A0A077ZF35_TRITR Loading...

Poly [ADP-ribose] polymerase

AlphaFold DB , UniProt , Accession A0A077ZF35, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,196 aa.

						>A0A077ZF35_TRITR|A0A077ZF35
MNRSQRPEVTLQGSPKSFSNADREIFEACRDGDIRRVKKLVSAKNANIRDSIGRKSTPLHFAAGFGRKEVVTYLISVGATVGARDEGGLVPLHNACSFGHAAVTRLLIKSGADPNAVDHWGFSPLHEAALKGKVDVCIALLQSGANPNIRNLDGKTPFDLADSNSRAVLTGEYRKDELLEAARSGNEELLMSLLTPLNVNIHADDGRKSTPLHLAAGYNRTQIVKLLLQYFADVHVQDKGGLVPLHNACSYGHLEVTELLIKYGANVNALDLWQFSPLHEAASKGRVEVCSCLLAHGADPTVENSNGKTAIDLASSVELRQLLQSTTCSVFLAFFGRIHILDEYEGHCLLTACQKGDLAKFKRYLSESTVNFRNPYTGENALHILCNASRDADLFMVKALVAAGVNVNERNKNLLSPLHMAADRGCTELINILIENGANVNLLDGLGQTCLHRCTKRNLSEACKLLLDKGVDASIVNLHGFTAGQLATGSTAESIERQMLEAAKAGDLQSVKRILKLSTDCDSILNCRDVEGRNSTPLHFAAGYNRLEVVKYLVESGANLHARDKGGLEPLHNACSYGHYEVTELLIQNGADVNACDLWKFTPLHEAAANGKFDICKLLLSHGADRSLVNRDGETALDLVKDSNSDIADLLRGDVAILEAAKRGELDNLFCCCELPLSIEPLSLAGYNNYEVAEFLIQKGADVNAKDRGGLIPLHNAASYGHFEIGQLLIQHGALANAQDLWGFTPLHEASQKGRFQLVSFLLSHGADPTIRNHDNQIPLDLATAEDVRILLQDAMPTTYRTGSSPVANSKEESEHDFGMPNSNSSPKRPSCNSAPALKNCPRNWLHQERDKPLAEMDVSLFLKSIDLECLQPLLMQEQVLFVMLNFLITMDVLVEMSQEDLIAIGLTSYGVRHRLMRSIEKLTIGQPVGCTMPGFPPCSSGFVGTMLVPLAKDHIEFMAVEDEVIIDFFKNKNPINSLRHMQSTIVQHQSAVCAGGLFDKYNVVKVDKVFNRRLWERYIRRRDDVAEENSGQHNEKLLFHGSPFVHAIVQKGFDERHAYIGGMFGAGIYFAEHSSKSNQYVHGIGGGTGCLAHKDKSCYVCLRYLLLCRVTLGKSFVHSASMKLAHAPPGHHSILGRPSSAGLAYPEYVIYRGEQANFFPYGAYPEYLVTYQIIKPEKDKTADASSSVDDLTVCP
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.4	Very low	31.1	Very low	239 Å²	239	166 Å²	166	100%	1.177	83%	0.832	S	S	*	*				0	136.3	0	-80.7	-179.3	170.3	0	0	109.3
2	N	33.3	Very low	30.7	Very low	151 Å²	151	169.1 Å²	169.1	81%	0.807	84%	0.842	S	S	*	*			trans	-66.2	143.8	-174.6	-90.4	-25.1	0	0	0	112.6	S4	N2-S4 PolarHBondContact O-N 3.17Å
3	R	36.6	Very low	30.5	Very low	258 Å²	258	161.2 Å²	161.2	97%	0.974	83%	0.83	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	1	-173.4	-97.3	-179.5	175	179.2	-1.4	116.9
4	S	37.1	Very low	30.3	Very low	108 Å²	108	157.4 Å²	157.4	76%	0.755	82%	0.824	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	6	-170.7	54	0	0	0	0	116.1	N2	N2-S4 PolarHBondContact O-N 3.17Å
5	Q	30.1	Very low	30.6	Very low	175 Å²	175	155.3 Å²	155.3	82%	0.818	82%	0.824	S	S	*	*			trans	-120.3	43.3	179.8	-67.6	-171.9	-8.6	0	0	114
6	R	29.2	Very low	30.9	Very low	211 Å²	211	157.6 Å²	157.6	80%	0.796	83%	0.825	S	S	*	*			trans	-90.6	124.9	163.1	-85.7	-172.8	177.4	-172.4	-1.7	109.5	E8	R6-E8 PolarHBondContact O-N 3Å
7	P	28.6	Very low	31.4	Very low	112 Å²	112	155.3 Å²	155.3	73%	0.727	83%	0.825	S	S	*	*			trans	-70.5	127.2	178.7	27.4	-30	0	0	0	110.1	V9	P7-V9 PolarHBondContact O-N 3.28Å; P7-V9 VanDerWaalsContact O-N 3.08Å
8	E	28.1	Very low	31.9	Very low	182 Å²	182	151.8 Å²	151.8	85%	0.85	80%	0.802	S	S	*	*			trans	-65.4	101.8	169.4	-80.4	-176.9	150.4	0	0	109.4	R6 T10	R6-E8 PolarHBondContact O-N 3Å; E8-T10 PolarHBondContact O-N 2.98Å
9	V	28.9	Very low	33.2	Very low	115 Å²	115	146.6 Å²	146.6	70%	0.697	78%	0.779	S	S	*	*			trans	-81.3	96	168.6	179.4	0	0	0	0	107.6	P7 L11	P7-V9 PolarHBondContact O-N 3.28Å; P7-V9 VanDerWaalsContact O-N 3.08Å; V9-L11 HydrophobicContact CG1-CD1 4.15Å; V9-L11 HydrophobicContact CG1-CG 4Å; V9-L11 PolarHBondContact O-N 3.22Å
10	T	27.8	Very low	34.7	Very low	126 Å²	126	146.2 Å²	146.2	77%	0.773	78%	0.777	S	S	*	*			trans	-78.8	105.5	171.1	34.2	0	0	0	0	109.3	E8	E8-T10 PolarHBondContact O-N 2.98Å
11	L	30.2	Very low	36.1	Very low	149 Å²	149	141.6 Å²	141.6	78%	0.78	76%	0.76	S	S	*	*			trans	-102.1	104.8	171.7	-78.4	165.9	0	0	0	109.8	V9 G13	V9-L11 HydrophobicContact CG1-CD1 4.15Å; V9-L11 HydrophobicContact CG1-CG 4Å; V9-L11 PolarHBondContact O-N 3.22Å; L11-G13 PolarHBondContact O-N 3.44Å
12	Q	26.1	Very low	38.2	Very low	203 Å²	203	132.1 Å²	132.1	95%	0.949	71%	0.714	S	S	*	*			trans	-65.5	112.6	164	-72.7	178.3	-11.2	0	0	109.3
13	G	28.1	Very low	40.6	Very low	66 Å²	66	131.6 Å²	131.6	68%	0.68	70%	0.701	S	S	*	*			trans	-170.3	108.4	170.3	0	0	0	0	0	109.6	L11	L11-G13 PolarHBondContact O-N 3.44Å
14	S	28	Very low	43	Very low	108 Å²	108	122.8 Å²	122.8	76%	0.755	67%	0.671	S	S	*	*			trans	-51.6	131.6	177.7	52.7	0	0	0	0	111.2	K16	S14-K16 PolarHBondContact O-N 2.6Å
15	P	34.4	Very low	45.6	Very low	127 Å²	127	117.8 Å²	117.8	83%	0.825	64%	0.636	S	S	*	*			trans	-67.2	109.9	-177.1	27.1	-31.6	0	0	0	108.9	S17	P15-S17 PolarHBondContact O-N 3.23Å
16	K	35.9	Very low	48.5	Very low	191 Å²	191	110.2 Å²	110.2	83%	0.83	60%	0.6	S	S	*	*			trans	-60.9	121.4	164.7	-75.7	-175.2	176.5	-179.9	0	106.8	S14 F18	S14-K16 PolarHBondContact O-N 2.6Å; K16-F18 PolarHBondContact O-N 3.34Å
17	S	39.2	Very low	51.4	Low	119 Å²	119	102.3 Å²	102.3	83%	0.832	57%	0.572	S	S	*	*			trans	-50.6	107	177.1	53.7	0	0	0	0	109.7	P15 S19	P15-S17 PolarHBondContact O-N 3.23Å; S17-S19 PolarHBondContact O-N 2.85Å
18	F	40.7	Very low	54.5	Low	92 Å²	92	97 Å²	97	40%	0.404	54%	0.537	S	S	.	.			trans	-64.5	122.8	179.1	-132.6	-97.3	0	0	0	108.4	K16 D22 R49	K16-F18 PolarHBondContact O-N 3.34Å; F18-D22 HydrophobicContact CD1-CB 3.84Å; F18-D22 HydrophobicContact CE1-CB 3.54Å; F18-D22 HydrophobicContact CZ-CB 4.37Å; F18-R49 VanDerWaalsContact CZ-O 3.24Å; F18-R49 WeakPolarHBondContact CZ-O 3.24Å
19	S	55.7	Low	57.6	Low	54 Å²	54	88.3 Å²	88.3	38%	0.378	50%	0.497	S	S	.	.			trans	-78.1	146.3	-177.2	75.2	0	0	0	0	110	S17 A21 D22	S17-S19 PolarHBondContact O-N 2.85Å; S19-A21 PolarHBondContact O-N 3.5Å; S19-D22 PolarHBondContact N-OD2 2.92Å; S19-D22 PolarHBondContact O-N 2.88Å; S19-D22 PolarHBondContact OG-N 3.4Å; S19-D22 PolarHBondContact OG-OD2 3.42Å
20	N	63.4	Low	60.6	Low	137 Å²	137	87.3 Å²	87.3	73%	0.733	48%	0.48	S	S	*	.	H	α-helix	trans	-52.4	-29	171.9	-83.5	-18.4	0	0	0	112	D22 R23 E24	N20-D22 VanDerWaalsContact C-N 3.34Å; N20-D22 PolarHBondContact O-N 3.5Å; N20-R23 PolarHBondContact O-N 3.24Å; N20-E24 PolarHBondContact O-N 3.31Å
21	A	65.2	Low	63.5	Low	51 Å²	51	85 Å²	85	42%	0.421	46%	0.463	S	S	.	.	H	α-helix	trans	-64.2	-32.6	178.1	0	0	0	0	0	113.7	S19 E24	S19-A21 PolarHBondContact O-N 3.5Å; A21-E24 PolarHBondContact O-N 2.82Å
22	D	76.3	Confident	66.4	Low	39 Å²	39	79 Å²	79	21%	0.209	44%	0.438	C	S	.	.	H	α-helix	trans	-71	-36.9	179.3	-63.8	-52.9	0	0	0	111.4	F18 S19 N20 E24 I25 F26 I48	F18-D22 HydrophobicContact CD1-CB 3.84Å; F18-D22 HydrophobicContact CE1-CB 3.54Å; F18-D22 HydrophobicContact CZ-CB 4.37Å; S19-D22 PolarHBondContact N-OD2 2.92Å; S19-D22 PolarHBondContact O-N 2.88Å; S19-D22 PolarHBondContact OG-N 3.4Å; S19-D22 PolarHBondContact OG-OD2 3.42Å; N20-D22 VanDerWaalsContact C-N 3.34Å; N20-D22 PolarHBondContact O-N 3.5Å; D22-E24 VanDerWaalsContact C-N 3.29Å; D22-E24 PolarHBondContact O-N 2.83Å; D22-I25 WeakPolarHBondContact O-CB 3.47Å; D22-I25 PolarHBondContact O-N 3.18Å; D22-F26 WeakPolarHBondContact O-CD2 3.3Å; D22-I48 HydrophobicContact CB-CD1 4.21Å
23	R	82.9	Confident	69.6	Low	140 Å²	140	72.6 Å²	72.6	53%	0.528	41%	0.411	S	S	.	.	H	α-helix	trans	-63.4	-37.9	175.9	-178	178.9	151.4	179.4	-7.8	111.5	N20 I25 F26 E27	N20-R23 PolarHBondContact O-N 3.24Å; R23-I25 VanDerWaalsContact C-N 3.25Å; R23-I25 PolarHBondContact O-N 3.24Å; R23-F26 PolarHBondContact O-N 3.39Å; R23-E27 IonicContact CZ-OE1 3.16Å; R23-E27 IonicContact NE-OE1 3.44Å; R23-E27 PolarHBondContact NE-OE1 3.46Å; R23-E27 IonicContact NH2-OE1 2.71Å; R23-E27 PolarHBondContact NH2-OE1 3.31Å; R23-E27 PolarHBondContact O-N 2.99Å
24	E	87.8	Confident	72.7	Confident	74 Å²	74	71 Å²	71	35%	0.346	39%	0.386	S	S	.	.	H	α-helix	trans	-61.9	-30.7	177.6	-69.8	-168.8	-156.2	0	0	113.4	N20 A21 D22 E27 A28 R36 L40	N20-E24 PolarHBondContact O-N 3.31Å; A21-E24 PolarHBondContact O-N 2.82Å; D22-E24 VanDerWaalsContact C-N 3.29Å; D22-E24 PolarHBondContact O-N 2.83Å; E24-E27 PolarHBondContact O-N 3.29Å; E24-A28 VanDerWaalsContact O-CB 3.31Å; E24-A28 WeakPolarHBondContact O-CB 3.48Å; E24-A28 PolarHBondContact O-N 2.96Å; E24-R36 VanDerWaalsContact CG-NH2 3.3Å; E24-R36 IonicContact OE2-CZ 3.93Å; E24-R36 IonicContact OE2-NE 3.37Å; E24-R36 IonicContact OE2-NH2 2.82Å; E24-R36 PolarHBondContact OE2-NH2 3.11Å; E24-L40 HydrophobicContact CB-CD1 3.88Å
25	I	91.1	Very high	75.7	Confident	3 Å²	3	75.5 Å²	75.5	2%	0.015	39%	0.386	C	S	.	.	H	α-helix	trans	-62.3	-47.5	176.1	-68	165.9	0	0	0	110.4	D22 R23 A28 C29 L40 V41 N45 I48 P58	D22-I25 WeakPolarHBondContact O-CB 3.47Å; D22-I25 PolarHBondContact O-N 3.18Å; R23-I25 VanDerWaalsContact C-N 3.25Å; R23-I25 PolarHBondContact O-N 3.24Å; I25-A28 PolarHBondContact O-N 3Å; I25-C29 WeakPolarHBondContact O-CB 3.46Å; I25-C29 PolarHBondContact O-N 3.46Å; I25-C29 PolarHBondContact O-SG 3.13Å; I25-L40 HydrophobicContact CG1-CB 3.75Å; I25-L40 HydrophobicContact CG1-CD1 4.42Å; I25-V41 HydrophobicContact CG1-CG2 4.4Å; I25-V41 HydrophobicContact CG2-CG2 3.66Å; I25-N45 VanDerWaalsContact CD1-ND2 3.34Å; I25-N45 WeakPolarHBondContact CD1-ND2 3.48Å; I25-I48 HydrophobicContact CB-CD1 4.3Å; I25-I48 HydrophobicContact CD1-CD1 3.72Å; I25-I48 HydrophobicContact CG2-CD1 4.32Å; I25-P58 HydrophobicContact CG2-CB 4.19Å; I25-P58 HydrophobicContact CG2-CG 3.85Å
26	F	91.8	Very high	78.5	Confident	15 Å²	15	73.2 Å²	73.2	7%	0.066	36%	0.361	C	S	.	.	H	α-helix	trans	-66.6	-40	-179.1	-64.8	-80.2	0	0	0	112	D22 R23 C29 R30 I48 D50 S56 P58 F61	D22-F26 WeakPolarHBondContact O-CD2 3.3Å; R23-F26 PolarHBondContact O-N 3.39Å; F26-C29 PolarHBondContact O-N 2.9Å; F26-R30 WeakPolarHBondContact O-CB 3.46Å; F26-R30 PolarHBondContact O-N 3.24Å; F26-I48 HydrophobicContact CD2-CD1 4.5Å; F26-I48 HydrophobicContact CE2-CD1 3.65Å; F26-I48 HydrophobicContact CE2-CG1 4Å; F26-I48 HydrophobicContact CZ-CD1 3.92Å; F26-I48 HydrophobicContact CZ-CG1 3.72Å; F26-D50 HydrophobicContact CD1-CB 4.37Å; F26-D50 HydrophobicContact CD2-CB 4.5Å; F26-D50 HydrophobicContact CE1-CB 3.93Å; F26-D50 HydrophobicContact CE2-CB 4.09Å; F26-D50 HydrophobicContact CZ-CB 3.78Å; F26-S56 WeakPolarHBondContact CE1-O 3.12Å; F26-P58 HydrophobicContact CD1-CG 4.46Å; F26-P58 HydrophobicContact CE1-CG 4.02Å; F26-P58 HydrophobicContact CZ-CG 4.39Å; F26-F61 AromaticContact CD1-CD2 3.66Å; F26-F61 HydrophobicContact CD1-CD2 3.66Å; F26-F61 AromaticContact CD1-CE2 3.71Å; F26-F61 HydrophobicContact CD1-CE2 3.71Å; F26-F61 HydrophobicContact CD1-CG 4.24Å; F26-F61 HydrophobicContact CD1-CZ 4.34Å; F26-F61 HydrophobicContact CE1-CD2 4.24Å; F26-F61 HydrophobicContact CE1-CE2 4.2Å
27	E	89.7	Confident	81.2	Confident	46 Å²	46	64.1 Å²	64.1	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-61.9	-47.1	174.3	-69.8	175.9	179	0	0	110.8	R23 E24 C29 R30 D31	R23-E27 IonicContact CZ-OE1 3.16Å; R23-E27 IonicContact NE-OE1 3.44Å; R23-E27 PolarHBondContact NE-OE1 3.46Å; R23-E27 IonicContact NH2-OE1 2.71Å; R23-E27 PolarHBondContact NH2-OE1 3.31Å; R23-E27 PolarHBondContact O-N 2.99Å; E24-E27 PolarHBondContact O-N 3.29Å; E27-C29 PolarHBondContact O-N 3.16Å; E27-R30 WeakPolarHBondContact O-CB 3.35Å; E27-R30 PolarHBondContact O-N 3.36Å; E27-D31 WeakPolarHBondContact O-CB 3.29Å; E27-D31 PolarHBondContact O-N 3.24Å
28	A	92.4	Very high	83.8	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.2	-41.1	176.7	0	0	0	0	0	112.7	E24 I25 D31 G32 D33 R36 V37 L40	E24-A28 VanDerWaalsContact O-CB 3.31Å; E24-A28 WeakPolarHBondContact O-CB 3.48Å; E24-A28 PolarHBondContact O-N 2.96Å; I25-A28 PolarHBondContact O-N 3Å; A28-D31 PolarHBondContact O-N 2.84Å; A28-G32 PolarHBondContact O-N 3.37Å; A28-D33 PolarHBondContact O-N 3.03Å; A28-R36 HydrophobicContact CB-CB 4.12Å; A28-R36 HydrophobicContact CB-CG 3.84Å; A28-V37 HydrophobicContact CB-CG2 3.79Å; A28-L40 HydrophobicContact CB-CD1 4.49Å
29	C	93.1	Very high	86.2	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.2	-36.7	176.3	-72.1	0	0	0	0	113.1	I25 F26 E27 F61 A62 R67 V70	I25-C29 WeakPolarHBondContact O-CB 3.46Å; I25-C29 PolarHBondContact O-N 3.46Å; I25-C29 PolarHBondContact O-SG 3.13Å; F26-C29 PolarHBondContact O-N 2.9Å; E27-C29 PolarHBondContact O-N 3.16Å; C29-F61 HydrophobicContact CB-CB 4.46Å; C29-A62 HydrophobicContact CB-CB 4.37Å; C29-R67 WeakPolarHBondContact O-CG 3.42Å; C29-V70 HydrophobicContact CB-CG1 4.29Å
30	R	91.7	Very high	87.8	Confident	93 Å²	93	68.1 Å²	68.1	35%	0.351	32%	0.319	S	S	.	.	H	α-helix	trans	-65.7	-46.8	174.1	178.6	-166.9	71.2	-162.6	-5.7	111.2	F26 E27 G32 F61 F65 R67	F26-R30 WeakPolarHBondContact O-CB 3.46Å; F26-R30 PolarHBondContact O-N 3.24Å; E27-R30 WeakPolarHBondContact O-CB 3.35Å; E27-R30 PolarHBondContact O-N 3.36Å; R30-G32 VanDerWaalsContact C-N 3.26Å; R30-G32 PolarHBondContact O-N 3.25Å; R30-F61 HydrophobicContact CB-CD1 4.47Å; R30-F65 HydrophobicContact CB-CD2 4.23Å; R30-F65 HydrophobicContact CB-CE2 4.33Å; R30-F65 HydrophobicContact CG-CD1 3.99Å; R30-F65 HydrophobicContact CG-CD2 3.75Å; R30-F65 HydrophobicContact CG-CE1 3.82Å; R30-F65 HydrophobicContact CG-CE2 3.6Å; R30-F65 HydrophobicContact CG-CG 3.97Å; R30-F65 HydrophobicContact CG-CZ 3.63Å; R30-R67 PolarHBondContact O-NE 3.15Å; R30-R67 PolarHBondContact O-NH2 3.08Å; R30-R67 VanDerWaalsContact O-NH2 3.1Å
31	D	90.6	Very high	89.1	Confident	77 Å²	77	62 Å²	62	41%	0.412	29%	0.287	S	S	.	.	H	α-helix	trans	-75	-20.8	-173.8	-62	-13.6	0	0	0	111.4	E27 A28	E27-D31 WeakPolarHBondContact O-CB 3.29Å; E27-D31 PolarHBondContact O-N 3.24Å; A28-D31 PolarHBondContact O-N 2.84Å
32	G	91.1	Very high	90.3	Very high	25 Å²	25	62 Å²	62	26%	0.258	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	14.3	179.2	0	0	0	0	0	113.6	A28 R30 I34	A28-G32 PolarHBondContact O-N 3.37Å; R30-G32 VanDerWaalsContact C-N 3.26Å; R30-G32 PolarHBondContact O-N 3.25Å; G32-I34 PolarHBondContact O-N 3.21Å
33	D	92.3	Very high	90.8	Very high	68 Å²	68	63.9 Å²	63.9	36%	0.364	31%	0.305	S	S	.	.			trans	-74.7	87.7	179.2	-176.6	-12.6	0	0	0	110.7	A28 R35 R36 V37	A28-D33 PolarHBondContact O-N 3.03Å; D33-R35 PolarHBondContact O-N 2.97Å; D33-R35 WeakPolarHBondContact OD1-CB 3.41Å; D33-R35 PolarHBondContact OD1-N 2.84Å; D33-R35 VanDerWaalsContact OD1-N 3.12Å; D33-R36 HydrophobicContact CB-CB 3.99Å; D33-R36 PolarHBondContact O-N 3.16Å; D33-R36 PolarHBondContact OD1-N 3.06Å; D33-R36 VanDerWaalsContact OD2-CB 3.22Å; D33-R36 WeakPolarHBondContact OD2-CB 3.46Å; D33-V37 VanDerWaalsContact O-CG2 3.31Å; D33-V37 WeakPolarHBondContact O-CG2 3.19Å; D33-V37 PolarHBondContact O-N 3.25Å
34	I	93.3	Very high	90.9	Very high	33 Å²	33	67 Å²	67	17%	0.169	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-32	-179	-170.5	60.4	0	0	0	112.8	G32 K38 V70 Y73	G32-I34 PolarHBondContact O-N 3.21Å; I34-K38 HydrophobicContact CD1-CG 4.45Å; I34-K38 HydrophobicContact CG1-CD 4.28Å; I34-K38 HydrophobicContact CG1-CG 4.46Å; I34-K38 WeakPolarHBondContact O-CB 3.42Å; I34-K38 VanDerWaalsContact O-CG 3.25Å; I34-K38 WeakPolarHBondContact O-CG 3.17Å; I34-K38 PolarHBondContact O-N 2.95Å; I34-V70 HydrophobicContact CB-CG2 4.44Å; I34-V70 HydrophobicContact CD1-CG2 4.12Å; I34-Y73 HydrophobicContact CD1-CD1 4.42Å; I34-Y73 HydrophobicContact CD1-CG 4.13Å
35	R	91.8	Very high	91	Very high	201 Å²	201	65 Å²	65	76%	0.758	31%	0.314	S	S	*	.	H	α-helix	trans	-69.1	-43.9	179.5	-67.5	-179.9	178.8	173.6	-0.3	110	D33 K39	D33-R35 PolarHBondContact O-N 2.97Å; D33-R35 WeakPolarHBondContact OD1-CB 3.41Å; D33-R35 PolarHBondContact OD1-N 2.84Å; D33-R35 VanDerWaalsContact OD1-N 3.12Å; R35-K39 WeakPolarHBondContact O-CG 3.32Å; R35-K39 PolarHBondContact O-N 3.26Å
36	R	92.1	Very high	91	Very high	79 Å²	79	64.8 Å²	64.8	30%	0.298	31%	0.313	S	S	.	.	H	α-helix	trans	-68	-42.3	175.9	-170.7	174.3	-178.3	-168.6	0.6	111.6	E24 A28 D33 K38 K39 L40	E24-R36 VanDerWaalsContact CG-NH2 3.3Å; E24-R36 IonicContact OE2-CZ 3.93Å; E24-R36 IonicContact OE2-NE 3.37Å; E24-R36 IonicContact OE2-NH2 2.82Å; E24-R36 PolarHBondContact OE2-NH2 3.11Å; A28-R36 HydrophobicContact CB-CB 4.12Å; A28-R36 HydrophobicContact CB-CG 3.84Å; D33-R36 HydrophobicContact CB-CB 3.99Å; D33-R36 PolarHBondContact O-N 3.16Å; D33-R36 PolarHBondContact OD1-N 3.06Å; D33-R36 VanDerWaalsContact OD2-CB 3.22Å; D33-R36 WeakPolarHBondContact OD2-CB 3.46Å; R36-K38 PolarHBondContact O-N 3.19Å; R36-K39 PolarHBondContact O-N 2.75Å; R36-K39 VanDerWaalsContact O-N 3.16Å; R36-L40 HydrophobicContact CG-CD1 3.7Å; R36-L40 HydrophobicContact CG-CG 4.31Å; R36-L40 WeakPolarHBondContact O-CG 3.43Å; R36-L40 PolarHBondContact O-N 2.9Å
37	V	92.8	Very high	91.1	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-58.2	-46.6	174	173.3	0	0	0	0	111.2	A28 D33 K39 L40 V41 V70 Y73 L74	A28-V37 HydrophobicContact CB-CG2 3.79Å; D33-V37 VanDerWaalsContact O-CG2 3.31Å; D33-V37 WeakPolarHBondContact O-CG2 3.19Å; D33-V37 PolarHBondContact O-N 3.25Å; V37-K39 PolarHBondContact O-N 3.36Å; V37-L40 PolarHBondContact O-N 3.31Å; V37-V41 HydrophobicContact CG1-CB 4.25Å; V37-V41 HydrophobicContact CG1-CG2 3.82Å; V37-V41 WeakPolarHBondContact O-CB 3.31Å; V37-V41 PolarHBondContact O-N 3.43Å; V37-V70 HydrophobicContact CG1-CG1 4.22Å; V37-V70 HydrophobicContact CG2-CG1 4.05Å; V37-V70 HydrophobicContact CG2-CG2 4.28Å; V37-Y73 HydrophobicContact CG1-CD1 3.81Å; V37-Y73 HydrophobicContact CG1-CE1 4.12Å; V37-L74 HydrophobicContact CG1-CD2 4.39Å
38	K	93.1	Very high	91.2	Very high	118 Å²	118	66.3 Å²	66.3	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-59.1	-32.7	177.8	-79.9	177.6	174.3	-177.8	0	113.4	I34 R36 Y73	I34-K38 HydrophobicContact CD1-CG 4.45Å; I34-K38 HydrophobicContact CG1-CD 4.28Å; I34-K38 HydrophobicContact CG1-CG 4.46Å; I34-K38 WeakPolarHBondContact O-CB 3.42Å; I34-K38 VanDerWaalsContact O-CG 3.25Å; I34-K38 WeakPolarHBondContact O-CG 3.17Å; I34-K38 PolarHBondContact O-N 2.95Å; R36-K38 PolarHBondContact O-N 3.19Å; K38-Y73 HydrophobicContact CB-CE1 4.35Å; K38-Y73 HydrophobicContact CD-CE2 4.39Å; K38-Y73 HydrophobicContact CG-CD1 4.14Å; K38-Y73 HydrophobicContact CG-CD2 4.02Å; K38-Y73 HydrophobicContact CG-CE1 3.8Å; K38-Y73 HydrophobicContact CG-CE2 3.68Å; K38-Y73 HydrophobicContact CG-CG 4.24Å
39	K	91.1	Very high	91.2	Very high	183 Å²	183	71.4 Å²	71.4	80%	0.796	34%	0.342	S	S	*	.	H	α-helix	trans	-77.8	-36.2	177	-72.1	178.8	-179.8	-178.7	0	113.1	R35 R36 V37	R35-K39 WeakPolarHBondContact O-CG 3.32Å; R35-K39 PolarHBondContact O-N 3.26Å; R36-K39 PolarHBondContact O-N 2.75Å; R36-K39 VanDerWaalsContact O-N 3.16Å; V37-K39 PolarHBondContact O-N 3.36Å
40	L	90.1	Very high	91	Very high	49 Å²	49	72.3 Å²	72.3	26%	0.257	35%	0.346	S	S	.	.	H	α-helix	trans	-93.8	-28.7	-172	-62.4	176.6	0	0	0	113.8	E24 I25 A28 R36 V37 N45	E24-L40 HydrophobicContact CB-CD1 3.88Å; I25-L40 HydrophobicContact CG1-CB 3.75Å; I25-L40 HydrophobicContact CG1-CD1 4.42Å; A28-L40 HydrophobicContact CB-CD1 4.49Å; R36-L40 HydrophobicContact CG-CD1 3.7Å; R36-L40 HydrophobicContact CG-CG 4.31Å; R36-L40 WeakPolarHBondContact O-CG 3.43Å; R36-L40 PolarHBondContact O-N 2.9Å; V37-L40 PolarHBondContact O-N 3.31Å; L40-N45 PolarHBondContact O-ND2 3.43Å
41	V	91.6	Very high	90.4	Very high	8 Å²	8	71.4 Å²	71.4	5%	0.048	36%	0.355	C	S	.	.			trans	-97.5	132.7	-174.5	-177.3	0	0	0	0	111.7	I25 V37 A46 Y73 L74 V77	I25-V41 HydrophobicContact CG1-CG2 4.4Å; I25-V41 HydrophobicContact CG2-CG2 3.66Å; V37-V41 HydrophobicContact CG1-CB 4.25Å; V37-V41 HydrophobicContact CG1-CG2 3.82Å; V37-V41 WeakPolarHBondContact O-CB 3.31Å; V37-V41 PolarHBondContact O-N 3.43Å; V41-A46 HydrophobicContact CG1-CB 4.04Å; V41-Y73 HydrophobicContact CB-CE1 4.49Å; V41-L74 HydrophobicContact CB-CD2 4.48Å; V41-L74 HydrophobicContact CG1-CD2 3.84Å; V41-L74 HydrophobicContact CG2-CD2 4.24Å; V41-V77 HydrophobicContact CG1-CG1 4.24Å
42	S	89.1	Confident	89.8	Confident	52 Å²	52	74.8 Å²	74.8	36%	0.364	37%	0.371	S	S	.	.			trans	-134.2	167.4	176.2	70.8	0	0	0	0	109.9	K44 N45 A46	S42-K44 PolarHBondContact O-N 3.4Å; S42-K44 PolarHBondContact OG-N 3.17Å; S42-N45 PolarHBondContact N-OD1 2.92Å; S42-N45 PolarHBondContact O-N 2.9Å; S42-N45 PolarHBondContact O-OD1 3.32Å; S42-N45 PolarHBondContact OG-OD1 3.02Å; S42-N45 VanDerWaalsContact OG-OD1 3.07Å; S42-A46 PolarHBondContact O-N 3.09Å
43	A	86.7	Confident	89.2	Confident	78 Å²	78	75.7 Å²	75.7	65%	0.645	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-24.8	176.9	0	0	0	0	0	113.4	V77	A43-V77 HydrophobicContact CB-CG1 4.43Å; A43-V77 VanDerWaalsContact N-CG1 3.32Å
44	K	85.2	Confident	88.9	Confident	206 Å²	206	79.2 Å²	79.2	90%	0.896	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-28.9	179.3	-67	-176.2	180	178.5	0	113.5	S42	S42-K44 PolarHBondContact O-N 3.4Å; S42-K44 PolarHBondContact OG-N 3.17Å
45	N	90.9	Very high	88.8	Confident	30 Å²	30	82 Å²	82	16%	0.16	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	1.8	-174.5	67.4	-4.7	0	0	0	114.2	I25 L40 S42 N47 I48	I25-N45 VanDerWaalsContact CD1-ND2 3.34Å; I25-N45 WeakPolarHBondContact CD1-ND2 3.48Å; L40-N45 PolarHBondContact O-ND2 3.43Å; S42-N45 PolarHBondContact N-OD1 2.92Å; S42-N45 PolarHBondContact O-N 2.9Å; S42-N45 PolarHBondContact O-OD1 3.32Å; S42-N45 PolarHBondContact OG-OD1 3.02Å; S42-N45 VanDerWaalsContact OG-OD1 3.07Å; N45-N47 PolarHBondContact O-N 3.21Å; N45-I48 HydrophobicContact CB-CG2 3.73Å; N45-I48 WeakPolarHBondContact O-CG1 3.36Å; N45-I48 WeakPolarHBondContact O-CG2 3.44Å; N45-I48 PolarHBondContact O-N 3.37Å; N45-I48 VanDerWaalsContact O-N 3.11Å
46	A	90.9	Very high	88.9	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-24.3	176.9	0	0	0	0	0	114.4	V41 S42 V77 A79	V41-A46 HydrophobicContact CG1-CB 4.04Å; S42-A46 PolarHBondContact O-N 3.09Å; A46-V77 HydrophobicContact CB-CG1 4.18Å; A46-A79 HydrophobicContact CB-CB 4.41Å
47	N	93.6	Very high	89	Confident	57 Å²	57	69.3 Å²	69.3	31%	0.305	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	22.9	-179.6	-66.4	-60.6	0	0	0	113.6	N45 G78 A79 T80	N45-N47 PolarHBondContact O-N 3.21Å; N47-G78 PolarHBondContact ND2-O 3.05Å; N47-A79 WeakPolarHBondContact OD1-CA 3.39Å; N47-T80 PolarHBondContact OD1-N 3.46Å
48	I	92.7	Very high	89.2	Confident	35 Å²	35	69.3 Å²	69.3	18%	0.179	35%	0.353	C	S	.	.			trans	-57.9	154.5	170.3	60.1	176	0	0	0	110.5	D22 I25 F26 N45 T57 P58	D22-I48 HydrophobicContact CB-CD1 4.21Å; I25-I48 HydrophobicContact CB-CD1 4.3Å; I25-I48 HydrophobicContact CD1-CD1 3.72Å; I25-I48 HydrophobicContact CG2-CD1 4.32Å; F26-I48 HydrophobicContact CD2-CD1 4.5Å; F26-I48 HydrophobicContact CE2-CD1 3.65Å; F26-I48 HydrophobicContact CE2-CG1 4Å; F26-I48 HydrophobicContact CZ-CD1 3.92Å; F26-I48 HydrophobicContact CZ-CG1 3.72Å; N45-I48 HydrophobicContact CB-CG2 3.73Å; N45-I48 WeakPolarHBondContact O-CG1 3.36Å; N45-I48 WeakPolarHBondContact O-CG2 3.44Å; N45-I48 PolarHBondContact O-N 3.37Å; N45-I48 VanDerWaalsContact O-N 3.11Å; I48-T57 WeakPolarHBondContact O-CA 3.21Å; I48-P58 HydrophobicContact CG1-CG 3.86Å; I48-P58 WeakPolarHBondContact O-CD 3.44Å
49	R	92.1	Very high	89.3	Confident	108 Å²	108	63.7 Å²	63.7	41%	0.408	33%	0.329	S	S	.	.			trans	-114	135	179.1	-67.8	179.9	172.3	-86.1	7.1	109.1	F18 K55 S56 T57 R84	F18-R49 VanDerWaalsContact CZ-O 3.24Å; F18-R49 WeakPolarHBondContact CZ-O 3.24Å; R49-K55 HydrophobicContact CB-CB 4.12Å; R49-K55 WeakPolarHBondContact CG-O 3.39Å; R49-K55 PolarHBondContact NH1-O 3.38Å; R49-S56 WeakPolarHBondContact CA-O 3.45Å; R49-T57 HydrophobicContact CG-CG2 4.47Å; R49-R84 VanDerWaalsContact CZ-O 3.29Å; R49-R84 PolarHBondContact NH1-O 3.44Å; R49-R84 PolarHBondContact NH2-O 3.34Å
50	D	88.6	Confident	89.6	Confident	18 Å²	18	55 Å²	55	10%	0.096	29%	0.291	C	S	.	.			trans	-64.4	149.4	178	78.6	-40	0	0	0	111.6	F26 G53 K55 S56 F61	F26-D50 HydrophobicContact CD1-CB 4.37Å; F26-D50 HydrophobicContact CD2-CB 4.5Å; F26-D50 HydrophobicContact CE1-CB 3.93Å; F26-D50 HydrophobicContact CE2-CB 4.09Å; F26-D50 HydrophobicContact CZ-CB 3.78Å; D50-G53 WeakPolarHBondContact OD2-CA 3.48Å; D50-G53 PolarHBondContact OD2-N 2.93Å; D50-K55 WeakPolarHBondContact O-CA 3.23Å; D50-K55 WeakPolarHBondContact OD1-CA 3.47Å; D50-K55 PolarHBondContact OD1-N 3.07Å; D50-S56 PolarHBondContact N-O 3.46Å; D50-S56 PolarHBondContact OD1-N 2.66Å; D50-F61 HydrophobicContact CB-CE2 4.47Å
51	S	79.7	Confident	89.8	Confident	75 Å²	75	55.2 Å²	55.2	52%	0.524	29%	0.29	S	S	.	.	S	Bend	trans	-97.2	-19.9	-178.7	54.2	0	0	0	0	113.6
52	I	76.4	Confident	90	Very high	148 Å²	148	54.9 Å²	54.9	76%	0.759	29%	0.288	S	S	*	.	S	Bend	trans	-94.4	-31.1	-172.9	-56.5	173.5	0	0	0	111.4
53	G	79.1	Confident	90.4	Very high	43 Å²	43	52.4 Å²	52.4	44%	0.443	27%	0.271	S	S	.	.	S	Bend	trans	-106.9	-138.5	-177.4	0	0	0	0	0	113.8	D50 K55	D50-G53 WeakPolarHBondContact OD2-CA 3.48Å; D50-G53 PolarHBondContact OD2-N 2.93Å; G53-K55 PolarHBondContact O-N 3.36Å
54	R	86.1	Confident	90.8	Very high	143 Å²	143	49 Å²	49	54%	0.54	24%	0.243	S	C	.	.	S	Bend	trans	-84.3	20.2	-171.6	-71.7	-176.1	143.9	119.4	-5.9	113.9	S56 D85 E86	R54-S56 PolarHBondContact O-N 3.36Å; R54-D85 HydrophobicContact CB-CB 4.33Å; R54-D85 WeakPolarHBondContact CB-OD2 3.37Å; R54-D85 WeakPolarHBondContact O-CB 3.32Å; R54-E86 HydrophobicContact CB-CB 4.47Å; R54-E86 WeakPolarHBondContact O-CB 3.16Å; R54-E86 WeakPolarHBondContact O-CG 3.32Å; R54-E86 PolarHBondContact O-N 3.5Å
55	K	90.6	Very high	91.4	Very high	92 Å²	92	43.5 Å²	43.5	40%	0.4	22%	0.219	S	C	.	.	S	Bend	trans	56.5	35.3	-170	-58.3	179.6	179.2	149	0	112.9	R49 D50 G53 E86	R49-K55 HydrophobicContact CB-CB 4.12Å; R49-K55 WeakPolarHBondContact CG-O 3.39Å; R49-K55 PolarHBondContact NH1-O 3.38Å; D50-K55 WeakPolarHBondContact O-CA 3.23Å; D50-K55 WeakPolarHBondContact OD1-CA 3.47Å; D50-K55 PolarHBondContact OD1-N 3.07Å; G53-K55 PolarHBondContact O-N 3.36Å; K55-E86 HydrophobicContact CB-CG 4.04Å; K55-E86 HydrophobicContact CD-CG 3.78Å; K55-E86 WeakPolarHBondContact CD-OE1 3.23Å; K55-E86 WeakPolarHBondContact CE-OE1 3.45Å; K55-E86 HydrophobicContact CG-CG 3.93Å; K55-E86 IonicContact NZ-OE1 3.53Å; K55-E86 PolarHBondContact NZ-OE1 3.38Å
56	S	94.2	Very high	91.6	Very high	11 Å²	11	43.2 Å²	43.2	8%	0.077	22%	0.223	C	C	.	.			trans	-67.7	150.2	174.1	-71.6	0	0	0	0	111.6	F26 R49 D50 R54	F26-S56 WeakPolarHBondContact CE1-O 3.12Å; R49-S56 WeakPolarHBondContact CA-O 3.45Å; D50-S56 PolarHBondContact N-O 3.46Å; D50-S56 PolarHBondContact OD1-N 2.66Å; R54-S56 PolarHBondContact O-N 3.36Å
57	T	95.2	Very high	91.9	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.012	24%	0.24	C	C	.	.			trans	-91	164.2	175.8	67.7	0	0	0	0	112.1	I48 R49 L59 H60 F61 A83	I48-T57 WeakPolarHBondContact O-CA 3.21Å; R49-T57 HydrophobicContact CG-CG2 4.47Å; T57-L59 PolarHBondContact O-N 2.94Å; T57-L59 VanDerWaalsContact O-N 3.11Å; T57-H60 PolarHBondContact N-ND1 3.02Å; T57-H60 VanDerWaalsContact N-ND1 3.2Å; T57-H60 WeakPolarHBondContact O-CB 3.44Å; T57-H60 PolarHBondContact O-N 2.97Å; T57-H60 PolarHBondContact OG1-ND1 3.25Å; T57-F61 PolarHBondContact O-N 3.33Å; T57-A83 HydrophobicContact CG2-CB 3.97Å
58	P	95.3	Very high	92	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-50.9	-35.5	172.8	-30.1	35.4	0	0	0	113.3	I25 F26 I48 H60 F61 A62 L74	I25-P58 HydrophobicContact CG2-CB 4.19Å; I25-P58 HydrophobicContact CG2-CG 3.85Å; F26-P58 HydrophobicContact CD1-CG 4.46Å; F26-P58 HydrophobicContact CE1-CG 4.02Å; F26-P58 HydrophobicContact CZ-CG 4.39Å; I48-P58 HydrophobicContact CG1-CG 3.86Å; I48-P58 WeakPolarHBondContact O-CD 3.44Å; P58-H60 PolarHBondContact O-N 3.33Å; P58-F61 PolarHBondContact O-N 2.88Å; P58-A62 PolarHBondContact O-N 2.99Å; P58-L74 HydrophobicContact CB-CD1 4.14Å; P58-L74 HydrophobicContact CB-CD2 4.21Å
