3.33Å; D1217-Y1219 PolarHBondContact O-N 2.84Å; D1217-Y1219 WeakPolarHBondContact OD1-CB 3.25Å; D1217-Y1219 WeakPolarHBondContact OD1-CD2 3.38Å; D1217-Y1219 PolarHBondContact OD1-N 3.1Å; Y1219-E1221 VanDerWaalsContact C-N 3.34Å; Y1219-E1221 PolarHBondContact O-N 3.3Å; Y1219-S1222 WeakPolarHBondContact CA-OG 3.35Å; Y1219-S1222 PolarHBondContact O-N 3.29Å; Y1219-S1222 VanDerWaalsContact O-N 3.15Å; Y1219-S1222 PolarHBondContact O-OG 3.27Å; Y1219-S1222 VanDerWaalsContact O-OG 3.08Å; Y1219-R1223 VanDerWaalsContact O-CG 3.29Å; Y1219-R1223 WeakPolarHBondContact O-CG 3.32Å; Y1219-R1223 PolarHBondContact O-N 3.21Å; Y1219-R1223 VanDerWaalsContact O-N 3.15Å
1220	L	77.2	Confident	84.4	Confident	65 Å²	65	44.7 Å²	44.7	34%	0.34	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-56.8	-46	-169.1	-176	64.7	0	0	0	112.6	D1217	D1217-L1220 PolarHBondContact O-N 3.27Å
1221	E	80	Confident	84.3	Confident	30 Å²	30	45 Å²	45	14%	0.14	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-80.3	-16.3	-177.7	-60.9	-64.7	161.9	0	0	113.7	Y608 L1206 Y1219	Y608-E1221 HydrophobicContact CD2-CG 4.11Å; Y608-E1221 HydrophobicContact CE2-CG 3.96Å; L1206-E1221 HydrophobicContact CD2-CB 4.27Å; Y1219-E1221 VanDerWaalsContact C-N 3.34Å; Y1219-E1221 PolarHBondContact O-N 3.3Å
1222	S	82.5	Confident	84.5	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.014	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-97.4	-4.4	179.3	63.4	0	0	0	0	113.6	A1203 E1207 Y1219	A1203-S1222 WeakPolarHBondContact O-CB 3.42Å; E1207-S1222 PolarHBondContact OE2-OG 3.42Å; Y1219-S1222 WeakPolarHBondContact CA-OG 3.35Å; Y1219-S1222 PolarHBondContact O-N 3.29Å; Y1219-S1222 VanDerWaalsContact O-N 3.15Å; Y1219-S1222 PolarHBondContact O-OG 3.27Å; Y1219-S1222 VanDerWaalsContact O-OG 3.08Å
1223	R	82	Confident	84.6	Confident	30 Å²	30	37.8 Å²	37.8	11%	0.113	19%	0.186	C	C	.	.			trans	-67.1	130.8	-179.1	-82.7	165.7	-165.8	177	18.8	113.1	K1118 L1155 D1217 Y1219	K1118-R1223 WeakPolarHBondContact CE-O 3.48Å; K1118-R1223 PolarHBondContact NZ-O 2.75Å; L1155-R1223 HydrophobicContact CD1-CG 4.45Å; D1217-R1223 IonicContact OD1-NH2 2.75Å; D1217-R1223 PolarHBondContact OD1-NH2 3.35Å; D1217-R1223 VanDerWaalsContact OD1-NH2 3.16Å; D1217-R1223 IonicContact OD2-CZ 2.58Å; D1217-R1223 IonicContact OD2-NH2 3.58Å; D1217-R1223 PolarHBondContact OD2-NH2 3.21Å; Y1219-R1223 VanDerWaalsContact O-CG 3.29Å; Y1219-R1223 WeakPolarHBondContact O-CG 3.32Å; Y1219-R1223 PolarHBondContact O-N 3.21Å; Y1219-R1223 VanDerWaalsContact O-N 3.15Å
1224	L	84.6	Confident	84.7	Confident	9 Å²	9	37.9 Å²	37.9	5%	0.047	19%	0.186	C	C	.	.			trans	-123.7	135.2	178.6	-58.5	172.7	0	0	0	111.1	L1121 F1146 L1150 V1199 L1200 A1203 L1226	L1121-L1224 HydrophobicContact CD2-CD2 4.37Å; F1146-L1224 HydrophobicContact CD1-CD2 3.81Å; F1146-L1224 HydrophobicContact CE1-CD2 3.58Å; F1146-L1224 HydrophobicContact CG-CD2 4.48Å; F1146-L1224 HydrophobicContact CZ-CD2 4.08Å; L1150-L1224 WeakPolarHBondContact CD1-O 3.39Å; V1199-L1224 HydrophobicContact CG1-CD1 3.63Å; V1199-L1224 HydrophobicContact CG1-CD2 4.37Å; L1200-L1224 HydrophobicContact CD2-CD1 4.06Å; A1203-L1224 HydrophobicContact CB-CD1 4.49Å; L1224-L1226 HydrophobicContact CB-CD2 4.3Å
1225	D	83.7	Confident	85	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.011	15%	0.149	C	C	.	.			trans	-97.7	92.8	172.2	-165.3	-5.4	0	0	0	110.9	A1145 N1148 L1150 R1227 I1228	A1145-D1225 PolarHBondContact O-N 2.91Å; N1148-D1225 HydrophobicContact CB-CB 4.01Å; N1148-D1225 PolarHBondContact ND2-OD2 3.26Å; L1150-D1225 HydrophobicContact CD1-CB 3.98Å; L1150-D1225 HydrophobicContact CD2-CB 4.12Å; L1150-D1225 HydrophobicContact CG-CB 3.96Å; D1225-R1227 VanDerWaalsContact C-N 3.28Å; D1225-R1227 PolarHBondContact O-N 3.25Å; D1225-R1227 WeakPolarHBondContact OD1-CB 3.14Å; D1225-R1227 IonicContact OD1-CZ 2.97Å; D1225-R1227 PolarHBondContact OD1-N 3.4Å; D1225-R1227 IonicContact OD1-NE 2.73Å; D1225-R1227 PolarHBondContact OD1-NE 3.27Å; D1225-R1227 IonicContact OD1-NH2 3.13Å; D1225-R1227 PolarHBondContact OD1-NH2 3.23Å; D1225-R1227 IonicContact OD2-CZ 3.08Å; D1225-R1227 IonicContact OD2-NE 3.36Å; D1225-R1227 IonicContact OD2-NH2 2.7Å; D1225-R1227 PolarHBondContact OD2-NH2 3.47Å; D1225-I1228 HydrophobicContact CB-CG2 4.47Å; D1225-I1228 WeakPolarHBondContact O-CG2 3.33Å
1226	L	86.7	Confident	85.4	Confident	6 Å²	6	30.7 Å²	30.7	3%	0.031	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.5	-179	-58.4	-178.4	0	0	0	113.2	A1145 L1168 D1184 L1185 I1188 F1196 L1224 I1228 V1229 P1230	A1145-L1226 HydrophobicContact CB-CD2 4.29Å; L1168-L1226 HydrophobicContact CD1-CD1 3.89Å; D1184-L1226 HydrophobicContact CB-CD1 4.4Å; L1185-L1226 HydrophobicContact CD2-CD1 3.89Å; L1185-L1226 HydrophobicContact CG-CD1 4.48Å; I1188-L1226 HydrophobicContact CD1-CB 4.36Å; I1188-L1226 HydrophobicContact CD1-CD1 4.46Å; I1188-L1226 HydrophobicContact CD1-CD2 4.22Å; F1196-L1226 HydrophobicContact CD1-CD2 3.86Å; F1196-L1226 HydrophobicContact CE1-CD2 3.47Å; F1196-L1226 VanDerWaalsContact CE1-CD2 3.47Å; F1196-L1226 HydrophobicContact CZ-CD2 4.34Å; L1224-L1226 HydrophobicContact CB-CD2 4.3Å; L1226-I1228 VanDerWaalsContact C-N 3.29Å; L1226-I1228 PolarHBondContact O-N 3.09Å; L1226-V1229 PolarHBondContact O-N 2.9Å; L1226-P1230 WeakPolarHBondContact O-CD 3.4Å
1227	R	82.7	Confident	86.2	Confident	98 Å²	98	29.4 Å²	29.4	37%	0.37	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-30.3	-174.9	-57.6	171.5	-61.9	174	7.9	112.6	D1225 I1250	D1225-R1227 VanDerWaalsContact C-N 3.28Å; D1225-R1227 PolarHBondContact O-N 3.25Å; D1225-R1227 WeakPolarHBondContact OD1-CB 3.14Å; D1225-R1227 IonicContact OD1-CZ 2.97Å; D1225-R1227 PolarHBondContact OD1-N 3.4Å; D1225-R1227 IonicContact OD1-NE 2.73Å; D1225-R1227 PolarHBondContact OD1-NE 3.27Å; D1225-R1227 IonicContact OD1-NH2 3.13Å; D1225-R1227 PolarHBondContact OD1-NH2 3.23Å; D1225-R1227 IonicContact OD2-CZ 3.08Å; D1225-R1227 IonicContact OD2-NE 3.36Å; D1225-R1227 IonicContact OD2-NH2 2.7Å; D1225-R1227 PolarHBondContact OD2-NH2 3.47Å; R1227-I1250 HydrophobicContact CB-CD1 4.41Å
1228	I	86.6	Confident	86.8	Confident	4 Å²	4	28.5 Å²	28.5	2%	0.021	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-25	-176	-169.8	162	0	0	0	113.3	D1225 L1226 L1231 V1232 L1255	D1225-I1228 HydrophobicContact CB-CG2 4.47Å; D1225-I1228 WeakPolarHBondContact O-CG2 3.33Å; L1226-I1228 VanDerWaalsContact C-N 3.29Å; L1226-I1228 PolarHBondContact O-N 3.09Å; I1228-L1231 WeakPolarHBondContact O-CA 3.48Å; I1228-L1231 WeakPolarHBondContact O-CB 3.33Å; I1228-L1231 PolarHBondContact O-N 3.32Å; I1228-V1232 HydrophobicContact CD1-CG2 4.27Å; I1228-V1232 HydrophobicContact CG1-CG2 3.71Å; I1228-V1232 PolarHBondContact O-N 3.01Å; I1228-L1255 HydrophobicContact CD1-CD1 3.91Å; I1228-L1255 HydrophobicContact CG1-CD1 4.11Å
1229	V	90.6	Very high	87.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-46.7	-53.8	179.8	177	0	0	0	0	113.1	A1141 S1144 A1145 I1188 F1196 L1226 L1231 V1232 Y1233	A1141-V1229 HydrophobicContact CB-CG1 4.24Å; S1144-V1229 WeakPolarHBondContact OG-CA 3.22Å; A1145-V1229 HydrophobicContact CB-CG2 4Å; I1188-V1229 HydrophobicContact CG1-CG1 4.39Å; I1188-V1229 HydrophobicContact CG2-CG1 4.31Å; F1196-V1229 HydrophobicContact CE1-CG2 4.36Å; F1196-V1229 HydrophobicContact CE2-CG1 3.85Å; F1196-V1229 HydrophobicContact CZ-CB 4.37Å; F1196-V1229 HydrophobicContact CZ-CG1 3.75Å; F1196-V1229 HydrophobicContact CZ-CG2 3.73Å; L1226-V1229 PolarHBondContact O-N 2.9Å; V1229-L1231 VanDerWaalsContact C-N 3.27Å; V1229-L1231 PolarHBondContact O-N 3.2Å; V1229-V1232 PolarHBondContact O-N 3.08Å; V1229-Y1233 WeakPolarHBondContact O-CB 3.42Å; V1229-Y1233 PolarHBondContact O-N 3.04Å
1230	P	90.3	Very high	87.9	Confident	18 Å²	18	32.5 Å²	32.5	12%	0.117	17%	0.165	C	C	.	.	H	α-helix	trans	-66.2	-26.9	179.5	24.6	-35.2	0	0	0	114.3	C1187 L1226 K1234	C1187-P1230 HydrophobicContact CB-CG 4.07Å; C1187-P1230 WeakPolarHBondContact O-CB 3.28Å; L1226-P1230 WeakPolarHBondContact O-CD 3.4Å; P1230-K1234 WeakPolarHBondContact O-CG 3.36Å; P1230-K1234 PolarHBondContact O-N 3.31Å