59	L	97	Very high	92.2	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.6	-34.7	177	-170.6	60.4	0	0	0	112.8	T57 F61 A63 V71 L74 I75 A79 V81 P91 L107	T57-L59 PolarHBondContact O-N 2.94Å; T57-L59 VanDerWaalsContact O-N 3.11Å; L59-F61 VanDerWaalsContact C-N 3.34Å; L59-A63 WeakPolarHBondContact O-CB 3.49Å; L59-A63 PolarHBondContact O-N 3.32Å; L59-V71 HydrophobicContact CD1-CB 4.36Å; L59-V71 HydrophobicContact CD1-CG1 3.91Å; L59-V71 HydrophobicContact CD1-CG2 4.29Å; L59-L74 HydrophobicContact CB-CD1 4.4Å; L59-L74 HydrophobicContact CD1-CB 4.15Å; L59-L74 HydrophobicContact CD1-CD1 4.24Å; L59-I75 HydrophobicContact CD1-CG1 4.26Å; L59-I75 HydrophobicContact CD2-CG1 4.47Å; L59-A79 HydrophobicContact CB-CB 4.22Å; L59-A79 HydrophobicContact CD2-CB 4.02Å; L59-V81 HydrophobicContact CD2-CG1 4.21Å; L59-P91 HydrophobicContact CB-CG 4.2Å; L59-P91 HydrophobicContact CD2-CB 4.33Å; L59-P91 HydrophobicContact CD2-CG 3.94Å; L59-P91 HydrophobicContact CG-CB 3.95Å; L59-P91 HydrophobicContact CG-CG 3.86Å; L59-L107 HydrophobicContact CD1-CD2 4.31Å; L59-L107 HydrophobicContact CD2-CD2 4.32Å; L59-L107 HydrophobicContact CG-CD2 4.45Å
60	H	96.6	Very high	92.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-63.6	-39.8	173.9	-73.8	83.2	0	0	0	112.1	T57 P58 G64 A83 L89 P91 N94	T57-H60 PolarHBondContact N-ND1 3.02Å; T57-H60 VanDerWaalsContact N-ND1 3.2Å; T57-H60 WeakPolarHBondContact O-CB 3.44Å; T57-H60 PolarHBondContact O-N 2.97Å; T57-H60 PolarHBondContact OG1-ND1 3.25Å; P58-H60 PolarHBondContact O-N 3.33Å; H60-G64 PolarHBondContact O-N 3.41Å; H60-A83 PolarHBondContact CE1-O 3.01Å; H60-A83 PolarHBondContact NE2-O 3.15Å; H60-L89 PolarHBondContact NE2-O 3.47Å; H60-P91 WeakPolarHBondContact NE2-CD 3.45Å; H60-N94 PolarHBondContact O-ND2 3.01Å; H60-N94 VanDerWaalsContact O-ND2 3.14Å
61	F	94.4	Very high	92.8	Very high	54 Å²	54	49.9 Å²	49.9	24%	0.237	25%	0.25	C	C	.	.	H	α-helix	trans	-68.7	-55	176.9	-82	-104.6	0	0	0	110.3	F26 C29 R30 D50 T57 P58 L59 A63 G64 F65	F26-F61 AromaticContact CD1-CD2 3.66Å; F26-F61 HydrophobicContact CD1-CD2 3.66Å; F26-F61 AromaticContact CD1-CE2 3.71Å; F26-F61 HydrophobicContact CD1-CE2 3.71Å; F26-F61 HydrophobicContact CD1-CG 4.24Å; F26-F61 HydrophobicContact CD1-CZ 4.34Å; F26-F61 HydrophobicContact CE1-CD2 4.24Å; F26-F61 HydrophobicContact CE1-CE2 4.2Å; C29-F61 HydrophobicContact CB-CB 4.46Å; R30-F61 HydrophobicContact CB-CD1 4.47Å; D50-F61 HydrophobicContact CB-CE2 4.47Å; T57-F61 PolarHBondContact O-N 3.33Å; P58-F61 PolarHBondContact O-N 2.88Å; L59-F61 VanDerWaalsContact C-N 3.34Å; F61-A63 PolarHBondContact O-N 3.35Å; F61-G64 PolarHBondContact O-N 3.47Å; F61-G64 VanDerWaalsContact O-N 3.14Å; F61-F65 HydrophobicContact CD1-CE2 4.26Å; F61-F65 VanDerWaalsContact O-CD2 3.3Å; F61-F65 WeakPolarHBondContact O-CD2 3.28Å; F61-F65 PolarHBondContact O-N 3.32Å
62	A	96.7	Very high	93.7	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.2	-38	179.7	0	0	0	0	0	112.1	C29 P58 G66 R67 V70 V71 L74	C29-A62 HydrophobicContact CB-CB 4.37Å; P58-A62 PolarHBondContact O-N 2.99Å; A62-G66 PolarHBondContact O-N 3.01Å; A62-R67 HydrophobicContact CB-CB 4.45Å; A62-R67 PolarHBondContact O-N 2.97Å; A62-V70 HydrophobicContact CB-CB 4.24Å; A62-V70 HydrophobicContact CB-CG1 3.65Å; A62-V71 HydrophobicContact CB-CG2 3.72Å; A62-L74 HydrophobicContact CB-CD1 3.82Å
63	A	97.1	Very high	94.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-69.3	-46.2	176.6	0	0	0	0	0	113.3	L59 F61 F65 G66 P91 A95 H100 V103 L107	L59-A63 WeakPolarHBondContact O-CB 3.49Å; L59-A63 PolarHBondContact O-N 3.32Å; F61-A63 PolarHBondContact O-N 3.35Å; A63-F65 VanDerWaalsContact C-N 3.27Å; A63-F65 PolarHBondContact O-N 3.38Å; A63-G66 PolarHBondContact O-N 3.07Å; A63-P91 HydrophobicContact CB-CB 4.07Å; A63-P91 WeakPolarHBondContact CB-O 3.3Å; A63-A95 HydrophobicContact CB-CB 4.23Å; A63-H100 PolarHBondContact O-CD2 3.17Å; A63-V103 HydrophobicContact CB-CG1 4.15Å; A63-L107 HydrophobicContact CB-CD1 4.04Å
64	G	95.3	Very high	95.5	Very high	6 Å²	6	42.8 Å²	42.8	6%	0.062	20%	0.196	C	C	.	.	H	α-helix	trans	-67.9	-23.2	179.8	0	0	0	0	0	114.6	H60 F61 F98 H100	H60-G64 PolarHBondContact O-N 3.41Å; F61-G64 PolarHBondContact O-N 3.47Å; F61-G64 VanDerWaalsContact O-N 3.14Å; G64-F98 VanDerWaalsContact O-CD2 3.26Å; G64-F98 WeakPolarHBondContact O-CD2 3.49Å; G64-F98 WeakPolarHBondContact O-CG 3.15Å; G64-H100 PolarHBondContact O-CD2 3.49Å; G64-H100 PolarHBondContact O-NE2 2.92Å; G64-H100 VanDerWaalsContact O-NE2 3.14Å
65	F	96	Very high	95.9	Very high	92 Å²	92	37.9 Å²	37.9	40%	0.404	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	7.3	174.4	-72.2	-85	0	0	0	113.3	R30 F61 A63 R67	R30-F65 HydrophobicContact CB-CD2 4.23Å; R30-F65 HydrophobicContact CB-CE2 4.33Å; R30-F65 HydrophobicContact CG-CD1 3.99Å; R30-F65 HydrophobicContact CG-CD2 3.75Å; R30-F65 HydrophobicContact CG-CE1 3.82Å; R30-F65 HydrophobicContact CG-CE2 3.6Å; R30-F65 HydrophobicContact CG-CG 3.97Å; R30-F65 HydrophobicContact CG-CZ 3.63Å; F61-F65 HydrophobicContact CD1-CE2 4.26Å; F61-F65 VanDerWaalsContact O-CD2 3.3Å; F61-F65 WeakPolarHBondContact O-CD2 3.28Å; F61-F65 PolarHBondContact O-N 3.32Å; A63-F65 VanDerWaalsContact C-N 3.27Å; A63-F65 PolarHBondContact O-N 3.38Å; F65-R67 VanDerWaalsContact C-N 3.32Å; F65-R67 HydrophobicContact CB-CG 4.11Å; F65-R67 WeakPolarHBondContact O-CD 3.34Å; F65-R67 PolarHBondContact O-N 2.96Å; F65-R67 PolarHBondContact O-NE 2.77Å
66	G	95.6	Very high	96.2	Very high	23 Å²	23	37.9 Å²	37.9	24%	0.237	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	22.7	172.1	0	0	0	0	0	115.2	A62 A63 K68 H100	A62-G66 PolarHBondContact O-N 3.01Å; A63-G66 PolarHBondContact O-N 3.07Å; G66-K68 PolarHBondContact O-N 3.23Å; G66-H100 VanDerWaalsContact CA-CD2 3.41Å; G66-H100 WeakPolarHBondContact CA-CD2 3.16Å; G66-H100 PolarHBondContact N-CD2 3.21Å; G66-H100 PolarHBondContact N-NE2 3.22Å
67	R	96.8	Very high	96.1	Very high	97 Å²	97	38.7 Å²	38.7	37%	0.366	20%	0.196	S	C	.	.			trans	-82.1	75.6	-174.5	-51.7	-51.2	-172.9	-172.3	0.8	111.3	C29 R30 A62 F65 E69 V70 V71	C29-R67 WeakPolarHBondContact O-CG 3.42Å; R30-R67 PolarHBondContact O-NE 3.15Å; R30-R67 PolarHBondContact O-NH2 3.08Å; R30-R67 VanDerWaalsContact O-NH2 3.1Å; A62-R67 HydrophobicContact CB-CB 4.45Å; A62-R67 PolarHBondContact O-N 2.97Å; F65-R67 VanDerWaalsContact C-N 3.32Å; F65-R67 HydrophobicContact CB-CG 4.11Å; F65-R67 WeakPolarHBondContact O-CD 3.34Å; F65-R67 PolarHBondContact O-N 2.96Å; F65-R67 PolarHBondContact O-NE 2.77Å; R67-E69 PolarHBondContact O-N 3.06Å; R67-V70 HydrophobicContact CB-CB 3.9Å; R67-V70 HydrophobicContact CB-CG2 4.13Å; R67-V70 PolarHBondContact O-N 3.27Å; R67-V70 VanDerWaalsContact O-N 3.14Å; R67-V71 WeakPolarHBondContact O-CG2 3.34Å; R67-V71 PolarHBondContact O-N 3.19Å
68	K	96.8	Very high	96.1	Very high	120 Å²	120	40.6 Å²	40.6	52%	0.522	22%	0.216	S	C	.	.	H	α-helix	trans	-49.2	-50.9	-174.1	-174.6	-174.7	175.3	-171.3	0	113.7	G66 V70 V71 T72 A102 V103 L106	G66-K68 PolarHBondContact O-N 3.23Å; K68-V70 PolarHBondContact O-N 2.97Å; K68-V71 WeakPolarHBondContact O-CB 3.33Å; K68-V71 PolarHBondContact O-N 2.96Å; K68-T72 PolarHBondContact O-N 2.9Å; K68-T72 PolarHBondContact O-OG1 2.84Å; K68-T72 VanDerWaalsContact O-OG1 3.11Å; K68-A102 HydrophobicContact CD-CB 4.4Å; K68-V103 HydrophobicContact CB-CG2 4.16Å; K68-L106 HydrophobicContact CG-CD2 4.24Å
69	E	95.6	Very high	96.1	Very high	139 Å²	139	40.9 Å²	40.9	65%	0.65	22%	0.219	S	C	*	.	H	α-helix	trans	-63.5	-40.8	-178.6	-64.2	-176.7	-176.8	0	0	112.9	R67 T72 Y73	R67-E69 PolarHBondContact O-N 3.06Å; E69-T72 PolarHBondContact O-N 3.38Å; E69-Y73 PolarHBondContact O-N 2.95Å
70	V	97.3	Very high	96	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.012	24%	0.241	C	C	.	.	H	α-helix	trans	-64.5	-43	175.4	175	0	0	0	0	110.3	C29 I34 V37 A62 R67 K68 T72 Y73 L74	C29-V70 HydrophobicContact CB-CG1 4.29Å; I34-V70 HydrophobicContact CB-CG2 4.44Å; I34-V70 HydrophobicContact CD1-CG2 4.12Å; V37-V70 HydrophobicContact CG1-CG1 4.22Å; V37-V70 HydrophobicContact CG2-CG1 4.05Å; V37-V70 HydrophobicContact CG2-CG2 4.28Å; A62-V70 HydrophobicContact CB-CB 4.24Å; A62-V70 HydrophobicContact CB-CG1 3.65Å; R67-V70 HydrophobicContact CB-CB 3.9Å; R67-V70 HydrophobicContact CB-CG2 4.13Å; R67-V70 PolarHBondContact O-N 3.27Å; R67-V70 VanDerWaalsContact O-N 3.14Å; K68-V70 PolarHBondContact O-N 2.97Å; V70-T72 PolarHBondContact O-N 3.23Å; V70-Y73 PolarHBondContact O-N 3.26Å; V70-L74 HydrophobicContact CG1-CD1 3.86Å; V70-L74 HydrophobicContact CG1-CG 4.16Å; V70-L74 WeakPolarHBondContact O-CB 3.48Å; V70-L74 VanDerWaalsContact O-CG 3.24Å; V70-L74 WeakPolarHBondContact O-CG 3.39Å; V70-L74 PolarHBondContact O-N 3.2Å
71	V	97.4	Very high	96	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59	-47.4	174.7	171.6	0	0	0	0	110.8	L59 A62 R67 K68 Y73 L74 I75 V103 L106 L107	L59-V71 HydrophobicContact CD1-CB 4.36Å; L59-V71 HydrophobicContact CD1-CG1 3.91Å; L59-V71 HydrophobicContact CD1-CG2 4.29Å; A62-V71 HydrophobicContact CB-CG2 3.72Å; R67-V71 WeakPolarHBondContact O-CG2 3.34Å; R67-V71 PolarHBondContact O-N 3.19Å; K68-V71 WeakPolarHBondContact O-CB 3.33Å; K68-V71 PolarHBondContact O-N 2.96Å; V71-Y73 VanDerWaalsContact C-N 3.34Å; V71-Y73 PolarHBondContact O-N 2.79Å; V71-L74 PolarHBondContact O-N 3.13Å; V71-I75 HydrophobicContact CG1-CD1 3.74Å; V71-I75 HydrophobicContact CG1-CG1 4.5Å; V71-I75 VanDerWaalsContact O-CG1 3.27Å; V71-I75 WeakPolarHBondContact O-CG1 3.35Å; V71-I75 PolarHBondContact O-N 2.83Å; V71-V103 HydrophobicContact CG1-CG1 4.32Å; V71-V103 HydrophobicContact CG2-CG1 3.98Å; V71-L106 HydrophobicContact CB-CD2 4.07Å; V71-L106 HydrophobicContact CG1-CD2 3.6Å; V71-L106 HydrophobicContact CG1-CG 4.28Å; V71-L107 HydrophobicContact CG1-CD2 4.05Å; V71-L107 HydrophobicContact CG1-CG 4.36Å
72	T	97.3	Very high	96	Very high	66 Å²	66	45.2 Å²	45.2	41%	0.405	26%	0.258	S	S	.	.	H	α-helix	trans	-56.9	-46.8	176.7	-59.5	0	0	0	0	111.6	K68 E69 V70 I75 S76 L106	K68-T72 PolarHBondContact O-N 2.9Å; K68-T72 PolarHBondContact O-OG1 2.84Å; K68-T72 VanDerWaalsContact O-OG1 3.11Å; E69-T72 PolarHBondContact O-N 3.38Å; V70-T72 PolarHBondContact O-N 3.23Å; T72-I75 PolarHBondContact O-N 3.21Å; T72-S76 PolarHBondContact O-N 3.34Å; T72-L106 VanDerWaalsContact OG1-CD2 3.23Å; T72-L106 WeakPolarHBondContact OG1-CD2 3.38Å
73	Y	96.5	Very high	95.9	Very high	52 Å²	52	45.9 Å²	45.9	20%	0.204	26%	0.264	C	S	.	.	H	α-helix	trans	-67.8	-41.7	179.1	-179.3	-103.6	0	0	0	112.9	I34 V37 K38 V41 E69 V70 V71 I75 S76 V77	I34-Y73 HydrophobicContact CD1-CD1 4.42Å; I34-Y73 HydrophobicContact CD1-CG 4.13Å; V37-Y73 HydrophobicContact CG1-CD1 3.81Å; V37-Y73 HydrophobicContact CG1-CE1 4.12Å; K38-Y73 HydrophobicContact CB-CE1 4.35Å; K38-Y73 HydrophobicContact CD-CE2 4.39Å; K38-Y73 HydrophobicContact CG-CD1 4.14Å; K38-Y73 HydrophobicContact CG-CD2 4.02Å; K38-Y73 HydrophobicContact CG-CE1 3.8Å; K38-Y73 HydrophobicContact CG-CE2 3.68Å; K38-Y73 HydrophobicContact CG-CG 4.24Å; V41-Y73 HydrophobicContact CB-CE1 4.49Å; E69-Y73 PolarHBondContact O-N 2.95Å; V70-Y73 PolarHBondContact O-N 3.26Å; V71-Y73 VanDerWaalsContact C-N 3.34Å; V71-Y73 PolarHBondContact O-N 2.79Å; Y73-I75 VanDerWaalsContact C-N 3.31Å; Y73-I75 PolarHBondContact O-N 3.47Å; Y73-S76 PolarHBondContact O-N 3.07Å; Y73-S76 PolarHBondContact O-OG 3Å; Y73-V77 HydrophobicContact CD1-CG2 4.21Å; Y73-V77 HydrophobicContact CD2-CG2 4.26Å; Y73-V77 HydrophobicContact CE1-CG2 3.73Å; Y73-V77 HydrophobicContact CE2-CG2 3.78Å; Y73-V77 HydrophobicContact CG-CG2 4.46Å; Y73-V77 VanDerWaalsContact CZ-CG2 3.49Å; Y73-V77 VanDerWaalsContact O-CG2 3.32Å; Y73-V77 WeakPolarHBondContact O-CG2 3.4Å; Y73-V77 PolarHBondContact O-N 3.22Å
74	L	96.8	Very high	95.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-43.3	177.4	-74.5	175.1	0	0	0	111.2	V37 V41 P58 L59 A62 V70 V71 V77 G78 A79	V37-L74 HydrophobicContact CG1-CD2 4.39Å; V41-L74 HydrophobicContact CB-CD2 4.48Å; V41-L74 HydrophobicContact CG1-CD2 3.84Å; V41-L74 HydrophobicContact CG2-CD2 4.24Å; P58-L74 HydrophobicContact CB-CD1 4.14Å; P58-L74 HydrophobicContact CB-CD2 4.21Å; L59-L74 HydrophobicContact CB-CD1 4.4Å; L59-L74 HydrophobicContact CD1-CB 4.15Å; L59-L74 HydrophobicContact CD1-CD1 4.24Å; A62-L74 HydrophobicContact CB-CD1 3.82Å; V70-L74 HydrophobicContact CG1-CD1 3.86Å; V70-L74 HydrophobicContact CG1-CG 4.16Å; V70-L74 WeakPolarHBondContact O-CB 3.48Å; V70-L74 VanDerWaalsContact O-CG 3.24Å; V70-L74 WeakPolarHBondContact O-CG 3.39Å; V70-L74 PolarHBondContact O-N 3.2Å; V71-L74 PolarHBondContact O-N 3.13Å; L74-V77 PolarHBondContact O-N 3.47Å; L74-G78 PolarHBondContact O-N 3.07Å; L74-A79 HydrophobicContact CB-CB 3.87Å; L74-A79 WeakPolarHBondContact O-CB 3.43Å; L74-A79 PolarHBondContact O-N 3.19Å
75	I	96.2	Very high	95.7	Very high	40 Å²	40	50.8 Å²	50.8	21%	0.205	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-43.1	176.6	-66.4	167.6	0	0	0	110.4	L59 V71 T72 Y73 V77 G78 V81 L107	L59-I75 HydrophobicContact CD1-CG1 4.26Å; L59-I75 HydrophobicContact CD2-CG1 4.47Å; V71-I75 HydrophobicContact CG1-CD1 3.74Å; V71-I75 HydrophobicContact CG1-CG1 4.5Å; V71-I75 VanDerWaalsContact O-CG1 3.27Å; V71-I75 WeakPolarHBondContact O-CG1 3.35Å; V71-I75 PolarHBondContact O-N 2.83Å; T72-I75 PolarHBondContact O-N 3.21Å; Y73-I75 VanDerWaalsContact C-N 3.31Å; Y73-I75 PolarHBondContact O-N 3.47Å; I75-V77 VanDerWaalsContact C-N 3.26Å; I75-V77 PolarHBondContact O-N 3.45Å; I75-G78 PolarHBondContact O-N 3.35Å; I75-V81 HydrophobicContact CD1-CG1 4.19Å; I75-V81 HydrophobicContact CG1-CG1 4.13Å; I75-L107 HydrophobicContact CD1-CD2 4.14Å
76	S	95.3	Very high	95.5	Very high	91 Å²	91	51.6 Å²	51.6	64%	0.636	29%	0.286	S	S	*	.	H	α-helix	trans	-65.9	-27.8	179	74.4	0	0	0	0	113.5	T72 Y73 G78	T72-S76 PolarHBondContact O-N 3.34Å; Y73-S76 PolarHBondContact O-N 3.07Å; Y73-S76 PolarHBondContact O-OG 3Å; S76-G78 VanDerWaalsContact C-N 3.31Å
77	V	93.9	Very high	95.4	Very high	28 Å²	28	50.6 Å²	50.6	17%	0.17	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.3	174.6	178.8	0	0	0	0	112.7	V41 A43 A46 Y73 L74 I75	V41-V77 HydrophobicContact CG1-CG1 4.24Å; A43-V77 HydrophobicContact CB-CG1 4.43Å; A43-V77 VanDerWaalsContact N-CG1 3.32Å; A46-V77 HydrophobicContact CB-CG1 4.18Å; Y73-V77 HydrophobicContact CD1-CG2 4.21Å; Y73-V77 HydrophobicContact CD2-CG2 4.26Å; Y73-V77 HydrophobicContact CE1-CG2 3.73Å; Y73-V77 HydrophobicContact CE2-CG2 3.78Å; Y73-V77 HydrophobicContact CG-CG2 4.46Å; Y73-V77 VanDerWaalsContact CZ-CG2 3.49Å; Y73-V77 VanDerWaalsContact O-CG2 3.32Å; Y73-V77 WeakPolarHBondContact O-CG2 3.4Å; Y73-V77 PolarHBondContact O-N 3.22Å; L74-V77 PolarHBondContact O-N 3.47Å; I75-V77 VanDerWaalsContact C-N 3.26Å; I75-V77 PolarHBondContact O-N 3.45Å
78	G	93.8	Very high	95.3	Very high	42 Å²	42	46 Å²	46	43%	0.433	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	102	25.2	176.5	0	0	0	0	0	115.1	N47 L74 I75 S76 T80	N47-G78 PolarHBondContact ND2-O 3.05Å; L74-G78 PolarHBondContact O-N 3.07Å; I75-G78 PolarHBondContact O-N 3.35Å; S76-G78 VanDerWaalsContact C-N 3.31Å; G78-T80 PolarHBondContact O-N 2.74Å
79	A	95.8	Very high	95.2	Very high	7 Å²	7	41.4 Å²	41.4	6%	0.058	24%	0.24	C	C	.	.			trans	-65.4	131.4	169.8	0	0	0	0	0	111.1	A46 N47 L59 L74 V81	A46-A79 HydrophobicContact CB-CB 4.41Å; N47-A79 WeakPolarHBondContact OD1-CA 3.39Å; L59-A79 HydrophobicContact CB-CB 4.22Å; L59-A79 HydrophobicContact CD2-CB 4.02Å; L74-A79 HydrophobicContact CB-CB 3.87Å; L74-A79 WeakPolarHBondContact O-CB 3.43Å; L74-A79 PolarHBondContact O-N 3.19Å; A79-V81 PolarHBondContact O-N 2.74Å
80	T	95.2	Very high	95.3	Very high	75 Å²	75	35 Å²	35	46%	0.46	21%	0.211	S	C	.	.			trans	-81	111.6	-174.8	-55.6	0	0	0	0	110.7	N47 G78 G82 A83	N47-T80 PolarHBondContact OD1-N 3.46Å; G78-T80 PolarHBondContact O-N 2.74Å; T80-G82 PolarHBondContact O-N 2.78Å; T80-A83 HydrophobicContact CG2-CB 4.44Å; T80-A83 WeakPolarHBondContact O-CB 3.31Å; T80-A83 PolarHBondContact O-N 3.05Å; T80-A83 VanDerWaalsContact O-N 3.16Å
81	V	95.9	Very high	95.3	Very high	25 Å²	25	35 Å²	35	15%	0.152	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.9	179.7	-64.1	0	0	0	0	114.1	L59 I75 A79 P91 L107 A112	L59-V81 HydrophobicContact CD2-CG1 4.21Å; I75-V81 HydrophobicContact CD1-CG1 4.19Å; I75-V81 HydrophobicContact CG1-CG1 4.13Å; A79-V81 PolarHBondContact O-N 2.74Å; V81-P91 WeakPolarHBondContact O-CD 3.49Å; V81-L107 HydrophobicContact CG1-CD2 4.26Å; V81-A112 HydrophobicContact CB-CB 4.23Å; V81-A112 HydrophobicContact CG2-CB 4.48Å
82	G	94.3	Very high	95.4	Very high	44 Å²	44	35 Å²	35	45%	0.454	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	10.9	177.6	0	0	0	0	0	114.8	T80 R84	T80-G82 PolarHBondContact O-N 2.78Å; G82-R84 PolarHBondContact O-N 3.49Å
83	A	94.4	Very high	95.4	Very high	14 Å²	14	31.9 Å²	31.9	12%	0.116	19%	0.191	C	C	.	.			trans	-62.6	133.5	178.2	0	0	0	0	0	110.3	T57 H60 T80 V90 P91	T57-A83 HydrophobicContact CG2-CB 3.97Å; H60-A83 PolarHBondContact CE1-O 3.01Å; H60-A83 PolarHBondContact NE2-O 3.15Å; T80-A83 HydrophobicContact CG2-CB 4.44Å; T80-A83 WeakPolarHBondContact O-CB 3.31Å; T80-A83 PolarHBondContact O-N 3.05Å; T80-A83 VanDerWaalsContact O-N 3.16Å; A83-V90 WeakPolarHBondContact O-CA 3.3Å; A83-P91 WeakPolarHBondContact O-CD 3.14Å
84	R	95	Very high	95.4	Very high	100 Å²	100	30.9 Å²	30.9	38%	0.377	19%	0.189	S	C	.	.			trans	-102.3	135.1	178.6	-68.5	174.3	174.6	-89.9	8.6	111.5	R49 G82 G88 L89 V90 V117	R49-R84 VanDerWaalsContact CZ-O 3.29Å; R49-R84 PolarHBondContact NH1-O 3.44Å; R49-R84 PolarHBondContact NH2-O 3.34Å; G82-R84 PolarHBondContact O-N 3.49Å; R84-G88 PolarHBondContact NH1-O 3.33Å; R84-L89 CarbonylContact C-O 3.51Å; R84-L89 VanDerWaalsContact CA-O 3.27Å; R84-L89 WeakPolarHBondContact CA-O 3.15Å; R84-V90 HydrophobicContact CG-CG1 3.79Å; R84-V117 PolarHBondContact NH1-O 3.37Å; R84-V117 PolarHBondContact NH2-O 2.9Å
85	D	94.1	Very high	95.4	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.048	19%	0.189	C	C	.	.			trans	-78.5	-173.3	169.2	83.7	-10.6	0	0	0	111.6	R54 G87 G88 L89	R54-D85 HydrophobicContact CB-CB 4.33Å; R54-D85 WeakPolarHBondContact CB-OD2 3.37Å; R54-D85 WeakPolarHBondContact O-CB 3.32Å; D85-G87 VanDerWaalsContact C-N 3.26Å; D85-G87 PolarHBondContact O-N 3.16Å; D85-G87 VanDerWaalsContact OD1-CA 3.27Å; D85-G87 WeakPolarHBondContact OD1-CA 3.39Å; D85-G87 PolarHBondContact OD1-N 3.13Å; D85-G88 PolarHBondContact O-N 3.38Å; D85-G88 PolarHBondContact OD1-N 3.24Å; D85-L89 PolarHBondContact N-O 2.98Å; D85-L89 WeakPolarHBondContact OD1-CB 3.48Å; D85-L89 PolarHBondContact OD1-N 2.98Å
86	E	92.4	Very high	95.5	Very high	109 Å²	109	29 Å²	29	51%	0.509	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-27.9	177	-77.9	-152.1	154.2	0	0	113.8	R54 K55 G88 H119	R54-E86 HydrophobicContact CB-CB 4.47Å; R54-E86 WeakPolarHBondContact O-CB 3.16Å; R54-E86 WeakPolarHBondContact O-CG 3.32Å; R54-E86 PolarHBondContact O-N 3.5Å; K55-E86 HydrophobicContact CB-CG 4.04Å; K55-E86 HydrophobicContact CD-CG 3.78Å; K55-E86 WeakPolarHBondContact CD-OE1 3.23Å; K55-E86 WeakPolarHBondContact CE-OE1 3.45Å; K55-E86 HydrophobicContact CG-CG 3.93Å; K55-E86 IonicContact NZ-OE1 3.53Å; K55-E86 PolarHBondContact NZ-OE1 3.38Å; E86-G88 PolarHBondContact O-N 2.98Å; E86-H119 PolarHBondContact O-CE1 3.32Å; E86-H119 PolarHBondContact O-ND1 3.06Å
87	G	92.1	Very high	95.5	Very high	2 Å²	2	25.7 Å²	25.7	2%	0.021	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-7.8	172.8	0	0	0	0	0	113.2	D85 H119 W120	D85-G87 VanDerWaalsContact C-N 3.26Å; D85-G87 PolarHBondContact O-N 3.16Å; D85-G87 VanDerWaalsContact OD1-CA 3.27Å; D85-G87 WeakPolarHBondContact OD1-CA 3.39Å; D85-G87 PolarHBondContact OD1-N 3.13Å; G87-H119 WeakPolarHBondContact O-CB 3.49Å; G87-H119 PolarHBondContact O-N 3.38Å; G87-H119 PolarHBondContact O-ND1 3.33Å; G87-W120 WeakPolarHBondContact O-CZ3 3.35Å
88	G	94.5	Very high	95.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.176	C	C	.	.			trans	80.4	5.2	-171.5	0	0	0	0	0	112.5	R84 D85 E86 H119	R84-G88 PolarHBondContact NH1-O 3.33Å; D85-G88 PolarHBondContact O-N 3.38Å; D85-G88 PolarHBondContact OD1-N 3.24Å; E86-G88 PolarHBondContact O-N 2.98Å; G88-H119 PolarHBondContact N-CE1 3.21Å; G88-H119 PolarHBondContact N-ND1 2.86Å
89	L	96.3	Very high	95.6	Very high	25 Å²	25	29.9 Å²	29.9	13%	0.131	17%	0.169	C	C	.	.			trans	-69.7	142.4	178.3	-61.1	167.9	0	0	0	109.2	H60 R84 D85 H93 D118	H60-L89 PolarHBondContact NE2-O 3.47Å; R84-L89 CarbonylContact C-O 3.51Å; R84-L89 VanDerWaalsContact CA-O 3.27Å; R84-L89 WeakPolarHBondContact CA-O 3.15Å; D85-L89 PolarHBondContact N-O 2.98Å; D85-L89 WeakPolarHBondContact OD1-CB 3.48Å; D85-L89 PolarHBondContact OD1-N 2.98Å; L89-H93 HydrophobicContact CB-CB 4.22Å; L89-H93 HydrophobicContact CD2-CB 3.73Å; L89-D118 HydrophobicContact CD2-CB 3.82Å; L89-D118 HydrophobicContact CG-CB 4.41Å
90	V	97.3	Very high	95.6	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.03	18%	0.179	C	C	.	.			trans	-102.5	161.9	169.3	-62.8	0	0	0	0	109.6	A83 R84 L92 H93 A116	A83-V90 WeakPolarHBondContact O-CA 3.3Å; R84-V90 HydrophobicContact CG-CG1 3.79Å; V90-L92 HydrophobicContact CG2-CB 4.03Å; V90-L92 PolarHBondContact O-N 3.22Å; V90-H93 VanDerWaalsContact CG2-ND1 3.27Å; V90-H93 WeakPolarHBondContact CG2-ND1 3.41Å; V90-H93 PolarHBondContact N-ND1 3Å; V90-H93 WeakPolarHBondContact O-CB 3.34Å; V90-H93 PolarHBondContact O-N 3.16Å; V90-A116 HydrophobicContact CG2-CB 4.04Å
91	P	97.7	Very high	95.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-51.7	-30.7	179.6	-28.5	34.9	0	0	0	114.3	L59 H60 A63 V81 A83 H93 N94 A95 L107	L59-P91 HydrophobicContact CB-CG 4.2Å; L59-P91 HydrophobicContact CD2-CB 4.33Å; L59-P91 HydrophobicContact CD2-CG 3.94Å; L59-P91 HydrophobicContact CG-CB 3.95Å; L59-P91 HydrophobicContact CG-CG 3.86Å; H60-P91 WeakPolarHBondContact NE2-CD 3.45Å; A63-P91 HydrophobicContact CB-CB 4.07Å; A63-P91 WeakPolarHBondContact CB-O 3.3Å; V81-P91 WeakPolarHBondContact O-CD 3.49Å; A83-P91 WeakPolarHBondContact O-CD 3.14Å; P91-H93 VanDerWaalsContact C-N 3.35Å; P91-H93 PolarHBondContact O-N 3.1Å; P91-N94 PolarHBondContact O-N 3.13Å; P91-A95 PolarHBondContact O-N 3.31Å; P91-A95 VanDerWaalsContact O-N 3.12Å; P91-L107 HydrophobicContact CB-CD1 4.29Å; P91-L107 HydrophobicContact CB-CD2 4.45Å
92	L	98	Very high	95.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.4	-37	176	-171.3	60	0	0	0	112.9	V90 N94 A95 C96 T104 L107 I108 A112 P124 L140	V90-L92 HydrophobicContact CG2-CB 4.03Å; V90-L92 PolarHBondContact O-N 3.22Å; L92-N94 VanDerWaalsContact C-N 3.31Å; L92-N94 PolarHBondContact O-N 2.99Å; L92-A95 PolarHBondContact O-N 3.24Å; L92-C96 WeakPolarHBondContact O-CB 3.31Å; L92-C96 PolarHBondContact O-N 3.32Å; L92-C96 PolarHBondContact O-SG 3.21Å; L92-T104 HydrophobicContact CD1-CG2 3.85Å; L92-L107 HydrophobicContact CB-CD1 4.43Å; L92-L107 HydrophobicContact CD1-CB 4.09Å; L92-L107 HydrophobicContact CD1-CD1 4.21Å; L92-I108 HydrophobicContact CD1-CD1 4.35Å; L92-I108 HydrophobicContact CD1-CG1 4.01Å; L92-I108 HydrophobicContact CD2-CD1 4.45Å; L92-I108 HydrophobicContact CD2-CG1 3.91Å; L92-A112 HydrophobicContact CB-CB 4.44Å; L92-A112 HydrophobicContact CD2-CB 4.12Å; L92-P124 HydrophobicContact CB-CG 4.38Å; L92-P124 HydrophobicContact CD2-CB 4.33Å; L92-P124 HydrophobicContact CD2-CG 3.91Å; L92-P124 HydrophobicContact CG-CB 4.09Å; L92-P124 HydrophobicContact CG-CG 3.93Å; L92-L140 HydrophobicContact CD2-CD2 4.35Å
93	H	98.2	Very high	95.7	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.009	16%	0.16	C	C	.	.	H	α-helix	trans	-60.2	-43.6	174.7	-74.6	86.5	0	0	0	111.3	L89 V90 P91 C96 S97 A116 F122 P124	L89-H93 HydrophobicContact CB-CB 4.22Å; L89-H93 HydrophobicContact CD2-CB 3.73Å; V90-H93 VanDerWaalsContact CG2-ND1 3.27Å; V90-H93 WeakPolarHBondContact CG2-ND1 3.41Å; V90-H93 PolarHBondContact N-ND1 3Å; V90-H93 WeakPolarHBondContact O-CB 3.34Å; V90-H93 PolarHBondContact O-N 3.16Å; P91-H93 VanDerWaalsContact C-N 3.35Å; P91-H93 PolarHBondContact O-N 3.1Å; H93-C96 PolarHBondContact O-N 2.73Å; H93-S97 WeakPolarHBondContact O-CB 3.39Å; H93-S97 PolarHBondContact O-N 2.69Å; H93-A116 PolarHBondContact CE1-O 3.36Å; H93-A116 PolarHBondContact NE2-O 3.34Å; H93-F122 PolarHBondContact NE2-O 3.23Å; H93-P124 WeakPolarHBondContact NE2-CD 3.33Å
94	N	96.1	Very high	95.9	Very high	30 Å²	30	28.8 Å²	28.8	16%	0.16	16%	0.155	C	C	.	.	H	α-helix	trans	-64.7	-48.6	-179.5	-67.1	16.7	0	0	0	111.1	H60 P91 L92 C96 S97 F98	H60-N94 PolarHBondContact O-ND2 3.01Å; H60-N94 VanDerWaalsContact O-ND2 3.14Å; P91-N94 PolarHBondContact O-N 3.13Å; L92-N94 VanDerWaalsContact C-N 3.31Å; L92-N94 PolarHBondContact O-N 2.99Å; N94-C96 PolarHBondContact O-N 3.44Å; N94-S97 PolarHBondContact O-N 2.89Å; N94-F98 VanDerWaalsContact O-CD2 3.28Å; N94-F98 WeakPolarHBondContact O-CD2 3.41Å; N94-F98 PolarHBondContact O-N 3.06Å
95	A	97.7	Very high	96	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56.5	-40.9	175.8	0	0	0	0	0	111.7	A63 P91 L92 G99 H100 V103 L107	A63-A95 HydrophobicContact CB-CB 4.23Å; P91-A95 PolarHBondContact O-N 3.31Å; P91-A95 VanDerWaalsContact O-N 3.12Å; L92-A95 PolarHBondContact O-N 3.24Å; A95-G99 PolarHBondContact O-N 2.9Å; A95-G99 VanDerWaalsContact O-N 3.15Å; A95-H100 PolarHBondContact O-N 3.49Å; A95-V103 HydrophobicContact CB-CB 4.39Å; A95-V103 HydrophobicContact CB-CG1 3.95Å; A95-L107 HydrophobicContact CB-CD1 4.14Å
96	C	97.5	Very high	96.1	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-72.3	-42.7	-178	-67.8	0	0	0	0	113.7	L92 H93 N94 F98 G99 P124 A128 V136 L140	L92-C96 WeakPolarHBondContact O-CB 3.31Å; L92-C96 PolarHBondContact O-N 3.32Å; L92-C96 PolarHBondContact O-SG 3.21Å; H93-C96 PolarHBondContact O-N 2.73Å; N94-C96 PolarHBondContact O-N 3.44Å; C96-F98 VanDerWaalsContact C-N 3.28Å; C96-F98 PolarHBondContact O-N 3.46Å; C96-G99 PolarHBondContact O-N 2.9Å; C96-P124 HydrophobicContact CB-CB 4.23Å; C96-A128 HydrophobicContact CB-CB 4.34Å; C96-V136 HydrophobicContact CB-CG1 3.62Å; C96-V136 WeakPolarHBondContact SG-CG1 3.21Å; C96-L140 HydrophobicContact CB-CD1 4.5Å
97	S	95.4	Very high	96.4	Very high	22 Å²	22	25 Å²	25	15%	0.154	14%	0.137	C	C	.	.	H	α-helix	trans	-63.1	-34.6	-179.7	-160.8	0	0	0	0	111.9	H93 N94 E127	H93-S97 WeakPolarHBondContact O-CB 3.39Å; H93-S97 PolarHBondContact O-N 2.69Å; N94-S97 PolarHBondContact O-N 2.89Å; S97-E127 PolarHBondContact OG-OE2 3.36Å
98	F	94.2	Very high	96.6	Very high	131 Å²	131	26.1 Å²	26.1	58%	0.575	14%	0.143	S	C	*	.	H	α-helix	trans	-90.7	-8.9	178.5	-67.3	-71.2	0	0	0	114.8	G64 N94 C96	G64-F98 VanDerWaalsContact O-CD2 3.26Å; G64-F98 WeakPolarHBondContact O-CD2 3.49Å; G64-F98 WeakPolarHBondContact O-CG 3.15Å; N94-F98 VanDerWaalsContact O-CD2 3.28Å; N94-F98 WeakPolarHBondContact O-CD2 3.41Å; N94-F98 PolarHBondContact O-N 3.06Å; C96-F98 VanDerWaalsContact C-N 3.28Å; C96-F98 PolarHBondContact O-N 3.46Å