1231	L	89.9	Confident	88.5	Confident	9 Å²	9	29.4 Å²	29.4	5%	0.047	15%	0.148	C	C	.	.	H	α-helix	trans	-75.6	-43.6	179.2	-54.6	172.5	0	0	0	110.6	I1228 V1229 Y1233 K1234 W1235 T1244 C1248 I1250 L1255	I1228-L1231 WeakPolarHBondContact O-CA 3.48Å; I1228-L1231 WeakPolarHBondContact O-CB 3.33Å; I1228-L1231 PolarHBondContact O-N 3.32Å; V1229-L1231 VanDerWaalsContact C-N 3.27Å; V1229-L1231 PolarHBondContact O-N 3.2Å; L1231-Y1233 VanDerWaalsContact C-N 3.35Å; L1231-K1234 PolarHBondContact O-N 3.27Å; L1231-W1235 WeakPolarHBondContact O-CB 3.41Å; L1231-W1235 PolarHBondContact O-N 3.29Å; L1231-T1244 HydrophobicContact CB-CG2 3.87Å; L1231-T1244 HydrophobicContact CD2-CG2 4.15Å; L1231-C1248 HydrophobicContact CD1-CB 4.01Å; L1231-C1248 WeakPolarHBondContact CD1-SG 3.48Å; L1231-C1248 HydrophobicContact CD2-CB 3.79Å; L1231-I1250 HydrophobicContact CD1-CD1 3.89Å; L1231-L1255 HydrophobicContact CB-CD1 4.35Å; L1231-L1255 HydrophobicContact CD1-CD1 4.06Å
1232	V	92.8	Very high	88.7	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.7	-39.6	176.3	173.5	0	0	0	0	110.5	A1140 I1228 V1229 K1234 W1235 A1236 L1259 L1262 I1292	A1140-V1232 HydrophobicContact CB-CG1 4.15Å; A1140-V1232 WeakPolarHBondContact O-CG1 3.4Å; I1228-V1232 HydrophobicContact CD1-CG2 4.27Å; I1228-V1232 HydrophobicContact CG1-CG2 3.71Å; I1228-V1232 PolarHBondContact O-N 3.01Å; V1229-V1232 PolarHBondContact O-N 3.08Å; V1232-K1234 PolarHBondContact O-N 3.5Å; V1232-W1235 CarbonylContact O-C 3.59Å; V1232-W1235 PolarHBondContact O-N 2.84Å; V1232-A1236 WeakPolarHBondContact O-CB 3.44Å; V1232-A1236 PolarHBondContact O-N 3.41Å; V1232-L1259 HydrophobicContact CG2-CD2 3.79Å; V1232-L1262 HydrophobicContact CG1-CD2 3.72Å; V1232-L1262 HydrophobicContact CG2-CD2 4.2Å; V1232-I1292 HydrophobicContact CG1-CD1 4.5Å
1233	Y	93.5	Very high	88.8	Confident	59 Å²	59	31.8 Å²	31.8	23%	0.231	17%	0.17	C	C	.	.	H	α-helix	trans	-57.3	-47.9	173.3	-177	-108.8	0	0	0	111.9	P1137 D1138 A1141 P1189 H1191 V1229 L1231 W1235 A1236 N1237	P1137-Y1233 HydrophobicContact CB-CE2 4.4Å; D1138-Y1233 WeakPolarHBondContact OD1-CE2 3.44Å; A1141-Y1233 HydrophobicContact CB-CD2 4.08Å; A1141-Y1233 HydrophobicContact CB-CG 4.41Å; P1189-Y1233 HydrophobicContact CB-CE1 4.39Å; P1189-Y1233 HydrophobicContact CG-CD1 3.59Å; P1189-Y1233 HydrophobicContact CG-CD2 4.38Å; P1189-Y1233 HydrophobicContact CG-CE1 3.91Å; P1189-Y1233 HydrophobicContact CG-CG 3.83Å; H1191-Y1233 AromaticContact CE1-CZ 3.76Å; H1191-Y1233 PolarHBondContact CE1-OH 3.3Å; V1229-Y1233 WeakPolarHBondContact O-CB 3.42Å; V1229-Y1233 PolarHBondContact O-N 3.04Å; L1231-Y1233 VanDerWaalsContact C-N 3.35Å; Y1233-W1235 PolarHBondContact O-N 3.22Å; Y1233-A1236 PolarHBondContact O-N 2.58Å; Y1233-N1237 VanDerWaalsContact CE1-ND2 3.34Å; Y1233-N1237 WeakPolarHBondContact CE1-ND2 3.34Å; Y1233-N1237 VanDerWaalsContact CE2-ND2 3.32Å; Y1233-N1237 WeakPolarHBondContact CE2-ND2 3.38Å; Y1233-N1237 WeakPolarHBondContact O-CB 3.41Å; Y1233-N1237 PolarHBondContact O-N 2.89Å; Y1233-N1237 PolarHBondContact O-ND2 2.86Å
1234	K	91.9	Very high	88.9	Confident	60 Å²	60	30.5 Å²	30.5	26%	0.261	17%	0.166	S	C	.	.	H	α-helix	trans	-63.2	-42.3	175	-73.6	170.7	-178	161.5	0	111.9	P1230 L1231 V1232 N1237 Y1239	P1230-K1234 WeakPolarHBondContact O-CG 3.36Å; P1230-K1234 PolarHBondContact O-N 3.31Å; L1231-K1234 PolarHBondContact O-N 3.27Å; V1232-K1234 PolarHBondContact O-N 3.5Å; K1234-N1237 CarbonylContact O-C 3.5Å; K1234-N1237 PolarHBondContact O-N 2.85Å; K1234-Y1239 HydrophobicContact CB-CD2 4.15Å; K1234-Y1239 HydrophobicContact CB-CG 4.17Å; K1234-Y1239 WeakPolarHBondContact O-CB 3.25Å; K1234-Y1239 WeakPolarHBondContact O-CD2 3.3Å; K1234-Y1239 PolarHBondContact O-N 3.25Å
1235	W	93	Very high	88.9	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-61.5	-46.1	177.1	-177.9	-108.6	0	0	0	111.9	L1231 V1232 Y1233 N1237 G1238 Y1239 F1241 I1292 R1294 D1295 I1296 V1297	L1231-W1235 WeakPolarHBondContact O-CB 3.41Å; L1231-W1235 PolarHBondContact O-N 3.29Å; V1232-W1235 CarbonylContact O-C 3.59Å; V1232-W1235 PolarHBondContact O-N 2.84Å; Y1233-W1235 PolarHBondContact O-N 3.22Å; W1235-N1237 PolarHBondContact O-N 3.08Å; W1235-G1238 PolarHBondContact O-N 3.16Å; W1235-Y1239 WeakPolarHBondContact CZ3-O 3.03Å; W1235-F1241 HydrophobicContact CH2-CB 4.18Å; W1235-F1241 HydrophobicContact CH2-CD2 4.45Å; W1235-F1241 HydrophobicContact CZ3-CB 3.72Å; W1235-F1241 HydrophobicContact CZ3-CD2 4.17Å; W1235-F1241 HydrophobicContact CZ3-CG 4.47Å; W1235-I1292 PolarHBondContact NE1-O 2.93Å; W1235-R1294 VanDerWaalsContact CE3-NH2 3.27Å; W1235-R1294 HydrophobicContact CH2-CG 4.31Å; W1235-R1294 HydrophobicContact CZ2-CG 3.6Å; W1235-R1294 WeakPolarHBondContact CZ2-O 3.33Å; W1235-R1294 PolarHBondContact O-NH2 3.19Å; W1235-D1295 HydrophobicContact CH2-CB 4.09Å; W1235-I1296 HydrophobicContact CH2-CG2 4.45Å; W1235-V1297 HydrophobicContact CZ2-CG2 3.75Å
1236	A	94.1	Very high	88.6	Confident	4 Å²	4	35.5 Å²	35.5	3%	0.033	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-30.2	177.8	0	0	0	0	0	112.2	P1137 A1140 V1232 Y1233 G1238 L1291	P1137-A1236 HydrophobicContact CB-CB 3.93Å; A1140-A1236 HydrophobicContact CB-CB 4.02Å; V1232-A1236 WeakPolarHBondContact O-CB 3.44Å; V1232-A1236 PolarHBondContact O-N 3.41Å; Y1233-A1236 PolarHBondContact O-N 2.58Å; A1236-G1238 PolarHBondContact O-N 2.85Å; A1236-L1291 HydrophobicContact CB-CB 4.2Å; A1236-L1291 HydrophobicContact CB-CD1 4.46Å
1237	N	93.5	Very high	87.8	Confident	70 Å²	70	42.4 Å²	42.4	37%	0.374	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	13.5	171.9	-75.3	-62.1	0	0	0	114.5	Y1233 K1234 W1235 Y1239	Y1233-N1237 VanDerWaalsContact CE1-ND2 3.34Å; Y1233-N1237 WeakPolarHBondContact CE1-ND2 3.34Å; Y1233-N1237 VanDerWaalsContact CE2-ND2 3.32Å; Y1233-N1237 WeakPolarHBondContact CE2-ND2 3.38Å; Y1233-N1237 WeakPolarHBondContact O-CB 3.41Å; Y1233-N1237 PolarHBondContact O-N 2.89Å; Y1233-N1237 PolarHBondContact O-ND2 2.86Å; K1234-N1237 CarbonylContact O-C 3.5Å; K1234-N1237 PolarHBondContact O-N 2.85Å; W1235-N1237 PolarHBondContact O-N 3.08Å; N1237-Y1239 HydrophobicContact CB-CD2 4.1Å; N1237-Y1239 HydrophobicContact CB-CE2 4.07Å
1238	G	91.1	Very high	87.4	Confident	51 Å²	51	39.3 Å²	39.3	53%	0.526	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	9.2	170.8	0	0	0	0	0	116.2	W1235 A1236	W1235-G1238 PolarHBondContact O-N 3.16Å; A1236-G1238 PolarHBondContact O-N 2.85Å
1239	Y	90.7	Very high	87	Confident	120 Å²	120	47.1 Å²	47.1	47%	0.471	27%	0.266	S	S	.	.			trans	-63.6	146.5	176.6	-73.7	-113.6	0	0	0	111.3	K1234 W1235 N1237 R1294	K1234-Y1239 HydrophobicContact CB-CD2 4.15Å; K1234-Y1239 HydrophobicContact CB-CG 4.17Å; K1234-Y1239 WeakPolarHBondContact O-CB 3.25Å; K1234-Y1239 WeakPolarHBondContact O-CD2 3.3Å; K1234-Y1239 PolarHBondContact O-N 3.25Å; W1235-Y1239 WeakPolarHBondContact CZ3-O 3.03Å; N1237-Y1239 HydrophobicContact CB-CD2 4.1Å; N1237-Y1239 HydrophobicContact CB-CE2 4.07Å; Y1239-R1294 PolarHBondContact O-NH2 2.64Å
1240	S	89	Confident	86.5	Confident	43 Å²	43	48.7 Å²	48.7	30%	0.301	27%	0.273	S	S	.	.			trans	-66.7	152	174.3	73.2	0	0	0	0	111.6	S1242 A1243 T1244	S1240-S1242 VanDerWaalsContact C-N 3.26Å; S1240-S1242 PolarHBondContact O-N 3.21Å; S1240-A1243 PolarHBondContact O-N 2.84Å; S1240-A1243 WeakPolarHBondContact OG-CB 3.42Å; S1240-A1243 PolarHBondContact OG-N 3.17Å; S1240-T1244 PolarHBondContact O-N 2.97Å; S1240-T1244 VanDerWaalsContact O-N 3.12Å; S1240-T1244 PolarHBondContact O-OG1 3.03Å
1241	F	88.9	Confident	86.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.6	-40.3	-176.2	-174.4	-101.9	0	0	0	110.9	L468 L490 W1235 A1243 T1244 V1245 E1252 L1255 I1256 I1296	L468-F1241 HydrophobicContact CD1-CD1 3.96Å; L468-F1241 HydrophobicContact CD1-CE1 4.38Å; L468-F1241 HydrophobicContact CD2-CD1 4.21Å; L490-F1241 HydrophobicContact CD2-CE1 3.97Å; L490-F1241 HydrophobicContact CD2-CZ 4.12Å; W1235-F1241 HydrophobicContact CH2-CB 4.18Å; W1235-F1241 HydrophobicContact CH2-CD2 4.45Å; W1235-F1241 HydrophobicContact CZ3-CB 3.72Å; W1235-F1241 HydrophobicContact CZ3-CD2 4.17Å; W1235-F1241 HydrophobicContact CZ3-CG 4.47Å; F1241-A1243 VanDerWaalsContact C-N 3.28Å; F1241-A1243 PolarHBondContact O-N 3.47Å; F1241-T1244 PolarHBondContact O-N 3.31Å; F1241-T1244 VanDerWaalsContact O-N 3.16Å; F1241-V1245 HydrophobicContact CD1-CG2 3.97Å; F1241-V1245 HydrophobicContact CE1-CG2 3.56Å; F1241-V1245 HydrophobicContact CE2-CG2 4.15Å; F1241-V1245 HydrophobicContact CG-CG2 4.44Å; F1241-V1245 HydrophobicContact CZ-CG2 3.65Å; F1241-V1245 WeakPolarHBondContact O-CG2 3.34Å; F1241-V1245 PolarHBondContact O-N 2.97Å; F1241-E1252 HydrophobicContact CE1-CB 4.21Å; F1241-E1252 HydrophobicContact CE1-CG 4.31Å; F1241-E1252 HydrophobicContact CZ-CB 4.29Å; F1241-L1255 HydrophobicContact CE2-CD2 3.85Å; F1241-L1255 HydrophobicContact CE2-CG 4.31Å; F1241-L1255 HydrophobicContact CZ-CD2 4.24Å; F1241-I1256 HydrophobicContact CD2-CD1 4.1Å; F1241-I1256 HydrophobicContact CE2-CD1 3.37Å; F1241-I1256 HydrophobicContact CE2-CG1 3.99Å; F1241-I1256 HydrophobicContact CZ-CD1 3.67Å; F1241-I1256 HydrophobicContact CZ-CG1 3.81Å; F1241-I1296 HydrophobicContact CB-CG2 4.12Å; F1241-I1296 HydrophobicContact CD1-CG2 4.32Å; F1241-I1296 HydrophobicContact CD2-CG2 3.8Å; F1241-I1296 HydrophobicContact CE2-CG2 4.3Å; F1241-I1296 HydrophobicContact CG-CG2 3.81Å
1242	S	85	Confident	86.2	Confident	47 Å²	47	51.4 Å²	51.4	33%	0.329	29%	0.289	S	S	.	.	H	α-helix	trans	-57.4	-36.9	173.8	-174.3	0	0	0	0	113.5	S1240 S1246	S1240-S1242 VanDerWaalsContact C-N 3.26Å; S1240-S1242 PolarHBondContact O-N 3.21Å; S1242-S1246 WeakPolarHBondContact O-CB 3.47Å; S1242-S1246 PolarHBondContact O-N 3.07Å
1243	A	84.8	Confident	85.9	Confident	35 Å²	35	51.6 Å²	51.6	29%	0.289	29%	0.291	S	S	.	.	H	α-helix	trans	-77.5	-27.3	179.6	0	0	0	0	0	112.6	S1240 F1241 S1246	S1240-A1243 PolarHBondContact O-N 2.84Å; S1240-A1243 WeakPolarHBondContact OG-CB 3.42Å; S1240-A1243 PolarHBondContact OG-N 3.17Å; F1241-A1243 VanDerWaalsContact C-N 3.28Å; F1241-A1243 PolarHBondContact O-N 3.47Å; A1243-S1246 PolarHBondContact O-OG 3.18Å
1244	T	84.5	Confident	85.5	Confident	3 Å²	3	50 Å²	50	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-73.5	-44.8	175	-54.8	0	0	0	0	111	L1231 S1240 F1241 L1255	L1231-T1244 HydrophobicContact CB-CG2 3.87Å; L1231-T1244 HydrophobicContact CD2-CG2 4.15Å; S1240-T1244 PolarHBondContact O-N 2.97Å; S1240-T1244 VanDerWaalsContact O-N 3.12Å; S1240-T1244 PolarHBondContact O-OG1 3.03Å; F1241-T1244 PolarHBondContact O-N 3.31Å; F1241-T1244 VanDerWaalsContact O-N 3.16Å; T1244-L1255 HydrophobicContact CG2-CD2 4.3Å
1245	V	82.9	Confident	85.3	Confident	23 Å²	23	47.4 Å²	47.4	14%	0.139	28%	0.277	C	S	.	.	H	α-helix	trans	-70.6	-35.9	-177.7	174.1	0	0	0	0	112.4	F1241 K1247 C1248 E1252 L1255	F1241-V1245 HydrophobicContact CD1-CG2 3.97Å; F1241-V1245 HydrophobicContact CE1-CG2 3.56Å; F1241-V1245 HydrophobicContact CE2-CG2 4.15Å; F1241-V1245 HydrophobicContact CG-CG2 4.44Å; F1241-V1245 HydrophobicContact CZ-CG2 3.65Å; F1241-V1245 WeakPolarHBondContact O-CG2 3.34Å; F1241-V1245 PolarHBondContact O-N 2.97Å; V1245-K1247 PolarHBondContact O-N 2.89Å; V1245-C1248 PolarHBondContact O-N 3.44Å; V1245-E1252 HydrophobicContact CG1-CG 3.79Å; V1245-E1252 HydrophobicContact CG2-CG 4.22Å; V1245-L1255 HydrophobicContact CG2-CD2 3.96Å
1246	S	77.3	Confident	85.1	Confident	93 Å²	93	47.4 Å²	47.4	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-12.9	-175.8	68.9	0	0	0	0	114.7	S1242 A1243	S1242-S1246 WeakPolarHBondContact O-CB 3.47Å; S1242-S1246 PolarHBondContact O-N 3.07Å; A1243-S1246 PolarHBondContact O-OG 3.18Å
1247	K	70.2	Confident	84.7	Confident	151 Å²	151	52.5 Å²	52.5	66%	0.657	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	14.9	-179.2	-63	-174.7	177.6	-176.2	0	112.6	V1245	V1245-K1247 PolarHBondContact O-N 2.89Å
1248	C	74.4	Confident	84.4	Confident	33 Å²	33	49.4 Å²	49.4	22%	0.223	28%	0.283	C	S	.	.			trans	-140.4	142.3	-173.1	-167.3	0	0	0	0	113	L1231 V1245 I1250	L1231-C1248 HydrophobicContact CD1-CB 4.01Å; L1231-C1248 WeakPolarHBondContact CD1-SG 3.48Å; L1231-C1248 HydrophobicContact CD2-CB 3.79Å; V1245-C1248 PolarHBondContact O-N 3.44Å; C1248-I1250 VanDerWaalsContact C-N 3.28Å; C1248-I1250 WeakPolarHBondContact SG-CB 3.47Å; C1248-I1250 WeakPolarHBondContact SG-CG1 3.39Å; C1248-I1250 PolarHBondContact SG-N 3.47Å
1249	D	77.9	Confident	84.4	Confident	169 Å²	169	47.1 Å²	47.1	90%	0.904	26%	0.259	S	S	*	.			trans	-82.8	-3.4	173	-61.8	-32.6	0	0	0	113.3	P1251	D1249-P1251 WeakPolarHBondContact O-CD 3.48Å
1250	I	80.7	Confident	84.2	Confident	32 Å²	32	44 Å²	44	16%	0.164	25%	0.25	C	C	.	.	S	Bend	trans	-74.5	125.9	179.7	-62.4	171.8	0	0	0	109.2	R1227 L1231 C1248 E1252 L1255	R1227-I1250 HydrophobicContact CB-CD1 4.41Å; L1231-I1250 HydrophobicContact CD1-CD1 3.89Å; C1248-I1250 VanDerWaalsContact C-N 3.28Å; C1248-I1250 WeakPolarHBondContact SG-CB 3.47Å; C1248-I1250 WeakPolarHBondContact SG-CG1 3.39Å; C1248-I1250 PolarHBondContact SG-N 3.47Å; I1250-E1252 PolarHBondContact O-N 3.27Å; I1250-L1255 HydrophobicContact CG2-CB 4.24Å
1251	P	84.4	Confident	84.1	Confident	53 Å²	53	44.4 Å²	44.4	34%	0.344	25%	0.247	S	C	.	.			trans	-58	139.8	176.3	-27.5	37.5	0	0	0	112.3	D1249 G1253 S1254 L1255	D1249-P1251 WeakPolarHBondContact O-CD 3.48Å; P1251-G1253 VanDerWaalsContact C-N 3.31Å; P1251-G1253 PolarHBondContact O-N 3.34Å; P1251-S1254 WeakPolarHBondContact O-CA 3.27Å; P1251-S1254 WeakPolarHBondContact O-CB 3.46Å; P1251-S1254 PolarHBondContact O-N 2.99Å; P1251-L1255 PolarHBondContact O-N 3.3Å
1252	E	88.6	Confident	84.2	Confident	32 Å²	32	44.4 Å²	44.4	15%	0.15	25%	0.247	C	C	.	.	H	α-helix	trans	-50.2	-46.6	-175.2	-63.4	161.9	169.8	0	0	113	S470 L490 F1241 V1245 I1250 S1254 L1255 I1256	S470-E1252 WeakPolarHBondContact CB-OE2 3.45Å; S470-E1252 VanDerWaalsContact OG-CD 3.31Å; S470-E1252 PolarHBondContact OG-OE1 3.06Å; S470-E1252 PolarHBondContact OG-OE2 2.98Å; L490-E1252 HydrophobicContact CD2-CB 3.88Å; L490-E1252 HydrophobicContact CG-CB 4.07Å; F1241-E1252 HydrophobicContact CE1-CB 4.21Å; F1241-E1252 HydrophobicContact CE1-CG 4.31Å; F1241-E1252 HydrophobicContact CZ-CB 4.29Å; V1245-E1252 HydrophobicContact CG1-CG 3.79Å; V1245-E1252 HydrophobicContact CG2-CG 4.22Å; I1250-E1252 PolarHBondContact O-N 3.27Å; E1252-S1254 VanDerWaalsContact C-N 3.32Å; E1252-S1254 PolarHBondContact O-N 3.09Å; E1252-L1255 PolarHBondContact O-N 3.33Å; E1252-I1256 WeakPolarHBondContact O-CG1 3.44Å; E1252-I1256 PolarHBondContact O-N 3.3Å
1253	G	86.5	Confident	84.4	Confident	4 Å²	4	42.5 Å²	42.5	4%	0.041	23%	0.233	C	C	.	.	H	α-helix	trans	-67.5	-30	178.5	0	0	0	0	0	113.9	G488 M489 P1251 K1257	G488-G1253 WeakPolarHBondContact O-CA 3.1Å; G488-G1253 PolarHBondContact O-N 3.25Å; M489-G1253 WeakPolarHBondContact O-CA 3.49Å; P1251-G1253 VanDerWaalsContact C-N 3.31Å; P1251-G1253 PolarHBondContact O-N 3.34Å; G1253-K1257 WeakPolarHBondContact O-CB 3.5Å; G1253-K1257 PolarHBondContact O-N 2.78Å
1254	S	85.3	Confident	84.4	Confident	26 Å²	26	43.2 Å²	43.2	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-71.1	-40.8	173.6	-63.8	0	0	0	0	111	R426 P1251 E1252 K1257 S1258	R426-S1254 PolarHBondContact NH1-OG 2.73Å; P1251-S1254 WeakPolarHBondContact O-CA 3.27Å; P1251-S1254 WeakPolarHBondContact O-CB 3.46Å; P1251-S1254 PolarHBondContact O-N 2.99Å; E1252-S1254 VanDerWaalsContact C-N 3.32Å; E1252-S1254 PolarHBondContact O-N 3.09Å; S1254-K1257 WeakPolarHBondContact O-CB 3.44Å; S1254-K1257 PolarHBondContact O-N 3.25Å; S1254-S1258 PolarHBondContact O-N 3.35Å; S1254-S1258 PolarHBondContact O-OG 2.73Å
1255	L	88.8	Confident	84.7	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-46.1	174.1	-180	61.2	0	0	0	111.8	I1228 L1231 F1241 T1244 V1245 I1250 P1251 E1252 K1257 S1258 L1259	I1228-L1255 HydrophobicContact CD1-CD1 3.91Å; I1228-L1255 HydrophobicContact CG1-CD1 4.11Å; L1231-L1255 HydrophobicContact CB-CD1 4.35Å; L1231-L1255 HydrophobicContact CD1-CD1 4.06Å; F1241-L1255 HydrophobicContact CE2-CD2 3.85Å; F1241-L1255 HydrophobicContact CE2-CG 4.31Å; F1241-L1255 HydrophobicContact CZ-CD2 4.24Å; T1244-L1255 HydrophobicContact CG2-CD2 4.3Å; V1245-L1255 HydrophobicContact CG2-CD2 3.96Å; I1250-L1255 HydrophobicContact CG2-CB 4.24Å; P1251-L1255 PolarHBondContact O-N 3.3Å; E1252-L1255 PolarHBondContact O-N 3.33Å; L1255-K1257 VanDerWaalsContact C-N 3.32Å; L1255-K1257 PolarHBondContact O-N 3.5Å; L1255-S1258 PolarHBondContact O-N 2.95Å; L1255-L1259 HydrophobicContact CG-CD1 4.21Å; L1255-L1259 WeakPolarHBondContact O-CG 3.3Å; L1255-L1259 PolarHBondContact O-N 3.34Å