99	G	95.1	Very high	96.7	Very high	28 Å²	28	35.1 Å²	35.1	29%	0.289	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	22.3	173.4	0	0	0	0	0	115.6	A95 C96 A101	A95-G99 PolarHBondContact O-N 2.9Å; A95-G99 VanDerWaalsContact O-N 3.15Å; C96-G99 PolarHBondContact O-N 2.9Å; G99-A101 PolarHBondContact O-N 3.2Å; G99-A101 VanDerWaalsContact O-N 3.09Å
100	H	96.8	Very high	96.6	Very high	59 Å²	59	36 Å²	36	27%	0.273	19%	0.19	S	C	.	.			trans	-86.6	71.7	-175	-61.1	-53.6	0	0	0	112.9	A63 G64 G66 A95 A102 V103 T104	A63-H100 PolarHBondContact O-CD2 3.17Å; G64-H100 PolarHBondContact O-CD2 3.49Å; G64-H100 PolarHBondContact O-NE2 2.92Å; G64-H100 VanDerWaalsContact O-NE2 3.14Å; G66-H100 VanDerWaalsContact CA-CD2 3.41Å; G66-H100 WeakPolarHBondContact CA-CD2 3.16Å; G66-H100 PolarHBondContact N-CD2 3.21Å; G66-H100 PolarHBondContact N-NE2 3.22Å; A95-H100 PolarHBondContact O-N 3.49Å; H100-A102 VanDerWaalsContact C-N 3.33Å; H100-A102 PolarHBondContact O-N 3.48Å; H100-V103 HydrophobicContact CB-CB 4.09Å; H100-V103 HydrophobicContact CB-CG2 4.31Å; H100-V103 PolarHBondContact O-N 2.93Å; H100-T104 PolarHBondContact O-N 3.11Å; H100-T104 PolarHBondContact O-OG1 3.31Å
101	A	95.5	Very high	96.5	Very high	21 Å²	21	38.7 Å²	38.7	17%	0.174	22%	0.218	C	C	.	.	H	α-helix	trans	-54	-40.7	-173.8	0	0	0	0	0	114.6	G99 V103 T104 R105 D135 V136	G99-A101 PolarHBondContact O-N 3.2Å; G99-A101 VanDerWaalsContact O-N 3.09Å; A101-V103 VanDerWaalsContact C-N 3.33Å; A101-V103 PolarHBondContact O-N 3.49Å; A101-T104 WeakPolarHBondContact O-CB 3.25Å; A101-T104 PolarHBondContact O-N 3.06Å; A101-R105 WeakPolarHBondContact O-CG 3.46Å; A101-R105 PolarHBondContact O-N 2.96Å; A101-D135 HydrophobicContact CB-CB 4.17Å; A101-V136 HydrophobicContact CB-CG2 4.14Å
102	A	94.8	Very high	96.5	Very high	58 Å²	58	38.9 Å²	38.9	48%	0.479	22%	0.22	S	C	.	.	H	α-helix	trans	-63.6	-38.1	178	0	0	0	0	0	112.7	K68 H100 L106	K68-A102 HydrophobicContact CD-CB 4.4Å; H100-A102 VanDerWaalsContact C-N 3.33Å; H100-A102 PolarHBondContact O-N 3.48Å; A102-L106 PolarHBondContact O-N 3.24Å
103	V	97.7	Very high	96.4	Very high	3 Å²	3	43 Å²	43	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-72.9	-39.7	176	174.9	0	0	0	0	110.9	A63 K68 V71 A95 H100 A101 R105 L106 L107	A63-V103 HydrophobicContact CB-CG1 4.15Å; K68-V103 HydrophobicContact CB-CG2 4.16Å; V71-V103 HydrophobicContact CG1-CG1 4.32Å; V71-V103 HydrophobicContact CG2-CG1 3.98Å; A95-V103 HydrophobicContact CB-CB 4.39Å; A95-V103 HydrophobicContact CB-CG1 3.95Å; H100-V103 HydrophobicContact CB-CB 4.09Å; H100-V103 HydrophobicContact CB-CG2 4.31Å; H100-V103 PolarHBondContact O-N 2.93Å; A101-V103 VanDerWaalsContact C-N 3.33Å; A101-V103 PolarHBondContact O-N 3.49Å; V103-R105 PolarHBondContact O-N 2.89Å; V103-L106 PolarHBondContact O-N 3.48Å; V103-L107 HydrophobicContact CG1-CD1 3.94Å; V103-L107 HydrophobicContact CG1-CG 4.25Å; V103-L107 WeakPolarHBondContact O-CG 3.19Å; V103-L107 PolarHBondContact O-N 3.22Å
104	T	98	Very high	96.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-54	-51.3	173.3	-62.5	0	0	0	0	111	L92 H100 A101 L106 L107 I108 V136 A139 L140	L92-T104 HydrophobicContact CD1-CG2 3.85Å; H100-T104 PolarHBondContact O-N 3.11Å; H100-T104 PolarHBondContact O-OG1 3.31Å; A101-T104 WeakPolarHBondContact O-CB 3.25Å; A101-T104 PolarHBondContact O-N 3.06Å; T104-L106 VanDerWaalsContact C-N 3.34Å; T104-L106 PolarHBondContact O-N 3.08Å; T104-L107 PolarHBondContact O-N 3.02Å; T104-I108 HydrophobicContact CG2-CD1 3.88Å; T104-I108 WeakPolarHBondContact O-CG1 3.41Å; T104-I108 PolarHBondContact O-N 2.91Å; T104-I108 VanDerWaalsContact O-N 3.07Å; T104-V136 HydrophobicContact CG2-CG1 4.29Å; T104-A139 HydrophobicContact CG2-CB 4.44Å; T104-L140 HydrophobicContact CG2-CD2 4.15Å; T104-L140 HydrophobicContact CG2-CG 4.21Å
105	R	96.9	Very high	96.4	Very high	104 Å²	104	44.4 Å²	44.4	39%	0.392	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-41.9	177.5	-67.4	-179.8	-163.6	-81	2.7	112.1	A101 V103 K109 A139	A101-R105 WeakPolarHBondContact O-CG 3.46Å; A101-R105 PolarHBondContact O-N 2.96Å; V103-R105 PolarHBondContact O-N 2.89Å; R105-K109 VanDerWaalsContact O-CB 3.29Å; R105-K109 WeakPolarHBondContact O-CB 3.44Å; R105-K109 PolarHBondContact O-N 2.93Å; R105-A139 HydrophobicContact CG-CB 4.09Å
106	L	96.9	Very high	96.4	Very high	34 Å²	34	44.8 Å²	44.8	18%	0.178	25%	0.254	C	S	.	.	H	α-helix	trans	-62.9	-45.1	178	176.3	64.3	0	0	0	112.3	K68 V71 T72 A102 V103 T104 K109 S110	K68-L106 HydrophobicContact CG-CD2 4.24Å; V71-L106 HydrophobicContact CB-CD2 4.07Å; V71-L106 HydrophobicContact CG1-CD2 3.6Å; V71-L106 HydrophobicContact CG1-CG 4.28Å; T72-L106 VanDerWaalsContact OG1-CD2 3.23Å; T72-L106 WeakPolarHBondContact OG1-CD2 3.38Å; A102-L106 PolarHBondContact O-N 3.24Å; V103-L106 PolarHBondContact O-N 3.48Å; T104-L106 VanDerWaalsContact C-N 3.34Å; T104-L106 PolarHBondContact O-N 3.08Å; L106-K109 PolarHBondContact O-N 3.37Å; L106-S110 WeakPolarHBondContact O-CB 3.48Å; L106-S110 PolarHBondContact O-N 2.96Å; L106-S110 PolarHBondContact O-OG 3.09Å
107	L	97.7	Very high	96.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.8	-45.2	179.2	-75.4	171	0	0	0	111.5	L59 A63 V71 I75 V81 P91 L92 A95 V103 T104 S110 G111 A112	L59-L107 HydrophobicContact CD1-CD2 4.31Å; L59-L107 HydrophobicContact CD2-CD2 4.32Å; L59-L107 HydrophobicContact CG-CD2 4.45Å; A63-L107 HydrophobicContact CB-CD1 4.04Å; V71-L107 HydrophobicContact CG1-CD2 4.05Å; V71-L107 HydrophobicContact CG1-CG 4.36Å; I75-L107 HydrophobicContact CD1-CD2 4.14Å; V81-L107 HydrophobicContact CG1-CD2 4.26Å; P91-L107 HydrophobicContact CB-CD1 4.29Å; P91-L107 HydrophobicContact CB-CD2 4.45Å; L92-L107 HydrophobicContact CB-CD1 4.43Å; L92-L107 HydrophobicContact CD1-CB 4.09Å; L92-L107 HydrophobicContact CD1-CD1 4.21Å; A95-L107 HydrophobicContact CB-CD1 4.14Å; V103-L107 HydrophobicContact CG1-CD1 3.94Å; V103-L107 HydrophobicContact CG1-CG 4.25Å; V103-L107 WeakPolarHBondContact O-CG 3.19Å; V103-L107 PolarHBondContact O-N 3.22Å; T104-L107 PolarHBondContact O-N 3.02Å; L107-S110 CarbonylContact O-C 3.35Å; L107-S110 WeakPolarHBondContact O-CA 3.45Å; L107-S110 WeakPolarHBondContact O-CB 3.49Å; L107-S110 PolarHBondContact O-N 3.17Å; L107-S110 VanDerWaalsContact O-N 3.07Å; L107-G111 PolarHBondContact O-N 3.17Å; L107-A112 HydrophobicContact CB-CB 4.02Å; L107-A112 WeakPolarHBondContact O-CB 3.11Å; L107-A112 PolarHBondContact O-N 3.45Å
108	I	96.8	Very high	96.3	Very high	27 Å²	27	47 Å²	47	14%	0.138	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-44	178.8	-61.3	164.1	0	0	0	110.8	L92 T104 S110 G111 P114 L140	L92-I108 HydrophobicContact CD1-CD1 4.35Å; L92-I108 HydrophobicContact CD1-CG1 4.01Å; L92-I108 HydrophobicContact CD2-CD1 4.45Å; L92-I108 HydrophobicContact CD2-CG1 3.91Å; T104-I108 HydrophobicContact CG2-CD1 3.88Å; T104-I108 WeakPolarHBondContact O-CG1 3.41Å; T104-I108 PolarHBondContact O-N 2.91Å; T104-I108 VanDerWaalsContact O-N 3.07Å; I108-S110 PolarHBondContact O-N 2.97Å; I108-S110 VanDerWaalsContact O-N 3.16Å; I108-G111 PolarHBondContact O-N 3.17Å; I108-P114 HydrophobicContact CD1-CB 4.46Å; I108-L140 HydrophobicContact CD1-CD2 3.95Å
109	K	95.6	Very high	96.4	Very high	189 Å²	189	46.4 Å²	46.4	82%	0.822	27%	0.265	S	S	*	.	H	α-helix	trans	-58.3	-28.4	172.9	-174.1	176.4	179.3	180	0	112.4	R105 L106 G111	R105-K109 VanDerWaalsContact O-CB 3.29Å; R105-K109 WeakPolarHBondContact O-CB 3.44Å; R105-K109 PolarHBondContact O-N 2.93Å; L106-K109 PolarHBondContact O-N 3.37Å; K109-G111 VanDerWaalsContact C-N 3.28Å; K109-G111 PolarHBondContact O-N 2.64Å
110	S	95.6	Very high	96.5	Very high	44 Å²	44	50.4 Å²	50.4	31%	0.308	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	11.4	176.5	-52	0	0	0	0	113.5	L106 L107 I108	L106-S110 WeakPolarHBondContact O-CB 3.48Å; L106-S110 PolarHBondContact O-N 2.96Å; L106-S110 PolarHBondContact O-OG 3.09Å; L107-S110 CarbonylContact O-C 3.35Å; L107-S110 WeakPolarHBondContact O-CA 3.45Å; L107-S110 WeakPolarHBondContact O-CB 3.49Å; L107-S110 PolarHBondContact O-N 3.17Å; L107-S110 VanDerWaalsContact O-N 3.07Å; I108-S110 PolarHBondContact O-N 2.97Å; I108-S110 VanDerWaalsContact O-N 3.16Å
111	G	95.2	Very high	96.4	Very high	60 Å²	60	48.3 Å²	48.3	62%	0.619	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.1	13.5	174.8	0	0	0	0	0	115.4	L107 I108 K109 D113	L107-G111 PolarHBondContact O-N 3.17Å; I108-G111 PolarHBondContact O-N 3.17Å; K109-G111 VanDerWaalsContact C-N 3.28Å; K109-G111 PolarHBondContact O-N 2.64Å; G111-D113 PolarHBondContact O-N 3.27Å
112	A	96.5	Very high	96.5	Very high	5 Å²	5	48.8 Å²	48.8	4%	0.041	26%	0.264	C	S	.	.			trans	-67.6	128.6	170.8	0	0	0	0	0	110.3	V81 L92 L107 P114	V81-A112 HydrophobicContact CB-CB 4.23Å; V81-A112 HydrophobicContact CG2-CB 4.48Å; L92-A112 HydrophobicContact CB-CB 4.44Å; L92-A112 HydrophobicContact CD2-CB 4.12Å; L107-A112 HydrophobicContact CB-CB 4.02Å; L107-A112 WeakPolarHBondContact O-CB 3.11Å; L107-A112 PolarHBondContact O-N 3.45Å; A112-P114 VanDerWaalsContact O-CD 3.3Å; A112-P114 WeakPolarHBondContact O-CD 3.36Å
113	D	96.6	Very high	96.7	Very high	87 Å²	87	46.1 Å²	46.1	47%	0.465	24%	0.241	S	C	.	.			trans	-71.4	115.2	177	176.2	13.7	0	0	0	110.6	G111 N115 A116	G111-D113 PolarHBondContact O-N 3.27Å; D113-N115 PolarHBondContact O-N 2.97Å; D113-N115 WeakPolarHBondContact OD1-CA 3.33Å; D113-N115 WeakPolarHBondContact OD1-CB 3.44Å; D113-N115 PolarHBondContact OD1-N 3.48Å; D113-A116 HydrophobicContact CB-CB 4.27Å; D113-A116 WeakPolarHBondContact O-CB 3.41Å; D113-A116 PolarHBondContact O-N 3.43Å; D113-A116 PolarHBondContact OD2-N 3.23Å
114	P	96.8	Very high	96.7	Very high	14 Å²	14	46 Å²	46	9%	0.091	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.7	178	29.3	-35.5	0	0	0	113.3	I108 A112 L140 S143 A145	I108-P114 HydrophobicContact CD1-CB 4.46Å; A112-P114 VanDerWaalsContact O-CD 3.3Å; A112-P114 WeakPolarHBondContact O-CD 3.36Å; P114-L140 HydrophobicContact CB-CD2 4.17Å; P114-S143 WeakPolarHBondContact CG-O 3.17Å; P114-A145 HydrophobicContact CB-CB 4.13Å
115	N	97.7	Very high	96.7	Very high	46 Å²	46	46 Å²	46	25%	0.246	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	6.7	-179.9	-64.7	-56.3	0	0	0	113.6	D113 V117 G144 A145 N146 I149	D113-N115 PolarHBondContact O-N 2.97Å; D113-N115 WeakPolarHBondContact OD1-CA 3.33Å; D113-N115 WeakPolarHBondContact OD1-CB 3.44Å; D113-N115 PolarHBondContact OD1-N 3.48Å; N115-V117 PolarHBondContact O-N 3.23Å; N115-G144 PolarHBondContact ND2-O 3.44Å; N115-G144 VanDerWaalsContact ND2-O 3.09Å; N115-A145 WeakPolarHBondContact OD1-CA 3.38Å; N115-N146 WeakPolarHBondContact OD1-CB 3.47Å; N115-N146 PolarHBondContact OD1-N 3.5Å; N115-I149 HydrophobicContact CB-CD1 3.9Å
116	A	96.7	Very high	96.7	Very high	9 Å²	9	41 Å²	41	7%	0.074	22%	0.222	C	C	.	.			trans	-56.9	128.4	176.4	0	0	0	0	0	110	V90 H93 D113 P124	V90-A116 HydrophobicContact CG2-CB 4.04Å; H93-A116 PolarHBondContact CE1-O 3.36Å; H93-A116 PolarHBondContact NE2-O 3.34Å; D113-A116 HydrophobicContact CB-CB 4.27Å; D113-A116 WeakPolarHBondContact O-CB 3.41Å; D113-A116 PolarHBondContact O-N 3.43Å; D113-A116 PolarHBondContact OD2-N 3.23Å; A116-P124 WeakPolarHBondContact O-CD 3.29Å
117	V	96.5	Very high	96.7	Very high	55 Å²	55	41 Å²	41	33%	0.333	22%	0.22	S	C	.	.			trans	-104.9	141.3	176.6	-66.8	0	0	0	0	111.5	R84 N115 F122 I149	R84-V117 PolarHBondContact NH1-O 3.37Å; R84-V117 PolarHBondContact NH2-O 2.9Å; N115-V117 PolarHBondContact O-N 3.23Å; V117-F122 CarbonylContact C-O 3.53Å; V117-F122 VanDerWaalsContact CA-O 3.22Å; V117-F122 WeakPolarHBondContact CA-O 3.28Å; V117-I149 HydrophobicContact CG1-CG2 3.85Å
118	D	95.6	Very high	96.6	Very high	14 Å²	14	41 Å²	41	8%	0.075	22%	0.22	C	C	.	.			trans	-77.1	-172	173.5	77	-2.4	0	0	0	112.8	L89 W120 G121 F122	L89-D118 HydrophobicContact CD2-CB 3.82Å; L89-D118 HydrophobicContact CG-CB 4.41Å; D118-W120 PolarHBondContact O-N 2.9Å; D118-W120 VanDerWaalsContact OD1-C 3.32Å; D118-W120 WeakPolarHBondContact OD1-CA 3.38Å; D118-W120 PolarHBondContact OD1-N 3.44Å; D118-G121 PolarHBondContact O-N 2.95Å; D118-G121 PolarHBondContact OD1-N 3.44Å; D118-F122 PolarHBondContact N-O 2.96Å; D118-F122 PolarHBondContact OD1-N 3.01Å
119	H	96.1	Very high	96.6	Very high	118 Å²	118	39.7 Å²	39.7	55%	0.546	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-13.3	178.8	-66.2	145.4	0	0	0	114.3	E86 G87 G88	E86-H119 PolarHBondContact O-CE1 3.32Å; E86-H119 PolarHBondContact O-ND1 3.06Å; G87-H119 WeakPolarHBondContact O-CB 3.49Å; G87-H119 PolarHBondContact O-N 3.38Å; G87-H119 PolarHBondContact O-ND1 3.33Å; G88-H119 PolarHBondContact N-CE1 3.21Å; G88-H119 PolarHBondContact N-ND1 2.86Å
120	W	96	Very high	96.6	Very high	112 Å²	112	34.1 Å²	34.1	42%	0.424	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	4.2	176.3	-63.8	-85.6	0	0	0	113.2	G87 D118 F122 L152	G87-W120 WeakPolarHBondContact O-CZ3 3.35Å; D118-W120 PolarHBondContact O-N 2.9Å; D118-W120 VanDerWaalsContact OD1-C 3.32Å; D118-W120 WeakPolarHBondContact OD1-CA 3.38Å; D118-W120 PolarHBondContact OD1-N 3.44Å; W120-F122 VanDerWaalsContact C-N 3.27Å; W120-F122 HydrophobicContact CB-CD2 3.84Å; W120-F122 HydrophobicContact CB-CE2 4.27Å; W120-L152 WeakPolarHBondContact O-CB 3.37Å; W120-L152 WeakPolarHBondContact O-CG 3.38Å; W120-L152 PolarHBondContact O-N 2.95Å
121	G	95.6	Very high	96.6	Very high	14 Å²	14	37.3 Å²	37.3	14%	0.144	20%	0.201	C	C	.	.	S	Bend	trans	77.3	10.9	-177.8	0	0	0	0	0	113.8	D118 N151	D118-G121 PolarHBondContact O-N 2.95Å; D118-G121 PolarHBondContact OD1-N 3.44Å; G121-N151 WeakPolarHBondContact O-CA 3.49Å
122	F	97.6	Very high	96.6	Very high	32 Å²	32	35.4 Å²	35.4	14%	0.14	18%	0.182	C	C	.	.			trans	-75	134.3	173	-80.2	-111.5	0	0	0	109.1	H93 V117 D118 W120 H126 L130 N151 L160	H93-F122 PolarHBondContact NE2-O 3.23Å; V117-F122 CarbonylContact C-O 3.53Å; V117-F122 VanDerWaalsContact CA-O 3.22Å; V117-F122 WeakPolarHBondContact CA-O 3.28Å; D118-F122 PolarHBondContact N-O 2.96Å; D118-F122 PolarHBondContact OD1-N 3.01Å; W120-F122 VanDerWaalsContact C-N 3.27Å; W120-F122 HydrophobicContact CB-CD2 3.84Å; W120-F122 HydrophobicContact CB-CE2 4.27Å; F122-H126 HydrophobicContact CB-CB 4.24Å; F122-H126 HydrophobicContact CD1-CB 3.51Å; F122-H126 HydrophobicContact CE1-CB 4.22Å; F122-H126 HydrophobicContact CG-CB 4.18Å; F122-L130 HydrophobicContact CE1-CD2 4.41Å; F122-N151 HydrophobicContact CD2-CB 3.96Å; F122-N151 HydrophobicContact CE2-CB 4.04Å; F122-N151 WeakPolarHBondContact CE2-ND2 3.47Å; F122-N151 VanDerWaalsContact CZ-ND2 3.27Å; F122-N151 WeakPolarHBondContact CZ-ND2 3.5Å; F122-L160 HydrophobicContact CD1-CD1 4.45Å; F122-L160 HydrophobicContact CE1-CD1 3.49Å; F122-L160 VanDerWaalsContact CE1-CD1 3.49Å; F122-L160 HydrophobicContact CZ-CD1 3.8Å
123	S	97.7	Very high	96.6	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.007	20%	0.195	C	C	.	.			trans	-98.5	166.2	169	71.1	0	0	0	0	110.3	L125 H126 E127	S123-L125 PolarHBondContact O-N 2.82Å; S123-H126 PolarHBondContact N-ND1 3.23Å; S123-H126 VanDerWaalsContact N-ND1 3.1Å; S123-H126 WeakPolarHBondContact O-CB 3.33Å; S123-H126 PolarHBondContact O-N 3.18Å; S123-H126 PolarHBondContact OG-N 2.89Å; S123-H126 PolarHBondContact OG-ND1 3.34Å; S123-E127 PolarHBondContact O-N 3.02Å
124	P	98	Very high	96.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-53.8	-30.7	174.1	-27.7	33.6	0	0	0	113.4	L92 H93 C96 A116 E127 A128 L140	L92-P124 HydrophobicContact CB-CG 4.38Å; L92-P124 HydrophobicContact CD2-CB 4.33Å; L92-P124 HydrophobicContact CD2-CG 3.91Å; L92-P124 HydrophobicContact CG-CB 4.09Å; L92-P124 HydrophobicContact CG-CG 3.93Å; H93-P124 WeakPolarHBondContact NE2-CD 3.33Å; C96-P124 HydrophobicContact CB-CB 4.23Å; A116-P124 WeakPolarHBondContact O-CD 3.29Å; P124-E127 PolarHBondContact O-N 2.76Å; P124-A128 WeakPolarHBondContact O-CB 3.31Å; P124-A128 PolarHBondContact O-N 3.22Å; P124-L140 HydrophobicContact CB-CD1 4.03Å; P124-L140 HydrophobicContact CB-CD2 3.97Å
125	L	97.8	Very high	96.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-72.4	-33.7	176.8	-172	59.6	0	0	0	112.5	S123 A129 C137 L140 L141 A145 P147 P157 L169	S123-L125 PolarHBondContact O-N 2.82Å; L125-A129 WeakPolarHBondContact O-CB 3.43Å; L125-A129 PolarHBondContact O-N 2.75Å; L125-C137 HydrophobicContact CD1-CB 4.05Å; L125-L140 HydrophobicContact CB-CD1 4.06Å; L125-L140 HydrophobicContact CD1-CB 4.22Å; L125-L140 HydrophobicContact CD1-CD1 4.06Å; L125-L141 HydrophobicContact CD2-CD2 3.92Å; L125-L141 HydrophobicContact CD2-CG 4.46Å; L125-A145 HydrophobicContact CB-CB 4.49Å; L125-A145 HydrophobicContact CD2-CB 4.18Å; L125-P147 HydrophobicContact CD2-CB 4.07Å; L125-P157 HydrophobicContact CB-CG 4.22Å; L125-P157 HydrophobicContact CD2-CB 4.38Å; L125-P157 HydrophobicContact CD2-CG 4.14Å; L125-P157 HydrophobicContact CG-CB 3.95Å; L125-P157 HydrophobicContact CG-CG 3.97Å; L125-L169 HydrophobicContact CD1-CD2 4.25Å; L125-L169 HydrophobicContact CD2-CD2 4.1Å; L125-L169 HydrophobicContact CG-CD2 4.35Å
126	H	97.6	Very high	96.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-45.7	171.6	-71.2	87.7	0	0	0	110.9	F122 S123 A129 L130 I149 K155 P157	F122-H126 HydrophobicContact CB-CB 4.24Å; F122-H126 HydrophobicContact CD1-CB 3.51Å; F122-H126 HydrophobicContact CE1-CB 4.22Å; F122-H126 HydrophobicContact CG-CB 4.18Å; S123-H126 PolarHBondContact N-ND1 3.23Å; S123-H126 VanDerWaalsContact N-ND1 3.1Å; S123-H126 WeakPolarHBondContact O-CB 3.33Å; S123-H126 PolarHBondContact O-N 3.18Å; S123-H126 PolarHBondContact OG-N 2.89Å; S123-H126 PolarHBondContact OG-ND1 3.34Å; H126-A129 PolarHBondContact O-N 2.95Å; H126-L130 WeakPolarHBondContact O-CB 3.47Å; H126-L130 PolarHBondContact O-N 3.43Å; H126-I149 PolarHBondContact CE1-O 2.93Å; H126-I149 PolarHBondContact NE2-O 3.27Å; H126-K155 PolarHBondContact NE2-O 3.49Å; H126-K155 VanDerWaalsContact NE2-O 3.16Å; H126-P157 VanDerWaalsContact NE2-CD 3.35Å; H126-P157 WeakPolarHBondContact NE2-CD 3.44Å
127	E	96.4	Very high	96.4	Very high	33 Å²	33	37.1 Å²	37.1	15%	0.154	19%	0.185	C	C	.	.	H	α-helix	trans	-64.1	-46.8	178.8	-84.1	-62.1	166.6	0	0	112.2	S97 S123 P124 A129 L130 K131	S97-E127 PolarHBondContact OG-OE2 3.36Å; S123-E127 PolarHBondContact O-N 3.02Å; P124-E127 PolarHBondContact O-N 2.76Å; E127-A129 VanDerWaalsContact C-N 3.34Å; E127-A129 PolarHBondContact O-N 3.42Å; E127-L130 PolarHBondContact O-N 2.67Å; E127-K131 WeakPolarHBondContact O-CB 3.38Å; E127-K131 VanDerWaalsContact O-CG 3.26Å; E127-K131 WeakPolarHBondContact O-CG 3.37Å; E127-K131 PolarHBondContact O-N 3.27Å; E127-K131 VanDerWaalsContact O-N 3.08Å
128	A	97.3	Very high	96.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-45.3	176.8	0	0	0	0	0	111.8	C96 P124 K131 G132 K133 V136 C137 L140	C96-A128 HydrophobicContact CB-CB 4.34Å; P124-A128 WeakPolarHBondContact O-CB 3.31Å; P124-A128 PolarHBondContact O-N 3.22Å; A128-K131 PolarHBondContact O-N 3.49Å; A128-G132 PolarHBondContact O-N 3.14Å; A128-K133 HydrophobicContact CB-CB 4.33Å; A128-K133 PolarHBondContact O-N 2.97Å; A128-V136 HydrophobicContact CB-CB 4.13Å; A128-V136 HydrophobicContact CB-CG1 3.65Å; A128-C137 VanDerWaalsContact CB-SG 3.56Å; A128-L140 HydrophobicContact CB-CD1 4.14Å
129	A	96.8	Very high	96.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-67.1	-45	-179.3	0	0	0	0	0	112.6	L125 H126 E127 K131 G132 P157 A161 L169	L125-A129 WeakPolarHBondContact O-CB 3.43Å; L125-A129 PolarHBondContact O-N 2.75Å; H126-A129 PolarHBondContact O-N 2.95Å; E127-A129 VanDerWaalsContact C-N 3.34Å; E127-A129 PolarHBondContact O-N 3.42Å; A129-K131 VanDerWaalsContact C-N 3.25Å; A129-K131 PolarHBondContact O-N 3.36Å; A129-G132 PolarHBondContact O-N 2.86Å; A129-P157 HydrophobicContact CB-CB 4.1Å; A129-A161 HydrophobicContact CB-CB 4.04Å; A129-A161 WeakPolarHBondContact O-CA 3.47Å; A129-L169 HydrophobicContact CB-CD1 4.07Å
130	L	95.3	Very high	96.5	Very high	73 Å²	73	28.3 Å²	28.3	38%	0.382	14%	0.14	S	C	.	.	H	α-helix	trans	-61.3	-34.3	177.6	178.1	65.8	0	0	0	112.1	F122 H126 E127 L160	F122-L130 HydrophobicContact CE1-CD2 4.41Å; H126-L130 WeakPolarHBondContact O-CB 3.47Å; H126-L130 PolarHBondContact O-N 3.43Å; E127-L130 PolarHBondContact O-N 2.67Å; L130-L160 HydrophobicContact CB-CB 4.47Å; L130-L160 HydrophobicContact CD1-CB 4.26Å
131	K	95	Very high	96.5	Very high	110 Å²	110	23.2 Å²	23.2	48%	0.478	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	5.1	-178.2	-60.4	-60.7	-176.3	-172.2	0	114.2	E127 A128 A129 K133	E127-K131 WeakPolarHBondContact O-CB 3.38Å; E127-K131 VanDerWaalsContact O-CG 3.26Å; E127-K131 WeakPolarHBondContact O-CG 3.37Å; E127-K131 PolarHBondContact O-N 3.27Å; E127-K131 VanDerWaalsContact O-N 3.08Å; A128-K131 PolarHBondContact O-N 3.49Å; A129-K131 VanDerWaalsContact C-N 3.25Å; A129-K131 PolarHBondContact O-N 3.36Å; K131-K133 VanDerWaalsContact C-N 3.34Å; K131-K133 HydrophobicContact CB-CG 3.9Å; K131-K133 PolarHBondContact O-N 3.42Å
132	G	95	Very high	96.4	Very high	21 Å²	21	23.6 Å²	23.6	22%	0.216	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	23.8	177.8	0	0	0	0	0	114.6	A128 A129 V134 D162 S165	A128-G132 PolarHBondContact O-N 3.14Å; A129-G132 PolarHBondContact O-N 2.86Å; G132-V134 PolarHBondContact O-N 3.23Å; G132-V134 VanDerWaalsContact O-N 3.14Å; G132-D162 WeakPolarHBondContact CA-OD2 3.26Å; G132-S165 VanDerWaalsContact CA-OG 3.31Å; G132-S165 WeakPolarHBondContact CA-OG 3.28Å
133	K	96	Very high	96.2	Very high	74 Å²	74	24.2 Å²	24.2	32%	0.322	13%	0.128	S	C	.	.			trans	-89.4	73	-172.7	-54.1	-54.7	-178	177.6	0	111.5	A128 K131 D135 V136 C137	A128-K133 HydrophobicContact CB-CB 4.33Å; A128-K133 PolarHBondContact O-N 2.97Å; K131-K133 VanDerWaalsContact C-N 3.34Å; K131-K133 HydrophobicContact CB-CG 3.9Å; K131-K133 PolarHBondContact O-N 3.42Å; K133-D135 PolarHBondContact O-N 3.16Å; K133-V136 HydrophobicContact CB-CB 4.04Å; K133-V136 HydrophobicContact CB-CG2 4.21Å; K133-V136 WeakPolarHBondContact O-CB 3.19Å; K133-V136 PolarHBondContact O-N 3.43Å; K133-V136 VanDerWaalsContact O-N 3.14Å; K133-C137 PolarHBondContact O-N 3.49Å; K133-C137 PolarHBondContact O-SG 3.25Å; K133-C137 VanDerWaalsContact O-SG 3.4Å
134	V	95.7	Very high	96	Very high	16 Å²	16	26.5 Å²	26.5	10%	0.097	15%	0.151	C	C	.	.	H	α-helix	trans	-48.5	-54.2	-176.6	168.4	0	0	0	0	113.5	G132 V136 C137 I138 N164 V168 Y173	G132-V134 PolarHBondContact O-N 3.23Å; G132-V134 VanDerWaalsContact O-N 3.14Å; V134-V136 PolarHBondContact O-N 3.35Å; V134-C137 WeakPolarHBondContact O-CB 3.26Å; V134-C137 PolarHBondContact O-N 3.49Å; V134-I138 HydrophobicContact CG1-CD1 4.06Å; V134-I138 WeakPolarHBondContact O-CG1 3.47Å; V134-I138 PolarHBondContact O-N 2.71Å; V134-N164 HydrophobicContact CG2-CB 3.91Å; V134-V168 HydrophobicContact CB-CG2 4.45Å; V134-V168 HydrophobicContact CG1-CG2 3.79Å; V134-V168 HydrophobicContact CG2-CG2 4.38Å; V134-Y173 HydrophobicContact CG1-CD1 4.24Å; V134-Y173 HydrophobicContact CG1-CD2 4.45Å; V134-Y173 HydrophobicContact CG1-CE1 3.62Å; V134-Y173 HydrophobicContact CG1-CE2 3.89Å; V134-Y173 VanDerWaalsContact CG1-CZ 3.44Å
135	D	95.1	Very high	95.9	Very high	105 Å²	105	26.8 Å²	26.8	56%	0.561	15%	0.153	S	C	*	.	H	α-helix	trans	-63	-32.6	-176	-57.3	-26.5	0	0	0	112.6	A101 K133 A139	A101-D135 HydrophobicContact CB-CB 4.17Å; K133-D135 PolarHBondContact O-N 3.16Å; D135-A139 WeakPolarHBondContact O-CB 3.21Å; D135-A139 PolarHBondContact O-N 3.37Å
136	V	96.9	Very high	95.8	Very high	1 Å²	1	30 Å²	30	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-72	-42.3	174.8	174.9	0	0	0	0	110.7	C96 A101 T104 A128 K133 V134 I138 A139 L140	C96-V136 HydrophobicContact CB-CG1 3.62Å; C96-V136 WeakPolarHBondContact SG-CG1 3.21Å; A101-V136 HydrophobicContact CB-CG2 4.14Å; T104-V136 HydrophobicContact CG2-CG1 4.29Å; A128-V136 HydrophobicContact CB-CB 4.13Å; A128-V136 HydrophobicContact CB-CG1 3.65Å; K133-V136 HydrophobicContact CB-CB 4.04Å; K133-V136 HydrophobicContact CB-CG2 4.21Å; K133-V136 WeakPolarHBondContact O-CB 3.19Å; K133-V136 PolarHBondContact O-N 3.43Å; K133-V136 VanDerWaalsContact O-N 3.14Å; V134-V136 PolarHBondContact O-N 3.35Å; V136-I138 VanDerWaalsContact C-N 3.3Å; V136-I138 PolarHBondContact O-N 3.21Å; V136-A139 PolarHBondContact O-N 3.4Å; V136-L140 HydrophobicContact CG1-CD1 3.95Å; V136-L140 HydrophobicContact CG1-CG 4.32Å; V136-L140 WeakPolarHBondContact O-CB 3.5Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 2.85Å
137	C	97.2	Very high	95.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-56	-46.9	174	-67.8	0	0	0	0	110.9	L125 A128 K133 V134 L140 L141 V168	L125-C137 HydrophobicContact CD1-CB 4.05Å; A128-C137 VanDerWaalsContact CB-SG 3.56Å; K133-C137 PolarHBondContact O-N 3.49Å; K133-C137 PolarHBondContact O-SG 3.25Å; K133-C137 VanDerWaalsContact O-SG 3.4Å; V134-C137 WeakPolarHBondContact O-CB 3.26Å; V134-C137 PolarHBondContact O-N 3.49Å; C137-L140 PolarHBondContact O-N 3.41Å; C137-L141 VanDerWaalsContact O-CG 3.29Å; C137-L141 WeakPolarHBondContact O-CG 3.29Å; C137-L141 PolarHBondContact O-N 2.93Å; C137-V168 HydrophobicContact CB-CG1 4.04Å
138	I	96.5	Very high	95.7	Very high	3 Å²	3	35.2 Å²	35.2	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-60.1	-50.6	176.2	-64.5	170	0	0	0	110.4	V134 V136 L140 L141 Q142 V168 Y173 T195	V134-I138 HydrophobicContact CG1-CD1 4.06Å; V134-I138 WeakPolarHBondContact O-CG1 3.47Å; V134-I138 PolarHBondContact O-N 2.71Å; V136-I138 VanDerWaalsContact C-N 3.3Å; V136-I138 PolarHBondContact O-N 3.21Å; I138-L140 VanDerWaalsContact C-N 3.29Å; I138-L140 PolarHBondContact O-N 2.94Å; I138-L141 PolarHBondContact O-N 3.43Å; I138-Q142 HydrophobicContact CG2-CG 4.21Å; I138-Q142 WeakPolarHBondContact O-CB 3.16Å; I138-Q142 VanDerWaalsContact O-CG 3.24Å; I138-Q142 WeakPolarHBondContact O-CG 3.01Å; I138-Q142 PolarHBondContact O-N 3.03Å; I138-V168 HydrophobicContact CG1-CG1 3.72Å; I138-V168 HydrophobicContact CG1-CG2 4.38Å; I138-Y173 HydrophobicContact CD1-CD1 4.04Å; I138-Y173 HydrophobicContact CD1-CE1 3.99Å; I138-T195 HydrophobicContact CB-CG2 4.45Å; I138-T195 HydrophobicContact CG2-CG2 3.96Å
139	A	95.4	Very high	95.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-38.1	-179.7	0	0	0	0	0	113.2	T104 R105 D135 V136 S143	T104-A139 HydrophobicContact CG2-CB 4.44Å; R105-A139 HydrophobicContact CG-CB 4.09Å; D135-A139 WeakPolarHBondContact O-CB 3.21Å; D135-A139 PolarHBondContact O-N 3.37Å; V136-A139 PolarHBondContact O-N 3.4Å; A139-S143 WeakPolarHBondContact O-CB 3.47Å; A139-S143 PolarHBondContact O-N 2.88Å; A139-S143 PolarHBondContact O-OG 3.31Å
140	L	97.3	Very high	95.6	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68	-48.4	176.4	-77.4	170.3	0	0	0	111.7	L92 C96 T104 I108 P114 P124 L125 A128 V136 C137 I138 Q142 S143 G144 A145	L92-L140 HydrophobicContact CD2-CD2 4.35Å; C96-L140 HydrophobicContact CB-CD1 4.5Å; T104-L140 HydrophobicContact CG2-CD2 4.15Å; T104-L140 HydrophobicContact CG2-CG 4.21Å; I108-L140 HydrophobicContact CD1-CD2 3.95Å; P114-L140 HydrophobicContact CB-CD2 4.17Å; P124-L140 HydrophobicContact CB-CD1 4.03Å; P124-L140 HydrophobicContact CB-CD2 3.97Å; L125-L140 HydrophobicContact CB-CD1 4.06Å; L125-L140 HydrophobicContact CD1-CB 4.22Å; L125-L140 HydrophobicContact CD1-CD1 4.06Å; A128-L140 HydrophobicContact CB-CD1 4.14Å; V136-L140 HydrophobicContact CG1-CD1 3.95Å; V136-L140 HydrophobicContact CG1-CG 4.32Å; V136-L140 WeakPolarHBondContact O-CB 3.5Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 2.85Å; C137-L140 PolarHBondContact O-N 3.41Å; I138-L140 VanDerWaalsContact C-N 3.29Å; I138-L140 PolarHBondContact O-N 2.94Å; L140-Q142 VanDerWaalsContact C-N 3.34Å; L140-Q142 PolarHBondContact O-N 3.18Å; L140-S143 CarbonylContact O-C 3.48Å; L140-S143 WeakPolarHBondContact O-CA 3.22Å; L140-S143 PolarHBondContact O-N 3.16Å; L140-G144 PolarHBondContact O-N 2.96Å; L140-A145 VanDerWaalsContact C-CB 3.48Å; L140-A145 HydrophobicContact CB-CB 3.76Å; L140-A145 WeakPolarHBondContact O-CB 3.48Å; L140-A145 PolarHBondContact O-N 2.9Å