1256	I	89.2	Confident	85.1	Confident	3 Å²	3	42 Å²	42	2%	0.015	22%	0.223	C	C	.	.	H	α-helix	trans	-59.9	-43.1	175.4	-65.5	-64	0	0	0	111.2	L490 P491 F1241 E1252 S1258 L1259 L1260 I1296 V1297	L490-I1256 HydrophobicContact CD2-CD1 4.46Å; L490-I1256 HydrophobicContact CD2-CG1 3.68Å; P491-I1256 HydrophobicContact CG-CG2 3.83Å; F1241-I1256 HydrophobicContact CD2-CD1 4.1Å; F1241-I1256 HydrophobicContact CE2-CD1 3.37Å; F1241-I1256 HydrophobicContact CE2-CG1 3.99Å; F1241-I1256 HydrophobicContact CZ-CD1 3.67Å; F1241-I1256 HydrophobicContact CZ-CG1 3.81Å; E1252-I1256 WeakPolarHBondContact O-CG1 3.44Å; E1252-I1256 PolarHBondContact O-N 3.3Å; I1256-S1258 VanDerWaalsContact C-N 3.32Å; I1256-S1258 PolarHBondContact O-N 3.47Å; I1256-L1259 HydrophobicContact CD1-CD1 4.45Å; I1256-L1259 PolarHBondContact O-N 2.94Å; I1256-L1260 HydrophobicContact CG2-CD1 3.98Å; I1256-L1260 HydrophobicContact CG2-CG 4.31Å; I1256-L1260 WeakPolarHBondContact O-CG 3.33Å; I1256-L1260 PolarHBondContact O-N 2.79Å; I1256-I1296 HydrophobicContact CD1-CG1 4.42Å; I1256-I1296 HydrophobicContact CD1-CG2 3.66Å; I1256-V1297 HydrophobicContact CD1-CG2 3.97Å
1257	K	84.6	Confident	85.7	Confident	111 Å²	111	40.9 Å²	40.9	48%	0.483	20%	0.204	S	C	.	.	H	α-helix	trans	-58.1	-46	177.2	-173.8	-172.5	173.6	-165.5	0	111.2	G1253 S1254 L1255 L1260 Q1261	G1253-K1257 WeakPolarHBondContact O-CB 3.5Å; G1253-K1257 PolarHBondContact O-N 2.78Å; S1254-K1257 WeakPolarHBondContact O-CB 3.44Å; S1254-K1257 PolarHBondContact O-N 3.25Å; L1255-K1257 VanDerWaalsContact C-N 3.32Å; L1255-K1257 PolarHBondContact O-N 3.5Å; K1257-L1260 PolarHBondContact O-N 3.19Å; K1257-Q1261 WeakPolarHBondContact O-CG 3.23Å; K1257-Q1261 PolarHBondContact O-N 2.86Å
1258	S	87.2	Confident	86.6	Confident	5 Å²	5	34.9 Å²	34.9	4%	0.035	18%	0.179	C	C	.	.	H	α-helix	trans	-67.7	-34.1	179.1	-56.2	0	0	0	0	112.7	N1148 S1254 L1255 I1256 Q1261 L1262	N1148-S1258 PolarHBondContact ND2-OG 3.32Å; N1148-S1258 PolarHBondContact OD1-OG 3.27Å; S1254-S1258 PolarHBondContact O-N 3.35Å; S1254-S1258 PolarHBondContact O-OG 2.73Å; L1255-S1258 PolarHBondContact O-N 2.95Å; I1256-S1258 VanDerWaalsContact C-N 3.32Å; I1256-S1258 PolarHBondContact O-N 3.47Å; S1258-Q1261 PolarHBondContact O-N 3.47Å; S1258-L1262 WeakPolarHBondContact O-CB 3.2Å; S1258-L1262 PolarHBondContact O-N 3.37Å
1259	L	90.8	Very high	87.5	Confident	3 Å²	3	33.3 Å²	33.3	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-65.6	-39.4	172.3	-71.5	167.9	0	0	0	112.2	V1232 L1255 I1256 L1262 D1263 I1292 V1297	V1232-L1259 HydrophobicContact CG2-CD2 3.79Å; L1255-L1259 HydrophobicContact CG-CD1 4.21Å; L1255-L1259 WeakPolarHBondContact O-CG 3.3Å; L1255-L1259 PolarHBondContact O-N 3.34Å; I1256-L1259 HydrophobicContact CD1-CD1 4.45Å; I1256-L1259 PolarHBondContact O-N 2.94Å; L1259-L1262 WeakPolarHBondContact O-CB 3.2Å; L1259-L1262 PolarHBondContact O-N 3.22Å; L1259-D1263 PolarHBondContact O-N 3.44Å; L1259-I1292 HydrophobicContact CD2-CG2 4.02Å; L1259-V1297 HydrophobicContact CB-CG1 4.18Å; L1259-V1297 HydrophobicContact CB-CG2 4.26Å; L1259-V1297 HydrophobicContact CD1-CG2 3.76Å
1260	L	87.5	Confident	88.2	Confident	55 Å²	55	25.4 Å²	25.4	29%	0.288	13%	0.126	S	C	.	.	H	α-helix	trans	-68.1	-38.9	175.2	-70.9	172.4	0	0	0	112.2	I1256 K1257 L1262 D1263 E1264 V1297	I1256-L1260 HydrophobicContact CG2-CD1 3.98Å; I1256-L1260 HydrophobicContact CG2-CG 4.31Å; I1256-L1260 WeakPolarHBondContact O-CG 3.33Å; I1256-L1260 PolarHBondContact O-N 2.79Å; K1257-L1260 PolarHBondContact O-N 3.19Å; L1260-L1262 VanDerWaalsContact C-N 3.3Å; L1260-D1263 PolarHBondContact O-N 2.94Å; L1260-E1264 PolarHBondContact O-N 3.39Å; L1260-V1297 HydrophobicContact CD2-CG1 3.91Å; L1260-V1297 WeakPolarHBondContact CD2-O 3.45Å; L1260-V1297 HydrophobicContact CG-CG1 4.39Å
1261	Q	86	Confident	88.7	Confident	50 Å²	50	25.5 Å²	25.5	23%	0.234	14%	0.135	C	C	.	.	H	α-helix	trans	-64.9	-36.8	173	-72.8	174.9	-52.2	0	0	111.6	A1147 K1257 S1258 E1264 L1265	A1147-Q1261 HydrophobicContact CB-CB 4.35Å; K1257-Q1261 WeakPolarHBondContact O-CG 3.23Å; K1257-Q1261 PolarHBondContact O-N 2.86Å; S1258-Q1261 PolarHBondContact O-N 3.47Å; Q1261-E1264 PolarHBondContact O-N 2.91Å; Q1261-L1265 WeakPolarHBondContact O-CB 3.37Å; Q1261-L1265 PolarHBondContact O-N 3.39Å
1262	L	91.4	Very high	89	Confident	1 Å²	1	23 Å²	23	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-66.7	-43	174.2	178.1	59.3	0	0	0	111.9	L1143 A1147 V1232 S1258 L1259 L1260 E1264 L1265 I1266 I1292	L1143-L1262 HydrophobicContact CB-CD1 3.74Å; A1147-L1262 HydrophobicContact CB-CB 3.83Å; A1147-L1262 HydrophobicContact CB-CD1 4.22Å; V1232-L1262 HydrophobicContact CG1-CD2 3.72Å; V1232-L1262 HydrophobicContact CG2-CD2 4.2Å; S1258-L1262 WeakPolarHBondContact O-CB 3.2Å; S1258-L1262 PolarHBondContact O-N 3.37Å; L1259-L1262 WeakPolarHBondContact O-CB 3.2Å; L1259-L1262 PolarHBondContact O-N 3.22Å; L1260-L1262 VanDerWaalsContact C-N 3.3Å; L1262-E1264 VanDerWaalsContact C-N 3.3Å; L1262-E1264 PolarHBondContact O-N 3.49Å; L1262-L1265 PolarHBondContact O-N 3.23Å; L1262-I1266 HydrophobicContact CD1-CD1 3.84Å; L1262-I1266 HydrophobicContact CD1-CG1 3.99Å; L1262-I1266 HydrophobicContact CG-CD1 3.8Å; L1262-I1266 HydrophobicContact CG-CG1 4.36Å; L1262-I1266 WeakPolarHBondContact O-CB 3.46Å; L1262-I1266 VanDerWaalsContact O-CG1 3.26Å; L1262-I1266 WeakPolarHBondContact O-CG1 3.45Å; L1262-I1266 PolarHBondContact O-N 3.43Å; L1262-I1292 HydrophobicContact CD2-CD1 3.5Å; L1262-I1292 HydrophobicContact CD2-CG1 4.41Å; L1262-I1292 HydrophobicContact CG-CD1 3.91Å
1263	D	89.9	Confident	89.2	Confident	7 Å²	7	21.5 Å²	21.5	4%	0.037	11%	0.112	C	C	.	.	H	α-helix	trans	-58.5	-43.8	174	178.5	67.1	0	0	0	111.4	L1259 L1260 I1266 R1267 R1289 H1293	L1259-D1263 PolarHBondContact O-N 3.44Å; L1260-D1263 PolarHBondContact O-N 2.94Å; D1263-I1266 PolarHBondContact O-N 2.76Å; D1263-R1267 WeakPolarHBondContact O-CB 3.44Å; D1263-R1267 PolarHBondContact O-N 2.89Å; D1263-R1289 WeakPolarHBondContact OD1-CG 3.5Å; D1263-R1289 IonicContact OD1-CZ 2.9Å; D1263-R1289 IonicContact OD1-NE 3.3Å; D1263-R1289 PolarHBondContact OD1-NE 2.93Å; D1263-R1289 IonicContact OD1-NH2 2.85Å; D1263-R1289 IonicContact OD2-NE 2.85Å; D1263-R1289 IonicContact OD2-NH2 3.57Å; D1263-H1293 IonicContact OD1-CD2 3.04Å; D1263-H1293 IonicContact OD1-CG 3.93Å; D1263-H1293 IonicContact OD2-CD2 3.36Å
1264	E	85	Confident	89.5	Confident	49 Å²	49	27.6 Å²	27.6	23%	0.229	13%	0.134	C	C	.	.	H	α-helix	trans	-62.1	-44.5	175.8	179.8	162.3	-159.8	0	0	112.1	K216 L1260 Q1261 L1262 R1267 H1268	K216-E1264 IonicContact NZ-OE2 3.89Å; L1260-E1264 PolarHBondContact O-N 3.39Å; Q1261-E1264 PolarHBondContact O-N 2.91Å; L1262-E1264 VanDerWaalsContact C-N 3.3Å; L1262-E1264 PolarHBondContact O-N 3.49Å; E1264-R1267 WeakPolarHBondContact O-CB 3.24Å; E1264-R1267 PolarHBondContact O-N 3.27Å; E1264-R1267 IonicContact OE1-NH2 2.65Å; E1264-H1268 PolarHBondContact O-N 3.5Å; E1264-H1268 VanDerWaalsContact O-N 3.08Å; E1264-H1268 PolarHBondContact O-ND1 3.43Å; E1264-H1268 IonicContact OE1-CE1 2.78Å
1265	L	89.9	Confident	89.6	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-61.6	-48.3	176.7	-177.9	62.5	0	0	0	111.8	L1122 F1146 A1147 Q1261 L1262 R1267 H1268 I1269	L1122-L1265 HydrophobicContact CD1-CD1 3.67Å; L1122-L1265 HydrophobicContact CD1-CD2 4.24Å; L1122-L1265 HydrophobicContact CD1-CG 4.44Å; F1146-L1265 HydrophobicContact CB-CD2 3.95Å; A1147-L1265 HydrophobicContact CB-CD2 4.41Å; Q1261-L1265 WeakPolarHBondContact O-CB 3.37Å; Q1261-L1265 PolarHBondContact O-N 3.39Å; L1262-L1265 PolarHBondContact O-N 3.23Å; L1265-R1267 VanDerWaalsContact C-N 3.28Å; L1265-R1267 PolarHBondContact O-N 3.01Å; L1265-H1268 PolarHBondContact O-N 3.32Å; L1265-H1268 VanDerWaalsContact O-N 3.16Å; L1265-I1269 HydrophobicContact CD1-CD1 4.15Å; L1265-I1269 HydrophobicContact CD1-CG1 4.38Å; L1265-I1269 HydrophobicContact CD2-CD1 4.44Å; L1265-I1269 HydrophobicContact CG-CD1 3.84Å; L1265-I1269 HydrophobicContact CG-CG1 4.46Å; L1265-I1269 WeakPolarHBondContact O-CG1 3.37Å; L1265-I1269 PolarHBondContact O-N 3.05Å
1266	I	92.6	Very high	89.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-41.2	177.8	-75.4	174.3	0	0	0	110.6	L1143 L1262 D1263 H1268 I1269 S1270 I1285 R1289 I1292	L1143-I1266 HydrophobicContact CD1-CG1 3.89Å; L1262-I1266 HydrophobicContact CD1-CD1 3.84Å; L1262-I1266 HydrophobicContact CD1-CG1 3.99Å; L1262-I1266 HydrophobicContact CG-CD1 3.8Å; L1262-I1266 HydrophobicContact CG-CG1 4.36Å; L1262-I1266 WeakPolarHBondContact O-CB 3.46Å; L1262-I1266 VanDerWaalsContact O-CG1 3.26Å; L1262-I1266 WeakPolarHBondContact O-CG1 3.45Å; L1262-I1266 PolarHBondContact O-N 3.43Å; D1263-I1266 PolarHBondContact O-N 2.76Å; I1266-H1268 PolarHBondContact O-N 3.18Å; I1266-I1269 PolarHBondContact O-N 2.93Å; I1266-S1270 WeakPolarHBondContact O-CB 3.39Å; I1266-S1270 PolarHBondContact O-N 2.79Å; I1266-I1285 HydrophobicContact CB-CG2 4.41Å; I1266-I1285 HydrophobicContact CG2-CG2 3.6Å; I1266-I1285 WeakPolarHBondContact CG2-O 3.32Å; I1266-R1289 HydrophobicContact CG2-CB 3.56Å; I1266-R1289 HydrophobicContact CG2-CG 3.85Å; I1266-I1292 HydrophobicContact CD1-CD1 3.34Å
1267	R	89.7	Confident	89.5	Confident	68 Å²	68	36.2 Å²	36.2	26%	0.257	18%	0.182	S	C	.	.	H	α-helix	trans	-61.5	-43	176	-175.9	178.1	58.9	64.3	2.6	112	G239 D1263 E1264 L1265 G1271	G239-R1267 PolarHBondContact O-NE 2.89Å; G239-R1267 PolarHBondContact O-NH2 3.33Å; D1263-R1267 WeakPolarHBondContact O-CB 3.44Å; D1263-R1267 PolarHBondContact O-N 2.89Å; E1264-R1267 WeakPolarHBondContact O-CB 3.24Å; E1264-R1267 PolarHBondContact O-N 3.27Å; E1264-R1267 IonicContact OE1-NH2 2.65Å; L1265-R1267 VanDerWaalsContact C-N 3.28Å; L1265-R1267 PolarHBondContact O-N 3.01Å; R1267-G1271 PolarHBondContact O-N 3.1Å
1268	H	89.2	Confident	89.7	Confident	26 Å²	26	33.8 Å²	33.8	12%	0.12	17%	0.174	C	C	.	.	H	α-helix	trans	-67.3	-44	176.8	-66.6	146.3	0	0	0	112	T1116 E1264 L1265 I1266 G1271 A1272	T1116-H1268 WeakPolarHBondContact CG2-CE1 3.36Å; T1116-H1268 VanDerWaalsContact CG2-ND1 3.27Å; T1116-H1268 WeakPolarHBondContact CG2-ND1 3.41Å; T1116-H1268 PolarHBondContact OG1-ND1 2.75Å; E1264-H1268 PolarHBondContact O-N 3.5Å; E1264-H1268 VanDerWaalsContact O-N 3.08Å; E1264-H1268 PolarHBondContact O-ND1 3.43Å; E1264-H1268 IonicContact OE1-CE1 2.78Å; L1265-H1268 PolarHBondContact O-N 3.32Å; L1265-H1268 VanDerWaalsContact O-N 3.16Å; I1266-H1268 PolarHBondContact O-N 3.18Å; H1268-G1271 PolarHBondContact O-N 3.36Å; H1268-A1272 WeakPolarHBondContact O-CB 3.49Å; H1268-A1272 PolarHBondContact O-N 3.48Å
1269	I	92.8	Very high	89.9	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-63.2	-46.2	177.5	-62.2	167.6	0	0	0	110.9	L1115 L1126 L1143 L1265 I1266 G1271 A1272 C1273 I1285	L1115-I1269 HydrophobicContact CD2-CG1 3.74Å; L1126-I1269 HydrophobicContact CD1-CD1 4.36Å; L1126-I1269 HydrophobicContact CD1-CG1 4.12Å; L1126-I1269 HydrophobicContact CD1-CG2 3.63Å; L1126-I1269 HydrophobicContact CD2-CG2 3.83Å; L1126-I1269 HydrophobicContact CG-CG2 4.41Å; L1143-I1269 HydrophobicContact CD1-CD1 4Å; L1143-I1269 HydrophobicContact CD2-CD1 3.77Å; L1265-I1269 HydrophobicContact CD1-CD1 4.15Å; L1265-I1269 HydrophobicContact CD1-CG1 4.38Å; L1265-I1269 HydrophobicContact CD2-CD1 4.44Å; L1265-I1269 HydrophobicContact CG-CD1 3.84Å; L1265-I1269 HydrophobicContact CG-CG1 4.46Å; L1265-I1269 WeakPolarHBondContact O-CG1 3.37Å; L1265-I1269 PolarHBondContact O-N 3.05Å; I1266-I1269 PolarHBondContact O-N 2.93Å; I1269-G1271 VanDerWaalsContact C-N 3.31Å; I1269-G1271 PolarHBondContact O-N 3.02Å; I1269-A1272 PolarHBondContact O-N 3.45Å; I1269-C1273 WeakPolarHBondContact O-CB 3.44Å; I1269-C1273 PolarHBondContact O-N 3.47Å; I1269-C1273 PolarHBondContact O-SG 3.05Å; I1269-I1285 HydrophobicContact CB-CD1 4.4Å; I1269-I1285 HydrophobicContact CG2-CD1 3.42Å; I1269-I1285 VanDerWaalsContact CG2-CD1 3.42Å
1270	S	92.6	Very high	90	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-60	-43	177.2	-179.7	0	0	0	0	111.7	I1266 C1273 R1274 S1282 D1286	I1266-S1270 WeakPolarHBondContact O-CB 3.39Å; I1266-S1270 PolarHBondContact O-N 2.79Å; S1270-C1273 PolarHBondContact O-N 2.95Å; S1270-R1274 VanDerWaalsContact O-CB 3.32Å; S1270-R1274 WeakPolarHBondContact O-CB 3.43Å; S1270-R1274 PolarHBondContact O-N 2.9Å; S1270-S1282 PolarHBondContact O-OG 2.99Å; S1270-S1282 PolarHBondContact OG-OG 3.4Å; S1270-D1286 VanDerWaalsContact CB-OD1 3.25Å; S1270-D1286 WeakPolarHBondContact CB-OD1 3.34Å; S1270-D1286 PolarHBondContact OG-OD1 3.3Å; S1270-D1286 PolarHBondContact OG-OD2 2.93Å
1271	G	90.8	Very high	90.2	Very high	33 Å²	33	42.3 Å²	42.3	34%	0.34	22%	0.215	S	C	.	.	H	α-helix	trans	-58	-48.1	174	0	0	0	0	0	112.6	R1267 H1268 I1269 R1274 Q1275	R1267-G1271 PolarHBondContact O-N 3.1Å; H1268-G1271 PolarHBondContact O-N 3.36Å; I1269-G1271 VanDerWaalsContact C-N 3.31Å; I1269-G1271 PolarHBondContact O-N 3.02Å; G1271-R1274 PolarHBondContact O-N 3.02Å; G1271-Q1275 WeakPolarHBondContact O-CB 3.35Å; G1271-Q1275 PolarHBondContact O-N 3.46Å
1272	A	91.6	Very high	90.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-53.2	176.7	0	0	0	0	0	111.4	F1111 E1114 H1268 I1269 R1274 Q1275 F1276	F1111-A1272 HydrophobicContact CD2-CB 4.34Å; F1111-A1272 HydrophobicContact CE1-CB 4.19Å; F1111-A1272 HydrophobicContact CE2-CB 3.9Å; F1111-A1272 HydrophobicContact CZ-CB 3.81Å; E1114-A1272 HydrophobicContact CB-CB 3.73Å; E1114-A1272 HydrophobicContact CG-CB 4.38Å; H1268-A1272 WeakPolarHBondContact O-CB 3.49Å; H1268-A1272 PolarHBondContact O-N 3.48Å; I1269-A1272 PolarHBondContact O-N 3.45Å; A1272-R1274 PolarHBondContact O-N 3.39Å; A1272-Q1275 PolarHBondContact O-N 3.06Å; A1272-F1276 WeakPolarHBondContact O-CD2 3.49Å; A1272-F1276 PolarHBondContact O-N 3.31Å
1273	C	92.2	Very high	90.6	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-54.6	-41.2	178.5	-68.7	0	0	0	0	112.1	I1269 S1270 G1277 N1278	I1269-C1273 WeakPolarHBondContact O-CB 3.44Å; I1269-C1273 PolarHBondContact O-N 3.47Å; I1269-C1273 PolarHBondContact O-SG 3.05Å; S1270-C1273 PolarHBondContact O-N 2.95Å; C1273-G1277 PolarHBondContact O-N 3.28Å; C1273-G1277 VanDerWaalsContact O-N 3.17Å; C1273-N1278 HydrophobicContact CB-CB 4.41Å; C1273-N1278 CarbonylContact O-C 3.59Å; C1273-N1278 PolarHBondContact O-N 2.96Å
1274	R	91.6	Very high	90.8	Very high	132 Å²	132	48.5 Å²	48.5	50%	0.498	25%	0.246	S	C	.	.	H	α-helix	trans	-66.5	-43.2	176.6	-170.8	-178.8	-59.3	167.7	1.4	112.6	S1270 G1271 A1272 F1276 G1277 D1286	S1270-R1274 VanDerWaalsContact O-CB 3.32Å; S1270-R1274 WeakPolarHBondContact O-CB 3.43Å; S1270-R1274 PolarHBondContact O-N 2.9Å; G1271-R1274 PolarHBondContact O-N 3.02Å; A1272-R1274 PolarHBondContact O-N 3.39Å; R1274-F1276 VanDerWaalsContact C-N 3.31Å; R1274-F1276 PolarHBondContact O-N 2.89Å; R1274-G1277 PolarHBondContact O-N 3.35Å; R1274-D1286 IonicContact NH2-OD2 2.77Å; R1274-D1286 PolarHBondContact NH2-OD2 3Å
1275	Q	88.1	Confident	91.3	Very high	115 Å²	115	46.2 Å²	46.2	54%	0.537	24%	0.235	S	C	.	.	H	α-helix	trans	-65.8	-33.5	179.6	-178	174.3	-13.9	0	0	112.4	E1114 G1271 A1272	E1114-Q1275 VanDerWaalsContact CD-OE1 3.3Å; G1271-Q1275 WeakPolarHBondContact O-CB 3.35Å; G1271-Q1275 PolarHBondContact O-N 3.46Å; A1272-Q1275 PolarHBondContact O-N 3.06Å