141	L	96.1	Very high	95.6	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-42.7	178.3	-71	168.3	0	0	0	111.7	L125 C137 I138 S143 G144 P147 V168 L169 T195 P196 L197	L125-L141 HydrophobicContact CD2-CD2 3.92Å; L125-L141 HydrophobicContact CD2-CG 4.46Å; C137-L141 VanDerWaalsContact O-CG 3.29Å; C137-L141 WeakPolarHBondContact O-CG 3.29Å; C137-L141 PolarHBondContact O-N 2.93Å; I138-L141 PolarHBondContact O-N 3.43Å; L141-S143 PolarHBondContact O-N 2.79Å; L141-S143 VanDerWaalsContact O-N 3.17Å; L141-G144 PolarHBondContact O-N 3.34Å; L141-G144 VanDerWaalsContact O-N 3.07Å; L141-P147 HydrophobicContact CD2-CB 4.23Å; L141-P147 HydrophobicContact CD2-CG 4.31Å; L141-V168 HydrophobicContact CD1-CG1 3.82Å; L141-L169 HydrophobicContact CD1-CD2 4.29Å; L141-T195 HydrophobicContact CB-CG2 4Å; L141-T195 HydrophobicContact CD1-CG2 4.15Å; L141-P196 WeakPolarHBondContact O-CD 3.35Å; L141-L197 HydrophobicContact CD1-CD1 3.77Å; L141-L197 HydrophobicContact CD2-CD1 3.77Å; L141-L197 HydrophobicContact CD2-CG 4.34Å; L141-L197 HydrophobicContact CG-CD1 4.42Å
142	Q	94.3	Very high	95.6	Very high	23 Å²	23	42.3 Å²	42.3	11%	0.107	23%	0.231	C	C	.	.	H	α-helix	trans	-58.3	-25.9	172.9	-76.2	175	-14.2	0	0	113	I138 L140 M191 L194 T195 Y230	I138-Q142 HydrophobicContact CG2-CG 4.21Å; I138-Q142 WeakPolarHBondContact O-CB 3.16Å; I138-Q142 VanDerWaalsContact O-CG 3.24Å; I138-Q142 WeakPolarHBondContact O-CG 3.01Å; I138-Q142 PolarHBondContact O-N 3.03Å; L140-Q142 VanDerWaalsContact C-N 3.34Å; L140-Q142 PolarHBondContact O-N 3.18Å; Q142-M191 PolarHBondContact NE2-O 3.18Å; Q142-L194 WeakPolarHBondContact CG-O 3.31Å; Q142-L194 PolarHBondContact NE2-O 2.55Å; Q142-T195 HydrophobicContact CG-CG2 4.39Å; Q142-Y230 HydrophobicContact CB-CE1 4.19Å; Q142-Y230 HydrophobicContact CG-CE1 4.11Å
143	S	93.6	Very high	95.6	Very high	45 Å²	45	47.1 Å²	47.1	32%	0.315	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	15.6	179.9	-48.3	0	0	0	0	113.3	P114 A139 L140 L141	P114-S143 WeakPolarHBondContact CG-O 3.17Å; A139-S143 WeakPolarHBondContact O-CB 3.47Å; A139-S143 PolarHBondContact O-N 2.88Å; A139-S143 PolarHBondContact O-OG 3.31Å; L140-S143 CarbonylContact O-C 3.48Å; L140-S143 WeakPolarHBondContact O-CA 3.22Å; L140-S143 PolarHBondContact O-N 3.16Å; L141-S143 PolarHBondContact O-N 2.79Å; L141-S143 VanDerWaalsContact O-N 3.17Å
144	G	92.6	Very high	95.5	Very high	48 Å²	48	45.2 Å²	45.2	50%	0.495	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	21.9	175.4	0	0	0	0	0	115.1	N115 L140 L141 N146	N115-G144 PolarHBondContact ND2-O 3.44Å; N115-G144 VanDerWaalsContact ND2-O 3.09Å; L140-G144 PolarHBondContact O-N 2.96Å; L141-G144 PolarHBondContact O-N 3.34Å; L141-G144 VanDerWaalsContact O-N 3.07Å; G144-N146 PolarHBondContact O-N 3.27Å
145	A	96	Very high	95.6	Very high	6 Å²	6	48.9 Å²	48.9	5%	0.05	27%	0.268	C	S	.	.			trans	-62.8	130.7	167.7	0	0	0	0	0	110.4	P114 N115 L125 L140 P147	P114-A145 HydrophobicContact CB-CB 4.13Å; N115-A145 WeakPolarHBondContact OD1-CA 3.38Å; L125-A145 HydrophobicContact CB-CB 4.49Å; L125-A145 HydrophobicContact CD2-CB 4.18Å; L140-A145 VanDerWaalsContact C-CB 3.48Å; L140-A145 HydrophobicContact CB-CB 3.76Å; L140-A145 WeakPolarHBondContact O-CB 3.48Å; L140-A145 PolarHBondContact O-N 2.9Å; A145-P147 VanDerWaalsContact O-CD 3.32Å; A145-P147 WeakPolarHBondContact O-CD 3.25Å
146	N	95.9	Very high	95.7	Very high	69 Å²	69	44.5 Å²	44.5	37%	0.369	25%	0.245	S	C	.	.			trans	-85.2	112.7	-180	179.9	-0.1	0	0	0	109.8	N115 G144 N148 I149	N115-N146 WeakPolarHBondContact OD1-CB 3.47Å; N115-N146 PolarHBondContact OD1-N 3.5Å; G144-N146 PolarHBondContact O-N 3.27Å; N146-N148 PolarHBondContact O-N 3.13Å; N146-N148 WeakPolarHBondContact OD1-CB 3.07Å; N146-N148 PolarHBondContact OD1-N 3.5Å; N146-N148 PolarHBondContact OD1-ND2 3.25Å; N146-I149 HydrophobicContact CB-CD1 4.08Å; N146-I149 HydrophobicContact CB-CG1 3.98Å
147	P	95.2	Very high	95.7	Very high	25 Å²	25	44.4 Å²	44.4	16%	0.162	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-3.6	179.7	32.2	-35.8	0	0	0	113.5	L125 L141 A145 P157 L169 L197	L125-P147 HydrophobicContact CD2-CB 4.07Å; L141-P147 HydrophobicContact CD2-CB 4.23Å; L141-P147 HydrophobicContact CD2-CG 4.31Å; A145-P147 VanDerWaalsContact O-CD 3.32Å; A145-P147 WeakPolarHBondContact O-CD 3.25Å; P147-P157 VanDerWaalsContact O-CD 3.3Å; P147-P157 WeakPolarHBondContact O-CD 3.43Å; P147-L169 HydrophobicContact CB-CD2 4.24Å; P147-L197 HydrophobicContact CB-CD1 4.48Å; P147-L197 HydrophobicContact CG-CD1 4.28Å; P147-L197 HydrophobicContact CG-CD2 4.17Å
148	N	95.9	Very high	95.7	Very high	117 Å²	117	48.6 Å²	48.6	63%	0.626	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	1.3	-177.2	-57.6	-59.2	0	0	0	113.9	N146 R150	N146-N148 PolarHBondContact O-N 3.13Å; N146-N148 WeakPolarHBondContact OD1-CB 3.07Å; N146-N148 PolarHBondContact OD1-N 3.5Å; N146-N148 PolarHBondContact OD1-ND2 3.25Å; N148-R150 PolarHBondContact O-N 2.82Å
149	I	96.7	Very high	95.7	Very high	31 Å²	31	52.4 Å²	52.4	16%	0.159	28%	0.283	C	S	.	.			trans	-60	135.1	173.8	-64.3	174.5	0	0	0	108.4	N115 V117 H126 N146 T156 P157	N115-I149 HydrophobicContact CB-CD1 3.9Å; V117-I149 HydrophobicContact CG1-CG2 3.85Å; H126-I149 PolarHBondContact CE1-O 2.93Å; H126-I149 PolarHBondContact NE2-O 3.27Å; N146-I149 HydrophobicContact CB-CD1 4.08Å; N146-I149 HydrophobicContact CB-CG1 3.98Å; I149-T156 WeakPolarHBondContact O-CA 3.18Å; I149-P157 WeakPolarHBondContact O-CD 3.44Å
150	R	96.7	Very high	95.7	Very high	162 Å²	162	54 Å²	54	61%	0.611	29%	0.292	S	S	*	.			trans	-108.5	132.8	176.5	-66	-179.2	-178.2	-84.7	-3.6	110.1	N148 G154 K155 T156	N148-R150 PolarHBondContact O-N 2.82Å; R150-G154 PolarHBondContact NH1-O 3.39Å; R150-K155 WeakPolarHBondContact CA-O 3.39Å; R150-T156 HydrophobicContact CG-CG2 3.86Å
151	N	95.4	Very high	95.6	Very high	10 Å²	10	54 Å²	54	5%	0.053	29%	0.292	C	S	.	.			trans	-74.4	-178	172.6	76.1	-3.8	0	0	0	111.8	G121 F122 D153 G154 K155	G121-N151 WeakPolarHBondContact O-CA 3.49Å; F122-N151 HydrophobicContact CD2-CB 3.96Å; F122-N151 HydrophobicContact CE2-CB 4.04Å; F122-N151 WeakPolarHBondContact CE2-ND2 3.47Å; F122-N151 VanDerWaalsContact CZ-ND2 3.27Å; F122-N151 WeakPolarHBondContact CZ-ND2 3.5Å; N151-D153 PolarHBondContact O-N 3.27Å; N151-D153 WeakPolarHBondContact OD1-CA 3.18Å; N151-D153 WeakPolarHBondContact OD1-CB 3.23Å; N151-D153 PolarHBondContact OD1-N 3.41Å; N151-G154 WeakPolarHBondContact O-CA 3.47Å; N151-G154 PolarHBondContact O-N 2.96Å; N151-G154 PolarHBondContact OD1-N 3.11Å; N151-K155 PolarHBondContact N-O 2.68Å; N151-K155 PolarHBondContact OD1-N 3.47Å; N151-K155 PolarHBondContact OD1-O 2.92Å
152	L	94.4	Very high	95.2	Very high	128 Å²	128	56.5 Å²	56.5	67%	0.67	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.7	178.7	-76	179.4	0	0	0	114.3	W120 G154	W120-L152 WeakPolarHBondContact O-CB 3.37Å; W120-L152 WeakPolarHBondContact O-CG 3.38Å; W120-L152 PolarHBondContact O-N 2.95Å; L152-G154 PolarHBondContact O-N 2.97Å
153	D	94.1	Very high	94.8	Very high	123 Å²	123	59.4 Å²	59.4	66%	0.658	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	2.7	174.3	-61.1	-38.2	0	0	0	112.4	N151 K155	N151-D153 PolarHBondContact O-N 3.27Å; N151-D153 WeakPolarHBondContact OD1-CA 3.18Å; N151-D153 WeakPolarHBondContact OD1-CB 3.23Å; N151-D153 PolarHBondContact OD1-N 3.41Å; D153-K155 HydrophobicContact CB-CD 4.47Å; D153-K155 HydrophobicContact CB-CG 4.3Å; D153-K155 PolarHBondContact O-N 3.42Å
154	G	94.4	Very high	94.6	Very high	34 Å²	34	61.8 Å²	61.8	35%	0.351	34%	0.337	S	S	.	.	S	Bend	trans	76.1	7.4	-177.6	0	0	0	0	0	114.5	R150 N151 L152	R150-G154 PolarHBondContact NH1-O 3.39Å; N151-G154 WeakPolarHBondContact O-CA 3.47Å; N151-G154 PolarHBondContact O-N 2.96Å; N151-G154 PolarHBondContact OD1-N 3.11Å; L152-G154 PolarHBondContact O-N 2.97Å
155	K	97.7	Very high	94.6	Very high	93 Å²	93	59.5 Å²	59.5	40%	0.404	31%	0.314	S	S	.	.			trans	-88.9	141.6	-177.4	-65	-176.7	180	178.5	0	111.1	H126 R150 N151 D153 D159 L160	H126-K155 PolarHBondContact NE2-O 3.49Å; H126-K155 VanDerWaalsContact NE2-O 3.16Å; R150-K155 WeakPolarHBondContact CA-O 3.39Å; N151-K155 PolarHBondContact N-O 2.68Å; N151-K155 PolarHBondContact OD1-N 3.47Å; N151-K155 PolarHBondContact OD1-O 2.92Å; D153-K155 HydrophobicContact CB-CD 4.47Å; D153-K155 HydrophobicContact CB-CG 4.3Å; D153-K155 PolarHBondContact O-N 3.42Å; K155-D159 HydrophobicContact CB-CB 3.99Å; K155-D159 HydrophobicContact CG-CB 4.3Å; K155-L160 HydrophobicContact CB-CD2 4.39Å; K155-L160 HydrophobicContact CB-CG 4.26Å; K155-L160 HydrophobicContact CD-CD2 3.53Å; K155-L160 HydrophobicContact CD-CG 4.29Å
156	T	97.4	Very high	94.5	Very high	12 Å²	12	64.4 Å²	64.4	7%	0.074	33%	0.331	C	S	.	.			trans	-89.4	169.2	171.9	63.1	0	0	0	0	110.9	I149 R150 F158 D159 L160	I149-T156 WeakPolarHBondContact O-CA 3.18Å; R150-T156 HydrophobicContact CG-CG2 3.86Å; T156-F158 PolarHBondContact O-N 3.16Å; T156-F158 PolarHBondContact OG1-N 2.91Å; T156-D159 PolarHBondContact N-OD2 3.09Å; T156-D159 PolarHBondContact O-N 3.09Å; T156-D159 VanDerWaalsContact O-N 3.14Å; T156-D159 VanDerWaalsContact OG1-CG 3.24Å; T156-D159 PolarHBondContact OG1-N 2.99Å; T156-D159 PolarHBondContact OG1-OD2 3.2Å; T156-L160 PolarHBondContact O-N 2.88Å
157	P	97.2	Very high	94.4	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-53.9	-35.9	170.1	-26	35.1	0	0	0	112.9	L125 H126 A129 P147 I149 L160 A161 L169	L125-P157 HydrophobicContact CB-CG 4.22Å; L125-P157 HydrophobicContact CD2-CB 4.38Å; L125-P157 HydrophobicContact CD2-CG 4.14Å; L125-P157 HydrophobicContact CG-CB 3.95Å; L125-P157 HydrophobicContact CG-CG 3.97Å; H126-P157 VanDerWaalsContact NE2-CD 3.35Å; H126-P157 WeakPolarHBondContact NE2-CD 3.44Å; A129-P157 HydrophobicContact CB-CB 4.1Å; P147-P157 VanDerWaalsContact O-CD 3.3Å; P147-P157 WeakPolarHBondContact O-CD 3.43Å; I149-P157 WeakPolarHBondContact O-CD 3.44Å; P157-L160 PolarHBondContact O-N 2.99Å; P157-A161 WeakPolarHBondContact O-CB 3.4Å; P157-A161 PolarHBondContact O-N 3.01Å; P157-L169 HydrophobicContact CB-CD1 4.04Å
158	F	96.3	Very high	94.4	Very high	87 Å²	87	61.4 Å²	61.4	38%	0.382	32%	0.317	S	S	.	.	H	α-helix	trans	-64.5	-40.2	178.4	177.3	-95.7	0	0	0	112.4	T156 L160 A161 R166 L169 T170	T156-F158 PolarHBondContact O-N 3.16Å; T156-F158 PolarHBondContact OG1-N 2.91Å; F158-L160 PolarHBondContact O-N 3.2Å; F158-A161 WeakPolarHBondContact O-CB 3.46Å; F158-A161 PolarHBondContact O-N 3.27Å; F158-R166 HydrophobicContact CD2-CB 4.39Å; F158-R166 HydrophobicContact CD2-CG 4.07Å; F158-R166 HydrophobicContact CE2-CB 3.99Å; F158-R166 HydrophobicContact CE2-CG 3.84Å; F158-R166 HydrophobicContact CZ-CG 4.44Å; F158-L169 HydrophobicContact CB-CB 4.5Å; F158-L169 HydrophobicContact CB-CD1 4.15Å; F158-L169 HydrophobicContact CD2-CB 4.04Å; F158-T170 HydrophobicContact CD2-CG2 4.28Å; F158-T170 HydrophobicContact CE2-CG2 3.57Å; F158-T170 HydrophobicContact CZ-CG2 4.34Å
159	D	96.4	Very high	94.3	Very high	83 Å²	83	56.6 Å²	56.6	44%	0.444	29%	0.292	S	S	.	.	H	α-helix	trans	-66.5	-24.4	-179.8	-60.2	-47.2	0	0	0	112.9	K155 T156	K155-D159 HydrophobicContact CB-CB 3.99Å; K155-D159 HydrophobicContact CG-CB 4.3Å; T156-D159 PolarHBondContact N-OD2 3.09Å; T156-D159 PolarHBondContact O-N 3.09Å; T156-D159 VanDerWaalsContact O-N 3.14Å; T156-D159 VanDerWaalsContact OG1-CG 3.24Å; T156-D159 PolarHBondContact OG1-N 2.99Å; T156-D159 PolarHBondContact OG1-OD2 3.2Å
160	L	95.1	Very high	94.1	Very high	33 Å²	33	58.2 Å²	58.2	17%	0.173	30%	0.303	C	S	.	.	H	α-helix	trans	-99.7	-13.1	179.5	-63.9	-177.9	0	0	0	113.7	F122 L130 K155 T156 P157 F158	F122-L160 HydrophobicContact CD1-CD1 4.45Å; F122-L160 HydrophobicContact CE1-CD1 3.49Å; F122-L160 VanDerWaalsContact CE1-CD1 3.49Å; F122-L160 HydrophobicContact CZ-CD1 3.8Å; L130-L160 HydrophobicContact CB-CB 4.47Å; L130-L160 HydrophobicContact CD1-CB 4.26Å; K155-L160 HydrophobicContact CB-CD2 4.39Å; K155-L160 HydrophobicContact CB-CG 4.26Å; K155-L160 HydrophobicContact CD-CD2 3.53Å; K155-L160 HydrophobicContact CD-CG 4.29Å; T156-L160 PolarHBondContact O-N 2.88Å; P157-L160 PolarHBondContact O-N 2.99Å; F158-L160 PolarHBondContact O-N 3.2Å
161	A	95.3	Very high	93.9	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.008	27%	0.274	C	S	.	.			trans	-65.3	147.9	-173.9	0	0	0	0	0	112.8	A129 P157 F158 R166 L169	A129-A161 HydrophobicContact CB-CB 4.04Å; A129-A161 WeakPolarHBondContact O-CA 3.47Å; P157-A161 WeakPolarHBondContact O-CB 3.4Å; P157-A161 PolarHBondContact O-N 3.01Å; F158-A161 WeakPolarHBondContact O-CB 3.46Å; F158-A161 PolarHBondContact O-N 3.27Å; A161-R166 HydrophobicContact CB-CB 4.42Å; A161-R166 HydrophobicContact CB-CG 3.55Å; A161-R166 PolarHBondContact O-NE 2.73Å; A161-R166 PolarHBondContact O-NH2 3.3Å; A161-L169 HydrophobicContact CB-CD1 3.99Å
162	D	89.4	Confident	93.6	Very high	57 Å²	57	55.7 Å²	55.7	31%	0.305	30%	0.298	S	S	.	.			trans	-75.1	179.3	164.4	73.1	-5.9	0	0	0	112.1	G132 N164 S165 R166	G132-D162 WeakPolarHBondContact CA-OD2 3.26Å; D162-N164 VanDerWaalsContact C-N 3.33Å; D162-N164 PolarHBondContact O-N 2.98Å; D162-N164 PolarHBondContact OD1-N 3.1Å; D162-S165 PolarHBondContact O-N 2.92Å; D162-S165 WeakPolarHBondContact OD1-CB 3.38Å; D162-S165 PolarHBondContact OD1-N 3.3Å; D162-S165 PolarHBondContact OD1-OG 2.87Å; D162-R166 WeakPolarHBondContact O-CB 3.34Å; D162-R166 VanDerWaalsContact O-CG 3.26Å; D162-R166 WeakPolarHBondContact O-CG 3.33Å; D162-R166 PolarHBondContact O-N 2.84Å
163	S	86.2	Confident	93.6	Very high	83 Å²	83	52.1 Å²	52.1	58%	0.58	28%	0.276	S	S	*	.	H	α-helix	trans	-58.4	-42.4	-176.9	53.1	0	0	0	0	113.2	A167	S163-A167 PolarHBondContact O-N 3.31Å
164	N	87.8	Confident	93.6	Very high	95 Å²	95	51 Å²	51	51%	0.508	26%	0.263	S	S	.	.	H	α-helix	trans	-74.3	-42.3	-175.8	-66.9	-7	0	0	0	111.3	V134 D162 R166 A167	V134-N164 HydrophobicContact CG2-CB 3.91Å; D162-N164 VanDerWaalsContact C-N 3.33Å; D162-N164 PolarHBondContact O-N 2.98Å; D162-N164 PolarHBondContact OD1-N 3.1Å; N164-R166 VanDerWaalsContact C-N 3.34Å; N164-A167 PolarHBondContact O-N 3.37Å
165	S	92.2	Very high	93.6	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-70.8	-30.2	178.7	-52.1	0	0	0	0	112.1	G132 D162 A167 V168 L169	G132-S165 VanDerWaalsContact CA-OG 3.31Å; G132-S165 WeakPolarHBondContact CA-OG 3.28Å; D162-S165 PolarHBondContact O-N 2.92Å; D162-S165 WeakPolarHBondContact OD1-CB 3.38Å; D162-S165 PolarHBondContact OD1-N 3.3Å; D162-S165 PolarHBondContact OD1-OG 2.87Å; S165-A167 VanDerWaalsContact C-N 3.33Å; S165-A167 PolarHBondContact O-N 3.32Å; S165-V168 WeakPolarHBondContact O-CB 3.4Å; S165-V168 PolarHBondContact O-N 2.78Å; S165-L169 WeakPolarHBondContact O-CG 3.42Å; S165-L169 PolarHBondContact O-N 2.91Å; S165-L169 VanDerWaalsContact O-N 3.13Å
166	R	94.9	Very high	93.4	Very high	110 Å²	110	51.6 Å²	51.6	42%	0.415	26%	0.26	S	S	.	.	H	α-helix	trans	-59.4	-44	171.7	-80.8	-175.5	-145.8	120.5	6.9	111.7	F158 A161 D162 N164 V168 L169 T170	F158-R166 HydrophobicContact CD2-CB 4.39Å; F158-R166 HydrophobicContact CD2-CG 4.07Å; F158-R166 HydrophobicContact CE2-CB 3.99Å; F158-R166 HydrophobicContact CE2-CG 3.84Å; F158-R166 HydrophobicContact CZ-CG 4.44Å; A161-R166 HydrophobicContact CB-CB 4.42Å; A161-R166 HydrophobicContact CB-CG 3.55Å; A161-R166 PolarHBondContact O-NE 2.73Å; A161-R166 PolarHBondContact O-NH2 3.3Å; D162-R166 WeakPolarHBondContact O-CB 3.34Å; D162-R166 VanDerWaalsContact O-CG 3.26Å; D162-R166 WeakPolarHBondContact O-CG 3.33Å; D162-R166 PolarHBondContact O-N 2.84Å; N164-R166 VanDerWaalsContact C-N 3.34Å; R166-V168 PolarHBondContact O-N 3.38Å; R166-L169 CarbonylContact O-C 3.52Å; R166-L169 PolarHBondContact O-N 2.98Å; R166-T170 WeakPolarHBondContact O-CG2 3.44Å; R166-T170 PolarHBondContact O-N 3.18Å; R166-T170 PolarHBondContact O-OG1 2.99Å
167	A	93.3	Very high	93.3	Very high	27 Å²	27	54.6 Å²	54.6	22%	0.223	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-34	178.2	0	0	0	0	0	111.9	S163 N164 S165 T170 G171 E172 Y173	S163-A167 PolarHBondContact O-N 3.31Å; N164-A167 PolarHBondContact O-N 3.37Å; S165-A167 VanDerWaalsContact C-N 3.33Å; S165-A167 PolarHBondContact O-N 3.32Å; A167-T170 WeakPolarHBondContact CA-OG1 3.35Å; A167-T170 PolarHBondContact O-OG1 3.47Å; A167-T170 VanDerWaalsContact O-OG1 3.13Å; A167-G171 CarbonylContact O-C 3.57Å; A167-G171 PolarHBondContact O-N 3.41Å; A167-E172 PolarHBondContact O-N 2.99Å; A167-Y173 HydrophobicContact CB-CD2 4.31Å; A167-Y173 PolarHBondContact O-N 3.3Å
168	V	95	Very high	93.3	Very high	3 Å²	3	54.6 Å²	54.6	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-67.2	-44.1	174.9	-179.6	0	0	0	0	110.3	V134 C137 I138 L141 S165 R166 T170 G171 Y173	V134-V168 HydrophobicContact CB-CG2 4.45Å; V134-V168 HydrophobicContact CG1-CG2 3.79Å; V134-V168 HydrophobicContact CG2-CG2 4.38Å; C137-V168 HydrophobicContact CB-CG1 4.04Å; I138-V168 HydrophobicContact CG1-CG1 3.72Å; I138-V168 HydrophobicContact CG1-CG2 4.38Å; L141-V168 HydrophobicContact CD1-CG1 3.82Å; S165-V168 WeakPolarHBondContact O-CB 3.4Å; S165-V168 PolarHBondContact O-N 2.78Å; R166-V168 PolarHBondContact O-N 3.38Å; V168-T170 VanDerWaalsContact C-N 3.29Å; V168-T170 PolarHBondContact O-N 2.81Å; V168-G171 PolarHBondContact O-N 3.3Å; V168-G171 VanDerWaalsContact O-N 3.1Å; V168-Y173 HydrophobicContact CG2-CD1 3.99Å; V168-Y173 HydrophobicContact CG2-CD2 4.01Å; V168-Y173 HydrophobicContact CG2-CG 3.63Å
169	L	94.9	Very high	93.3	Very high	17 Å²	17	51 Å²	51	9%	0.089	26%	0.258	C	S	.	.	H	α-helix	trans	-75	-13.9	-177.8	-65.4	172.6	0	0	0	113.9	L125 A129 L141 P147 P157 F158 A161 S165 R166 L197	L125-L169 HydrophobicContact CD1-CD2 4.25Å; L125-L169 HydrophobicContact CD2-CD2 4.1Å; L125-L169 HydrophobicContact CG-CD2 4.35Å; A129-L169 HydrophobicContact CB-CD1 4.07Å; L141-L169 HydrophobicContact CD1-CD2 4.29Å; P147-L169 HydrophobicContact CB-CD2 4.24Å; P157-L169 HydrophobicContact CB-CD1 4.04Å; F158-L169 HydrophobicContact CB-CB 4.5Å; F158-L169 HydrophobicContact CB-CD1 4.15Å; F158-L169 HydrophobicContact CD2-CB 4.04Å; A161-L169 HydrophobicContact CB-CD1 3.99Å; S165-L169 WeakPolarHBondContact O-CG 3.42Å; S165-L169 PolarHBondContact O-N 2.91Å; S165-L169 VanDerWaalsContact O-N 3.13Å; R166-L169 CarbonylContact O-C 3.52Å; R166-L169 PolarHBondContact O-N 2.98Å; L169-L197 WeakPolarHBondContact O-CD1 3.46Å
170	T	92.6	Very high	93.2	Very high	65 Å²	65	51.5 Å²	51.5	40%	0.399	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-9.1	167.5	58.6	0	0	0	0	112.8	F158 R166 A167 V168 E172	F158-T170 HydrophobicContact CD2-CG2 4.28Å; F158-T170 HydrophobicContact CE2-CG2 3.57Å; F158-T170 HydrophobicContact CZ-CG2 4.34Å; R166-T170 WeakPolarHBondContact O-CG2 3.44Å; R166-T170 PolarHBondContact O-N 3.18Å; R166-T170 PolarHBondContact O-OG1 2.99Å; A167-T170 WeakPolarHBondContact CA-OG1 3.35Å; A167-T170 PolarHBondContact O-OG1 3.47Å; A167-T170 VanDerWaalsContact O-OG1 3.13Å; V168-T170 VanDerWaalsContact C-N 3.29Å; V168-T170 PolarHBondContact O-N 2.81Å; T170-E172 VanDerWaalsContact C-N 3.28Å; T170-E172 PolarHBondContact O-N 3.17Å
171	G	90.9	Very high	93.3	Very high	1 Å²	1	50 Å²	50	1%	0.01	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	-2.9	-173.6	0	0	0	0	0	115	A167 V168 Y173 N198 I201	A167-G171 CarbonylContact O-C 3.57Å; A167-G171 PolarHBondContact O-N 3.41Å; V168-G171 PolarHBondContact O-N 3.3Å; V168-G171 VanDerWaalsContact O-N 3.1Å; G171-Y173 VanDerWaalsContact C-N 3.32Å; G171-Y173 PolarHBondContact O-N 3.33Å; G171-N198 WeakPolarHBondContact O-CB 3.48Å; G171-I201 WeakPolarHBondContact O-CD1 3.28Å
172	E	90.8	Very high	93.4	Very high	117 Å²	117	49.9 Å²	49.9	55%	0.547	25%	0.25	S	C	.	.			trans	-80.2	-10.9	-176.6	-63.3	-173.6	155.3	0	0	114.2	A167 T170 R174 K175	A167-E172 PolarHBondContact O-N 2.99Å; T170-E172 VanDerWaalsContact C-N 3.28Å; T170-E172 PolarHBondContact O-N 3.17Å; E172-R174 PolarHBondContact O-N 2.6Å; E172-R174 VanDerWaalsContact O-N 3.13Å; E172-K175 PolarHBondContact O-N 3.26Å
173	Y	94	Very high	93.8	Very high	54 Å²	54	51 Å²	51	21%	0.212	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	117.2	-178.9	-176.8	-103.6	0	0	0	111.9	V134 I138 A167 V168 G171 K175 L193	V134-Y173 HydrophobicContact CG1-CD1 4.24Å; V134-Y173 HydrophobicContact CG1-CD2 4.45Å; V134-Y173 HydrophobicContact CG1-CE1 3.62Å; V134-Y173 HydrophobicContact CG1-CE2 3.89Å; V134-Y173 VanDerWaalsContact CG1-CZ 3.44Å; I138-Y173 HydrophobicContact CD1-CD1 4.04Å; I138-Y173 HydrophobicContact CD1-CE1 3.99Å; A167-Y173 HydrophobicContact CB-CD2 4.31Å; A167-Y173 PolarHBondContact O-N 3.3Å; V168-Y173 HydrophobicContact CG2-CD1 3.99Å; V168-Y173 HydrophobicContact CG2-CD2 4.01Å; V168-Y173 HydrophobicContact CG2-CG 3.63Å; G171-Y173 VanDerWaalsContact C-N 3.32Å; G171-Y173 PolarHBondContact O-N 3.33Å; Y173-K175 PolarHBondContact O-N 3.35Å; Y173-K175 VanDerWaalsContact O-N 3.12Å; Y173-L193 HydrophobicContact CD1-CD2 4.26Å; Y173-L193 HydrophobicContact CE1-CD2 4.04Å
174	R	94.2	Very high	94.2	Very high	100 Å²	100	49.3 Å²	49.3	38%	0.377	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.2	38.3	179.2	-63.5	175.1	71.9	-172.7	2.2	112.9	E172 D176 E177 L178 L193	E172-R174 PolarHBondContact O-N 2.6Å; E172-R174 VanDerWaalsContact O-N 3.13Å; R174-D176 VanDerWaalsContact C-N 3.26Å; R174-D176 PolarHBondContact O-N 3.16Å; R174-E177 HydrophobicContact CB-CB 4.4Å; R174-E177 IonicContact CZ-OE1 3.54Å; R174-E177 IonicContact CZ-OE2 3.97Å; R174-E177 VanDerWaalsContact NE-CD 3.3Å; R174-E177 IonicContact NE-OE1 2.71Å; R174-E177 PolarHBondContact NE-OE1 2.94Å; R174-E177 IonicContact NE-OE2 2.82Å; R174-E177 PolarHBondContact NE-OE2 2.74Å; R174-E177 VanDerWaalsContact NH2-CD 3.35Å; R174-E177 IonicContact NH2-OE1 3.49Å; R174-E177 PolarHBondContact NH2-OE1 3.14Å; R174-E177 IonicContact NH2-OE2 3.63Å; R174-E177 PolarHBondContact NH2-OE2 3.27Å; R174-E177 PolarHBondContact O-N 2.98Å; R174-E177 VanDerWaalsContact O-N 3.14Å; R174-L178 PolarHBondContact O-N 3.32Å; R174-L178 VanDerWaalsContact O-N 3.1Å; R174-L193 HydrophobicContact CB-CD1 4.12Å; R174-L193 HydrophobicContact CB-CD2 4.1Å
175	K	93.6	Very high	94.6	Very high	34 Å²	34	46 Å²	46	15%	0.148	23%	0.225	C	C	.	.	H	α-helix	trans	-56.7	-37.3	-177.6	68.4	-179.6	-177.7	178.9	0	113.7	E172 Y173 E177 L178 L179 I201 D204	E172-K175 PolarHBondContact O-N 3.26Å; Y173-K175 PolarHBondContact O-N 3.35Å; Y173-K175 VanDerWaalsContact O-N 3.12Å; K175-E177 VanDerWaalsContact C-N 3.29Å; K175-E177 PolarHBondContact O-N 2.95Å; K175-L178 PolarHBondContact O-N 3.31Å; K175-L179 WeakPolarHBondContact O-CD1 3.26Å; K175-L179 VanDerWaalsContact O-CG 3.29Å; K175-L179 WeakPolarHBondContact O-CG 3.41Å; K175-L179 PolarHBondContact O-N 3.01Å; K175-I201 HydrophobicContact CB-CD1 3.37Å; K175-I201 HydrophobicContact CB-CG1 4.15Å; K175-I201 HydrophobicContact CD-CD1 3.82Å; K175-I201 HydrophobicContact CD-CG1 4.35Å; K175-I201 HydrophobicContact CG-CD1 4.23Å; K175-D204 WeakPolarHBondContact CE-OD2 3.2Å; K175-D204 IonicContact NZ-OD1 3.16Å; K175-D204 PolarHBondContact NZ-OD1 2.94Å; K175-D204 IonicContact NZ-OD2 2.88Å; K175-D204 PolarHBondContact NZ-OD2 3.27Å
176	D	94.3	Very high	94.9	Very high	104 Å²	104	49.1 Å²	49.1	56%	0.556	24%	0.242	S	C	*	.	H	α-helix	trans	-64.5	-38.9	-179.2	-59.5	-33.3	0	0	0	110.9	R174 L179 E180	R174-D176 VanDerWaalsContact C-N 3.26Å; R174-D176 PolarHBondContact O-N 3.16Å; D176-L179 PolarHBondContact O-N 3.11Å; D176-E180 WeakPolarHBondContact O-CB 3.44Å; D176-E180 PolarHBondContact O-N 3.33Å
177	E	95.8	Very high	94.9	Very high	76 Å²	76	48.1 Å²	48.1	36%	0.355	24%	0.242	S	C	.	.	H	α-helix	trans	-71.9	-35.7	177	-60.5	-175	-117	0	0	112.1	R174 K175 E180 A181 L193	R174-E177 HydrophobicContact CB-CB 4.4Å; R174-E177 IonicContact CZ-OE1 3.54Å; R174-E177 IonicContact CZ-OE2 3.97Å; R174-E177 VanDerWaalsContact NE-CD 3.3Å; R174-E177 IonicContact NE-OE1 2.71Å; R174-E177 PolarHBondContact NE-OE1 2.94Å; R174-E177 IonicContact NE-OE2 2.82Å; R174-E177 PolarHBondContact NE-OE2 2.74Å; R174-E177 VanDerWaalsContact NH2-CD 3.35Å; R174-E177 IonicContact NH2-OE1 3.49Å; R174-E177 PolarHBondContact NH2-OE1 3.14Å; R174-E177 IonicContact NH2-OE2 3.63Å; R174-E177 PolarHBondContact NH2-OE2 3.27Å; R174-E177 PolarHBondContact O-N 2.98Å; R174-E177 VanDerWaalsContact O-N 3.14Å; K175-E177 VanDerWaalsContact C-N 3.29Å; K175-E177 PolarHBondContact O-N 2.95Å; E177-E180 PolarHBondContact O-N 2.81Å; E177-A181 VanDerWaalsContact O-CB 3.25Å; E177-A181 WeakPolarHBondContact O-CB 3.27Å; E177-A181 PolarHBondContact O-N 2.85Å; E177-L193 HydrophobicContact CB-CD1 3.9Å
178	L	96.2	Very high	95	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-43.5	172.3	-179.5	73.3	0	0	0	111.4	R174 K175 A181 A182 L190 L193 L194 N198 I201 P211	R174-L178 PolarHBondContact O-N 3.32Å; R174-L178 VanDerWaalsContact O-N 3.1Å; K175-L178 PolarHBondContact O-N 3.31Å; L178-A181 PolarHBondContact O-N 3.02Å; L178-A182 PolarHBondContact O-N 3.39Å; L178-L190 HydrophobicContact CD1-CD1 3.76Å; L178-L190 HydrophobicContact CD1-CG 4.2Å; L178-L193 HydrophobicContact CB-CB 4.42Å; L178-L193 HydrophobicContact CB-CD1 4.33Å; L178-L193 HydrophobicContact CD1-CB 3.92Å; L178-L194 HydrophobicContact CD1-CB 4.06Å; L178-L194 HydrophobicContact CD1-CD1 4.38Å; L178-N198 HydrophobicContact CD2-CB 4.09Å; L178-I201 HydrophobicContact CD2-CG2 4.01Å; L178-P211 HydrophobicContact CD2-CG 4.27Å; L178-P211 HydrophobicContact CG-CG 4.45Å
179	L	96	Very high	95	Very high	11 Å²	11	56.5 Å²	56.5	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-66.3	-41.3	177.8	-71.1	163.5	0	0	0	111.4	K175 D176 A182 R183 I201 A203 P211 L214	K175-L179 WeakPolarHBondContact O-CD1 3.26Å; K175-L179 VanDerWaalsContact O-CG 3.29Å; K175-L179 WeakPolarHBondContact O-CG 3.41Å; K175-L179 PolarHBondContact O-N 3.01Å; D176-L179 PolarHBondContact O-N 3.11Å; L179-A182 PolarHBondContact O-N 3.48Å; L179-R183 PolarHBondContact O-N 2.79Å; L179-I201 HydrophobicContact CD2-CG2 4.36Å; L179-I201 HydrophobicContact CG-CG2 4.44Å; L179-A203 HydrophobicContact CD1-CB 3.8Å; L179-A203 HydrophobicContact CD2-CB 4.44Å; L179-P211 HydrophobicContact CD2-CG 3.91Å; L179-L214 HydrophobicContact CB-CD1 3.94Å; L179-L214 HydrophobicContact CD2-CD1 3.75Å; L179-L214 HydrophobicContact CG-CD1 4.47Å; L179-L214 WeakPolarHBondContact O-CD1 3.27Å