1276	F	89.2	Confident	91.5	Very high	54 Å²	54	48.4 Å²	48.4	24%	0.237	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	11.3	-179.1	-65.1	-74.5	0	0	0	114.2	F1107 F1110 F1111 E1114 A1272 R1274	F1107-F1276 AromaticContact CD2-CD1 3.98Å; F1107-F1276 HydrophobicContact CD2-CD1 3.98Å; F1107-F1276 HydrophobicContact CD2-CE1 4.49Å; F1107-F1276 HydrophobicContact CE2-CB 3.9Å; F1107-F1276 AromaticContact CE2-CD1 3.44Å; F1107-F1276 HydrophobicContact CE2-CD1 3.44Å; F1107-F1276 VanDerWaalsContact CE2-CD1 3.44Å; F1107-F1276 HydrophobicContact CE2-CE1 4.35Å; F1107-F1276 AromaticContact CE2-CG 3.98Å; F1107-F1276 HydrophobicContact CE2-CG 3.98Å; F1107-F1276 HydrophobicContact CZ-CB 3.73Å; F1107-F1276 AromaticContact CZ-CD1 3.98Å; F1107-F1276 HydrophobicContact CZ-CD1 3.98Å; F1107-F1276 HydrophobicContact CZ-CG 4.07Å; F1110-F1276 VanDerWaalsContact C-CZ 3.45Å; F1110-F1276 HydrophobicContact CB-CE1 3.76Å; F1110-F1276 HydrophobicContact CB-CZ 3.66Å; F1111-F1276 VanDerWaalsContact CA-CE2 3.5Å; F1111-F1276 HydrophobicContact CB-CD2 4.27Å; F1111-F1276 HydrophobicContact CB-CE2 4.15Å; F1111-F1276 HydrophobicContact CD2-CB 4.24Å; F1111-F1276 AromaticContact CD2-CD2 3.42Å; F1111-F1276 HydrophobicContact CD2-CD2 3.42Å; F1111-F1276 VanDerWaalsContact CD2-CD2 3.42Å; F1111-F1276 HydrophobicContact CD2-CE2 4.07Å; F1111-F1276 AromaticContact CD2-CG 3.97Å; F1111-F1276 HydrophobicContact CD2-CG 3.97Å; F1111-F1276 HydrophobicContact CE2-CD2 4.1Å; F1111-F1276 HydrophobicContact CG-CD2 4.18Å; F1111-F1276 HydrophobicContact CG-CE2 4.41Å; E1114-F1276 HydrophobicContact CG-CE2 4.02Å; A1272-F1276 WeakPolarHBondContact O-CD2 3.49Å; A1272-F1276 PolarHBondContact O-N 3.31Å; R1274-F1276 VanDerWaalsContact C-N 3.31Å; R1274-F1276 PolarHBondContact O-N 2.89Å
1277	G	87.9	Confident	91.6	Very high	45 Å²	45	54 Å²	54	46%	0.464	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	1.5	168.8	0	0	0	0	0	116.8	C1273 R1274 H1279	C1273-G1277 PolarHBondContact O-N 3.28Å; C1273-G1277 VanDerWaalsContact O-N 3.17Å; R1274-G1277 PolarHBondContact O-N 3.35Å; G1277-H1279 VanDerWaalsContact C-N 3.31Å; G1277-H1279 PolarHBondContact O-CD2 3.22Å; G1277-H1279 PolarHBondContact O-N 3.1Å; G1277-H1279 VanDerWaalsContact O-N 3.09Å
1278	N	88.9	Confident	91.9	Very high	59 Å²	59	50.8 Å²	50.8	32%	0.316	26%	0.261	S	S	.	.			trans	-86.1	72.3	173.2	-166.4	-15.9	0	0	0	111	C1273 I1280 L1281 S1282	C1273-N1278 HydrophobicContact CB-CB 4.41Å; C1273-N1278 CarbonylContact O-C 3.59Å; C1273-N1278 PolarHBondContact O-N 2.96Å; N1278-I1280 VanDerWaalsContact C-N 3.35Å; N1278-I1280 PolarHBondContact O-N 3.44Å; N1278-L1281 HydrophobicContact CB-CB 4.43Å; N1278-L1281 VanDerWaalsContact CG-CB 3.43Å; N1278-L1281 WeakPolarHBondContact ND2-CB 3.22Å; N1278-L1281 WeakPolarHBondContact OD1-CB 3.44Å; N1278-L1281 PolarHBondContact OD1-N 3.14Å; N1278-S1282 PolarHBondContact O-N 3.36Å; N1278-S1282 VanDerWaalsContact O-N 3.11Å
1279	H	91.2	Very high	92.1	Very high	114 Å²	114	53.1 Å²	53.1	53%	0.528	27%	0.269	S	S	.	.	H	α-helix	trans	-66.3	-34	-178.1	-61.5	-66.7	0	0	0	113.1	G1277 S1282 L1283	G1277-H1279 VanDerWaalsContact C-N 3.31Å; G1277-H1279 PolarHBondContact O-CD2 3.22Å; G1277-H1279 PolarHBondContact O-N 3.1Å; G1277-H1279 VanDerWaalsContact O-N 3.09Å; H1279-S1282 PolarHBondContact O-N 3.31Å; H1279-L1283 WeakPolarHBondContact O-CG 3.42Å; H1279-L1283 PolarHBondContact O-N 3.11Å
1280	I	91.5	Very high	92.1	Very high	125 Å²	125	55.6 Å²	55.6	64%	0.641	29%	0.294	S	S	*	.	H	α-helix	trans	-65.1	-48.7	-179.2	-61.1	173.6	0	0	0	110.1	N1278 L1283 K1284	N1278-I1280 VanDerWaalsContact C-N 3.35Å; N1278-I1280 PolarHBondContact O-N 3.44Å; I1280-L1283 PolarHBondContact O-N 3.07Å; I1280-K1284 PolarHBondContact O-N 3.4Å; I1280-K1284 VanDerWaalsContact O-N 3.14Å
1281	L	91.7	Very high	92.2	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.021	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-40.7	177.1	-176.8	59.9	0	0	0	111.2	L1126 I1131 N1278 L1283 K1284 I1285	L1126-L1281 HydrophobicContact CD2-CD2 4.41Å; I1131-L1281 HydrophobicContact CD1-CD1 4Å; I1131-L1281 HydrophobicContact CG1-CD1 4.09Å; N1278-L1281 HydrophobicContact CB-CB 4.43Å; N1278-L1281 VanDerWaalsContact CG-CB 3.43Å; N1278-L1281 WeakPolarHBondContact ND2-CB 3.22Å; N1278-L1281 WeakPolarHBondContact OD1-CB 3.44Å; N1278-L1281 PolarHBondContact OD1-N 3.14Å; L1281-L1283 VanDerWaalsContact C-N 3.31Å; L1281-L1283 PolarHBondContact O-N 3.48Å; L1281-K1284 PolarHBondContact O-N 3.09Å; L1281-I1285 HydrophobicContact CD1-CD1 3.93Å; L1281-I1285 HydrophobicContact CD1-CG1 4.08Å; L1281-I1285 HydrophobicContact CD2-CD1 4.31Å; L1281-I1285 HydrophobicContact CG-CD1 3.71Å; L1281-I1285 HydrophobicContact CG-CG1 4.24Å; L1281-I1285 WeakPolarHBondContact O-CB 3.32Å; L1281-I1285 VanDerWaalsContact O-CG1 3.23Å; L1281-I1285 WeakPolarHBondContact O-CG1 3.15Å; L1281-I1285 PolarHBondContact O-N 2.99Å
1282	S	93.3	Very high	92.2	Very high	3 Å²	3	56.3 Å²	56.3	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-55.9	-43.8	174.8	175.6	0	0	0	0	112	S1270 N1278 H1279 I1285 D1286	S1270-S1282 PolarHBondContact O-OG 2.99Å; S1270-S1282 PolarHBondContact OG-OG 3.4Å; N1278-S1282 PolarHBondContact O-N 3.36Å; N1278-S1282 VanDerWaalsContact O-N 3.11Å; H1279-S1282 PolarHBondContact O-N 3.31Å; S1282-I1285 PolarHBondContact O-N 3.41Å; S1282-D1286 WeakPolarHBondContact O-CB 3.34Å; S1282-D1286 PolarHBondContact O-N 3.48Å
1283	L	93.9	Very high	92.1	Very high	121 Å²	121	60 Å²	60	63%	0.634	31%	0.306	S	S	*	.	H	α-helix	trans	-64.3	-44.1	177	-72.1	172	0	0	0	112.6	H1279 I1280 L1281 I1285 D1286 E1287	H1279-L1283 WeakPolarHBondContact O-CG 3.42Å; H1279-L1283 PolarHBondContact O-N 3.11Å; I1280-L1283 PolarHBondContact O-N 3.07Å; L1281-L1283 VanDerWaalsContact C-N 3.31Å; L1281-L1283 PolarHBondContact O-N 3.48Å; L1283-I1285 VanDerWaalsContact C-N 3.31Å; L1283-I1285 PolarHBondContact O-N 2.81Å; L1283-D1286 PolarHBondContact O-N 2.93Å; L1283-E1287 PolarHBondContact O-N 2.79Å
1284	K	93.7	Very high	92	Very high	64 Å²	64	61.7 Å²	61.7	28%	0.278	31%	0.312	S	S	.	.	H	α-helix	trans	-62.8	-38	176	-70.5	-172.9	176.6	-170.3	0	112.3	D1132 I1139 I1280 L1281 E1287 A1288	D1132-K1284 PolarHBondContact O-NZ 3.13Å; I1139-K1284 HydrophobicContact CD1-CB 3.89Å; I1139-K1284 HydrophobicContact CD1-CD 4.43Å; I1280-K1284 PolarHBondContact O-N 3.4Å; I1280-K1284 VanDerWaalsContact O-N 3.14Å; L1281-K1284 PolarHBondContact O-N 3.09Å; K1284-E1287 WeakPolarHBondContact O-CB 3.45Å; K1284-E1287 PolarHBondContact O-N 3.22Å; K1284-A1288 PolarHBondContact O-N 3.08Å
1285	I	94.2	Very high	91.8	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-70.4	-39.6	177.4	-69.6	179.4	0	0	0	110.8	I1131 I1139 I1266 I1269 L1281 S1282 L1283 E1287 A1288 R1289	I1131-I1285 HydrophobicContact CD1-CD1 4.47Å; I1139-I1285 HydrophobicContact CG2-CG1 4.2Å; I1266-I1285 HydrophobicContact CB-CG2 4.41Å; I1266-I1285 HydrophobicContact CG2-CG2 3.6Å; I1266-I1285 WeakPolarHBondContact CG2-O 3.32Å; I1269-I1285 HydrophobicContact CB-CD1 4.4Å; I1269-I1285 HydrophobicContact CG2-CD1 3.42Å; I1269-I1285 VanDerWaalsContact CG2-CD1 3.42Å; L1281-I1285 HydrophobicContact CD1-CD1 3.93Å; L1281-I1285 HydrophobicContact CD1-CG1 4.08Å; L1281-I1285 HydrophobicContact CD2-CD1 4.31Å; L1281-I1285 HydrophobicContact CG-CD1 3.71Å; L1281-I1285 HydrophobicContact CG-CG1 4.24Å; L1281-I1285 WeakPolarHBondContact O-CB 3.32Å; L1281-I1285 VanDerWaalsContact O-CG1 3.23Å; L1281-I1285 WeakPolarHBondContact O-CG1 3.15Å; L1281-I1285 PolarHBondContact O-N 2.99Å; S1282-I1285 PolarHBondContact O-N 3.41Å; L1283-I1285 VanDerWaalsContact C-N 3.31Å; L1283-I1285 PolarHBondContact O-N 2.81Å; I1285-E1287 VanDerWaalsContact C-N 3.31Å; I1285-E1287 PolarHBondContact O-N 3.5Å; I1285-A1288 WeakPolarHBondContact O-CB 3.48Å; I1285-A1288 PolarHBondContact O-N 2.82Å; I1285-R1289 PolarHBondContact O-N 3.03Å
1286	D	94.7	Very high	91.7	Very high	48 Å²	48	51.8 Å²	51.8	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-64.6	-35.5	172.7	-76	-20.6	0	0	0	111.6	S1270 R1274 S1282 L1283 R1289 G1290	S1270-D1286 VanDerWaalsContact CB-OD1 3.25Å; S1270-D1286 WeakPolarHBondContact CB-OD1 3.34Å; S1270-D1286 PolarHBondContact OG-OD1 3.3Å; S1270-D1286 PolarHBondContact OG-OD2 2.93Å; R1274-D1286 IonicContact NH2-OD2 2.77Å; R1274-D1286 PolarHBondContact NH2-OD2 3Å; S1282-D1286 WeakPolarHBondContact O-CB 3.34Å; S1282-D1286 PolarHBondContact O-N 3.48Å; L1283-D1286 PolarHBondContact O-N 2.93Å; D1286-R1289 VanDerWaalsContact O-CB 3.26Å; D1286-R1289 WeakPolarHBondContact O-CB 3.32Å; D1286-R1289 PolarHBondContact O-N 2.92Å; D1286-G1290 PolarHBondContact O-N 3.31Å; D1286-G1290 VanDerWaalsContact O-N 3.08Å