180	E	95.6	Very high	95.1	Very high	94 Å²	94	55.7 Å²	55.7	44%	0.439	27%	0.274	S	S	.	.	H	α-helix	trans	-68.8	-37.3	175.5	-174.2	52.6	-144.8	0	0	112	D176 E177 A182 R183 S184	D176-E180 WeakPolarHBondContact O-CB 3.44Å; D176-E180 PolarHBondContact O-N 3.33Å; E177-E180 PolarHBondContact O-N 2.81Å; E180-A182 VanDerWaalsContact C-N 3.29Å; E180-A182 PolarHBondContact O-N 3.18Å; E180-R183 PolarHBondContact O-N 3.23Å; E180-R183 WeakPolarHBondContact OE2-CD 3.1Å; E180-R183 IonicContact OE2-NE 2.67Å; E180-S184 VanDerWaalsContact O-CB 3.29Å; E180-S184 WeakPolarHBondContact O-CB 3.19Å; E180-S184 PolarHBondContact O-N 3.01Å; E180-S184 PolarHBondContact O-OG 3.33Å
181	A	97.4	Very high	95.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.7	-42.2	172	0	0	0	0	0	111.2	E177 L178 R183 S184 G185 N186 L189 L190	E177-A181 VanDerWaalsContact O-CB 3.25Å; E177-A181 WeakPolarHBondContact O-CB 3.27Å; E177-A181 PolarHBondContact O-N 2.85Å; L178-A181 PolarHBondContact O-N 3.02Å; A181-R183 PolarHBondContact O-N 2.95Å; A181-S184 PolarHBondContact O-OG 3.4Å; A181-G185 WeakPolarHBondContact O-CA 3.43Å; A181-G185 PolarHBondContact O-N 2.72Å; A181-N186 HydrophobicContact CB-CB 4.27Å; A181-N186 PolarHBondContact O-N 3Å; A181-L189 HydrophobicContact CB-CB 4.1Å; A181-L189 HydrophobicContact CB-CD2 4.05Å; A181-L189 HydrophobicContact CB-CG 4Å; A181-L190 HydrophobicContact CB-CB 4.07Å; A181-L190 HydrophobicContact CB-CD1 4.32Å
182	A	97.3	Very high	95.4	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-35.6	176.8	0	0	0	0	0	113.2	L178 L179 E180 L190 P211 A215 R220 I223	L178-A182 PolarHBondContact O-N 3.39Å; L179-A182 PolarHBondContact O-N 3.48Å; E180-A182 VanDerWaalsContact C-N 3.29Å; E180-A182 PolarHBondContact O-N 3.18Å; A182-L190 HydrophobicContact CB-CD1 3.97Å; A182-P211 HydrophobicContact CB-CB 3.82Å; A182-A215 WeakPolarHBondContact O-CA 3.38Å; A182-R220 WeakPolarHBondContact O-CG 3.48Å; A182-I223 HydrophobicContact CB-CG2 4.08Å
183	R	96	Very high	95.6	Very high	80 Å²	80	52.3 Å²	52.3	30%	0.302	26%	0.259	S	S	.	.	H	α-helix	trans	-71.4	-50.6	176	-176.1	-172.2	-60.8	-151	3.7	112.4	L179 E180 A181 G185 L214 Y218 R220	L179-R183 PolarHBondContact O-N 2.79Å; E180-R183 PolarHBondContact O-N 3.23Å; E180-R183 WeakPolarHBondContact OE2-CD 3.1Å; E180-R183 IonicContact OE2-NE 2.67Å; A181-R183 PolarHBondContact O-N 2.95Å; R183-G185 VanDerWaalsContact C-N 3.34Å; R183-L214 HydrophobicContact CB-CB 4.5Å; R183-Y218 HydrophobicContact CG-CD1 4.2Å; R183-Y218 HydrophobicContact CG-CD2 3.74Å; R183-Y218 HydrophobicContact CG-CE1 4.06Å; R183-Y218 HydrophobicContact CG-CE2 3.6Å; R183-Y218 HydrophobicContact CG-CG 4.04Å; R183-R220 PolarHBondContact O-NE 3.29Å; R183-R220 PolarHBondContact O-NH2 3.11Å
184	S	96.4	Very high	95.7	Very high	48 Å²	48	49.7 Å²	49.7	34%	0.336	25%	0.249	S	C	.	.	H	α-helix	trans	-73.2	-25.3	-176.1	59.7	0	0	0	0	112.9	E180 A181 R220	E180-S184 VanDerWaalsContact O-CB 3.29Å; E180-S184 WeakPolarHBondContact O-CB 3.19Å; E180-S184 PolarHBondContact O-N 3.01Å; E180-S184 PolarHBondContact O-OG 3.33Å; A181-S184 PolarHBondContact O-OG 3.4Å; S184-R220 PolarHBondContact O-NE 2.96Å; S184-R220 PolarHBondContact O-NH2 2.86Å; S184-R220 VanDerWaalsContact O-NH2 3.14Å
185	G	96.3	Very high	95.7	Very high	24 Å²	24	45 Å²	45	25%	0.247	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	18.8	-174.1	0	0	0	0	0	113.8	A181 R183 E187	A181-G185 WeakPolarHBondContact O-CA 3.43Å; A181-G185 PolarHBondContact O-N 2.72Å; R183-G185 VanDerWaalsContact C-N 3.34Å; G185-E187 PolarHBondContact O-N 2.91Å; G185-E187 VanDerWaalsContact O-N 3.12Å
186	N	96.8	Very high	95.6	Very high	67 Å²	67	46.3 Å²	46.3	36%	0.358	24%	0.243	S	C	.	.			trans	-78.4	94.4	-179.2	-171.7	-24.5	0	0	0	111	A181 E188 L189 L190	A181-N186 HydrophobicContact CB-CB 4.27Å; A181-N186 PolarHBondContact O-N 3Å; N186-E188 PolarHBondContact OD1-N 3.25Å; N186-L189 HydrophobicContact CB-CB 4.16Å; N186-L189 VanDerWaalsContact CG-CB 3.44Å; N186-L189 WeakPolarHBondContact OD1-CB 3.32Å; N186-L189 PolarHBondContact OD1-N 3.02Å; N186-L190 VanDerWaalsContact O-CB 3.28Å; N186-L190 WeakPolarHBondContact O-CB 3.49Å; N186-L190 PolarHBondContact O-N 3.22Å
187	E	96.4	Very high	95.5	Very high	89 Å²	89	44.5 Å²	44.5	42%	0.416	23%	0.233	S	C	.	.	H	α-helix	trans	-64.6	-41.7	-176.8	-64.7	178.6	-151.4	0	0	113.1	G185 L190 M191 Q222 I223 L226	G185-E187 PolarHBondContact O-N 2.91Å; G185-E187 VanDerWaalsContact O-N 3.12Å; E187-L190 PolarHBondContact O-N 3.18Å; E187-M191 WeakPolarHBondContact O-CB 3.48Å; E187-M191 VanDerWaalsContact O-CG 3.28Å; E187-M191 WeakPolarHBondContact O-CG 3.28Å; E187-M191 PolarHBondContact O-N 2.99Å; E187-Q222 HydrophobicContact CG-CG 4.19Å; E187-Q222 WeakPolarHBondContact OE1-CB 3.36Å; E187-Q222 WeakPolarHBondContact OE1-CG 3.23Å; E187-Q222 VanDerWaalsContact OE2-CG 3.29Å; E187-Q222 WeakPolarHBondContact OE2-CG 3.34Å; E187-I223 HydrophobicContact CB-CD1 4.31Å; E187-I223 HydrophobicContact CG-CD1 3.73Å; E187-L226 HydrophobicContact CB-CD1 4.42Å; E187-L226 HydrophobicContact CG-CD1 4.39Å
188	E	94.4	Very high	95.4	Very high	165 Å²	165	41.1 Å²	41.1	77%	0.771	22%	0.217	S	C	*	.	H	α-helix	trans	-65.7	-48.2	-178	-174.3	179.5	-179.2	0	0	110.9	N186 M191 S192	N186-E188 PolarHBondContact OD1-N 3.25Å; E188-M191 PolarHBondContact O-N 3.12Å; E188-S192 WeakPolarHBondContact O-CB 3.06Å; E188-S192 PolarHBondContact O-N 3.24Å
189	L	95.8	Very high	95.3	Very high	41 Å²	41	41.2 Å²	41.2	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-63.5	-44.1	176.6	-177	59.7	0	0	0	111	A181 N186 M191 S192 L193	A181-L189 HydrophobicContact CB-CB 4.1Å; A181-L189 HydrophobicContact CB-CD2 4.05Å; A181-L189 HydrophobicContact CB-CG 4Å; N186-L189 HydrophobicContact CB-CB 4.16Å; N186-L189 VanDerWaalsContact CG-CB 3.44Å; N186-L189 WeakPolarHBondContact OD1-CB 3.32Å; N186-L189 PolarHBondContact OD1-N 3.02Å; L189-M191 PolarHBondContact O-N 2.86Å; L189-S192 PolarHBondContact O-N 3.26Å; L189-S192 PolarHBondContact O-OG 2.92Å; L189-L193 HydrophobicContact CD1-CD1 3.98Å; L189-L193 HydrophobicContact CD1-CG 4.41Å; L189-L193 HydrophobicContact CG-CD1 4.31Å; L189-L193 PolarHBondContact O-N 3.06Å
190	L	96.9	Very high	95.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-56	-52.2	175.8	-171.8	93.9	0	0	0	110.4	L178 A181 A182 N186 E187 S192 L193 L194 I223 L226 L227	L178-L190 HydrophobicContact CD1-CD1 3.76Å; L178-L190 HydrophobicContact CD1-CG 4.2Å; A181-L190 HydrophobicContact CB-CB 4.07Å; A181-L190 HydrophobicContact CB-CD1 4.32Å; A182-L190 HydrophobicContact CB-CD1 3.97Å; N186-L190 VanDerWaalsContact O-CB 3.28Å; N186-L190 WeakPolarHBondContact O-CB 3.49Å; N186-L190 PolarHBondContact O-N 3.22Å; E187-L190 PolarHBondContact O-N 3.18Å; L190-S192 PolarHBondContact O-N 3.19Å; L190-L193 PolarHBondContact O-N 3.26Å; L190-L193 VanDerWaalsContact O-N 3.08Å; L190-L194 HydrophobicContact CD2-CD2 4.02Å; L190-L194 HydrophobicContact CG-CB 4.43Å; L190-L194 HydrophobicContact CG-CD2 4.34Å; L190-L194 WeakPolarHBondContact O-CB 3.44Å; L190-L194 PolarHBondContact O-N 2.89Å; L190-I223 HydrophobicContact CB-CD1 4.16Å; L190-I223 HydrophobicContact CD1-CG2 4.19Å; L190-I223 HydrophobicContact CD2-CD1 3.82Å; L190-I223 HydrophobicContact CD2-CG2 3.92Å; L190-I223 HydrophobicContact CG-CD1 4.43Å; L190-L226 HydrophobicContact CD2-CB 4.08Å; L190-L226 HydrophobicContact CD2-CD1 4.11Å; L190-L227 HydrophobicContact CD1-CD2 4.43Å
191	M	94.9	Very high	95.1	Very high	59 Å²	59	39.7 Å²	39.7	29%	0.291	21%	0.213	S	C	.	.	H	α-helix	trans	-67.4	-23.2	-179.2	-73	-59.6	-61.8	0	0	113.5	Q142 E187 E188 L189 L193 L226 Y230	Q142-M191 PolarHBondContact NE2-O 3.18Å; E187-M191 WeakPolarHBondContact O-CB 3.48Å; E187-M191 VanDerWaalsContact O-CG 3.28Å; E187-M191 WeakPolarHBondContact O-CG 3.28Å; E187-M191 PolarHBondContact O-N 2.99Å; E188-M191 PolarHBondContact O-N 3.12Å; L189-M191 PolarHBondContact O-N 2.86Å; M191-L193 VanDerWaalsContact C-N 3.3Å; M191-L226 HydrophobicContact CG-CD1 4.01Å; M191-L226 HydrophobicContact SD-CB 4.47Å; M191-L226 HydrophobicContact SD-CD1 4.05Å; M191-L226 HydrophobicContact SD-CD2 3.83Å; M191-L226 HydrophobicContact SD-CG 4.33Å; M191-Y230 HydrophobicContact CE-CE2 3.75Å; M191-Y230 WeakPolarHBondContact CE-OH 3.14Å; M191-Y230 HydrophobicContact SD-CE2 3.82Å
192	S	94.2	Very high	94.8	Very high	49 Å²	49	43.2 Å²	43.2	34%	0.343	23%	0.229	S	C	.	.	H	α-helix	trans	-72.8	-21.6	173.2	80	0	0	0	0	113.3	E188 L189 L190	E188-S192 WeakPolarHBondContact O-CB 3.06Å; E188-S192 PolarHBondContact O-N 3.24Å; L189-S192 PolarHBondContact O-N 3.26Å; L189-S192 PolarHBondContact O-OG 2.92Å; L190-S192 PolarHBondContact O-N 3.19Å
193	L	95.3	Very high	94.4	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-117.7	-26.5	-172.9	-62.7	178.3	0	0	0	114	Y173 R174 E177 L178 L189 L190 M191 T195 N198	Y173-L193 HydrophobicContact CD1-CD2 4.26Å; Y173-L193 HydrophobicContact CE1-CD2 4.04Å; R174-L193 HydrophobicContact CB-CD1 4.12Å; R174-L193 HydrophobicContact CB-CD2 4.1Å; E177-L193 HydrophobicContact CB-CD1 3.9Å; L178-L193 HydrophobicContact CB-CB 4.42Å; L178-L193 HydrophobicContact CB-CD1 4.33Å; L178-L193 HydrophobicContact CD1-CB 3.92Å; L189-L193 HydrophobicContact CD1-CD1 3.98Å; L189-L193 HydrophobicContact CD1-CG 4.41Å; L189-L193 HydrophobicContact CG-CD1 4.31Å; L189-L193 PolarHBondContact O-N 3.06Å; L190-L193 PolarHBondContact O-N 3.26Å; L190-L193 VanDerWaalsContact O-N 3.08Å; M191-L193 VanDerWaalsContact C-N 3.3Å; L193-T195 PolarHBondContact O-N 3.43Å; L193-N198 PolarHBondContact O-ND2 3.36Å
194	L	95.6	Very high	93.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.247	C	C	.	.			trans	-67.8	129.3	-171.4	-179.6	62.3	0	0	0	111.6	Q142 L178 L190 V199 L227 Y230	Q142-L194 WeakPolarHBondContact CG-O 3.31Å; Q142-L194 PolarHBondContact NE2-O 2.55Å; L178-L194 HydrophobicContact CD1-CB 4.06Å; L178-L194 HydrophobicContact CD1-CD1 4.38Å; L190-L194 HydrophobicContact CD2-CD2 4.02Å; L190-L194 HydrophobicContact CG-CB 4.43Å; L190-L194 HydrophobicContact CG-CD2 4.34Å; L190-L194 WeakPolarHBondContact O-CB 3.44Å; L190-L194 PolarHBondContact O-N 2.89Å; L194-V199 HydrophobicContact CD1-CB 3.95Å; L194-V199 HydrophobicContact CD1-CG2 4.02Å; L194-L227 HydrophobicContact CD1-CD2 3.79Å; L194-L227 HydrophobicContact CD2-CD2 4.07Å; L194-Y230 HydrophobicContact CD2-CD2 3.4Å; L194-Y230 HydrophobicContact CD2-CE2 4.05Å; L194-Y230 HydrophobicContact CD2-CG 3.72Å; L194-Y230 HydrophobicContact CG-CD1 4.45Å; L194-Y230 HydrophobicContact CG-CD2 4.1Å; L194-Y230 HydrophobicContact CG-CG 3.98Å
195	T	93.9	Very high	92.8	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	26%	0.257	C	S	.	.			trans	-139.8	162	175	66.8	0	0	0	0	109.7	I138 L141 Q142 L193 L197 N198 V199	I138-T195 HydrophobicContact CB-CG2 4.45Å; I138-T195 HydrophobicContact CG2-CG2 3.96Å; L141-T195 HydrophobicContact CB-CG2 4Å; L141-T195 HydrophobicContact CD1-CG2 4.15Å; Q142-T195 HydrophobicContact CG-CG2 4.39Å; L193-T195 PolarHBondContact O-N 3.43Å; T195-L197 PolarHBondContact O-N 3.25Å; T195-L197 PolarHBondContact OG1-N 3.46Å; T195-N198 PolarHBondContact N-OD1 3.45Å; T195-N198 PolarHBondContact O-N 3.26Å; T195-N198 VanDerWaalsContact O-N 3.12Å; T195-N198 PolarHBondContact O-OD1 2.93Å; T195-N198 PolarHBondContact OG1-N 3.34Å; T195-N198 PolarHBondContact OG1-OD1 3.48Å; T195-V199 PolarHBondContact O-N 2.84Å
196	P	91.5	Very high	91.8	Very high	61 Å²	61	49.7 Å²	49.7	40%	0.396	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.8	171.7	-25.6	35.3	0	0	0	114.1	L141	L141-P196 WeakPolarHBondContact O-CD 3.35Å
197	L	92.1	Very high	91.3	Very high	66 Å²	66	54.4 Å²	54.4	35%	0.346	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-24.4	180	-60.4	179.8	0	0	0	113.4	L141 P147 L169 T195	L141-L197 HydrophobicContact CD1-CD1 3.77Å; L141-L197 HydrophobicContact CD2-CD1 3.77Å; L141-L197 HydrophobicContact CD2-CG 4.34Å; L141-L197 HydrophobicContact CG-CD1 4.42Å; P147-L197 HydrophobicContact CB-CD1 4.48Å; P147-L197 HydrophobicContact CG-CD1 4.28Å; P147-L197 HydrophobicContact CG-CD2 4.17Å; L169-L197 WeakPolarHBondContact O-CD1 3.46Å; T195-L197 PolarHBondContact O-N 3.25Å; T195-L197 PolarHBondContact OG1-N 3.46Å
198	N	93.9	Very high	91.1	Very high	5 Å²	5	55.9 Å²	55.9	3%	0.027	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-1.4	-178.2	70.1	8.7	0	0	0	114.4	G171 L178 L193 T195 N200 I201	G171-N198 WeakPolarHBondContact O-CB 3.48Å; L178-N198 HydrophobicContact CD2-CB 4.09Å; L193-N198 PolarHBondContact O-ND2 3.36Å; T195-N198 PolarHBondContact N-OD1 3.45Å; T195-N198 PolarHBondContact O-N 3.26Å; T195-N198 VanDerWaalsContact O-N 3.12Å; T195-N198 PolarHBondContact O-OD1 2.93Å; T195-N198 PolarHBondContact OG1-N 3.34Å; T195-N198 PolarHBondContact OG1-OD1 3.48Å; N198-N200 PolarHBondContact O-N 2.83Å; N198-N200 VanDerWaalsContact O-N 3.13Å; N198-I201 HydrophobicContact CB-CB 4.37Å; N198-I201 HydrophobicContact CB-CD1 4.47Å; N198-I201 VanDerWaalsContact O-CB 3.23Å; N198-I201 WeakPolarHBondContact O-CB 3.38Å; N198-I201 WeakPolarHBondContact O-CG2 3.34Å; N198-I201 PolarHBondContact O-N 2.89Å
199	V	94.5	Very high	91.1	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.018	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-34.4	-179.5	66.1	0	0	0	0	113.3	L194 T195 L227 A232	L194-V199 HydrophobicContact CD1-CB 3.95Å; L194-V199 HydrophobicContact CD1-CG2 4.02Å; T195-V199 PolarHBondContact O-N 2.84Å; V199-L227 HydrophobicContact CG2-CD2 4.15Å; V199-A232 HydrophobicContact CG2-CB 3.57Å
200	N	93.6	Very high	91.1	Very high	50 Å²	50	46.6 Å²	46.6	27%	0.267	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	23.5	177	-64.3	-42	0	0	0	112.4	N198 D233	N198-N200 PolarHBondContact O-N 2.83Å; N198-N200 VanDerWaalsContact O-N 3.13Å; N200-D233 PolarHBondContact OD1-N 3.29Å
201	I	93.5	Very high	91.1	Very high	23 Å²	23	46.6 Å²	46.6	12%	0.118	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-60.3	147	175.7	-164.7	147.5	0	0	0	110.3	G171 K175 L178 L179 N198 T210 P211	G171-I201 WeakPolarHBondContact O-CD1 3.28Å; K175-I201 HydrophobicContact CB-CD1 3.37Å; K175-I201 HydrophobicContact CB-CG1 4.15Å; K175-I201 HydrophobicContact CD-CD1 3.82Å; K175-I201 HydrophobicContact CD-CG1 4.35Å; K175-I201 HydrophobicContact CG-CD1 4.23Å; L178-I201 HydrophobicContact CD2-CG2 4.01Å; L179-I201 HydrophobicContact CD2-CG2 4.36Å; L179-I201 HydrophobicContact CG-CG2 4.44Å; N198-I201 HydrophobicContact CB-CB 4.37Å; N198-I201 HydrophobicContact CB-CD1 4.47Å; N198-I201 VanDerWaalsContact O-CB 3.23Å; N198-I201 WeakPolarHBondContact O-CB 3.38Å; N198-I201 WeakPolarHBondContact O-CG2 3.34Å; N198-I201 PolarHBondContact O-N 2.89Å; I201-T210 VanDerWaalsContact O-CA 3.25Å; I201-T210 WeakPolarHBondContact O-CA 3.44Å; I201-P211 HydrophobicContact CG2-CG 3.99Å; I201-P211 WeakPolarHBondContact O-CD 3.06Å
202	H	92	Very high	91.3	Very high	74 Å²	74	43.8 Å²	43.8	34%	0.343	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-101	142.6	177.6	-65.2	-82.5	0	0	0	110.5	K208	H202-K208 HydrophobicContact CB-CB 4.25Å; H202-K208 PolarHBondContact ND1-O 3.35Å
203	A	88	Confident	91.4	Very high	7 Å²	7	41.5 Å²	41.5	6%	0.058	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-60.9	138.9	164.2	0	0	0	0	0	110.4	L179 D205 K208 S209	L179-A203 HydrophobicContact CD1-CB 3.8Å; L179-A203 HydrophobicContact CD2-CB 4.44Å; A203-D205 VanDerWaalsContact CB-OD1 3.31Å; A203-D205 WeakPolarHBondContact CB-OD1 3.21Å; A203-D205 PolarHBondContact O-N 3.38Å; A203-K208 WeakPolarHBondContact O-CA 3.46Å; A203-S209 PolarHBondContact N-O 2.93Å
204	D	83.4	Confident	91.5	Very high	115 Å²	115	42 Å²	42	62%	0.615	22%	0.223	S	C	*	.	S	Bend	trans	-73	-23.3	175.6	-71.4	-9.9	0	0	0	111.5	K175	K175-D204 WeakPolarHBondContact CE-OD2 3.2Å; K175-D204 IonicContact NZ-OD1 3.16Å; K175-D204 PolarHBondContact NZ-OD1 2.94Å; K175-D204 IonicContact NZ-OD2 2.88Å; K175-D204 PolarHBondContact NZ-OD2 3.27Å
205	D	75.4	Confident	91.6	Very high	103 Å²	103	42 Å²	42	55%	0.551	22%	0.223	S	C	*	.	S	Bend	trans	-87.8	147.9	-174.9	72.2	-12.2	0	0	0	113.4	A203 R207 K208	A203-D205 VanDerWaalsContact CB-OD1 3.31Å; A203-D205 WeakPolarHBondContact CB-OD1 3.21Å; A203-D205 PolarHBondContact O-N 3.38Å; D205-R207 PolarHBondContact O-N 3.2Å; D205-K208 PolarHBondContact O-N 3.08Å; D205-K208 VanDerWaalsContact O-N 3.17Å
206	G	76.8	Confident	91.8	Very high	62 Å²	62	42 Å²	42	64%	0.639	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	-87.6	166	0	0	0	0	0	116.3	K239	G206-K239 VanDerWaalsContact O-CD 3.26Å; G206-K239 WeakPolarHBondContact O-CD 3.28Å
207	R	86	Confident	92	Very high	166 Å²	166	39.5 Å²	39.5	63%	0.626	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-9.9	-168.4	-79.3	-171.6	163.8	85.7	0.7	115.3	D205 S209 D238 K239	D205-R207 PolarHBondContact O-N 3.2Å; R207-S209 VanDerWaalsContact C-N 3.25Å; R207-S209 PolarHBondContact O-N 3.44Å; R207-D238 WeakPolarHBondContact O-CB 3.44Å; R207-K239 WeakPolarHBondContact O-CB 3.35Å; R207-K239 PolarHBondContact O-N 3.48Å
208	K	91.4	Very high	92.2	Very high	121 Å²	121	41.6 Å²	41.6	53%	0.526	21%	0.213	S	C	.	.			trans	54.9	39	-172.8	-63.7	-167	169.1	-166.9	0	114	H202 A203 D205 K239	H202-K208 HydrophobicContact CB-CB 4.25Å; H202-K208 PolarHBondContact ND1-O 3.35Å; A203-K208 WeakPolarHBondContact O-CA 3.46Å; D205-K208 PolarHBondContact O-N 3.08Å; D205-K208 VanDerWaalsContact O-N 3.17Å; K208-K239 HydrophobicContact CB-CB 4.45Å
209	S	94.2	Very high	92.4	Very high	11 Å²	11	44.9 Å²	44.9	8%	0.077	23%	0.23	C	C	.	.			trans	-71.2	143.3	179	-59.2	0	0	0	0	111.2	A203 R207	A203-S209 PolarHBondContact N-O 2.93Å; R207-S209 VanDerWaalsContact C-N 3.25Å; R207-S209 PolarHBondContact O-N 3.44Å
210	T	96.2	Very high	92.6	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.246	C	C	.	.			trans	-83.6	166.4	171.4	70	0	0	0	0	111.7	I201 L212 H213 L214 V236	I201-T210 VanDerWaalsContact O-CA 3.25Å; I201-T210 WeakPolarHBondContact O-CA 3.44Å; T210-L212 PolarHBondContact O-N 3.49Å; T210-L212 VanDerWaalsContact O-N 3.12Å; T210-L212 PolarHBondContact OG1-N 2.94Å; T210-H213 PolarHBondContact N-ND1 3.48Å; T210-H213 WeakPolarHBondContact O-CB 3.45Å; T210-H213 PolarHBondContact O-N 3.42Å; T210-H213 PolarHBondContact OG1-N 3.25Å; T210-H213 PolarHBondContact OG1-ND1 2.95Å; T210-L214 PolarHBondContact O-N 3.11Å; T210-L214 VanDerWaalsContact O-N 3.14Å; T210-V236 HydrophobicContact CG2-CB 4.31Å; T210-V236 HydrophobicContact CG2-CG1 3.64Å
211	P	97.2	Very high	92.7	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-48.6	-38.1	170.5	-30.9	35.7	0	0	0	112.9	L178 L179 A182 I201 L214 A215 L227	L178-P211 HydrophobicContact CD2-CG 4.27Å; L178-P211 HydrophobicContact CG-CG 4.45Å; L179-P211 HydrophobicContact CD2-CG 3.91Å; A182-P211 HydrophobicContact CB-CB 3.82Å; I201-P211 HydrophobicContact CG2-CG 3.99Å; I201-P211 WeakPolarHBondContact O-CD 3.06Å; P211-L214 PolarHBondContact O-N 3.35Å; P211-A215 VanDerWaalsContact O-CB 3.3Å; P211-A215 WeakPolarHBondContact O-CB 3.47Å; P211-A215 PolarHBondContact O-N 2.9Å; P211-L227 VanDerWaalsContact C-CD1 3.43Å; P211-L227 HydrophobicContact CB-CD1 3.74Å; P211-L227 HydrophobicContact CB-CD2 3.72Å; P211-L227 HydrophobicContact CB-CG 4.41Å
212	L	97.9	Very high	92.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-69	-38.1	-179.8	-171.7	61.4	0	0	0	112.2	T210 L214 A216 V224 L227 L228 A232 V234 P244 L260	T210-L212 PolarHBondContact O-N 3.49Å; T210-L212 VanDerWaalsContact O-N 3.12Å; T210-L212 PolarHBondContact OG1-N 2.94Å; L212-L214 VanDerWaalsContact C-N 3.34Å; L212-L214 PolarHBondContact O-N 2.87Å; L212-A216 WeakPolarHBondContact O-CB 3.24Å; L212-A216 PolarHBondContact O-N 3.09Å; L212-V224 HydrophobicContact CD1-CB 4.38Å; L212-V224 HydrophobicContact CD1-CG1 3.71Å; L212-L227 HydrophobicContact CB-CD1 4.19Å; L212-L227 HydrophobicContact CD1-CB 4.15Å; L212-L227 HydrophobicContact CD1-CD1 4.23Å; L212-L228 HydrophobicContact CD1-CD2 4.42Å; L212-L228 HydrophobicContact CD1-CG 4.36Å; L212-L228 HydrophobicContact CD2-CD2 4.03Å; L212-A232 HydrophobicContact CB-CB 4.24Å; L212-A232 HydrophobicContact CD2-CB 3.82Å; L212-A232 HydrophobicContact CG-CB 4.44Å; L212-V234 HydrophobicContact CD2-CG1 4.17Å; L212-P244 HydrophobicContact CB-CG 4.22Å; L212-P244 HydrophobicContact CD2-CB 4.22Å; L212-P244 HydrophobicContact CD2-CG 3.86Å; L212-P244 HydrophobicContact CG-CB 3.91Å; L212-P244 HydrophobicContact CG-CG 3.85Å; L212-L260 HydrophobicContact CD1-CD2 4.13Å; L212-L260 HydrophobicContact CD2-CD2 4.12Å; L212-L260 HydrophobicContact CG-CD2 4.28Å
213	H	97.3	Very high	93.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-42.5	173.3	-72.7	88.9	0	0	0	112.1	T210 G217 V236 L242 P244 N247	T210-H213 PolarHBondContact N-ND1 3.48Å; T210-H213 WeakPolarHBondContact O-CB 3.45Å; T210-H213 PolarHBondContact O-N 3.42Å; T210-H213 PolarHBondContact OG1-N 3.25Å; T210-H213 PolarHBondContact OG1-ND1 2.95Å; H213-G217 PolarHBondContact O-N 3.18Å; H213-V236 PolarHBondContact CE1-O 2.81Å; H213-V236 PolarHBondContact NE2-O 3.11Å; H213-L242 PolarHBondContact NE2-O 2.79Å; H213-P244 WeakPolarHBondContact NE2-CD 3Å; H213-N247 PolarHBondContact O-ND2 3.23Å
214	L	96.5	Very high	93.7	Very high	15 Å²	15	46.7 Å²	46.7	8%	0.079	23%	0.233	C	C	.	.	H	α-helix	trans	-68.6	-53.7	179.6	-63	176.8	0	0	0	110.3	L179 R183 T210 P211 L212 A216 G217 Y218	L179-L214 HydrophobicContact CB-CD1 3.94Å; L179-L214 HydrophobicContact CD2-CD1 3.75Å; L179-L214 HydrophobicContact CG-CD1 4.47Å; L179-L214 WeakPolarHBondContact O-CD1 3.27Å; R183-L214 HydrophobicContact CB-CB 4.5Å; T210-L214 PolarHBondContact O-N 3.11Å; T210-L214 VanDerWaalsContact O-N 3.14Å; P211-L214 PolarHBondContact O-N 3.35Å; L212-L214 VanDerWaalsContact C-N 3.34Å; L212-L214 PolarHBondContact O-N 2.87Å; L214-A216 PolarHBondContact O-N 3.35Å; L214-G217 PolarHBondContact O-N 3.35Å; L214-G217 VanDerWaalsContact O-N 3.12Å; L214-Y218 VanDerWaalsContact O-CD2 3.3Å; L214-Y218 WeakPolarHBondContact O-CD2 3.5Å; L214-Y218 PolarHBondContact O-N 2.86Å
215	A	97.9	Very high	94.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-56.5	-39.3	178.3	0	0	0	0	0	111.9	A182 P211 N219 R220 I223 V224 L227	A182-A215 WeakPolarHBondContact O-CA 3.38Å; P211-A215 VanDerWaalsContact O-CB 3.3Å; P211-A215 WeakPolarHBondContact O-CB 3.47Å; P211-A215 PolarHBondContact O-N 2.9Å; A215-N219 PolarHBondContact O-N 3.48Å; A215-R220 HydrophobicContact CB-CB 4.16Å; A215-R220 PolarHBondContact O-N 2.96Å; A215-I223 HydrophobicContact CB-CB 4.05Å; A215-I223 HydrophobicContact CB-CG2 3.51Å; A215-V224 HydrophobicContact CB-CG2 3.65Å; A215-L227 HydrophobicContact CB-CD1 3.97Å
216	A	97.8	Very high	95.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-43.7	177	0	0	0	0	0	112.8	L212 L214 P244 A248 H253 V256 L260	L212-A216 WeakPolarHBondContact O-CB 3.24Å; L212-A216 PolarHBondContact O-N 3.09Å; L214-A216 PolarHBondContact O-N 3.35Å; A216-P244 HydrophobicContact CB-CB 4.24Å; A216-A248 HydrophobicContact CB-CB 4.35Å; A216-H253 PolarHBondContact O-CD2 2.94Å; A216-V256 HydrophobicContact CB-CG1 3.9Å; A216-L260 HydrophobicContact CB-CD1 4.14Å
217	G	96.2	Very high	96.3	Very high	9 Å²	9	37.9 Å²	37.9	9%	0.093	17%	0.168	C	C	.	.	H	α-helix	trans	-71.7	-29.7	179.5	0	0	0	0	0	114.4	H213 L214 H253	H213-G217 PolarHBondContact O-N 3.18Å; L214-G217 PolarHBondContact O-N 3.35Å; L214-G217 VanDerWaalsContact O-N 3.12Å; G217-H253 PolarHBondContact O-CD2 2.92Å; G217-H253 PolarHBondContact O-NE2 3.25Å
218	Y	97.4	Very high	96.8	Very high	110 Å²	110	30.4 Å²	30.4	43%	0.431	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	13.7	-178.9	-74.1	-89.2	0	0	0	114.1	R183 L214 R220	R183-Y218 HydrophobicContact CG-CD1 4.2Å; R183-Y218 HydrophobicContact CG-CD2 3.74Å; R183-Y218 HydrophobicContact CG-CE1 4.06Å; R183-Y218 HydrophobicContact CG-CE2 3.6Å; R183-Y218 HydrophobicContact CG-CG 4.04Å; L214-Y218 VanDerWaalsContact O-CD2 3.3Å; L214-Y218 WeakPolarHBondContact O-CD2 3.5Å; L214-Y218 PolarHBondContact O-N 2.86Å; Y218-R220 WeakPolarHBondContact O-CD 3.22Å; Y218-R220 PolarHBondContact O-N 3.31Å; Y218-R220 PolarHBondContact O-NE 3.18Å
219	N	97.3	Very high	96.8	Very high	73 Å²	73	30 Å²	30	39%	0.39	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	43.1	179	-158.7	27	0	0	0	114.5	A215 T221	A215-N219 PolarHBondContact O-N 3.48Å; N219-T221 PolarHBondContact O-N 2.89Å
220	R	97.9	Very high	96.7	Very high	94 Å²	94	31.5 Å²	31.5	36%	0.355	14%	0.144	S	C	.	.			trans	-93.1	67	179.6	-54	-50.5	-175.4	-176.8	0.5	110.6	A182 R183 S184 A215 Y218 Q222 I223 V224	A182-R220 WeakPolarHBondContact O-CG 3.48Å; R183-R220 PolarHBondContact O-NE 3.29Å; R183-R220 PolarHBondContact O-NH2 3.11Å; S184-R220 PolarHBondContact O-NE 2.96Å; S184-R220 PolarHBondContact O-NH2 2.86Å; S184-R220 VanDerWaalsContact O-NH2 3.14Å; A215-R220 HydrophobicContact CB-CB 4.16Å; A215-R220 PolarHBondContact O-N 2.96Å; Y218-R220 WeakPolarHBondContact O-CD 3.22Å; Y218-R220 PolarHBondContact O-N 3.31Å; Y218-R220 PolarHBondContact O-NE 3.18Å; R220-Q222 VanDerWaalsContact C-N 3.26Å; R220-Q222 PolarHBondContact O-N 3.16Å; R220-Q222 VanDerWaalsContact O-N 3.11Å; R220-I223 HydrophobicContact CB-CB 3.79Å; R220-I223 HydrophobicContact CB-CG1 3.8Å; R220-I223 WeakPolarHBondContact O-CB 3.46Å; R220-I223 PolarHBondContact O-N 3.37Å; R220-V224 WeakPolarHBondContact O-CG2 3.41Å; R220-V224 PolarHBondContact O-N 2.79Å
221	T	97.3	Very high	96.4	Very high	26 Å²	26	39.6 Å²	39.6	16%	0.16	18%	0.18	C	C	.	.	H	α-helix	trans	-49.6	-42.6	-171.8	-51.5	0	0	0	0	113.7	N219 V224 K225	N219-T221 PolarHBondContact O-N 2.89Å; T221-V224 PolarHBondContact O-N 3.4Å; T221-K225 WeakPolarHBondContact O-CG 3.48Å; T221-K225 PolarHBondContact O-N 3.23Å
222	Q	96.7	Very high	96.4	Very high	74 Å²	74	40 Å²	40	35%	0.346	18%	0.183	S	C	.	.	H	α-helix	trans	-71.3	-39.1	179.7	-171.9	55.2	26.7	0	0	112.8	E187 R220 K225 L226	E187-Q222 HydrophobicContact CG-CG 4.19Å; E187-Q222 WeakPolarHBondContact OE1-CB 3.36Å; E187-Q222 WeakPolarHBondContact OE1-CG 3.23Å; E187-Q222 VanDerWaalsContact OE2-CG 3.29Å; E187-Q222 WeakPolarHBondContact OE2-CG 3.34Å; R220-Q222 VanDerWaalsContact C-N 3.26Å; R220-Q222 PolarHBondContact O-N 3.16Å; R220-Q222 VanDerWaalsContact O-N 3.11Å; Q222-K225 WeakPolarHBondContact O-CB 3.39Å; Q222-K225 PolarHBondContact O-N 3.33Å; Q222-L226 WeakPolarHBondContact O-CG 3.44Å; Q222-L226 PolarHBondContact O-N 2.88Å
223	I	98.2	Very high	96.2	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-43.5	171.9	-59.3	-62.7	0	0	0	110.8	A182 E187 L190 A215 R220 K225 L226 L227	A182-I223 HydrophobicContact CB-CG2 4.08Å; E187-I223 HydrophobicContact CB-CD1 4.31Å; E187-I223 HydrophobicContact CG-CD1 3.73Å; L190-I223 HydrophobicContact CB-CD1 4.16Å; L190-I223 HydrophobicContact CD1-CG2 4.19Å; L190-I223 HydrophobicContact CD2-CD1 3.82Å; L190-I223 HydrophobicContact CD2-CG2 3.92Å; L190-I223 HydrophobicContact CG-CD1 4.43Å; A215-I223 HydrophobicContact CB-CB 4.05Å; A215-I223 HydrophobicContact CB-CG2 3.51Å; R220-I223 HydrophobicContact CB-CB 3.79Å; R220-I223 HydrophobicContact CB-CG1 3.8Å; R220-I223 WeakPolarHBondContact O-CB 3.46Å; R220-I223 PolarHBondContact O-N 3.37Å; I223-K225 VanDerWaalsContact C-N 3.3Å; I223-K225 PolarHBondContact O-N 3.5Å; I223-L226 PolarHBondContact O-N 3Å; I223-L227 HydrophobicContact CG2-CD1 3.76Å; I223-L227 HydrophobicContact CG2-CG 4.14Å; I223-L227 WeakPolarHBondContact O-CB 3.48Å; I223-L227 VanDerWaalsContact O-CG 3.3Å; I223-L227 WeakPolarHBondContact O-CG 3.27Å; I223-L227 PolarHBondContact O-N 3.09Å