1287	E	95.1	Very high	91.6	Very high	118 Å²	118	49.5 Å²	49.5	55%	0.551	26%	0.264	S	S	*	.	H	α-helix	trans	-63	-47.6	171	-171.6	-175.2	177.4	0	0	111.1	A1136 L1283 K1284 I1285 R1289 G1290 L1291	A1136-E1287 HydrophobicContact CB-CB 3.99Å; A1136-E1287 HydrophobicContact CB-CG 3.69Å; L1283-E1287 PolarHBondContact O-N 2.79Å; K1284-E1287 WeakPolarHBondContact O-CB 3.45Å; K1284-E1287 PolarHBondContact O-N 3.22Å; I1285-E1287 VanDerWaalsContact C-N 3.31Å; I1285-E1287 PolarHBondContact O-N 3.5Å; E1287-R1289 PolarHBondContact O-N 3.44Å; E1287-G1290 PolarHBondContact O-N 3.33Å; E1287-L1291 WeakPolarHBondContact O-CG 3.34Å; E1287-L1291 PolarHBondContact O-N 3.47Å
1288	A	95	Very high	91.3	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.9	-38.2	175.4	0	0	0	0	0	112	A1136 I1139 A1140 K1284 I1285 L1291 I1292	A1136-A1288 HydrophobicContact CB-CB 4.2Å; A1136-A1288 VanDerWaalsContact O-CB 3.27Å; A1136-A1288 WeakPolarHBondContact O-CB 3.46Å; I1139-A1288 HydrophobicContact CB-CB 4.32Å; I1139-A1288 HydrophobicContact CG2-CB 4.2Å; A1140-A1288 HydrophobicContact CB-CB 4.27Å; K1284-A1288 PolarHBondContact O-N 3.08Å; I1285-A1288 WeakPolarHBondContact O-CB 3.48Å; I1285-A1288 PolarHBondContact O-N 2.82Å; A1288-L1291 PolarHBondContact O-N 3.3Å; A1288-I1292 PolarHBondContact O-N 3.19Å
1289	R	93.9	Very high	90.9	Very high	76 Å²	76	48.7 Å²	48.7	29%	0.287	26%	0.255	S	S	.	.	H	α-helix	trans	-58.5	-47.9	172.7	-161.4	-176.6	168.5	-154.3	-7.3	111.9	D1263 I1266 I1285 D1286 E1287 L1291 I1292 H1293	D1263-R1289 WeakPolarHBondContact OD1-CG 3.5Å; D1263-R1289 IonicContact OD1-CZ 2.9Å; D1263-R1289 IonicContact OD1-NE 3.3Å; D1263-R1289 PolarHBondContact OD1-NE 2.93Å; D1263-R1289 IonicContact OD1-NH2 2.85Å; D1263-R1289 IonicContact OD2-NE 2.85Å; D1263-R1289 IonicContact OD2-NH2 3.57Å; I1266-R1289 HydrophobicContact CG2-CB 3.56Å; I1266-R1289 HydrophobicContact CG2-CG 3.85Å; I1285-R1289 PolarHBondContact O-N 3.03Å; D1286-R1289 VanDerWaalsContact O-CB 3.26Å; D1286-R1289 WeakPolarHBondContact O-CB 3.32Å; D1286-R1289 PolarHBondContact O-N 2.92Å; E1287-R1289 PolarHBondContact O-N 3.44Å; R1289-L1291 PolarHBondContact O-N 3.09Å; R1289-I1292 PolarHBondContact O-N 3.42Å; R1289-I1292 VanDerWaalsContact O-N 3.1Å; R1289-H1293 WeakPolarHBondContact O-CB 3.39Å; R1289-H1293 PolarHBondContact O-N 2.98Å
1290	G	92.9	Very high	90.3	Very high	51 Å²	51	46.8 Å²	46.8	53%	0.526	25%	0.252	S	S	.	.	H	α-helix	trans	-59.3	-32	179.3	0	0	0	0	0	113.4	D1286 E1287	D1286-G1290 PolarHBondContact O-N 3.31Å; D1286-G1290 VanDerWaalsContact O-N 3.08Å; E1287-G1290 PolarHBondContact O-N 3.33Å
1291	L	94	Very high	89.8	Confident	51 Å²	51	41.3 Å²	41.3	27%	0.267	23%	0.226	S	C	.	.	H	α-helix	trans	-73.2	-32.9	176.3	-60.2	177.5	0	0	0	113.1	A1136 P1137 A1236 E1287 A1288 R1289 R1294	A1136-L1291 HydrophobicContact CB-CD1 3.8Å; P1137-L1291 HydrophobicContact CB-CD1 4.42Å; P1137-L1291 HydrophobicContact CG-CD1 3.78Å; A1236-L1291 HydrophobicContact CB-CB 4.2Å; A1236-L1291 HydrophobicContact CB-CD1 4.46Å; E1287-L1291 WeakPolarHBondContact O-CG 3.34Å; E1287-L1291 PolarHBondContact O-N 3.47Å; A1288-L1291 PolarHBondContact O-N 3.3Å; R1289-L1291 PolarHBondContact O-N 3.09Å; L1291-R1294 WeakPolarHBondContact O-CD 3Å; L1291-R1294 PolarHBondContact O-NE 2.93Å
1292	I	92.3	Very high	89.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-85.2	-46.1	-179.2	-67	159.8	0	0	0	111.8	A1140 V1232 W1235 L1259 L1262 I1266 A1288 R1289 R1294	A1140-I1292 HydrophobicContact CB-CD1 3.48Å; A1140-I1292 VanDerWaalsContact CB-CD1 3.48Å; A1140-I1292 HydrophobicContact CB-CG1 3.98Å; V1232-I1292 HydrophobicContact CG1-CD1 4.5Å; W1235-I1292 PolarHBondContact NE1-O 2.93Å; L1259-I1292 HydrophobicContact CD2-CG2 4.02Å; L1262-I1292 HydrophobicContact CD2-CD1 3.5Å; L1262-I1292 HydrophobicContact CD2-CG1 4.41Å; L1262-I1292 HydrophobicContact CG-CD1 3.91Å; I1266-I1292 HydrophobicContact CD1-CD1 3.34Å; A1288-I1292 PolarHBondContact O-N 3.19Å; R1289-I1292 PolarHBondContact O-N 3.42Å; R1289-I1292 VanDerWaalsContact O-N 3.1Å; I1292-R1294 VanDerWaalsContact C-N 3.26Å; I1292-R1294 PolarHBondContact O-N 2.77Å
1293	H	88.5	Confident	88.7	Confident	77 Å²	77	41.8 Å²	41.8	36%	0.356	23%	0.227	S	C	.	.	S	Bend	trans	-81.3	67.6	-172.2	-172.5	-85.8	0	0	0	111.5	D1263 R1289 C1298	D1263-H1293 IonicContact OD1-CD2 3.04Å; D1263-H1293 IonicContact OD1-CG 3.93Å; D1263-H1293 IonicContact OD2-CD2 3.36Å; R1289-H1293 WeakPolarHBondContact O-CB 3.39Å; R1289-H1293 PolarHBondContact O-N 2.98Å; H1293-C1298 WeakPolarHBondContact CE1-CB 3.47Å
1294	R	90.1	Very high	87.9	Confident	38 Å²	38	37.2 Å²	37.2	14%	0.143	20%	0.204	C	C	.	.			trans	-136.9	161.7	179.8	65.6	-178.6	180	83.8	-1.5	112.7	W1235 Y1239 L1291 I1292 I1296 V1297	W1235-R1294 VanDerWaalsContact CE3-NH2 3.27Å; W1235-R1294 HydrophobicContact CH2-CG 4.31Å; W1235-R1294 HydrophobicContact CZ2-CG 3.6Å; W1235-R1294 WeakPolarHBondContact CZ2-O 3.33Å; W1235-R1294 PolarHBondContact O-NH2 3.19Å; Y1239-R1294 PolarHBondContact O-NH2 2.64Å; L1291-R1294 WeakPolarHBondContact O-CD 3Å; L1291-R1294 PolarHBondContact O-NE 2.93Å; I1292-R1294 VanDerWaalsContact C-N 3.26Å; I1292-R1294 PolarHBondContact O-N 2.77Å; R1294-I1296 PolarHBondContact O-N 3.3Å; R1294-V1297 WeakPolarHBondContact O-CB 2.98Å; R1294-V1297 PolarHBondContact O-N 3.06Å; R1294-V1297 VanDerWaalsContact O-N 3.12Å
1295	D	86.7	Confident	86.8	Confident	27 Å²	27	35.1 Å²	35.1	14%	0.144	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	-123.8	169	-50	-14.4	0	0	0	113.3	R462 W1235 V1297 C1298 S1299	R462-D1295 IonicContact CZ-OD1 3.35Å; R462-D1295 IonicContact CZ-OD2 3.22Å; R462-D1295 VanDerWaalsContact CZ-OD2 3.27Å; R462-D1295 VanDerWaalsContact NE-CG 3.28Å; R462-D1295 IonicContact NE-OD1 2.79Å; R462-D1295 PolarHBondContact NE-OD1 3.22Å; R462-D1295 IonicContact NE-OD2 2.92Å; R462-D1295 IonicContact NH1-OD1 3.08Å; R462-D1295 PolarHBondContact NH1-OD1 3.27Å; R462-D1295 IonicContact NH1-OD2 3.85Å; R462-D1295 PolarHBondContact NH1-OD2 3.4Å; R462-D1295 IonicContact NH2-OD1 3.78Å; R462-D1295 PolarHBondContact NH2-OD1 3.24Å; W1235-D1295 HydrophobicContact CH2-CB 4.09Å; D1295-V1297 PolarHBondContact O-N 3.43Å; D1295-C1298 PolarHBondContact N-SG 3.09Å; D1295-C1298 PolarHBondContact O-N 3.45Å; D1295-C1298 PolarHBondContact O-SG 2.66Å; D1295-S1299 PolarHBondContact O-N 3.45Å
1296	I	87	Confident	85	Confident	12 Å²	12	41.7 Å²	41.7	6%	0.062	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.7	-179	-167.3	162.9	0	0	0	113.2	L461 L468 L490 W1235 F1241 I1256 R1294	L461-I1296 HydrophobicContact CD2-CD1 4.38Å; L461-I1296 HydrophobicContact CD2-CG1 4.37Å; L468-I1296 HydrophobicContact CD1-CD1 4.33Å; L490-I1296 HydrophobicContact CD1-CD1 3.81Å; L490-I1296 HydrophobicContact CD2-CD1 3.69Å; L490-I1296 HydrophobicContact CG-CD1 4.3Å; W1235-I1296 HydrophobicContact CH2-CG2 4.45Å; F1241-I1296 HydrophobicContact CB-CG2 4.12Å; F1241-I1296 HydrophobicContact CD1-CG2 4.32Å; F1241-I1296 HydrophobicContact CD2-CG2 3.8Å; F1241-I1296 HydrophobicContact CE2-CG2 4.3Å; F1241-I1296 HydrophobicContact CG-CG2 3.81Å; I1256-I1296 HydrophobicContact CD1-CG1 4.42Å; I1256-I1296 HydrophobicContact CD1-CG2 3.66Å; R1294-I1296 PolarHBondContact O-N 3.3Å
1297	V	86.6	Confident	83	Confident	7 Å²	7	44 Å²	44	4%	0.042	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-36.3	178.9	-176.4	0	0	0	0	110.8	W1235 I1256 L1259 L1260 R1294 D1295	W1235-V1297 HydrophobicContact CZ2-CG2 3.75Å; I1256-V1297 HydrophobicContact CD1-CG2 3.97Å; L1259-V1297 HydrophobicContact CB-CG1 4.18Å; L1259-V1297 HydrophobicContact CB-CG2 4.26Å; L1259-V1297 HydrophobicContact CD1-CG2 3.76Å; L1260-V1297 HydrophobicContact CD2-CG1 3.91Å; L1260-V1297 WeakPolarHBondContact CD2-O 3.45Å; L1260-V1297 HydrophobicContact CG-CG1 4.39Å; R1294-V1297 WeakPolarHBondContact O-CB 2.98Å; R1294-V1297 PolarHBondContact O-N 3.06Å; R1294-V1297 VanDerWaalsContact O-N 3.12Å; D1295-V1297 PolarHBondContact O-N 3.43Å