224	V	98.2	Very high	96.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59	-44.1	176.6	-178.5	0	0	0	0	110	L212 A215 R220 T221 L226 L227 L228 V256 L259 L260	L212-V224 HydrophobicContact CD1-CB 4.38Å; L212-V224 HydrophobicContact CD1-CG1 3.71Å; A215-V224 HydrophobicContact CB-CG2 3.65Å; R220-V224 WeakPolarHBondContact O-CG2 3.41Å; R220-V224 PolarHBondContact O-N 2.79Å; T221-V224 PolarHBondContact O-N 3.4Å; V224-L226 PolarHBondContact O-N 2.77Å; V224-L227 PolarHBondContact O-N 3.36Å; V224-L228 HydrophobicContact CG1-CD1 3.89Å; V224-L228 HydrophobicContact CG1-CG 4.43Å; V224-L228 WeakPolarHBondContact O-CB 3.46Å; V224-L228 VanDerWaalsContact O-CG 3.23Å; V224-L228 WeakPolarHBondContact O-CG 3.34Å; V224-L228 PolarHBondContact O-N 2.77Å; V224-V256 HydrophobicContact CG1-CG1 4.46Å; V224-V256 HydrophobicContact CG2-CG1 4.16Å; V224-V256 HydrophobicContact CG2-CG2 4.4Å; V224-L259 HydrophobicContact CB-CD2 4.06Å; V224-L259 HydrophobicContact CG1-CD2 3.53Å; V224-L260 HydrophobicContact CG1-CD2 4.21Å
225	K	97.4	Very high	96.2	Very high	79 Å²	79	47.5 Å²	47.5	34%	0.343	22%	0.22	S	C	.	.	H	α-helix	trans	-58.7	-46.6	174.4	-72.3	171.6	-176.8	170.8	0	112.2	T221 Q222 I223 L228 Q229 L259	T221-K225 WeakPolarHBondContact O-CG 3.48Å; T221-K225 PolarHBondContact O-N 3.23Å; Q222-K225 WeakPolarHBondContact O-CB 3.39Å; Q222-K225 PolarHBondContact O-N 3.33Å; I223-K225 VanDerWaalsContact C-N 3.3Å; I223-K225 PolarHBondContact O-N 3.5Å; K225-L228 PolarHBondContact O-N 3.06Å; K225-Q229 VanDerWaalsContact O-CG 3.25Å; K225-Q229 WeakPolarHBondContact O-CG 3.5Å; K225-Q229 PolarHBondContact O-N 3.35Å; K225-L259 HydrophobicContact CB-CD2 4.47Å; K225-L259 HydrophobicContact CG-CD1 3.96Å; K225-L259 HydrophobicContact CG-CD2 3.65Å; K225-L259 HydrophobicContact CG-CG 4.48Å
226	L	95.6	Very high	96	Very high	16 Å²	16	48.5 Å²	48.5	8%	0.084	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-48.1	178.5	-68.8	171.6	0	0	0	111.3	E187 L190 M191 Q222 I223 V224 L228 Q229 Y230	E187-L226 HydrophobicContact CB-CD1 4.42Å; E187-L226 HydrophobicContact CG-CD1 4.39Å; L190-L226 HydrophobicContact CD2-CB 4.08Å; L190-L226 HydrophobicContact CD2-CD1 4.11Å; M191-L226 HydrophobicContact CG-CD1 4.01Å; M191-L226 HydrophobicContact SD-CB 4.47Å; M191-L226 HydrophobicContact SD-CD1 4.05Å; M191-L226 HydrophobicContact SD-CD2 3.83Å; M191-L226 HydrophobicContact SD-CG 4.33Å; Q222-L226 WeakPolarHBondContact O-CG 3.44Å; Q222-L226 PolarHBondContact O-N 2.88Å; I223-L226 PolarHBondContact O-N 3Å; V224-L226 PolarHBondContact O-N 2.77Å; L226-L228 VanDerWaalsContact C-N 3.34Å; L226-L228 PolarHBondContact O-N 2.59Å; L226-Q229 WeakPolarHBondContact O-CB 3.38Å; L226-Q229 PolarHBondContact O-N 3.3Å; L226-Q229 VanDerWaalsContact O-N 3.12Å; L226-Y230 WeakPolarHBondContact O-CD2 3Å; L226-Y230 PolarHBondContact O-N 2.94Å
227	L	97.7	Very high	95.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-58.9	-44.4	178.7	-71.3	172.7	0	0	0	112	L190 L194 V199 P211 L212 A215 I223 V224 Q229 Y230 F231 A232	L190-L227 HydrophobicContact CD1-CD2 4.43Å; L194-L227 HydrophobicContact CD1-CD2 3.79Å; L194-L227 HydrophobicContact CD2-CD2 4.07Å; V199-L227 HydrophobicContact CG2-CD2 4.15Å; P211-L227 VanDerWaalsContact C-CD1 3.43Å; P211-L227 HydrophobicContact CB-CD1 3.74Å; P211-L227 HydrophobicContact CB-CD2 3.72Å; P211-L227 HydrophobicContact CB-CG 4.41Å; L212-L227 HydrophobicContact CB-CD1 4.19Å; L212-L227 HydrophobicContact CD1-CB 4.15Å; L212-L227 HydrophobicContact CD1-CD1 4.23Å; A215-L227 HydrophobicContact CB-CD1 3.97Å; I223-L227 HydrophobicContact CG2-CD1 3.76Å; I223-L227 HydrophobicContact CG2-CG 4.14Å; I223-L227 WeakPolarHBondContact O-CB 3.48Å; I223-L227 VanDerWaalsContact O-CG 3.3Å; I223-L227 WeakPolarHBondContact O-CG 3.27Å; I223-L227 PolarHBondContact O-N 3.09Å; V224-L227 PolarHBondContact O-N 3.36Å; L227-Q229 VanDerWaalsContact C-N 3.34Å; L227-Q229 PolarHBondContact O-N 2.89Å; L227-Y230 CarbonylContact O-C 3.57Å; L227-Y230 PolarHBondContact O-N 3.23Å; L227-Y230 VanDerWaalsContact O-N 3.13Å; L227-F231 PolarHBondContact O-N 3.21Å; L227-A232 VanDerWaalsContact C-CB 3.48Å; L227-A232 HydrophobicContact CB-CB 3.87Å; L227-A232 WeakPolarHBondContact O-CB 3.3Å; L227-A232 PolarHBondContact O-N 3.05Å
228	L	95.8	Very high	95.7	Very high	9 Å²	9	53.6 Å²	53.6	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-64.9	-35.4	176.4	-67.3	170	0	0	0	112.6	L212 V224 K225 L226 Y230 F231 V234 L259 Y263	L212-L228 HydrophobicContact CD1-CD2 4.42Å; L212-L228 HydrophobicContact CD1-CG 4.36Å; L212-L228 HydrophobicContact CD2-CD2 4.03Å; V224-L228 HydrophobicContact CG1-CD1 3.89Å; V224-L228 HydrophobicContact CG1-CG 4.43Å; V224-L228 WeakPolarHBondContact O-CB 3.46Å; V224-L228 VanDerWaalsContact O-CG 3.23Å; V224-L228 WeakPolarHBondContact O-CG 3.34Å; V224-L228 PolarHBondContact O-N 2.77Å; K225-L228 PolarHBondContact O-N 3.06Å; L226-L228 VanDerWaalsContact C-N 3.34Å; L226-L228 PolarHBondContact O-N 2.59Å; L228-Y230 VanDerWaalsContact C-N 3.28Å; L228-Y230 PolarHBondContact O-N 3.28Å; L228-F231 PolarHBondContact O-N 2.72Å; L228-F231 VanDerWaalsContact O-N 3.14Å; L228-V234 HydrophobicContact CD2-CG1 3.41Å; L228-V234 VanDerWaalsContact CD2-CG1 3.41Å; L228-L259 HydrophobicContact CD1-CD2 3.58Å; L228-L259 HydrophobicContact CD1-CG 4.05Å; L228-Y263 HydrophobicContact CB-CD1 3.92Å; L228-Y263 HydrophobicContact CB-CE1 3.82Å; L228-Y263 HydrophobicContact CB-CE2 4.42Å; L228-Y263 HydrophobicContact CB-CG 4.27Å; L228-Y263 HydrophobicContact CD1-CD1 4.32Å; L228-Y263 HydrophobicContact CD1-CD2 3.65Å; L228-Y263 HydrophobicContact CD1-CE2 3.98Å; L228-Y263 HydrophobicContact CD1-CG 3.8Å; L228-Y263 HydrophobicContact CD2-CD1 4.26Å; L228-Y263 HydrophobicContact CD2-CG 4.15Å; L228-Y263 HydrophobicContact CG-CD1 4.39Å; L228-Y263 HydrophobicContact CG-CG 4.3Å
229	Q	91.8	Very high	95.5	Very high	113 Å²	113	55.4 Å²	55.4	53%	0.528	26%	0.258	S	S	.	.	H	α-helix	trans	-63.9	-33.4	172.4	-73.7	170.3	-0.9	0	0	112.5	K225 L226 L227 F231	K225-Q229 VanDerWaalsContact O-CG 3.25Å; K225-Q229 WeakPolarHBondContact O-CG 3.5Å; K225-Q229 PolarHBondContact O-N 3.35Å; L226-Q229 WeakPolarHBondContact O-CB 3.38Å; L226-Q229 PolarHBondContact O-N 3.3Å; L226-Q229 VanDerWaalsContact O-N 3.12Å; L227-Q229 VanDerWaalsContact C-N 3.34Å; L227-Q229 PolarHBondContact O-N 2.89Å; Q229-F231 PolarHBondContact O-N 3.39Å
230	Y	91.5	Very high	95.2	Very high	41 Å²	41	52.4 Å²	52.4	16%	0.161	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	21.5	173.9	-78.3	-84.6	0	0	0	113.3	Q142 M191 L194 L226 L227 L228 A232	Q142-Y230 HydrophobicContact CB-CE1 4.19Å; Q142-Y230 HydrophobicContact CG-CE1 4.11Å; M191-Y230 HydrophobicContact CE-CE2 3.75Å; M191-Y230 WeakPolarHBondContact CE-OH 3.14Å; M191-Y230 HydrophobicContact SD-CE2 3.82Å; L194-Y230 HydrophobicContact CD2-CD2 3.4Å; L194-Y230 HydrophobicContact CD2-CE2 4.05Å; L194-Y230 HydrophobicContact CD2-CG 3.72Å; L194-Y230 HydrophobicContact CG-CD1 4.45Å; L194-Y230 HydrophobicContact CG-CD2 4.1Å; L194-Y230 HydrophobicContact CG-CG 3.98Å; L226-Y230 WeakPolarHBondContact O-CD2 3Å; L226-Y230 PolarHBondContact O-N 2.94Å; L227-Y230 CarbonylContact O-C 3.57Å; L227-Y230 PolarHBondContact O-N 3.23Å; L227-Y230 VanDerWaalsContact O-N 3.13Å; L228-Y230 VanDerWaalsContact C-N 3.28Å; L228-Y230 PolarHBondContact O-N 3.28Å; Y230-A232 PolarHBondContact O-N 3.36Å
231	F	91.3	Very high	95.1	Very high	171 Å²	171	48.1 Å²	48.1	75%	0.75	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	35.8	175.5	-49.1	-80	0	0	0	114.3	L227 L228 Q229 D233	L227-F231 PolarHBondContact O-N 3.21Å; L228-F231 PolarHBondContact O-N 2.72Å; L228-F231 VanDerWaalsContact O-N 3.14Å; Q229-F231 PolarHBondContact O-N 3.39Å; F231-D233 PolarHBondContact O-N 3.34Å
232	A	96.1	Very high	95	Very high	8 Å²	8	47.8 Å²	47.8	7%	0.066	23%	0.227	C	C	.	.			trans	-56.7	129.2	166.1	0	0	0	0	0	109.8	V199 L212 L227 Y230 V234	V199-A232 HydrophobicContact CG2-CB 3.57Å; L212-A232 HydrophobicContact CB-CB 4.24Å; L212-A232 HydrophobicContact CD2-CB 3.82Å; L212-A232 HydrophobicContact CG-CB 4.44Å; L227-A232 VanDerWaalsContact C-CB 3.48Å; L227-A232 HydrophobicContact CB-CB 3.87Å; L227-A232 WeakPolarHBondContact O-CB 3.3Å; L227-A232 PolarHBondContact O-N 3.05Å; Y230-A232 PolarHBondContact O-N 3.36Å; A232-V234 PolarHBondContact O-N 2.79Å
233	D	95.2	Very high	95	Very high	67 Å²	67	44.6 Å²	44.6	36%	0.358	21%	0.212	S	C	.	.			trans	-83.1	117.5	-177.7	171.1	17.3	0	0	0	109.5	N200 F231 H235 V236	N200-D233 PolarHBondContact OD1-N 3.29Å; F231-D233 PolarHBondContact O-N 3.34Å; D233-H235 PolarHBondContact O-N 2.89Å; D233-H235 WeakPolarHBondContact OD1-CB 3.36Å; D233-H235 IonicContact OD1-CD2 2.91Å; D233-H235 IonicContact OD1-CG 2.76Å; D233-H235 PolarHBondContact OD1-N 3.18Å; D233-V236 HydrophobicContact CB-CG2 3.54Å; D233-V236 WeakPolarHBondContact O-CG2 3.17Å; D233-V236 PolarHBondContact O-N 2.8Å; D233-V236 WeakPolarHBondContact OD2-CG2 3.35Å
234	V	96.6	Very high	95	Very high	10 Å²	10	44.5 Å²	44.5	6%	0.061	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-9.6	-179.5	-64.7	0	0	0	0	113.1	L212 L228 A232 L260 A265	L212-V234 HydrophobicContact CD2-CG1 4.17Å; L228-V234 HydrophobicContact CD2-CG1 3.41Å; L228-V234 VanDerWaalsContact CD2-CG1 3.41Å; A232-V234 PolarHBondContact O-N 2.79Å; V234-L260 HydrophobicContact CG1-CD2 4.1Å; V234-A265 HydrophobicContact CB-CB 4.22Å; V234-A265 HydrophobicContact CG2-CB 4.41Å
235	H	96	Very high	95	Very high	96 Å²	96	44.5 Å²	44.5	44%	0.444	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-2.9	-179.1	-54.7	-61.2	0	0	0	113.6	D233 Q237 G264	D233-H235 PolarHBondContact O-N 2.89Å; D233-H235 WeakPolarHBondContact OD1-CB 3.36Å; D233-H235 IonicContact OD1-CD2 2.91Å; D233-H235 IonicContact OD1-CG 2.76Å; D233-H235 PolarHBondContact OD1-N 3.18Å; H235-Q237 PolarHBondContact O-N 3.29Å; H235-G264 PolarHBondContact CE1-O 3.3Å
236	V	94.6	Very high	95	Very high	21 Å²	21	40.8 Å²	40.8	13%	0.127	20%	0.196	C	C	.	.			trans	-59.4	134.2	176.8	-178.3	0	0	0	0	109.2	T210 H213 D233 V243 P244	T210-V236 HydrophobicContact CG2-CB 4.31Å; T210-V236 HydrophobicContact CG2-CG1 3.64Å; H213-V236 PolarHBondContact CE1-O 2.81Å; H213-V236 PolarHBondContact NE2-O 3.11Å; D233-V236 HydrophobicContact CB-CG2 3.54Å; D233-V236 WeakPolarHBondContact O-CG2 3.17Å; D233-V236 PolarHBondContact O-N 2.8Å; D233-V236 WeakPolarHBondContact OD2-CG2 3.35Å; V236-V243 WeakPolarHBondContact O-CA 3.44Å; V236-P244 WeakPolarHBondContact O-CD 3.23Å
237	Q	93.6	Very high	95.1	Very high	105 Å²	105	41.3 Å²	41.3	49%	0.491	20%	0.199	S	C	.	.			trans	-100.9	137.5	177.4	-69	-179.2	-27.9	0	0	110.7	H235 G241 L242 V243	H235-Q237 PolarHBondContact O-N 3.29Å; Q237-G241 PolarHBondContact NE2-O 2.81Å; Q237-L242 CarbonylContact C-O 3.55Å; Q237-L242 WeakPolarHBondContact CA-O 3.44Å; Q237-V243 HydrophobicContact CG-CG1 3.9Å
238	D	94.1	Very high	95.1	Very high	10 Å²	10	41.3 Å²	41.3	5%	0.053	20%	0.199	C	C	.	.			trans	-75.4	-176.7	165.9	89	-10.9	0	0	0	111.1	R207 G240 G241 L242	R207-D238 WeakPolarHBondContact O-CB 3.44Å; D238-G240 PolarHBondContact O-N 3.31Å; D238-G240 VanDerWaalsContact OD1-CA 3.31Å; D238-G240 WeakPolarHBondContact OD1-CA 3.38Å; D238-G240 PolarHBondContact OD1-N 2.84Å; D238-G241 PolarHBondContact O-N 3.3Å; D238-G241 PolarHBondContact OD1-N 2.77Å; D238-L242 PolarHBondContact N-O 3.46Å; D238-L242 WeakPolarHBondContact OD1-CB 3.44Å; D238-L242 PolarHBondContact OD1-N 3.46Å
239	K	92.4	Very high	95.2	Very high	148 Å²	148	40.9 Å²	40.9	64%	0.643	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-26.5	-179.7	-172.6	-179.3	179.2	-178.3	0	113.6	G206 R207 K208 G241 L272	G206-K239 VanDerWaalsContact O-CD 3.26Å; G206-K239 WeakPolarHBondContact O-CD 3.28Å; R207-K239 WeakPolarHBondContact O-CB 3.35Å; R207-K239 PolarHBondContact O-N 3.48Å; K208-K239 HydrophobicContact CB-CB 4.45Å; K239-G241 VanDerWaalsContact C-N 3.31Å; K239-L272 WeakPolarHBondContact O-CD1 3.35Å
240	G	91.7	Very high	95.4	Very high	11 Å²	11	36.4 Å²	36.4	11%	0.113	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-1.5	175.9	0	0	0	0	0	113.8	D238 L272	D238-G240 PolarHBondContact O-N 3.31Å; D238-G240 VanDerWaalsContact OD1-CA 3.31Å; D238-G240 WeakPolarHBondContact OD1-CA 3.38Å; D238-G240 PolarHBondContact OD1-N 2.84Å; G240-L272 WeakPolarHBondContact O-CB 3.31Å; G240-L272 WeakPolarHBondContact O-CG 3.35Å; G240-L272 PolarHBondContact O-N 3.48Å; G240-L272 VanDerWaalsContact O-N 3.09Å
241	G	94.5	Very high	95.6	Very high	3 Å²	3	41 Å²	41	3%	0.031	20%	0.196	C	C	.	.	S	Bend	trans	80.4	4.8	-171	0	0	0	0	0	113.3	Q237 D238 K239 D271	Q237-G241 PolarHBondContact NE2-O 2.81Å; D238-G241 PolarHBondContact O-N 3.3Å; D238-G241 PolarHBondContact OD1-N 2.77Å; K239-G241 VanDerWaalsContact C-N 3.31Å; G241-D271 WeakPolarHBondContact O-CA 3.43Å
242	L	95.9	Very high	95.8	Very high	19 Å²	19	34 Å²	34	10%	0.099	17%	0.171	C	C	.	.			trans	-75.5	131.5	-178.2	-61.5	162.1	0	0	0	108.8	H213 Q237 D238 H246 D271	H213-L242 PolarHBondContact NE2-O 2.79Å; Q237-L242 CarbonylContact C-O 3.55Å; Q237-L242 WeakPolarHBondContact CA-O 3.44Å; D238-L242 PolarHBondContact N-O 3.46Å; D238-L242 WeakPolarHBondContact OD1-CB 3.44Å; D238-L242 PolarHBondContact OD1-N 3.46Å; L242-H246 HydrophobicContact CB-CB 4.15Å; L242-H246 HydrophobicContact CD2-CB 3.63Å; L242-H246 HydrophobicContact CG-CB 4.47Å; L242-D271 HydrophobicContact CD2-CB 3.85Å; L242-D271 HydrophobicContact CG-CB 4.31Å
243	V	97.4	Very high	95.8	Very high	8 Å²	8	35.3 Å²	35.3	5%	0.048	18%	0.176	C	C	.	.			trans	-86.8	162.8	164.8	-59.7	0	0	0	0	111	V236 Q237 L245 H246 A269	V236-V243 WeakPolarHBondContact O-CA 3.44Å; Q237-V243 HydrophobicContact CG-CG1 3.9Å; V243-L245 HydrophobicContact CG2-CB 4.07Å; V243-L245 PolarHBondContact O-N 3.43Å; V243-H246 VanDerWaalsContact CG2-ND1 3.27Å; V243-H246 WeakPolarHBondContact CG2-ND1 3.37Å; V243-H246 PolarHBondContact N-ND1 3.25Å; V243-H246 WeakPolarHBondContact O-CB 3.31Å; V243-H246 PolarHBondContact O-N 3.16Å; V243-A269 HydrophobicContact CG1-CB 4.41Å; V243-A269 HydrophobicContact CG2-CB 3.78Å
244	P	97.8	Very high	95.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-54.1	-30.2	-179.1	-28.1	35.7	0	0	0	114.6	L212 H213 A216 V236 H246 N247 A248 L260	L212-P244 HydrophobicContact CB-CG 4.22Å; L212-P244 HydrophobicContact CD2-CB 4.22Å; L212-P244 HydrophobicContact CD2-CG 3.86Å; L212-P244 HydrophobicContact CG-CB 3.91Å; L212-P244 HydrophobicContact CG-CG 3.85Å; H213-P244 WeakPolarHBondContact NE2-CD 3Å; A216-P244 HydrophobicContact CB-CB 4.24Å; V236-P244 WeakPolarHBondContact O-CD 3.23Å; P244-H246 VanDerWaalsContact C-N 3.31Å; P244-H246 PolarHBondContact O-N 2.74Å; P244-N247 PolarHBondContact O-N 3.22Å; P244-A248 PolarHBondContact O-N 3.01Å; P244-L260 HydrophobicContact CB-CD1 4.15Å; P244-L260 HydrophobicContact CB-CD2 4.34Å
245	L	98.2	Very high	95.7	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-35.2	176.7	-173.4	61.9	0	0	0	112.6	V243 N247 A248 C249 T257 L260 I261 A265 V267 P277 L293	V243-L245 HydrophobicContact CG2-CB 4.07Å; V243-L245 PolarHBondContact O-N 3.43Å; L245-N247 VanDerWaalsContact C-N 3.33Å; L245-N247 PolarHBondContact O-N 3.3Å; L245-A248 PolarHBondContact O-N 3.29Å; L245-C249 WeakPolarHBondContact O-CB 3.35Å; L245-C249 PolarHBondContact O-N 2.72Å; L245-C249 PolarHBondContact O-SG 2.94Å; L245-T257 HydrophobicContact CD1-CG2 3.95Å; L245-L260 HydrophobicContact CB-CD1 4.38Å; L245-L260 HydrophobicContact CD1-CB 4.13Å; L245-L260 HydrophobicContact CD1-CD1 4.3Å; L245-I261 HydrophobicContact CD1-CG1 4.15Å; L245-I261 HydrophobicContact CD2-CG1 4.35Å; L245-A265 HydrophobicContact CB-CB 4.25Å; L245-A265 HydrophobicContact CD2-CB 3.95Å; L245-V267 HydrophobicContact CD2-CG1 4.35Å; L245-P277 HydrophobicContact CB-CG 4.43Å; L245-P277 HydrophobicContact CD2-CB 4.23Å; L245-P277 HydrophobicContact CD2-CG 3.85Å; L245-P277 HydrophobicContact CG-CB 4.08Å; L245-P277 HydrophobicContact CG-CG 3.96Å; L245-L293 HydrophobicContact CD2-CD2 4.38Å
246	H	98.1	Very high	95.8	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-60.9	-43.8	175.1	-71.8	91.3	0	0	0	111.3	L242 V243 P244 C249 S250 A269 F275 P277	L242-H246 HydrophobicContact CB-CB 4.15Å; L242-H246 HydrophobicContact CD2-CB 3.63Å; L242-H246 HydrophobicContact CG-CB 4.47Å; V243-H246 VanDerWaalsContact CG2-ND1 3.27Å; V243-H246 WeakPolarHBondContact CG2-ND1 3.37Å; V243-H246 PolarHBondContact N-ND1 3.25Å; V243-H246 WeakPolarHBondContact O-CB 3.31Å; V243-H246 PolarHBondContact O-N 3.16Å; P244-H246 VanDerWaalsContact C-N 3.31Å; P244-H246 PolarHBondContact O-N 2.74Å; H246-C249 PolarHBondContact O-N 2.9Å; H246-S250 WeakPolarHBondContact O-CB 3.3Å; H246-S250 PolarHBondContact O-N 3.17Å; H246-A269 PolarHBondContact CE1-O 2.81Å; H246-A269 PolarHBondContact NE2-O 3.33Å; H246-F275 PolarHBondContact NE2-O 3.38Å; H246-F275 VanDerWaalsContact NE2-O 3.08Å; H246-P277 WeakPolarHBondContact NE2-CD 3.25Å
247	N	96.5	Very high	95.9	Very high	27 Å²	27	34.3 Å²	34.3	14%	0.144	17%	0.169	C	C	.	.	H	α-helix	trans	-63.7	-48.5	179.8	-70.8	9.1	0	0	0	111.1	H213 P244 L245 C249 S250 Y251	H213-N247 PolarHBondContact O-ND2 3.23Å; P244-N247 PolarHBondContact O-N 3.22Å; L245-N247 VanDerWaalsContact C-N 3.33Å; L245-N247 PolarHBondContact O-N 3.3Å; N247-C249 PolarHBondContact O-N 3.37Å; N247-S250 PolarHBondContact O-N 3.22Å; N247-Y251 VanDerWaalsContact O-CD2 3.31Å; N247-Y251 WeakPolarHBondContact O-CD2 3.32Å; N247-Y251 PolarHBondContact O-N 3.44Å
248	A	98.1	Very high	96	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-56.8	-42.2	176.2	0	0	0	0	0	111.4	A216 P244 L245 G252 H253 V256 L260	A216-A248 HydrophobicContact CB-CB 4.35Å; P244-A248 PolarHBondContact O-N 3.01Å; L245-A248 PolarHBondContact O-N 3.29Å; A248-G252 PolarHBondContact O-N 3.44Å; A248-H253 PolarHBondContact O-N 2.82Å; A248-V256 HydrophobicContact CB-CB 4.33Å; A248-V256 HydrophobicContact CB-CG1 3.7Å; A248-L260 HydrophobicContact CB-CD1 4.07Å
249	C	97.5	Very high	96.1	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-72.6	-41.7	-177.6	-66.5	0	0	0	0	113.6	L245 H246 N247 Y251 G252 P277 A281 R286 V289 L293	L245-C249 WeakPolarHBondContact O-CB 3.35Å; L245-C249 PolarHBondContact O-N 2.72Å; L245-C249 PolarHBondContact O-SG 2.94Å; H246-C249 PolarHBondContact O-N 2.9Å; N247-C249 PolarHBondContact O-N 3.37Å; C249-Y251 VanDerWaalsContact C-N 3.3Å; C249-Y251 PolarHBondContact O-N 2.89Å; C249-G252 PolarHBondContact O-N 3.33Å; C249-P277 HydrophobicContact CB-CB 4.22Å; C249-P277 WeakPolarHBondContact CB-O 3.35Å; C249-A281 HydrophobicContact CB-CB 4.32Å; C249-R286 WeakPolarHBondContact O-CG 3.27Å; C249-V289 HydrophobicContact CB-CG1 3.88Å; C249-L293 HydrophobicContact CB-CD1 4.43Å
250	S	95.9	Very high	96.3	Very high	19 Å²	19	26.7 Å²	26.7	13%	0.133	14%	0.136	C	C	.	.	H	α-helix	trans	-61	-40.4	179.3	-163.5	0	0	0	0	111.6	H246 N247 E280 R286	H246-S250 WeakPolarHBondContact O-CB 3.3Å; H246-S250 PolarHBondContact O-N 3.17Å; N247-S250 PolarHBondContact O-N 3.22Å; S250-E280 VanDerWaalsContact CB-OE2 3.25Å; S250-E280 WeakPolarHBondContact CB-OE2 3.07Å; S250-E280 PolarHBondContact OG-OE2 3.45Å; S250-R286 PolarHBondContact O-NE 2.92Å; S250-R286 VanDerWaalsContact O-NE 3.1Å; S250-R286 PolarHBondContact O-NH2 3.2Å
251	Y	96.4	Very high	96.5	Very high	138 Å²	138	27.2 Å²	27.2	54%	0.541	14%	0.135	S	C	.	.	H	α-helix	trans	-85.8	-11.7	178.6	-69.8	-74.8	0	0	0	114.5	N247 C249 H253	N247-Y251 VanDerWaalsContact O-CD2 3.31Å; N247-Y251 WeakPolarHBondContact O-CD2 3.32Å; N247-Y251 PolarHBondContact O-N 3.44Å; C249-Y251 VanDerWaalsContact C-N 3.3Å; C249-Y251 PolarHBondContact O-N 2.89Å; Y251-H253 WeakPolarHBondContact CB-NE2 3.47Å
252	G	94.5	Very high	96.5	Very high	23 Å²	23	35.2 Å²	35.2	24%	0.237	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	24.4	174.7	0	0	0	0	0	114.6	A248 C249 L254	A248-G252 PolarHBondContact O-N 3.44Å; C249-G252 PolarHBondContact O-N 3.33Å; G252-L254 PolarHBondContact O-N 2.88Å; G252-L254 VanDerWaalsContact O-N 3.17Å
253	H	97.3	Very high	96.5	Very high	35 Å²	35	39.3 Å²	39.3	16%	0.162	18%	0.184	C	C	.	.			trans	-83.9	91.7	-176.5	-56.5	-39	0	0	0	110.5	A216 G217 A248 Y251 V256 T257	A216-H253 PolarHBondContact O-CD2 2.94Å; G217-H253 PolarHBondContact O-CD2 2.92Å; G217-H253 PolarHBondContact O-NE2 3.25Å; A248-H253 PolarHBondContact O-N 2.82Å; Y251-H253 WeakPolarHBondContact CB-NE2 3.47Å; H253-V256 HydrophobicContact CB-CB 4.07Å; H253-V256 HydrophobicContact CB-CG2 4.33Å; H253-T257 VanDerWaalsContact O-CB 3.3Å; H253-T257 WeakPolarHBondContact O-CB 3.25Å; H253-T257 PolarHBondContact O-N 3.11Å; H253-T257 PolarHBondContact O-OG1 3.41Å
254	L	93.6	Very high	96.3	Very high	46 Å²	46	41 Å²	41	24%	0.241	20%	0.204	C	C	.	.	H	α-helix	trans	-61.6	-52.1	-174.1	-179	63	0	0	0	112.9	G252 V256 T257 E258 E288 C292	G252-L254 PolarHBondContact O-N 2.88Å; G252-L254 VanDerWaalsContact O-N 3.17Å; L254-V256 VanDerWaalsContact C-N 3.32Å; L254-V256 PolarHBondContact O-N 3.01Å; L254-T257 WeakPolarHBondContact O-CA 3.47Å; L254-T257 VanDerWaalsContact O-CB 3.29Å; L254-T257 WeakPolarHBondContact O-CB 3.21Å; L254-T257 PolarHBondContact O-N 3.47Å; L254-T257 VanDerWaalsContact O-N 3.11Å; L254-E258 HydrophobicContact CD1-CG 4.44Å; L254-E258 PolarHBondContact O-N 2.78Å; L254-E288 HydrophobicContact CD2-CB 4.45Å; L254-C292 HydrophobicContact CD1-CB 3.56Å
255	E	95.3	Very high	96.2	Very high	128 Å²	128	41.4 Å²	41.4	60%	0.598	21%	0.207	S	C	*	.	H	α-helix	trans	-60.7	-40.8	-177.7	-65.9	-176.9	180	0	0	112.6	L259	E255-L259 WeakPolarHBondContact O-CB 3.32Å; E255-L259 PolarHBondContact O-N 3.15Å
256	V	98.1	Very high	96	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-42.5	176.2	171.3	0	0	0	0	110.5	A216 V224 A248 H253 L254 L259 L260	A216-V256 HydrophobicContact CB-CG1 3.9Å; V224-V256 HydrophobicContact CG1-CG1 4.46Å; V224-V256 HydrophobicContact CG2-CG1 4.16Å; V224-V256 HydrophobicContact CG2-CG2 4.4Å; A248-V256 HydrophobicContact CB-CB 4.33Å; A248-V256 HydrophobicContact CB-CG1 3.7Å; H253-V256 HydrophobicContact CB-CB 4.07Å; H253-V256 HydrophobicContact CB-CG2 4.33Å; L254-V256 VanDerWaalsContact C-N 3.32Å; L254-V256 PolarHBondContact O-N 3.01Å; V256-L259 PolarHBondContact O-N 2.88Å; V256-L260 HydrophobicContact CG1-CD1 4.04Å; V256-L260 HydrophobicContact CG1-CG 4.4Å; V256-L260 WeakPolarHBondContact O-CG 3.34Å; V256-L260 PolarHBondContact O-N 3.36Å
257	T	97.2	Very high	95.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.4	-51	175.3	-64.4	0	0	0	0	110.7	L245 H253 L254 L259 L260 I261 V289 L293	L245-T257 HydrophobicContact CD1-CG2 3.95Å; H253-T257 VanDerWaalsContact O-CB 3.3Å; H253-T257 WeakPolarHBondContact O-CB 3.25Å; H253-T257 PolarHBondContact O-N 3.11Å; H253-T257 PolarHBondContact O-OG1 3.41Å; L254-T257 WeakPolarHBondContact O-CA 3.47Å; L254-T257 VanDerWaalsContact O-CB 3.29Å; L254-T257 WeakPolarHBondContact O-CB 3.21Å; L254-T257 PolarHBondContact O-N 3.47Å; L254-T257 VanDerWaalsContact O-N 3.11Å; T257-L259 VanDerWaalsContact C-N 3.32Å; T257-L259 PolarHBondContact O-N 2.86Å; T257-L260 PolarHBondContact O-N 3.36Å; T257-I261 HydrophobicContact CG2-CD1 3.94Å; T257-I261 VanDerWaalsContact O-CG1 3.3Å; T257-I261 WeakPolarHBondContact O-CG1 3.32Å; T257-I261 PolarHBondContact O-N 3.41Å; T257-V289 HydrophobicContact CG2-CG1 4.38Å; T257-L293 HydrophobicContact CG2-CD2 4.34Å
258	E	95.5	Very high	95.7	Very high	77 Å²	77	46.9 Å²	46.9	36%	0.36	24%	0.237	S	C	.	.	H	α-helix	trans	-59.3	-42.6	176.5	-71.8	-177.9	167.6	0	0	112.1	L254 I261 K262	L254-E258 HydrophobicContact CD1-CG 4.44Å; L254-E258 PolarHBondContact O-N 2.78Å; E258-I261 PolarHBondContact O-N 3.31Å; E258-K262 VanDerWaalsContact O-CB 3.3Å; E258-K262 WeakPolarHBondContact O-CB 3.47Å; E258-K262 PolarHBondContact O-N 2.85Å
259	L	95.8	Very high	95.6	Very high	25 Å²	25	47.5 Å²	47.5	13%	0.131	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-46.1	178.6	-159.7	90.3	0	0	0	111.3	V224 K225 L228 E255 V256 T257 K262 Y263	V224-L259 HydrophobicContact CB-CD2 4.06Å; V224-L259 HydrophobicContact CG1-CD2 3.53Å; K225-L259 HydrophobicContact CB-CD2 4.47Å; K225-L259 HydrophobicContact CG-CD1 3.96Å; K225-L259 HydrophobicContact CG-CD2 3.65Å; K225-L259 HydrophobicContact CG-CG 4.48Å; L228-L259 HydrophobicContact CD1-CD2 3.58Å; L228-L259 HydrophobicContact CD1-CG 4.05Å; E255-L259 WeakPolarHBondContact O-CB 3.32Å; E255-L259 PolarHBondContact O-N 3.15Å; V256-L259 PolarHBondContact O-N 2.88Å; T257-L259 VanDerWaalsContact C-N 3.32Å; T257-L259 PolarHBondContact O-N 2.86Å; L259-K262 WeakPolarHBondContact O-CB 3.45Å; L259-K262 PolarHBondContact O-N 3.48Å; L259-Y263 HydrophobicContact CG-CD2 4.46Å; L259-Y263 HydrophobicContact CG-CE2 4.41Å; L259-Y263 VanDerWaalsContact O-CD2 3.29Å; L259-Y263 WeakPolarHBondContact O-CD2 3.39Å; L259-Y263 PolarHBondContact O-N 3.14Å; L259-Y263 VanDerWaalsContact O-N 3.13Å
260	L	98	Very high	95.5	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-43.5	178.8	-70.6	172.4	0	0	0	111.8	L212 A216 V224 V234 P244 L245 A248 V256 T257 K262 Y263 G264 A265	L212-L260 HydrophobicContact CD1-CD2 4.13Å; L212-L260 HydrophobicContact CD2-CD2 4.12Å; L212-L260 HydrophobicContact CG-CD2 4.28Å; A216-L260 HydrophobicContact CB-CD1 4.14Å; V224-L260 HydrophobicContact CG1-CD2 4.21Å; V234-L260 HydrophobicContact CG1-CD2 4.1Å; P244-L260 HydrophobicContact CB-CD1 4.15Å; P244-L260 HydrophobicContact CB-CD2 4.34Å; L245-L260 HydrophobicContact CB-CD1 4.38Å; L245-L260 HydrophobicContact CD1-CB 4.13Å; L245-L260 HydrophobicContact CD1-CD1 4.3Å; A248-L260 HydrophobicContact CB-CD1 4.07Å; V256-L260 HydrophobicContact CG1-CD1 4.04Å; V256-L260 HydrophobicContact CG1-CG 4.4Å; V256-L260 WeakPolarHBondContact O-CG 3.34Å; V256-L260 PolarHBondContact O-N 3.36Å; T257-L260 PolarHBondContact O-N 3.36Å; L260-K262 VanDerWaalsContact C-N 3.34Å; L260-K262 PolarHBondContact O-N 2.91Å; L260-Y263 CarbonylContact O-C 3.53Å; L260-Y263 PolarHBondContact O-N 2.82Å; L260-Y263 VanDerWaalsContact O-N 3.15Å; L260-G264 PolarHBondContact O-N 2.92Å; L260-A265 HydrophobicContact CB-CB 3.98Å; L260-A265 WeakPolarHBondContact O-CB 3.41Å; L260-A265 PolarHBondContact O-N 3.46Å
261	I	95.6	Very high	95.5	Very high	21 Å²	21	50.5 Å²	50.5	11%	0.108	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-42.6	176.6	-63.9	170.2	0	0	0	110.8	L245 T257 E258 Y263 G264 V267 L293 H296	L245-I261 HydrophobicContact CD1-CG1 4.15Å; L245-I261 HydrophobicContact CD2-CG1 4.35Å; T257-I261 HydrophobicContact CG2-CD1 3.94Å; T257-I261 VanDerWaalsContact O-CG1 3.3Å; T257-I261 WeakPolarHBondContact O-CG1 3.32Å; T257-I261 PolarHBondContact O-N 3.41Å; E258-I261 PolarHBondContact O-N 3.31Å; I261-Y263 PolarHBondContact O-N 2.96Å; I261-G264 PolarHBondContact O-N 2.8Å; I261-V267 HydrophobicContact CD1-CG1 3.78Å; I261-V267 HydrophobicContact CG1-CG1 3.84Å; I261-V267 HydrophobicContact CG2-CG1 4.38Å; I261-L293 HydrophobicContact CD1-CD2 4.16Å; I261-H296 HydrophobicContact CD1-CB 4.16Å; I261-H296 HydrophobicContact CG2-CB 4.02Å; I261-H296 VanDerWaalsContact CG2-CD2 3.43Å; I261-H296 WeakPolarHBondContact CG2-CD2 3.41Å
262	K	93.8	Very high	95.4	Very high	171 Å²	171	49.5 Å²	49.5	74%	0.743	26%	0.259	S	S	*	.	H	α-helix	trans	-57.9	-33.7	175.5	-179.1	-179.3	178.2	179.5	0	112.5	E258 L259 L260 G264	E258-K262 VanDerWaalsContact O-CB 3.3Å; E258-K262 WeakPolarHBondContact O-CB 3.47Å; E258-K262 PolarHBondContact O-N 2.85Å; L259-K262 WeakPolarHBondContact O-CB 3.45Å; L259-K262 PolarHBondContact O-N 3.48Å; L260-K262 VanDerWaalsContact C-N 3.34Å; L260-K262 PolarHBondContact O-N 2.91Å; K262-G264 VanDerWaalsContact C-N 3.27Å
263	Y	95.4	Very high	95.4	Very high	105 Å²	105	55.7 Å²	55.7	41%	0.412	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	14.8	175.2	-80.6	-100.5	0	0	0	113.6	L228 L259 L260 I261	L228-Y263 HydrophobicContact CB-CD1 3.92Å; L228-Y263 HydrophobicContact CB-CE1 3.82Å; L228-Y263 HydrophobicContact CB-CE2 4.42Å; L228-Y263 HydrophobicContact CB-CG 4.27Å; L228-Y263 HydrophobicContact CD1-CD1 4.32Å; L228-Y263 HydrophobicContact CD1-CD2 3.65Å; L228-Y263 HydrophobicContact CD1-CE2 3.98Å; L228-Y263 HydrophobicContact CD1-CG 3.8Å; L228-Y263 HydrophobicContact CD2-CD1 4.26Å; L228-Y263 HydrophobicContact CD2-CG 4.15Å; L228-Y263 HydrophobicContact CG-CD1 4.39Å; L228-Y263 HydrophobicContact CG-CG 4.3Å; L259-Y263 HydrophobicContact CG-CD2 4.46Å; L259-Y263 HydrophobicContact CG-CE2 4.41Å; L259-Y263 VanDerWaalsContact O-CD2 3.29Å; L259-Y263 WeakPolarHBondContact O-CD2 3.39Å; L259-Y263 PolarHBondContact O-N 3.14Å; L259-Y263 VanDerWaalsContact O-N 3.13Å; L260-Y263 CarbonylContact O-C 3.53Å; L260-Y263 PolarHBondContact O-N 2.82Å; L260-Y263 VanDerWaalsContact O-N 3.15Å; I261-Y263 PolarHBondContact O-N 2.96Å
264	G	93.5	Very high	95.3	Very high	45 Å²	45	58.3 Å²	58.3	46%	0.464	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	10.1	169.4	0	0	0	0	0	115.3	H235 L260 I261 K262 N266	H235-G264 PolarHBondContact CE1-O 3.3Å; L260-G264 PolarHBondContact O-N 2.92Å; I261-G264 PolarHBondContact O-N 2.8Å; K262-G264 VanDerWaalsContact C-N 3.27Å; G264-N266 PolarHBondContact O-N 3.18Å
265	A	96.4	Very high	95.4	Very high	8 Å²	8	57.9 Å²	57.9	7%	0.066	28%	0.284	C	S	.	.			trans	-57.6	129.9	177.1	0	0	0	0	0	111.3	V234 L245 L260 V267	V234-A265 HydrophobicContact CB-CB 4.22Å; V234-A265 HydrophobicContact CG2-CB 4.41Å; L245-A265 HydrophobicContact CB-CB 4.25Å; L245-A265 HydrophobicContact CD2-CB 3.95Å; L260-A265 HydrophobicContact CB-CB 3.98Å; L260-A265 WeakPolarHBondContact O-CB 3.41Å; L260-A265 PolarHBondContact O-N 3.46Å; A265-V267 PolarHBondContact O-N 3.24Å
266	N	94.4	Very high	95.5	Very high	79 Å²	79	51.9 Å²	51.9	42%	0.422	26%	0.256	S	S	.	.			trans	-74.2	111.6	179.3	177.9	10.7	0	0	0	110.1	G264 N268 A269	G264-N266 PolarHBondContact O-N 3.18Å; N266-N268 PolarHBondContact O-N 3.33Å; N266-N268 VanDerWaalsContact O-N 3.17Å; N266-N268 PolarHBondContact OD1-N 3.16Å; N266-A269 HydrophobicContact CB-CB 4.24Å; N266-A269 VanDerWaalsContact O-CB 3.29Å; N266-A269 WeakPolarHBondContact O-CB 3.41Å; N266-A269 PolarHBondContact O-N 3.04Å
267	V	94.1	Very high	95.4	Very high	11 Å²	11	51.9 Å²	51.9	7%	0.067	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-18.3	177.9	-62.5	0	0	0	0	113.9	L245 I261 A265 P277 L293 H296 A298	L245-V267 HydrophobicContact CD2-CG1 4.35Å; I261-V267 HydrophobicContact CD1-CG1 3.78Å; I261-V267 HydrophobicContact CG1-CG1 3.84Å; I261-V267 HydrophobicContact CG2-CG1 4.38Å; A265-V267 PolarHBondContact O-N 3.24Å; V267-P277 WeakPolarHBondContact O-CD 3.47Å; V267-L293 HydrophobicContact CB-CD2 4.19Å; V267-L293 HydrophobicContact CG1-CD2 4.01Å; V267-H296 HydrophobicContact CG1-CB 3.97Å; V267-A298 HydrophobicContact CB-CB 4.22Å; V267-A298 HydrophobicContact CG2-CB 4.23Å
268	N	93.9	Very high	95.2	Very high	53 Å²	53	51.9 Å²	51.9	28%	0.283	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	21.9	175.9	-63.4	-52.6	0	0	0	112.1	N266 G297 A298 D299	N266-N268 PolarHBondContact O-N 3.33Å; N266-N268 VanDerWaalsContact O-N 3.17Å; N266-N268 PolarHBondContact OD1-N 3.16Å; N268-G297 PolarHBondContact ND2-O 3.42Å; N268-A298 WeakPolarHBondContact OD1-CA 3.22Å; N268-D299 PolarHBondContact OD1-N 3.3Å
269	A	95.8	Very high	95.2	Very high	12 Å²	12	48.2 Å²	48.2	10%	0.099	24%	0.239	C	C	.	.			trans	-58.9	139.6	171.1	0	0	0	0	0	109.8	V243 H246 N266 S276 P277	V243-A269 HydrophobicContact CG1-CB 4.41Å; V243-A269 HydrophobicContact CG2-CB 3.78Å; H246-A269 PolarHBondContact CE1-O 2.81Å; H246-A269 PolarHBondContact NE2-O 3.33Å; N266-A269 HydrophobicContact CB-CB 4.24Å; N266-A269 VanDerWaalsContact O-CB 3.29Å; N266-A269 WeakPolarHBondContact O-CB 3.41Å; N266-A269 PolarHBondContact O-N 3.04Å; A269-S276 WeakPolarHBondContact O-CA 3.41Å; A269-P277 WeakPolarHBondContact O-CD 3.22Å
270	L	96.2	Very high	95.1	Very high	68 Å²	68	48.5 Å²	48.5	36%	0.356	24%	0.24	S	C	.	.			trans	-114.7	135.6	-179.8	-59	-179.4	0	0	0	110.2	F275 V302	L270-F275 WeakPolarHBondContact CA-O 3.32Å; L270-V302 HydrophobicContact CD2-CG1 4.07Å
271	D	95.1	Very high	94.9	Very high	14 Å²	14	48.5 Å²	48.5	8%	0.075	24%	0.24	C	C	.	.			trans	-82.8	-172.3	171	80.2	-5.4	0	0	0	112.1	G241 L242 W273 Q274 F275	G241-D271 WeakPolarHBondContact O-CA 3.43Å; L242-D271 HydrophobicContact CD2-CB 3.85Å; L242-D271 HydrophobicContact CG-CB 4.31Å; D271-W273 PolarHBondContact O-N 2.99Å; D271-W273 VanDerWaalsContact OD1-C 3.3Å; D271-W273 WeakPolarHBondContact OD1-CA 3.3Å; D271-W273 PolarHBondContact OD1-N 2.99Å; D271-Q274 PolarHBondContact O-N 3.48Å; D271-Q274 VanDerWaalsContact O-N 3.09Å; D271-Q274 PolarHBondContact OD1-N 3.25Å; D271-F275 PolarHBondContact N-O 2.84Å; D271-F275 WeakPolarHBondContact OD1-CB 3.46Å; D271-F275 PolarHBondContact OD1-N 3.18Å
272	L	94.8	Very high	94.7	Very high	118 Å²	118	47.5 Å²	47.5	62%	0.618	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.8	179.5	-67.5	177.2	0	0	0	114.3	K239 G240	K239-L272 WeakPolarHBondContact O-CD1 3.35Å; G240-L272 WeakPolarHBondContact O-CB 3.31Å; G240-L272 WeakPolarHBondContact O-CG 3.35Å; G240-L272 PolarHBondContact O-N 3.48Å; G240-L272 VanDerWaalsContact O-N 3.09Å
273	W	94.2	Very high	94.7	Very high	153 Å²	153	40.9 Å²	40.9	58%	0.58	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.2	12.3	175.2	-63.8	-83.4	0	0	0	112.7	D271 F275 S305	D271-W273 PolarHBondContact O-N 2.99Å; D271-W273 VanDerWaalsContact OD1-C 3.3Å; D271-W273 WeakPolarHBondContact OD1-CA 3.3Å; D271-W273 PolarHBondContact OD1-N 2.99Å; W273-F275 HydrophobicContact CB-CD2 4.41Å; W273-F275 PolarHBondContact O-N 3.4Å; W273-S305 VanDerWaalsContact C-OG 3.31Å; W273-S305 WeakPolarHBondContact O-CB 3.46Å; W273-S305 PolarHBondContact O-N 2.91Å; W273-S305 PolarHBondContact O-OG 3.44Å
274	Q	94.8	Very high	94.6	Very high	90 Å²	90	41.3 Å²	41.3	42%	0.421	21%	0.214	S	C	.	.			trans	57	27.7	-174.1	-58.2	178	75.6	0	0	112.7	D271 N304 S305	D271-Q274 PolarHBondContact O-N 3.48Å; D271-Q274 VanDerWaalsContact O-N 3.09Å; D271-Q274 PolarHBondContact OD1-N 3.25Å; Q274-N304 WeakPolarHBondContact O-CA 3.41Å; Q274-N304 WeakPolarHBondContact O-CB 3.4Å; Q274-S305 PolarHBondContact NE2-OG 3.43Å
275	F	96	Very high	94.4	Very high	37 Å²	37	40.5 Å²	40.5	16%	0.162	21%	0.205	C	C	.	.			trans	-74.4	134.4	166.5	-102.2	-116.1	0	0	0	109	H246 L270 D271 W273 H279 E280 N304 L313	H246-F275 PolarHBondContact NE2-O 3.38Å; H246-F275 VanDerWaalsContact NE2-O 3.08Å; L270-F275 WeakPolarHBondContact CA-O 3.32Å; D271-F275 PolarHBondContact N-O 2.84Å; D271-F275 WeakPolarHBondContact OD1-CB 3.46Å; D271-F275 PolarHBondContact OD1-N 3.18Å; W273-F275 HydrophobicContact CB-CD2 4.41Å; W273-F275 PolarHBondContact O-N 3.4Å; F275-H279 HydrophobicContact CB-CB 4.33Å; F275-H279 HydrophobicContact CD1-CB 3.26Å; F275-H279 HydrophobicContact CE1-CB 3.61Å; F275-H279 HydrophobicContact CG-CB 3.81Å; F275-H279 HydrophobicContact CZ-CB 4.41Å; F275-E280 HydrophobicContact CD1-CG 4.12Å; F275-N304 HydrophobicContact CD2-CB 4Å; F275-N304 HydrophobicContact CE2-CB 4.25Å; F275-N304 WeakPolarHBondContact CE2-ND2 3.43Å; F275-L313 HydrophobicContact CE1-CD1 3.66Å; F275-L313 HydrophobicContact CE2-CD1 3.93Å; F275-L313 HydrophobicContact CZ-CD1 3.23Å
276	S	96.1	Very high	94.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.007	22%	0.219	C	C	.	.			trans	-96	163.6	166.5	73.5	0	0	0	0	110.4	A269 L278 H279 E280	A269-S276 WeakPolarHBondContact O-CA 3.41Å; S276-L278 PolarHBondContact O-N 3.48Å; S276-L278 PolarHBondContact OG-N 3.26Å; S276-H279 PolarHBondContact N-ND1 3.49Å; S276-H279 VanDerWaalsContact N-ND1 3.13Å; S276-H279 WeakPolarHBondContact O-CB 3.31Å; S276-H279 PolarHBondContact O-N 3.3Å; S276-H279 PolarHBondContact OG-N 2.85Å; S276-H279 PolarHBondContact OG-ND1 3.34Å; S276-E280 PolarHBondContact O-N 2.84Å; S276-E280 VanDerWaalsContact O-N 3.13Å
277	P	97.2	Very high	93.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-51.2	-32.2	170.7	-28.7	34.1	0	0	0	113.3	L245 H246 C249 V267 A269 E280 A281 L293	L245-P277 HydrophobicContact CB-CG 4.43Å; L245-P277 HydrophobicContact CD2-CB 4.23Å; L245-P277 HydrophobicContact CD2-CG 3.85Å; L245-P277 HydrophobicContact CG-CB 4.08Å; L245-P277 HydrophobicContact CG-CG 3.96Å; H246-P277 WeakPolarHBondContact NE2-CD 3.25Å; C249-P277 HydrophobicContact CB-CB 4.22Å; C249-P277 WeakPolarHBondContact CB-O 3.35Å; V267-P277 WeakPolarHBondContact O-CD 3.47Å; A269-P277 WeakPolarHBondContact O-CD 3.22Å; P277-E280 PolarHBondContact O-N 3.3Å; P277-A281 WeakPolarHBondContact O-CB 3.47Å; P277-A281 PolarHBondContact O-N 3.47Å; P277-L293 HydrophobicContact CB-CD1 3.99Å; P277-L293 HydrophobicContact CB-CD2 4.11Å
278	L	93.2	Very high	93	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-71.2	-37.4	176.8	-174.9	62.2	0	0	0	112.5	S276 E280 A282 C290 L293 L294 A298 P300 A310	S276-L278 PolarHBondContact O-N 3.48Å; S276-L278 PolarHBondContact OG-N 3.26Å; L278-E280 VanDerWaalsContact C-N 3.34Å; L278-A282 WeakPolarHBondContact O-CB 3.3Å; L278-A282 PolarHBondContact O-N 3.49Å; L278-C290 HydrophobicContact CD1-CB 3.98Å; L278-L293 HydrophobicContact CB-CD1 4.12Å; L278-L293 HydrophobicContact CD1-CB 4.29Å; L278-L293 HydrophobicContact CD1-CD1 4.23Å; L278-L294 HydrophobicContact CD1-CG 4.33Å; L278-L294 HydrophobicContact CD2-CD2 3.85Å; L278-L294 HydrophobicContact CD2-CG 4.47Å; L278-A298 HydrophobicContact CB-CB 4.21Å; L278-A298 HydrophobicContact CD2-CB 4.02Å; L278-P300 HydrophobicContact CD2-CB 4.05Å; L278-A310 HydrophobicContact CD2-CB 4.16Å; L278-A310 HydrophobicContact CG-CB 3.85Å
279	H	94.7	Very high	92.8	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-43	172.3	-70	95.4	0	0	0	111.5	F275 S276 A282 S283 V302 K308 A310 L313	F275-H279 HydrophobicContact CB-CB 4.33Å; F275-H279 HydrophobicContact CD1-CB 3.26Å; F275-H279 HydrophobicContact CE1-CB 3.61Å; F275-H279 HydrophobicContact CG-CB 3.81Å; F275-H279 HydrophobicContact CZ-CB 4.41Å; S276-H279 PolarHBondContact N-ND1 3.49Å; S276-H279 VanDerWaalsContact N-ND1 3.13Å; S276-H279 WeakPolarHBondContact O-CB 3.31Å; S276-H279 PolarHBondContact O-N 3.3Å; S276-H279 PolarHBondContact OG-N 2.85Å; S276-H279 PolarHBondContact OG-ND1 3.34Å; H279-A282 PolarHBondContact O-N 3.49Å; H279-S283 VanDerWaalsContact O-CB 3.27Å; H279-S283 WeakPolarHBondContact O-CB 3.4Å; H279-S283 PolarHBondContact O-N 3.17Å; H279-S283 PolarHBondContact O-OG 3.41Å; H279-V302 PolarHBondContact CE1-O 3.29Å; H279-V302 PolarHBondContact NE2-O 2.92Å; H279-K308 PolarHBondContact NE2-O 2.96Å; H279-A310 PolarHBondContact CD2-N 2.9Å; H279-A310 VanDerWaalsContact CD2-N 3.3Å; H279-A310 PolarHBondContact NE2-N 3.06Å; H279-L313 HydrophobicContact CB-CD1 4.14Å
280	E	95.2	Very high	92.4	Very high	32 Å²	32	47.3 Å²	47.3	15%	0.15	23%	0.229	C	C	.	.	H	α-helix	trans	-59.3	-55.1	175.8	-85.1	-62.2	161.1	0	0	111	S250 F275 S276 P277 L278 A282 S283 K284	S250-E280 VanDerWaalsContact CB-OE2 3.25Å; S250-E280 WeakPolarHBondContact CB-OE2 3.07Å; S250-E280 PolarHBondContact OG-OE2 3.45Å; F275-E280 HydrophobicContact CD1-CG 4.12Å; S276-E280 PolarHBondContact O-N 2.84Å; S276-E280 VanDerWaalsContact O-N 3.13Å; P277-E280 PolarHBondContact O-N 3.3Å; L278-E280 VanDerWaalsContact C-N 3.34Å; E280-A282 VanDerWaalsContact C-N 3.34Å; E280-A282 PolarHBondContact O-N 2.89Å; E280-S283 PolarHBondContact O-N 3.37Å; E280-S283 PolarHBondContact O-OG 3.15Å; E280-K284 WeakPolarHBondContact O-CG 3.34Å; E280-K284 PolarHBondContact O-N 3.36Å
281	A	93.8	Very high	91.6	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-57.2	-45.1	178.8	0	0	0	0	0	112.2	C249 P277 K284 G285 R286 V289 C290 L293	C249-A281 HydrophobicContact CB-CB 4.32Å; P277-A281 WeakPolarHBondContact O-CB 3.47Å; P277-A281 PolarHBondContact O-N 3.47Å; A281-K284 PolarHBondContact O-N 2.96Å; A281-G285 PolarHBondContact O-N 3.25Å; A281-R286 HydrophobicContact CB-CB 4.11Å; A281-R286 PolarHBondContact O-N 3.25Å; A281-V289 HydrophobicContact CB-CB 4.32Å; A281-V289 HydrophobicContact CB-CG1 3.79Å; A281-C290 VanDerWaalsContact CB-SG 3.58Å; A281-L293 HydrophobicContact CB-CD1 4.22Å
282	A	91.2	Very high	91.1	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-45.2	-179	0	0	0	0	0	112.2	L278 H279 E280 K284 G285 A310 A314 S315 L319 L323	L278-A282 WeakPolarHBondContact O-CB 3.3Å; L278-A282 PolarHBondContact O-N 3.49Å; H279-A282 PolarHBondContact O-N 3.49Å; E280-A282 VanDerWaalsContact C-N 3.34Å; E280-A282 PolarHBondContact O-N 2.89Å; A282-K284 PolarHBondContact O-N 3.42Å; A282-G285 PolarHBondContact O-N 2.86Å; A282-G285 VanDerWaalsContact O-N 3.12Å; A282-A310 HydrophobicContact CB-CB 4.17Å; A282-A310 WeakPolarHBondContact CB-O 3.26Å; A282-A314 WeakPolarHBondContact O-CA 3.34Å; A282-S315 PolarHBondContact O-N 3.5Å; A282-L319 WeakPolarHBondContact O-CD2 3.44Å; A282-L323 HydrophobicContact CB-CD1 4.27Å
283	S	92.9	Very high	90.8	Very high	32 Å²	32	38.7 Å²	38.7	22%	0.224	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-26.4	179.3	78.8	0	0	0	0	113.3	H279 E280 L313	H279-S283 VanDerWaalsContact O-CB 3.27Å; H279-S283 WeakPolarHBondContact O-CB 3.4Å; H279-S283 PolarHBondContact O-N 3.17Å; H279-S283 PolarHBondContact O-OG 3.41Å; E280-S283 PolarHBondContact O-N 3.37Å; E280-S283 PolarHBondContact O-OG 3.15Å; S283-L313 WeakPolarHBondContact CA-O 3.43Å
284	K	93.9	Very high	90.2	Very high	115 Å²	115	31.4 Å²	31.4	50%	0.5	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	1.9	178.4	-57.3	-56.7	-179.6	-173.7	0	113.9	E280 A281 A282 R286	E280-K284 WeakPolarHBondContact O-CG 3.34Å; E280-K284 PolarHBondContact O-N 3.36Å; A281-K284 PolarHBondContact O-N 2.96Å; A282-K284 PolarHBondContact O-N 3.42Å; K284-R286 HydrophobicContact CB-CG 4.02Å
285	G	88.7	Confident	89.4	Confident	27 Å²	27	28 Å²	28	28%	0.278	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	26.8	177.1	0	0	0	0	0	115.1	A281 A282 V287 S315	A281-G285 PolarHBondContact O-N 3.25Å; A282-G285 PolarHBondContact O-N 2.86Å; A282-G285 VanDerWaalsContact O-N 3.12Å; G285-V287 PolarHBondContact O-N 3.15Å; G285-V287 VanDerWaalsContact O-N 3.11Å; G285-S315 VanDerWaalsContact CA-OG 3.24Å; G285-S315 WeakPolarHBondContact CA-OG 3.26Å; G285-S315 PolarHBondContact N-OG 2.62Å
286	R	89.7	Confident	88.7	Confident	95 Å²	95	30.7 Å²	30.7	36%	0.358	16%	0.158	S	C	.	.			trans	-85.9	74	-175.1	-49.6	-53.3	-172.4	-179	0.6	111.6	C249 S250 A281 K284 E288 V289 C290	C249-R286 WeakPolarHBondContact O-CG 3.27Å; S250-R286 PolarHBondContact O-NE 2.92Å; S250-R286 VanDerWaalsContact O-NE 3.1Å; S250-R286 PolarHBondContact O-NH2 3.2Å; A281-R286 HydrophobicContact CB-CB 4.11Å; A281-R286 PolarHBondContact O-N 3.25Å; K284-R286 HydrophobicContact CB-CG 4.02Å; R286-E288 PolarHBondContact O-N 3.21Å; R286-V289 HydrophobicContact CB-CB 3.97Å; R286-V289 HydrophobicContact CB-CG2 4.32Å; R286-V289 PolarHBondContact O-N 3.37Å; R286-C290 PolarHBondContact O-N 2.9Å; R286-C290 PolarHBondContact O-SG 3.14Å; R286-C290 VanDerWaalsContact O-SG 3.36Å
287	V	83.1	Confident	87.9	Confident	73 Å²	73	32 Å²	32	44%	0.442	17%	0.172	S	C	.	.	H	α-helix	trans	-53.6	-50.2	-171.4	-174.3	0	0	0	0	113.3	G285 V289 C290 S291 L319 L322	G285-V287 PolarHBondContact O-N 3.15Å; G285-V287 VanDerWaalsContact O-N 3.11Å; V287-V289 VanDerWaalsContact C-N 3.33Å; V287-V289 PolarHBondContact O-N 3.17Å; V287-C290 WeakPolarHBondContact O-CB 3.38Å; V287-C290 PolarHBondContact O-N 3.3Å; V287-S291 PolarHBondContact O-N 3.43Å; V287-L319 HydrophobicContact CG2-CD1 4.27Å; V287-L322 HydrophobicContact CG1-CD2 3.73Å
288	E	83.4	Confident	87.4	Confident	136 Å²	136	32 Å²	32	64%	0.636	17%	0.172	S	C	*	.	H	α-helix	trans	-63.8	-39.6	-177.9	-66.1	163.9	176.9	0	0	111.8	L254 R286 S291 C292	L254-E288 HydrophobicContact CD2-CB 4.45Å; R286-E288 PolarHBondContact O-N 3.21Å; E288-S291 PolarHBondContact O-N 2.72Å; E288-C292 WeakPolarHBondContact O-CB 3.46Å; E288-C292 PolarHBondContact O-N 3.43Å
289	V	89.8	Confident	86.8	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	18%	0.183	C	C	.	.	H	α-helix	trans	-68	-40.1	175.3	172.9	0	0	0	0	111.2	C249 T257 A281 R286 V287 C292 L293	C249-V289 HydrophobicContact CB-CG1 3.88Å; T257-V289 HydrophobicContact CG2-CG1 4.38Å; A281-V289 HydrophobicContact CB-CB 4.32Å; A281-V289 HydrophobicContact CB-CG1 3.79Å; R286-V289 HydrophobicContact CB-CB 3.97Å; R286-V289 HydrophobicContact CB-CG2 4.32Å; R286-V289 PolarHBondContact O-N 3.37Å; V287-V289 VanDerWaalsContact C-N 3.33Å; V287-V289 PolarHBondContact O-N 3.17Å; V289-C292 PolarHBondContact O-N 2.99Å; V289-L293 HydrophobicContact CG1-CD1 4.06Å; V289-L293 HydrophobicContact CG1-CG 4.31Å; V289-L293 WeakPolarHBondContact O-CB 3.25Å; V289-L293 WeakPolarHBondContact O-CG 3.47Å; V289-L293 PolarHBondContact O-N 3.22Å
290	C	86.2	Confident	86.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-57.1	-51.2	173.2	-69.1	0	0	0	0	110.8	L278 A281 R286 V287 C292 L293 L294	L278-C290 HydrophobicContact CD1-CB 3.98Å; A281-C290 VanDerWaalsContact CB-SG 3.58Å; R286-C290 PolarHBondContact O-N 2.9Å; R286-C290 PolarHBondContact O-SG 3.14Å; R286-C290 VanDerWaalsContact O-SG 3.36Å; V287-C290 WeakPolarHBondContact O-CB 3.38Å; V287-C290 PolarHBondContact O-N 3.3Å; C290-C292 VanDerWaalsContact C-N 3.34Å; C290-C292 PolarHBondContact O-N 3.11Å; C290-L293 PolarHBondContact O-N 3.41Å; C290-L294 VanDerWaalsContact O-CD1 3.22Å; C290-L294 WeakPolarHBondContact O-CD1 3.47Å; C290-L294 WeakPolarHBondContact O-CG 3.28Å; C290-L294 PolarHBondContact O-N 3.14Å
291	S	80.8	Confident	85.6	Confident	20 Å²	20	36.5 Å²	36.5	14%	0.14	20%	0.2	C	C	.	.	H	α-helix	trans	-56.6	-46.7	175.9	169.2	0	0	0	0	111.4	V287 E288 L293 L294 A295 E343	V287-S291 PolarHBondContact O-N 3.43Å; E288-S291 PolarHBondContact O-N 2.72Å; S291-L293 PolarHBondContact O-N 3.19Å; S291-L294 PolarHBondContact O-N 3.44Å; S291-A295 VanDerWaalsContact O-CB 3.28Å; S291-A295 WeakPolarHBondContact O-CB 3.26Å; S291-A295 PolarHBondContact O-N 3.34Å; S291-E343 WeakPolarHBondContact CB-OE1 3.36Å; S291-E343 PolarHBondContact OG-OE1 3.11Å
292	C	83.4	Confident	85.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.3	-47.1	175.4	178.5	0	0	0	0	112.4	L254 E288 V289 C290 A295 H296 Y376	L254-C292 HydrophobicContact CD1-CB 3.56Å; E288-C292 WeakPolarHBondContact O-CB 3.46Å; E288-C292 PolarHBondContact O-N 3.43Å; V289-C292 PolarHBondContact O-N 2.99Å; C290-C292 VanDerWaalsContact C-N 3.34Å; C290-C292 PolarHBondContact O-N 3.11Å; C292-A295 WeakPolarHBondContact O-CB 3.46Å; C292-A295 PolarHBondContact O-N 3.11Å; C292-H296 PolarHBondContact O-N 2.82Å; C292-H296 PolarHBondContact O-ND1 3.04Å; C292-Y376 PolarHBondContact N-OH 2.87Å
293	L	88.5	Confident	85.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.9	-43.5	-179.9	-73.9	172.5	0	0	0	112.2	L245 C249 T257 I261 V267 P277 L278 A281 V289 C290 S291 A295 H296 G297 A298	L245-L293 HydrophobicContact CD2-CD2 4.38Å; C249-L293 HydrophobicContact CB-CD1 4.43Å; T257-L293 HydrophobicContact CG2-CD2 4.34Å; I261-L293 HydrophobicContact CD1-CD2 4.16Å; V267-L293 HydrophobicContact CB-CD2 4.19Å; V267-L293 HydrophobicContact CG1-CD2 4.01Å; P277-L293 HydrophobicContact CB-CD1 3.99Å; P277-L293 HydrophobicContact CB-CD2 4.11Å; L278-L293 HydrophobicContact CB-CD1 4.12Å; L278-L293 HydrophobicContact CD1-CB 4.29Å; L278-L293 HydrophobicContact CD1-CD1 4.23Å; A281-L293 HydrophobicContact CB-CD1 4.22Å; V289-L293 HydrophobicContact CG1-CD1 4.06Å; V289-L293 HydrophobicContact CG1-CG 4.31Å; V289-L293 WeakPolarHBondContact O-CB 3.25Å; V289-L293 WeakPolarHBondContact O-CG 3.47Å; V289-L293 PolarHBondContact O-N 3.22Å; C290-L293 PolarHBondContact O-N 3.41Å; S291-L293 PolarHBondContact O-N 3.19Å; L293-A295 VanDerWaalsContact C-N 3.33Å; L293-A295 PolarHBondContact O-N 2.86Å; L293-H296 CarbonylContact O-C 3.55Å; L293-H296 WeakPolarHBondContact O-CA 3.31Å; L293-H296 PolarHBondContact O-N 3.3Å; L293-H296 VanDerWaalsContact O-N 3.1Å; L293-G297 PolarHBondContact O-N 3.38Å; L293-A298 HydrophobicContact CB-CB 3.76Å; L293-A298 VanDerWaalsContact O-CB 3.24Å; L293-A298 WeakPolarHBondContact O-CB 3.19Å; L293-A298 PolarHBondContact O-N 3.01Å
294	L	82.4	Confident	85.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.2	-40.4	177.4	-64.5	155.7	0	0	0	111.3	L278 C290 S291 H296 G297 P300 I340	L278-L294 HydrophobicContact CD1-CG 4.33Å; L278-L294 HydrophobicContact CD2-CD2 3.85Å; L278-L294 HydrophobicContact CD2-CG 4.47Å; C290-L294 VanDerWaalsContact O-CD1 3.22Å; C290-L294 WeakPolarHBondContact O-CD1 3.47Å; C290-L294 WeakPolarHBondContact O-CG 3.28Å; C290-L294 PolarHBondContact O-N 3.14Å; S291-L294 PolarHBondContact O-N 3.44Å; L294-H296 PolarHBondContact O-N 2.96Å; L294-H296 VanDerWaalsContact O-N 3.15Å; L294-G297 PolarHBondContact O-N 2.91Å; L294-P300 HydrophobicContact CD2-CB 4.26Å; L294-P300 HydrophobicContact CD2-CG 4.24Å; L294-I340 HydrophobicContact CD1-CB 3.78Å; L294-I340 HydrophobicContact CD1-CD1 4.29Å; L294-I340 HydrophobicContact CD1-CG1 3.58Å; L294-I340 HydrophobicContact CD1-CG2 3.22Å; L294-I340 HydrophobicContact CD2-CG2 3.81Å; L294-I340 HydrophobicContact CG-CG2 4.15Å
295	A	76.6	Confident	85.1	Confident	17 Å²	17	40.1 Å²	40.1	14%	0.14	23%	0.225	C	C	.	.	H	α-helix	trans	-57.7	-28.1	174.3	0	0	0	0	0	113	S291 C292 L293 H347 Y376	S291-A295 VanDerWaalsContact O-CB 3.28Å; S291-A295 WeakPolarHBondContact O-CB 3.26Å; S291-A295 PolarHBondContact O-N 3.34Å; C292-A295 WeakPolarHBondContact O-CB 3.46Å; C292-A295 PolarHBondContact O-N 3.11Å; L293-A295 VanDerWaalsContact C-N 3.33Å; L293-A295 PolarHBondContact O-N 2.86Å; A295-H347 VanDerWaalsContact CA-CD2 3.47Å; A295-H347 WeakPolarHBondContact CA-CD2 3.37Å; A295-H347 WeakPolarHBondContact CB-CE1 3.29Å; A295-H347 WeakPolarHBondContact CB-NE2 3.28Å; A295-Y376 HydrophobicContact CB-CE2 4.03Å
296	H	81.5	Confident	85.2	Confident	95 Å²	95	45 Å²	45	44%	0.44	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	11.8	176.6	-65.7	90.7	0	0	0	113.5	I261 V267 C292 L293 L294	I261-H296 HydrophobicContact CD1-CB 4.16Å; I261-H296 HydrophobicContact CG2-CB 4.02Å; I261-H296 VanDerWaalsContact CG2-CD2 3.43Å; I261-H296 WeakPolarHBondContact CG2-CD2 3.41Å; V267-H296 HydrophobicContact CG1-CB 3.97Å; C292-H296 PolarHBondContact O-N 2.82Å; C292-H296 PolarHBondContact O-ND1 3.04Å; L293-H296 CarbonylContact O-C 3.55Å; L293-H296 WeakPolarHBondContact O-CA 3.31Å; L293-H296 PolarHBondContact O-N 3.3Å; L293-H296 VanDerWaalsContact O-N 3.1Å; L294-H296 PolarHBondContact O-N 2.96Å; L294-H296 VanDerWaalsContact O-N 3.15Å
297	G	80.4	Confident	85.2	Confident	29 Å²	29	42.4 Å²	42.4	30%	0.299	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	24.7	172	0	0	0	0	0	115.5	N268 L293 L294 D299	N268-G297 PolarHBondContact ND2-O 3.42Å; L293-G297 PolarHBondContact O-N 3.38Å; L294-G297 PolarHBondContact O-N 2.91Å; G297-D299 PolarHBondContact O-N 3.31Å
298	A	85.9	Confident	85.6	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.247	C	C	.	.			trans	-63.7	130	167.8	0	0	0	0	0	110.1	V267 N268 L278 L293 P300 Y344	V267-A298 HydrophobicContact CB-CB 4.22Å; V267-A298 HydrophobicContact CG2-CB 4.23Å; N268-A298 WeakPolarHBondContact OD1-CA 3.22Å; L278-A298 HydrophobicContact CB-CB 4.21Å; L278-A298 HydrophobicContact CD2-CB 4.02Å; L293-A298 HydrophobicContact CB-CB 3.76Å; L293-A298 VanDerWaalsContact O-CB 3.24Å; L293-A298 WeakPolarHBondContact O-CB 3.19Å; L293-A298 PolarHBondContact O-N 3.01Å; A298-P300 WeakPolarHBondContact O-CD 3.44Å; A298-Y344 VanDerWaalsContact O-CD2 3.26Å; A298-Y344 WeakPolarHBondContact O-CD2 3.24Å; A298-Y344 WeakPolarHBondContact O-CE2 3.48Å
299	D	81.6	Confident	85.8	Confident	43 Å²	43	38 Å²	38	23%	0.23	22%	0.222	C	C	.	.			trans	-88.7	113	-177.3	-175.7	-12.6	0	0	0	109.9	N268 G297 T301 V302	N268-D299 PolarHBondContact OD1-N 3.3Å; G297-D299 PolarHBondContact O-N 3.31Å; D299-T301 PolarHBondContact O-N 3.33Å; D299-T301 WeakPolarHBondContact OD1-CB 3.41Å; D299-T301 PolarHBondContact OD1-N 2.92Å; D299-T301 PolarHBondContact OD1-OG1 3.01Å; D299-T301 PolarHBondContact OD2-OG1 3.16Å; D299-V302 HydrophobicContact CB-CG2 3.81Å
300	P	82.5	Confident	85.7	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-9.6	-179.4	31.3	-35.3	0	0	0	113.5	L278 L294 A298 I311 L341	L278-P300 HydrophobicContact CD2-CB 4.05Å; L294-P300 HydrophobicContact CD2-CB 4.26Å; L294-P300 HydrophobicContact CD2-CG 4.24Å; A298-P300 WeakPolarHBondContact O-CD 3.44Å; P300-I311 HydrophobicContact CB-CG1 4.48Å; P300-L341 HydrophobicContact CG-CD2 4.26Å
301	T	81.7	Confident	85.4	Confident	82 Å²	82	38.9 Å²	38.9	50%	0.503	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-7	-176.6	71.1	0	0	0	0	113.8	D299 E303	D299-T301 PolarHBondContact O-N 3.33Å; D299-T301 WeakPolarHBondContact OD1-CB 3.41Å; D299-T301 PolarHBondContact OD1-N 2.92Å; D299-T301 PolarHBondContact OD1-OG1 3.01Å; D299-T301 PolarHBondContact OD2-OG1 3.16Å; T301-E303 PolarHBondContact O-N 3.33Å
302	V	87.2	Confident	85.7	Confident	36 Å²	36	41.6 Å²	41.6	22%	0.218	24%	0.239	C	C	.	.			trans	-61.8	129	175.9	177.6	0	0	0	0	109.1	L270 H279 D299 T309	L270-V302 HydrophobicContact CD2-CG1 4.07Å; H279-V302 PolarHBondContact CE1-O 3.29Å; H279-V302 PolarHBondContact NE2-O 2.92Å; D299-V302 HydrophobicContact CB-CG2 3.81Å; V302-T309 WeakPolarHBondContact O-CA 3.33Å
303	E	88.4	Confident	85.9	Confident	119 Å²	119	43.2 Å²	43.2	56%	0.556	25%	0.248	S	C	*	.	B	Isolated β-bridge	trans	-93.9	138.9	175.7	-65.9	178.7	-177.5	0	0	110.5	T301 T309	T301-E303 PolarHBondContact O-N 3.33Å; E303-T309 HydrophobicContact CG-CG2 3.93Å
304	N	92.9	Very high	85.7	Confident	7 Å²	7	43.2 Å²	43.2	4%	0.037	25%	0.248	C	C	.	.			trans	-79.9	-178.7	170.5	71.4	12	0	0	0	112.3	Q274 F275 N306 G307 K308	Q274-N304 WeakPolarHBondContact O-CA 3.41Å; Q274-N304 WeakPolarHBondContact O-CB 3.4Å; F275-N304 HydrophobicContact CD2-CB 4Å; F275-N304 HydrophobicContact CE2-CB 4.25Å; F275-N304 WeakPolarHBondContact CE2-ND2 3.43Å; N304-N306 PolarHBondContact O-N 2.8Å; N304-N306 WeakPolarHBondContact OD1-CA 3.29Å; N304-N306 WeakPolarHBondContact OD1-CB 3.23Å; N304-N306 PolarHBondContact OD1-N 3.08Å; N304-G307 PolarHBondContact O-N 3.41Å; N304-G307 PolarHBondContact OD1-N 3.39Å; N304-K308 VanDerWaalsContact CG-O 3.23Å; N304-K308 PolarHBondContact N-O 3.3Å; N304-K308 PolarHBondContact OD1-N 2.87Å; N304-K308 PolarHBondContact OD1-O 2.69Å