1298	C	83.1	Confident	81.2	Confident	54 Å²	54	40 Å²	40	37%	0.365	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.9	11.3	179.1	67.5	0	0	0	0	113.7	H1293 D1295 P1300	H1293-C1298 WeakPolarHBondContact CE1-CB 3.47Å; D1295-C1298 PolarHBondContact N-SG 3.09Å; D1295-C1298 PolarHBondContact O-N 3.45Å; D1295-C1298 PolarHBondContact O-SG 2.66Å; C1298-P1300 WeakPolarHBondContact O-CD 3.37Å
1299	S	80.5	Confident	79	Confident	33 Å²	33	45.8 Å²	45.8	23%	0.231	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62.9	123	178.4	-179	0	0	0	0	110	D1295	D1295-S1299 PolarHBondContact O-N 3.45Å
1300	P	76.9	Confident	76.2	Confident	73 Å²	73	47.8 Å²	47.8	47%	0.474	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-63.8	147.7	178	26.5	-33.3	0	0	0	110.6	C1298	C1298-P1300 WeakPolarHBondContact O-CD 3.37Å
1301	S	82.2	Confident	73.7	Confident	11 Å²	11	47 Å²	47	8%	0.077	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-58.8	137.1	171.9	176.5	0	0	0	0	110.2	N220 E495 Y1303 V1304 S1305	N220-S1301 PolarHBondContact ND2-OG 3.15Å; E495-S1301 WeakPolarHBondContact OE1-CB 3.03Å; E495-S1301 PolarHBondContact OE1-OG 3.47Å; E495-S1301 WeakPolarHBondContact OE2-CA 3.18Å; E495-S1301 PolarHBondContact OE2-OG 2.96Å; S1301-Y1303 PolarHBondContact O-N 2.95Å; S1301-Y1303 PolarHBondContact OG-N 3.39Å; S1301-V1304 PolarHBondContact O-N 2.96Å; S1301-V1304 VanDerWaalsContact O-N 3.1Å; S1301-S1305 PolarHBondContact O-N 2.9Å; S1301-S1305 VanDerWaalsContact O-N 3.17Å
1302	L	83.6	Confident	71.3	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.021	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.9	175.9	-60.8	-173.7	0	0	0	111	I457 I492 E495 L499 V1304 S1305 I1308	I457-L1302 HydrophobicContact CD1-CD1 4.25Å; I457-L1302 HydrophobicContact CG1-CD1 4.31Å; I457-L1302 HydrophobicContact CG1-CD2 4.46Å; I492-L1302 HydrophobicContact CD1-CD2 4.44Å; I492-L1302 HydrophobicContact CG1-CD1 4.33Å; I492-L1302 HydrophobicContact CG1-CD2 4.06Å; I492-L1302 HydrophobicContact CG1-CG 4.24Å; E495-L1302 HydrophobicContact CB-CB 4.2Å; E495-L1302 HydrophobicContact CB-CD1 3.93Å; E495-L1302 HydrophobicContact CB-CG 4.16Å; E495-L1302 WeakPolarHBondContact OE2-CB 3.32Å; E495-L1302 PolarHBondContact OE2-N 3.09Å; L499-L1302 HydrophobicContact CD1-CB 3.95Å; L499-L1302 HydrophobicContact CD1-CD1 4.14Å; L1302-V1304 VanDerWaalsContact C-N 3.27Å; L1302-V1304 PolarHBondContact O-N 3.42Å; L1302-S1305 PolarHBondContact O-OG 3.34Å; L1302-S1305 VanDerWaalsContact O-OG 3.09Å; L1302-I1308 HydrophobicContact CB-CD1 3.6Å; L1302-I1308 HydrophobicContact CD2-CD1 3.99Å; L1302-I1308 HydrophobicContact CG-CD1 4.28Å; L1302-I1308 WeakPolarHBondContact O-CD1 3.47Å
1303	Y	77.7	Confident	68.7	Low	12 Å²	12	58 Å²	58	5%	0.047	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-24.8	177.9	-68	-71.7	0	0	0	114.2	N220 Q221 H224 E495 E498 L499 S1301	N220-Y1303 HydrophobicContact CB-CD2 4.33Å; N220-Y1303 HydrophobicContact CB-CG 4.49Å; Q221-Y1303 HydrophobicContact CB-CD1 4.45Å; Q221-Y1303 HydrophobicContact CB-CE1 4.27Å; Q221-Y1303 HydrophobicContact CG-CD1 4.49Å; Q221-Y1303 HydrophobicContact CG-CE1 4.03Å; H224-Y1303 PolarHBondContact ND1-O 3.23Å; E495-Y1303 HydrophobicContact CB-CE2 4.16Å; E495-Y1303 HydrophobicContact CG-CD2 4.11Å; E495-Y1303 HydrophobicContact CG-CE2 3.85Å; E498-Y1303 WeakPolarHBondContact CB-OH 3.37Å; E498-Y1303 PolarHBondContact OE2-OH 3.28Å; L499-Y1303 HydrophobicContact CD2-CD1 4.32Å; L499-Y1303 HydrophobicContact CD2-CE1 3.76Å; L499-Y1303 HydrophobicContact CG-CE1 4.39Å; S1301-Y1303 PolarHBondContact O-N 2.95Å; S1301-Y1303 PolarHBondContact OG-N 3.39Å
1304	V	76.4	Confident	66	Low	25 Å²	25	62.4 Å²	62.4	15%	0.152	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-30	-175.9	-179.7	0	0	0	0	111.6	L236 L243 S1301 L1302 Q1306	L236-V1304 HydrophobicContact CD2-CG2 4.03Å; L243-V1304 HydrophobicContact CD1-CG1 3.5Å; S1301-V1304 PolarHBondContact O-N 2.96Å; S1301-V1304 VanDerWaalsContact O-N 3.1Å; L1302-V1304 VanDerWaalsContact C-N 3.27Å; L1302-V1304 PolarHBondContact O-N 3.42Å; V1304-Q1306 PolarHBondContact O-N 3.46Å
1305	S	70.6	Confident	64.8	Low	20 Å²	20	63.7 Å²	63.7	14%	0.14	34%	0.34	C	S	.	.			trans	-66.4	123.7	-177.8	62.8	0	0	0	0	112	R460 S1301 L1302 D1307	R460-S1305 PolarHBondContact NH1-OG 2.71Å; R460-S1305 PolarHBondContact NH2-OG 3.34Å; S1301-S1305 PolarHBondContact O-N 2.9Å; S1301-S1305 VanDerWaalsContact O-N 3.17Å; L1302-S1305 PolarHBondContact O-OG 3.34Å; L1302-S1305 VanDerWaalsContact O-OG 3.09Å; S1305-D1307 PolarHBondContact O-N 3.31Å
1306	Q	57.8	Low	63.6	Low	139 Å²	139	65.6 Å²	65.6	65%	0.65	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-63.3	-28.9	-179.7	-71	177.8	-20.9	0	0	112.7	V1304 I1308 K1309	V1304-Q1306 PolarHBondContact O-N 3.46Å; Q1306-I1308 PolarHBondContact O-N 3.11Å; Q1306-I1308 VanDerWaalsContact O-N 3.08Å; Q1306-K1309 PolarHBondContact O-N 2.77Å
1307	D	52.6	Low	62.3	Low	97 Å²	97	68.6 Å²	68.6	52%	0.519	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-65.3	-17.1	-171.3	-30	-43.1	0	0	0	114.9	R460 S1305 K1309 L1310	R460-D1307 IonicContact CZ-OD2 2.63Å; R460-D1307 IonicContact NH2-OD2 2.76Å; R460-D1307 PolarHBondContact NH2-OD2 2.66Å; S1305-D1307 PolarHBondContact O-N 3.31Å; D1307-K1309 VanDerWaalsContact C-N 3.26Å; D1307-K1309 PolarHBondContact O-N 3.37Å; D1307-L1310 WeakPolarHBondContact O-CB 3.44Å; D1307-L1310 PolarHBondContact O-N 3.21Å
1308	I	55.9	Low	60.9	Low	34 Å²	34	72.2 Å²	72.2	17%	0.174	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-72.9	-22.9	-175.9	-59.7	-173.7	0	0	0	111.6	F453 L1302 Q1306 L1310 A1311	F453-I1308 HydrophobicContact CE2-CG2 4.38Å; L1302-I1308 HydrophobicContact CB-CD1 3.6Å; L1302-I1308 HydrophobicContact CD2-CD1 3.99Å; L1302-I1308 HydrophobicContact CG-CD1 4.28Å; L1302-I1308 WeakPolarHBondContact O-CD1 3.47Å; Q1306-I1308 PolarHBondContact O-N 3.11Å; Q1306-I1308 VanDerWaalsContact O-N 3.08Å; I1308-L1310 PolarHBondContact O-N 3.4Å; I1308-A1311 PolarHBondContact O-N 3.41Å
1309	K	49.5	Very low	59.5	Low	120 Å²	120	73.3 Å²	73.3	52%	0.522	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-61	-32.5	174.2	-74.2	-169.4	173.8	-171.8	0	112.1	Q1306 D1307 A1311 K1312	Q1306-K1309 PolarHBondContact O-N 2.77Å; D1307-K1309 VanDerWaalsContact C-N 3.26Å; D1307-K1309 PolarHBondContact O-N 3.37Å; K1309-A1311 PolarHBondContact O-N 2.89Å; K1309-K1312 PolarHBondContact O-N 3.22Å
1310	L	34.4	Very low	58.1	Low	119 Å²	119	76 Å²	76	62%	0.623	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-66.4	-20.6	-179.7	-67.6	163.5	0	0	0	113.6	D1307 I1308 K1312	D1307-L1310 WeakPolarHBondContact O-CB 3.44Å; D1307-L1310 PolarHBondContact O-N 3.21Å; I1308-L1310 PolarHBondContact O-N 3.4Å; L1310-K1312 VanDerWaalsContact C-N 3.33Å; L1310-K1312 PolarHBondContact O-N 3.47Å
1311	A	41.2	Very low	56.8	Low	33 Å²	33	76.2 Å²	76.2	27%	0.273	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-80.3	-13.4	-179.7	0	0	0	0	0	114	I1308 K1309	I1308-A1311 PolarHBondContact O-N 3.41Å; K1309-A1311 PolarHBondContact O-N 2.89Å
1312	K	43	Very low	54.8	Low	139 Å²	139	81.2 Å²	81.2	60%	0.604	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-20	-179.7	-71.1	-170.3	175	-173	0	113.5	D503 K1309 L1310	D503-K1312 VanDerWaalsContact CG-NZ 3.32Å; D503-K1312 IonicContact OD1-NZ 3.76Å; D503-K1312 PolarHBondContact OD1-NZ 2.85Å; D503-K1312 WeakPolarHBondContact OD2-CE 3.42Å; D503-K1312 IonicContact OD2-NZ 3.76Å; D503-K1312 PolarHBondContact OD2-NZ 3.45Å; D503-K1312 VanDerWaalsContact OD2-NZ 3.13Å; K1309-K1312 PolarHBondContact O-N 3.22Å; L1310-K1312 VanDerWaalsContact C-N 3.33Å; L1310-K1312 PolarHBondContact O-N 3.47Å
1313	D	37.6	Very low	52.4	Low	144 Å²	144	87.7 Å²	87.7	77%	0.77	45%	0.449	S	S	*	.			trans	-95.5	1.7	178	-66.1	-26.2	0	0	0	113.4
1314	D	32.5	Very low	50.1	Low	170 Å²	170	94.5 Å²	94.5	91%	0.909	49%	0.485	S	S	*	.			trans	-114.4	0	170.7	-78.8	-12.8	0	0	0	112.1	K452	K452-D1314 PolarHBondContact NZ-OXT 3.39Å

Retrieved 1,314 of 1,314 residues in 673.8 ms (Link to these results)

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