305	S	92.4	Very high	85.8	Confident	61 Å²	61	46.6 Å²	46.6	43%	0.427	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-12.4	179.7	-68	0	0	0	0	114.9	W273 Q274	W273-S305 VanDerWaalsContact C-OG 3.31Å; W273-S305 WeakPolarHBondContact O-CB 3.46Å; W273-S305 PolarHBondContact O-N 2.91Å; W273-S305 PolarHBondContact O-OG 3.44Å; Q274-S305 PolarHBondContact NE2-OG 3.43Å
306	N	91.8	Very high	85.9	Confident	129 Å²	129	47.7 Å²	47.7	69%	0.69	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	8.5	174.7	-62.7	-31.1	0	0	0	112.8	N304 K308	N304-N306 PolarHBondContact O-N 2.8Å; N304-N306 WeakPolarHBondContact OD1-CA 3.29Å; N304-N306 WeakPolarHBondContact OD1-CB 3.23Å; N304-N306 PolarHBondContact OD1-N 3.08Å; N306-K308 VanDerWaalsContact C-N 3.26Å; N306-K308 HydrophobicContact CB-CG 4.48Å; N306-K308 PolarHBondContact O-N 3.1Å
307	G	89.3	Confident	85.4	Confident	41 Å²	41	47.4 Å²	47.4	42%	0.423	28%	0.283	S	S	.	.	S	Bend	trans	68	24.2	-176.5	0	0	0	0	0	113.3	N304	N304-G307 PolarHBondContact O-N 3.41Å; N304-G307 PolarHBondContact OD1-N 3.39Å
308	K	91.2	Very high	84.7	Confident	98 Å²	98	51.1 Å²	51.1	43%	0.426	29%	0.292	S	S	.	.			trans	-107.3	133.4	178.9	-67	-170.9	178.2	-175.4	0	109.9	H279 N304 N306 D312 L313	H279-K308 PolarHBondContact NE2-O 2.96Å; N304-K308 VanDerWaalsContact CG-O 3.23Å; N304-K308 PolarHBondContact N-O 3.3Å; N304-K308 PolarHBondContact OD1-N 2.87Å; N304-K308 PolarHBondContact OD1-O 2.69Å; N306-K308 VanDerWaalsContact C-N 3.26Å; N306-K308 HydrophobicContact CB-CG 4.48Å; N306-K308 PolarHBondContact O-N 3.1Å; K308-D312 HydrophobicContact CB-CB 4Å; K308-D312 HydrophobicContact CG-CB 4.31Å; K308-L313 HydrophobicContact CB-CD2 4.09Å; K308-L313 HydrophobicContact CB-CG 4.25Å; K308-L313 HydrophobicContact CD-CD2 3.65Å
309	T	87.8	Confident	83.9	Confident	20 Å²	20	51.2 Å²	51.2	12%	0.123	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-81.6	170.3	171.4	64.6	0	0	0	0	111.4	V302 E303 I311 D312 L313	V302-T309 WeakPolarHBondContact O-CA 3.33Å; E303-T309 HydrophobicContact CG-CG2 3.93Å; T309-I311 PolarHBondContact O-N 3.36Å; T309-I311 WeakPolarHBondContact OG1-CB 3.46Å; T309-I311 PolarHBondContact OG1-N 3.05Å; T309-D312 PolarHBondContact N-OD2 2.93Å; T309-D312 PolarHBondContact O-N 3.2Å; T309-D312 VanDerWaalsContact O-N 3.11Å; T309-D312 VanDerWaalsContact OG1-CG 3.32Å; T309-D312 PolarHBondContact OG1-N 3.23Å; T309-D312 PolarHBondContact OG1-OD2 3.18Å; T309-L313 PolarHBondContact O-N 2.92Å
310	A	86.9	Confident	83.2	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-58.5	-30.8	171.9	0	0	0	0	0	112	L278 H279 A282 L313 A314	L278-A310 HydrophobicContact CD2-CB 4.16Å; L278-A310 HydrophobicContact CG-CB 3.85Å; H279-A310 PolarHBondContact CD2-N 2.9Å; H279-A310 VanDerWaalsContact CD2-N 3.3Å; H279-A310 PolarHBondContact NE2-N 3.06Å; A282-A310 HydrophobicContact CB-CB 4.17Å; A282-A310 WeakPolarHBondContact CB-O 3.26Å; A310-L313 PolarHBondContact O-N 3.45Å; A310-A314 PolarHBondContact O-N 3.14Å
311	I	81.1	Confident	82.1	Confident	19 Å²	19	60.2 Å²	60.2	10%	0.097	33%	0.329	C	S	.	.	H	α-helix	trans	-61.7	-47.5	174.7	-49.4	-172.3	0	0	0	110.7	P300 T309 L313 A314 L323 Q324 L341	P300-I311 HydrophobicContact CB-CG1 4.48Å; T309-I311 PolarHBondContact O-N 3.36Å; T309-I311 WeakPolarHBondContact OG1-CB 3.46Å; T309-I311 PolarHBondContact OG1-N 3.05Å; I311-L313 PolarHBondContact O-N 2.74Å; I311-A314 PolarHBondContact O-N 2.86Å; I311-L323 HydrophobicContact CB-CB 4.07Å; I311-L323 WeakPolarHBondContact CD1-O 3.49Å; I311-L323 HydrophobicContact CG1-CB 3.93Å; I311-L323 HydrophobicContact CG1-CD2 4.13Å; I311-L323 HydrophobicContact CG2-CB 3.77Å; I311-Q324 HydrophobicContact CG2-CB 3.87Å; I311-Q324 HydrophobicContact CG2-CG 4.19Å; I311-L341 HydrophobicContact CD1-CD1 3.96Å; I311-L341 HydrophobicContact CD1-CG 4.47Å
312	D	85.2	Confident	81	Confident	76 Å²	76	57.4 Å²	57.4	41%	0.406	31%	0.311	S	S	.	.	H	α-helix	trans	-67.2	-26.9	-177.7	-59.9	-51.4	0	0	0	113	K308 T309	K308-D312 HydrophobicContact CB-CB 4Å; K308-D312 HydrophobicContact CG-CB 4.31Å; T309-D312 PolarHBondContact N-OD2 2.93Å; T309-D312 PolarHBondContact O-N 3.2Å; T309-D312 VanDerWaalsContact O-N 3.11Å; T309-D312 VanDerWaalsContact OG1-CG 3.32Å; T309-D312 PolarHBondContact OG1-N 3.23Å; T309-D312 PolarHBondContact OG1-OD2 3.18Å
313	L	88.5	Confident	79.4	Confident	34 Å²	34	55.7 Å²	55.7	18%	0.178	30%	0.3	C	S	.	.	H	α-helix	trans	-87.6	-9.3	-178.3	-66.5	-175	0	0	0	114.4	F275 H279 S283 K308 T309 A310 I311 S315	F275-L313 HydrophobicContact CE1-CD1 3.66Å; F275-L313 HydrophobicContact CE2-CD1 3.93Å; F275-L313 HydrophobicContact CZ-CD1 3.23Å; H279-L313 HydrophobicContact CB-CD1 4.14Å; S283-L313 WeakPolarHBondContact CA-O 3.43Å; K308-L313 HydrophobicContact CB-CD2 4.09Å; K308-L313 HydrophobicContact CB-CG 4.25Å; K308-L313 HydrophobicContact CD-CD2 3.65Å; T309-L313 PolarHBondContact O-N 2.92Å; A310-L313 PolarHBondContact O-N 3.45Å; I311-L313 PolarHBondContact O-N 2.74Å; L313-S315 PolarHBondContact O-N 3.4Å
314	A	85.4	Confident	77.8	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.3	C	S	.	.			trans	-57.3	132.4	-175	0	0	0	0	0	113.2	A282 A310 I311 S316 L319 R320 L323	A282-A314 WeakPolarHBondContact O-CA 3.34Å; A310-A314 PolarHBondContact O-N 3.14Å; I311-A314 PolarHBondContact O-N 2.86Å; A314-S316 VanDerWaalsContact C-N 3.32Å; A314-S316 PolarHBondContact O-N 3.1Å; A314-L319 HydrophobicContact CB-CB 4.01Å; A314-L319 HydrophobicContact CB-CD2 3.91Å; A314-L319 HydrophobicContact CB-CG 3.7Å; A314-R320 HydrophobicContact CB-CB 4.46Å; A314-R320 HydrophobicContact CB-CG 3.56Å; A314-R320 PolarHBondContact O-NE 2.98Å; A314-R320 PolarHBondContact O-NH2 2.88Å; A314-L323 HydrophobicContact CB-CD1 3.33Å
315	S	84.3	Confident	75.4	Confident	72 Å²	72	56.5 Å²	56.5	50%	0.503	31%	0.306	S	S	.	.	S	Bend	trans	-70.3	-25.5	-170.7	61.1	0	0	0	0	114	A282 G285 L313	A282-S315 PolarHBondContact O-N 3.5Å; G285-S315 VanDerWaalsContact CA-OG 3.24Å; G285-S315 WeakPolarHBondContact CA-OG 3.26Å; G285-S315 PolarHBondContact N-OG 2.62Å; L313-S315 PolarHBondContact O-N 3.4Å
316	S	76.9	Confident	72.8	Confident	40 Å²	40	57.9 Å²	57.9	28%	0.28	31%	0.312	S	S	.	.	S	Bend	trans	-124.1	153.6	-179.4	72.8	0	0	0	0	112	A314 E318 L319 R320	A314-S316 VanDerWaalsContact C-N 3.32Å; A314-S316 PolarHBondContact O-N 3.1Å; S316-E318 VanDerWaalsContact CB-OE2 3.32Å; S316-E318 WeakPolarHBondContact CB-OE2 3.38Å; S316-E318 PolarHBondContact O-N 3.11Å; S316-L319 PolarHBondContact O-N 3.24Å; S316-L319 VanDerWaalsContact OG-CB 3.23Å; S316-L319 WeakPolarHBondContact OG-CB 3.21Å; S316-L319 PolarHBondContact OG-N 2.97Å; S316-R320 PolarHBondContact O-N 3.06Å
317	V	71.1	Confident	70	Confident	89 Å²	89	56.7 Å²	56.7	54%	0.539	31%	0.31	S	S	.	.	H	α-helix	trans	-62.9	-37.1	175	178.1	0	0	0	0	109.6	L319 R320 Q321	V317-L319 VanDerWaalsContact C-N 3.33Å; V317-L319 PolarHBondContact O-N 3.39Å; V317-R320 PolarHBondContact O-N 2.87Å; V317-Q321 HydrophobicContact CG1-CG 4.23Å; V317-Q321 WeakPolarHBondContact O-CB 3.39Å; V317-Q321 VanDerWaalsContact O-CG 3.25Å; V317-Q321 WeakPolarHBondContact O-CG 3.49Å; V317-Q321 PolarHBondContact O-N 3Å
318	E	65.9	Low	67.3	Low	106 Å²	106	59.8 Å²	59.8	50%	0.495	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-43.3	175.6	-62.6	74.4	-165.3	0	0	111.1	S316 Q321 L322	S316-E318 VanDerWaalsContact CB-OE2 3.32Å; S316-E318 WeakPolarHBondContact CB-OE2 3.38Å; S316-E318 PolarHBondContact O-N 3.11Å; E318-Q321 PolarHBondContact O-N 3.48Å; E318-L322 VanDerWaalsContact O-CB 3.3Å; E318-L322 WeakPolarHBondContact O-CB 3.41Å; E318-L322 PolarHBondContact O-N 2.85Å
319	L	69.1	Low	64.5	Low	2 Å²	2	59.7 Å²	59.7	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-72	-37.1	178.2	-176.2	58	0	0	0	111.4	A282 V287 A314 S316 V317 L322 L323 I340	A282-L319 WeakPolarHBondContact O-CD2 3.44Å; V287-L319 HydrophobicContact CG2-CD1 4.27Å; A314-L319 HydrophobicContact CB-CB 4.01Å; A314-L319 HydrophobicContact CB-CD2 3.91Å; A314-L319 HydrophobicContact CB-CG 3.7Å; S316-L319 PolarHBondContact O-N 3.24Å; S316-L319 VanDerWaalsContact OG-CB 3.23Å; S316-L319 WeakPolarHBondContact OG-CB 3.21Å; S316-L319 PolarHBondContact OG-N 2.97Å; V317-L319 VanDerWaalsContact C-N 3.33Å; V317-L319 PolarHBondContact O-N 3.39Å; L319-L322 HydrophobicContact CD1-CB 4.42Å; L319-L322 HydrophobicContact CD1-CD2 4.05Å; L319-L322 WeakPolarHBondContact O-CB 3.22Å; L319-L322 PolarHBondContact O-N 3.2Å; L319-L323 HydrophobicContact CD1-CD1 4.09Å; L319-L323 HydrophobicContact CD1-CG 4.42Å; L319-L323 HydrophobicContact CG-CD1 3.75Å; L319-L323 VanDerWaalsContact O-CB 3.26Å; L319-L323 WeakPolarHBondContact O-CB 3.44Å; L319-L323 VanDerWaalsContact O-CD1 3.29Å; L319-L323 WeakPolarHBondContact O-CD1 3.42Å; L319-L323 VanDerWaalsContact O-CG 3.23Å; L319-L323 WeakPolarHBondContact O-CG 3.27Å; L319-L323 PolarHBondContact O-N 3.33Å; L319-I340 HydrophobicContact CD1-CD1 4.06Å
320	R	67.3	Low	62.2	Low	116 Å²	116	65.3 Å²	65.3	44%	0.438	37%	0.369	S	S	.	.	H	α-helix	trans	-61.6	-44.8	170.8	-74.1	-175.8	-157.1	177.1	5.7	111.9	A314 S316 V317 L322 L323 Q324	A314-R320 HydrophobicContact CB-CB 4.46Å; A314-R320 HydrophobicContact CB-CG 3.56Å; A314-R320 PolarHBondContact O-NE 2.98Å; A314-R320 PolarHBondContact O-NH2 2.88Å; S316-R320 PolarHBondContact O-N 3.06Å; V317-R320 PolarHBondContact O-N 2.87Å; R320-L322 VanDerWaalsContact C-N 3.3Å; R320-L322 PolarHBondContact O-N 3.11Å; R320-L323 CarbonylContact O-C 3.55Å; R320-L323 WeakPolarHBondContact O-CA 3.23Å; R320-L323 WeakPolarHBondContact O-CB 3.24Å; R320-L323 PolarHBondContact O-N 3.17Å; R320-L323 VanDerWaalsContact O-N 3.11Å; R320-Q324 WeakPolarHBondContact O-CB 3.32Å; R320-Q324 PolarHBondContact O-N 2.9Å
321	Q	60.2	Low	59.6	Low	117 Å²	117	74.5 Å²	74.5	55%	0.547	41%	0.409	S	S	.	.	H	α-helix	trans	-64.7	-37.1	175.9	-74.9	174.7	-8	0	0	111.7	V317 E318 L323 S325 H339	V317-Q321 HydrophobicContact CG1-CG 4.23Å; V317-Q321 WeakPolarHBondContact O-CB 3.39Å; V317-Q321 VanDerWaalsContact O-CG 3.25Å; V317-Q321 WeakPolarHBondContact O-CG 3.49Å; V317-Q321 PolarHBondContact O-N 3Å; E318-Q321 PolarHBondContact O-N 3.48Å; Q321-L323 VanDerWaalsContact C-N 3.33Å; Q321-S325 VanDerWaalsContact O-CB 3.28Å; Q321-S325 WeakPolarHBondContact O-CB 3.31Å; Q321-S325 PolarHBondContact O-N 3.47Å; Q321-H339 PolarHBondContact O-ND1 3.26Å
322	L	57.2	Low	57.3	Low	23 Å²	23	79.6 Å²	79.6	12%	0.12	44%	0.436	C	S	.	.	H	α-helix	trans	-60.1	-46.3	170.3	-155.3	73.7	0	0	0	109.7	V287 E318 L319 R320 R337 I338 H339 I340	V287-L322 HydrophobicContact CG1-CD2 3.73Å; E318-L322 VanDerWaalsContact O-CB 3.3Å; E318-L322 WeakPolarHBondContact O-CB 3.41Å; E318-L322 PolarHBondContact O-N 2.85Å; L319-L322 HydrophobicContact CD1-CB 4.42Å; L319-L322 HydrophobicContact CD1-CD2 4.05Å; L319-L322 WeakPolarHBondContact O-CB 3.22Å; L319-L322 PolarHBondContact O-N 3.2Å; R320-L322 VanDerWaalsContact C-N 3.3Å; R320-L322 PolarHBondContact O-N 3.11Å; L322-R337 HydrophobicContact CD1-CB 4.03Å; L322-I338 WeakPolarHBondContact CD1-O 3.27Å; L322-H339 CarbonylContact O-C 3.54Å; L322-H339 WeakPolarHBondContact O-CA 3.43Å; L322-I340 HydrophobicContact CB-CD1 4Å; L322-I340 HydrophobicContact CD2-CD1 3.61Å; L322-I340 HydrophobicContact CD2-CG1 4.12Å; L322-I340 HydrophobicContact CG-CD1 3.74Å; L322-I340 HydrophobicContact CG-CG1 3.98Å; L322-I340 WeakPolarHBondContact O-CB 3.48Å; L322-I340 PolarHBondContact O-N 3.36Å
323	L	54	Low	55.1	Low	0 Å²	0	80.7 Å²	80.7	0%	0	46%	0.456	C	S	.	.	H	α-helix	trans	-70	-34.2	-179	-78.6	157.1	0	0	0	115.2	A282 I311 A314 L319 R320 Q321 I340 L341	A282-L323 HydrophobicContact CB-CD1 4.27Å; I311-L323 HydrophobicContact CB-CB 4.07Å; I311-L323 WeakPolarHBondContact CD1-O 3.49Å; I311-L323 HydrophobicContact CG1-CB 3.93Å; I311-L323 HydrophobicContact CG1-CD2 4.13Å; I311-L323 HydrophobicContact CG2-CB 3.77Å; A314-L323 HydrophobicContact CB-CD1 3.33Å; L319-L323 HydrophobicContact CD1-CD1 4.09Å; L319-L323 HydrophobicContact CD1-CG 4.42Å; L319-L323 HydrophobicContact CG-CD1 3.75Å; L319-L323 VanDerWaalsContact O-CB 3.26Å; L319-L323 WeakPolarHBondContact O-CB 3.44Å; L319-L323 VanDerWaalsContact O-CD1 3.29Å; L319-L323 WeakPolarHBondContact O-CD1 3.42Å; L319-L323 VanDerWaalsContact O-CG 3.23Å; L319-L323 WeakPolarHBondContact O-CG 3.27Å; L319-L323 PolarHBondContact O-N 3.33Å; R320-L323 CarbonylContact O-C 3.55Å; R320-L323 WeakPolarHBondContact O-CA 3.23Å; R320-L323 WeakPolarHBondContact O-CB 3.24Å; R320-L323 PolarHBondContact O-N 3.17Å; R320-L323 VanDerWaalsContact O-N 3.11Å; Q321-L323 VanDerWaalsContact C-N 3.33Å; L323-I340 HydrophobicContact CB-CD1 4.47Å; L323-I340 HydrophobicContact CD2-CB 4.19Å; L323-I340 HydrophobicContact CD2-CD1 3.68Å; L323-I340 HydrophobicContact CD2-CG1 4.49Å; L323-I340 HydrophobicContact CD2-CG2 3.45Å; L323-I340 VanDerWaalsContact CD2-CG2 3.45Å; L323-I340 HydrophobicContact CG-CD1 3.58Å; L323-I340 HydrophobicContact CG-CG2 4.26Å; L323-L341 WeakPolarHBondContact O-CD1 3.48Å
324	Q	55.3	Low	52.8	Low	120 Å²	120	88.3 Å²	88.3	56%	0.561	49%	0.488	S	S	*	.	H	α-helix	trans	-106.3	-20.8	-162.6	-163.3	161.5	25.2	0	0	114.7	I311 R320 T326	I311-Q324 HydrophobicContact CG2-CB 3.87Å; I311-Q324 HydrophobicContact CG2-CG 4.19Å; R320-Q324 WeakPolarHBondContact O-CB 3.32Å; R320-Q324 PolarHBondContact O-N 2.9Å; Q324-T326 PolarHBondContact O-N 3.21Å
325	S	42.3	Very low	50.5	Low	22 Å²	22	95.4 Å²	95.4	15%	0.154	52%	0.519	C	S	.	.			trans	-82.3	111.8	-171.7	167.1	0	0	0	0	112.4	Q321 T327 H339	Q321-S325 VanDerWaalsContact O-CB 3.28Å; Q321-S325 WeakPolarHBondContact O-CB 3.31Å; Q321-S325 PolarHBondContact O-N 3.47Å; S325-T327 VanDerWaalsContact C-N 3.32Å; S325-T327 PolarHBondContact OG-N 3.29Å; S325-T327 PolarHBondContact OG-OG1 3.37Å; S325-H339 VanDerWaalsContact CB-ND1 3.34Å; S325-H339 WeakPolarHBondContact CB-ND1 3.27Å; S325-H339 VanDerWaalsContact O-CB 3.23Å; S325-H339 WeakPolarHBondContact O-CB 3.49Å; S325-H339 PolarHBondContact OG-CE1 2.89Å; S325-H339 PolarHBondContact OG-ND1 3.36Å
326	T	37.3	Very low	48.4	Very low	90 Å²	90	95.7 Å²	95.7	55%	0.552	53%	0.534	S	S	*	.			trans	-89	5.9	161.4	46	0	0	0	0	112.6	Q324 C328 L341	Q324-T326 PolarHBondContact O-N 3.21Å; T326-C328 PolarHBondContact O-N 3.35Å; T326-L341 HydrophobicContact CG2-CD1 4.45Å
327	T	32.9	Very low	46.8	Very low	104 Å²	104	101.5 Å²	101.5	64%	0.638	55%	0.549	S	S	*	.			trans	-97.8	92.8	-172	37.9	0	0	0	0	112.5	S325 S329	S325-T327 VanDerWaalsContact C-N 3.32Å; S325-T327 PolarHBondContact OG-N 3.29Å; S325-T327 PolarHBondContact OG-OG1 3.37Å; T327-S329 PolarHBondContact O-N 3.3Å
328	C	34.1	Very low	45.6	Very low	106 Å²	106	101.6 Å²	101.6	72%	0.716	55%	0.546	S	S	*	.			trans	-62	112.3	159.6	-173.6	0	0	0	0	110	T326	T326-C328 PolarHBondContact O-N 3.35Å
329	S	32.6	Very low	45.1	Very low	96 Å²	96	99 Å²	99	67%	0.671	53%	0.534	S	S	*	.			trans	-169.5	85.8	162.2	167.1	0	0	0	0	112.7	T327 F331	T327-S329 PolarHBondContact O-N 3.3Å; S329-F331 VanDerWaalsContact C-N 3.31Å; S329-F331 PolarHBondContact O-N 2.8Å
330	V	38.8	Very low	44.4	Very low	138 Å²	138	99 Å²	99	84%	0.836	53%	0.533	S	S	*	.	S	Bend	trans	57.9	-17.3	141.8	-165.3	0	0	0	0	121.1
331	F	33.1	Very low	44	Very low	195 Å²	195	94.9 Å²	94.9	86%	0.855	52%	0.52	S	S	*	.	S	Bend	trans	-94.4	-7.4	-169.9	-140.2	-97.7	0	0	0	117.2	S329	S329-F331 VanDerWaalsContact C-N 3.31Å; S329-F331 PolarHBondContact O-N 2.8Å
332	L	32.3	Very low	44.2	Very low	125 Å²	125	90.2 Å²	90.2	65%	0.654	50%	0.499	S	S	*	.			trans	-118.4	20	-176.3	-71.1	176.3	0	0	0	115.7	F334 F335	L332-F334 PolarHBondContact O-N 3.34Å; L332-F335 CarbonylContact O-C 3.52Å; L332-F335 PolarHBondContact O-N 2.92Å
333	A	39.3	Very low	44.7	Very low	99 Å²	99	89.6 Å²	89.6	82%	0.818	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-11.8	173.9	0	0	0	0	0	114.2
334	F	40.5	Very low	45.5	Very low	194 Å²	194	91.1 Å²	91.1	85%	0.851	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-18.1	178.1	-144.1	-93.9	0	0	0	113.9	L332	L332-F334 PolarHBondContact O-N 3.34Å
335	F	36.9	Very low	46.8	Very low	149 Å²	149	88.2 Å²	88.2	65%	0.654	49%	0.488	S	S	*	.	S	Bend	trans	-134.8	85.2	172.8	-73.8	-82.7	0	0	0	107.9	L332 R337	L332-F335 CarbonylContact O-C 3.52Å; L332-F335 PolarHBondContact O-N 2.92Å; F335-R337 VanDerWaalsContact C-N 3.32Å; F335-R337 PolarHBondContact O-N 2.95Å
336	G	39	Very low	48.8	Very low	79 Å²	79	87.2 Å²	87.2	81%	0.814	48%	0.48	S	S	*	.			trans	-54.9	81.9	-172.7	0	0	0	0	0	115.3
337	R	43.1	Very low	50.9	Low	162 Å²	162	83.3 Å²	83.3	61%	0.611	46%	0.456	S	S	*	.			trans	-109.2	108.2	172.9	-68	-175.8	-175.6	-165.8	1.9	107.9	L322 F335	L322-R337 HydrophobicContact CD1-CB 4.03Å; F335-R337 VanDerWaalsContact C-N 3.32Å; F335-R337 PolarHBondContact O-N 2.95Å
338	I	45.8	Very low	53.4	Low	91 Å²	91	78.5 Å²	78.5	47%	0.467	43%	0.427	S	S	.	.			trans	-84.5	139	179.5	-70.6	167	0	0	0	109.6	L322 E343	L322-I338 WeakPolarHBondContact CD1-O 3.27Å; I338-E343 HydrophobicContact CG2-CB 4.39Å
339	H	55.6	Low	56.1	Low	51 Å²	51	73.5 Å²	73.5	24%	0.236	39%	0.393	C	S	.	.			trans	-79.6	133.7	-177.2	-57.3	-74.2	0	0	0	112	Q321 L322 S325 D342 E343	Q321-H339 PolarHBondContact O-ND1 3.26Å; L322-H339 CarbonylContact O-C 3.54Å; L322-H339 WeakPolarHBondContact O-CA 3.43Å; S325-H339 VanDerWaalsContact CB-ND1 3.34Å; S325-H339 WeakPolarHBondContact CB-ND1 3.27Å; S325-H339 VanDerWaalsContact O-CB 3.23Å; S325-H339 WeakPolarHBondContact O-CB 3.49Å; S325-H339 PolarHBondContact OG-CE1 2.89Å; S325-H339 PolarHBondContact OG-ND1 3.36Å; H339-D342 PolarHBondContact O-N 3.38Å; H339-E343 WeakPolarHBondContact O-CB 3.35Å; H339-E343 PolarHBondContact O-N 2.86Å
340	I	54.8	Low	58.8	Low	1 Å²	1	69.2 Å²	69.2	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-67.6	-36.5	-168	-81.9	161.4	0	0	0	114.1	L294 L319 L322 L323 E343 Y344	L294-I340 HydrophobicContact CD1-CB 3.78Å; L294-I340 HydrophobicContact CD1-CD1 4.29Å; L294-I340 HydrophobicContact CD1-CG1 3.58Å; L294-I340 HydrophobicContact CD1-CG2 3.22Å; L294-I340 HydrophobicContact CD2-CG2 3.81Å; L294-I340 HydrophobicContact CG-CG2 4.15Å; L319-I340 HydrophobicContact CD1-CD1 4.06Å; L322-I340 HydrophobicContact CB-CD1 4Å; L322-I340 HydrophobicContact CD2-CD1 3.61Å; L322-I340 HydrophobicContact CD2-CG1 4.12Å; L322-I340 HydrophobicContact CG-CD1 3.74Å; L322-I340 HydrophobicContact CG-CG1 3.98Å; L322-I340 WeakPolarHBondContact O-CB 3.48Å; L322-I340 PolarHBondContact O-N 3.36Å; L323-I340 HydrophobicContact CB-CD1 4.47Å; L323-I340 HydrophobicContact CD2-CB 4.19Å; L323-I340 HydrophobicContact CD2-CD1 3.68Å; L323-I340 HydrophobicContact CD2-CG1 4.49Å; L323-I340 HydrophobicContact CD2-CG2 3.45Å; L323-I340 VanDerWaalsContact CD2-CG2 3.45Å; L323-I340 HydrophobicContact CG-CD1 3.58Å; L323-I340 HydrophobicContact CG-CG2 4.26Å; I340-E343 WeakPolarHBondContact O-CB 3.35Å; I340-E343 PolarHBondContact O-N 3.39Å; I340-Y344 PolarHBondContact O-N 3.4Å
341	L	59.3	Low	61.2	Low	31 Å²	31	64.7 Å²	64.7	16%	0.162	34%	0.335	C	S	.	.	H	α-helix	trans	-65	-48.2	175.2	-98.9	158.2	0	0	0	110.5	P300 I311 L323 T326 E343 Y344 E345	P300-L341 HydrophobicContact CG-CD2 4.26Å; I311-L341 HydrophobicContact CD1-CD1 3.96Å; I311-L341 HydrophobicContact CD1-CG 4.47Å; L323-L341 WeakPolarHBondContact O-CD1 3.48Å; T326-L341 HydrophobicContact CG2-CD1 4.45Å; L341-E343 PolarHBondContact O-N 3.42Å; L341-Y344 PolarHBondContact O-N 3.49Å; L341-E345 WeakPolarHBondContact O-CG 3.24Å; L341-E345 PolarHBondContact O-N 3.07Å
342	D	64	Low	63.9	Low	18 Å²	18	55.4 Å²	55.4	10%	0.096	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-32.8	173.4	-69.1	-29.2	0	0	0	111.5	H339 G346 S368	H339-D342 PolarHBondContact O-N 3.38Å; D342-G346 WeakPolarHBondContact O-CA 3.42Å; D342-G346 PolarHBondContact O-N 3.26Å; D342-S368 WeakPolarHBondContact OD1-CB 3.3Å; D342-S368 PolarHBondContact OD1-OG 3.3Å
343	E	67.3	Low	66.7	Low	10 Å²	10	49.5 Å²	49.5	5%	0.047	26%	0.263	C	S	.	.	H	α-helix	trans	-65.7	-47.7	173.8	-171.3	173.4	-172.2	0	0	111.6	S291 I338 H339 I340 L341 G346 H347 F372	S291-E343 WeakPolarHBondContact CB-OE1 3.36Å; S291-E343 PolarHBondContact OG-OE1 3.11Å; I338-E343 HydrophobicContact CG2-CB 4.39Å; H339-E343 WeakPolarHBondContact O-CB 3.35Å; H339-E343 PolarHBondContact O-N 2.86Å; I340-E343 WeakPolarHBondContact O-CB 3.35Å; I340-E343 PolarHBondContact O-N 3.39Å; L341-E343 PolarHBondContact O-N 3.42Å; E343-G346 PolarHBondContact O-N 3.3Å; E343-H347 WeakPolarHBondContact O-CB 3.39Å; E343-H347 PolarHBondContact O-CD2 3.33Å; E343-H347 PolarHBondContact O-N 3.27Å; E343-F372 HydrophobicContact CB-CE2 4.15Å; E343-F372 HydrophobicContact CG-CE2 4.05Å; E343-F372 HydrophobicContact CG-CZ 4Å
344	Y	71.3	Confident	69.1	Low	33 Å²	33	50.9 Å²	50.9	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-48	175.3	170.2	-106	0	0	0	112.3	A298 I340 L341 G346 H347 C348 Y364	A298-Y344 VanDerWaalsContact O-CD2 3.26Å; A298-Y344 WeakPolarHBondContact O-CD2 3.24Å; A298-Y344 WeakPolarHBondContact O-CE2 3.48Å; I340-Y344 PolarHBondContact O-N 3.4Å; L341-Y344 PolarHBondContact O-N 3.49Å; Y344-G346 VanDerWaalsContact C-N 3.32Å; Y344-H347 PolarHBondContact O-N 2.83Å; Y344-C348 WeakPolarHBondContact O-CB 3.49Å; Y344-C348 PolarHBondContact O-N 3.27Å; Y344-C348 PolarHBondContact O-SG 2.64Å; Y344-Y364 HydrophobicContact CE1-CE1 4.41Å
345	E	82	Confident	71.3	Confident	59 Å²	59	49.1 Å²	49.1	28%	0.276	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-40	177.8	-66.9	-166.6	157.8	0	0	111.2	L341 C348 L349 Y364 T369	L341-E345 WeakPolarHBondContact O-CG 3.24Å; L341-E345 PolarHBondContact O-N 3.07Å; E345-C348 CarbonylContact O-C 3.46Å; E345-C348 WeakPolarHBondContact O-CB 3.33Å; E345-C348 PolarHBondContact O-N 3.23Å; E345-L349 WeakPolarHBondContact O-CB 3.32Å; E345-L349 PolarHBondContact O-N 2.84Å; E345-Y364 HydrophobicContact CB-CD1 3.88Å; E345-Y364 HydrophobicContact CB-CE1 4.48Å; E345-Y364 HydrophobicContact CG-CD1 3.86Å; E345-Y364 HydrophobicContact CG-CE1 4.06Å; E345-T369 HydrophobicContact CB-CG2 3.63Å
346	G	84.8	Confident	73.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58	-50.9	172.4	0	0	0	0	0	112.2	D342 E343 Y344 C348 L349 L350 F372	D342-G346 WeakPolarHBondContact O-CA 3.42Å; D342-G346 PolarHBondContact O-N 3.26Å; E343-G346 PolarHBondContact O-N 3.3Å; Y344-G346 VanDerWaalsContact C-N 3.32Å; G346-C348 VanDerWaalsContact C-N 3.3Å; G346-C348 PolarHBondContact O-N 2.72Å; G346-L349 WeakPolarHBondContact O-CB 3.47Å; G346-L349 PolarHBondContact O-N 3.25Å; G346-L349 VanDerWaalsContact O-N 3.14Å; G346-L350 WeakPolarHBondContact O-CG 3.38Å; G346-L350 PolarHBondContact O-N 3.2Å; G346-F372 VanDerWaalsContact C-CE1 3.44Å; G346-F372 VanDerWaalsContact CA-CG 3.46Å
347	H	81.9	Confident	76	Confident	9 Å²	9	42.7 Å²	42.7	4%	0.042	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-35.5	174.7	-81.9	-75.7	0	0	0	112.7	A295 E343 Y344 L350 T351 F372	A295-H347 VanDerWaalsContact CA-CD2 3.47Å; A295-H347 WeakPolarHBondContact CA-CD2 3.37Å; A295-H347 WeakPolarHBondContact CB-CE1 3.29Å; A295-H347 WeakPolarHBondContact CB-NE2 3.28Å; E343-H347 WeakPolarHBondContact O-CB 3.39Å; E343-H347 PolarHBondContact O-CD2 3.33Å; E343-H347 PolarHBondContact O-N 3.27Å; Y344-H347 PolarHBondContact O-N 2.83Å; H347-L350 PolarHBondContact O-N 3.48Å; H347-T351 VanDerWaalsContact O-CB 3.31Å; H347-T351 WeakPolarHBondContact O-CB 3.3Å; H347-T351 PolarHBondContact O-N 3.15Å; H347-T351 PolarHBondContact O-OG1 3.41Å; H347-F372 AromaticContact CD2-CE1 3.89Å; H347-F372 AromaticContact CD2-CZ 3.53Å; H347-F372 AromaticContact NE2-CZ 3.61Å
348	C	85.3	Confident	78.2	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.02	19%	0.192	C	C	.	.	H	α-helix	trans	-63.7	-40.7	172.2	-78.9	0	0	0	0	112.1	Y344 E345 G346 A352 Y364	Y344-C348 WeakPolarHBondContact O-CB 3.49Å; Y344-C348 PolarHBondContact O-N 3.27Å; Y344-C348 PolarHBondContact O-SG 2.64Å; E345-C348 CarbonylContact O-C 3.46Å; E345-C348 WeakPolarHBondContact O-CB 3.33Å; E345-C348 PolarHBondContact O-N 3.23Å; G346-C348 VanDerWaalsContact C-N 3.3Å; G346-C348 PolarHBondContact O-N 2.72Å; C348-A352 VanDerWaalsContact O-CB 3.3Å; C348-A352 WeakPolarHBondContact O-CB 3.49Å; C348-A352 PolarHBondContact O-N 3.49Å; C348-Y364 HydrophobicContact CB-CD1 3.88Å; C348-Y364 HydrophobicContact CB-CD2 3.64Å; C348-Y364 HydrophobicContact CB-CE1 3.95Å; C348-Y364 HydrophobicContact CB-CE2 3.75Å; C348-Y364 HydrophobicContact CB-CG 3.71Å
349	L	90.9	Very high	80.2	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-64.1	-46.9	173.4	178.5	65	0	0	0	111.3	E345 G346 T351 A352 C353 F361 L365 A381	E345-L349 WeakPolarHBondContact O-CB 3.32Å; E345-L349 PolarHBondContact O-N 2.84Å; G346-L349 WeakPolarHBondContact O-CB 3.47Å; G346-L349 PolarHBondContact O-N 3.25Å; G346-L349 VanDerWaalsContact O-N 3.14Å; L349-T351 PolarHBondContact O-N 3.35Å; L349-A352 WeakPolarHBondContact O-CB 3.21Å; L349-A352 PolarHBondContact O-N 3.31Å; L349-C353 PolarHBondContact O-N 3.1Å; L349-C353 PolarHBondContact O-SG 3.17Å; L349-F361 HydrophobicContact CD1-CD2 3.59Å; L349-F361 HydrophobicContact CD1-CE2 3.89Å; L349-F361 HydrophobicContact CD1-CG 4.43Å; L349-L365 HydrophobicContact CD1-CB 4.08Å; L349-L365 HydrophobicContact CD2-CD1 4.25Å; L349-A381 HydrophobicContact CD2-CB 4.34Å; L349-A381 HydrophobicContact CG-CB 4.37Å
350	L	89.9	Confident	81.8	Confident	6 Å²	6	38.1 Å²	38.1	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-60.5	-45.1	176.8	-65.2	-171.5	0	0	0	111.6	G346 H347 A352 C353 Q354 F372 N374 A381 I384	G346-L350 WeakPolarHBondContact O-CG 3.38Å; G346-L350 PolarHBondContact O-N 3.2Å; H347-L350 PolarHBondContact O-N 3.48Å; L350-A352 VanDerWaalsContact C-N 3.33Å; L350-A352 PolarHBondContact O-N 3.04Å; L350-C353 WeakPolarHBondContact O-CB 3.33Å; L350-C353 PolarHBondContact O-N 3.12Å; L350-Q354 WeakPolarHBondContact O-CB 3.31Å; L350-Q354 PolarHBondContact O-N 3.35Å; L350-F372 HydrophobicContact CD1-CD1 3.83Å; L350-F372 HydrophobicContact CD1-CE1 3.67Å; L350-F372 HydrophobicContact CD2-CD1 4.45Å; L350-F372 HydrophobicContact CG-CD1 3.94Å; L350-F372 HydrophobicContact CG-CE1 4.17Å; L350-N374 HydrophobicContact CD1-CB 3.69Å; L350-A381 HydrophobicContact CD2-CB 4.05Å; L350-I384 HydrophobicContact CB-CD1 3.63Å; L350-I384 HydrophobicContact CD1-CD1 4.31Å; L350-I384 HydrophobicContact CD2-CD1 3.73Å; L350-I384 HydrophobicContact CG-CD1 4.06Å
351	T	87.4	Confident	83.5	Confident	42 Å²	42	38.1 Å²	38.1	26%	0.258	20%	0.202	S	C	.	.	H	α-helix	trans	-64.1	-39.4	177	-58	0	0	0	0	111.3	H347 L349 Q354 K355	H347-T351 VanDerWaalsContact O-CB 3.31Å; H347-T351 WeakPolarHBondContact O-CB 3.3Å; H347-T351 PolarHBondContact O-N 3.15Å; H347-T351 PolarHBondContact O-OG1 3.41Å; L349-T351 PolarHBondContact O-N 3.35Å; T351-Q354 PolarHBondContact O-N 3.38Å; T351-K355 HydrophobicContact CG2-CD 4.06Å; T351-K355 HydrophobicContact CG2-CG 4.41Å; T351-K355 WeakPolarHBondContact O-CB 3.28Å; T351-K355 WeakPolarHBondContact O-CG 3.48Å; T351-K355 PolarHBondContact O-N 3.31Å
352	A	90.2	Very high	85	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-43.6	175.1	0	0	0	0	0	111.2	C348 L349 L350 K355 G356 D357 K360 F361	C348-A352 VanDerWaalsContact O-CB 3.3Å; C348-A352 WeakPolarHBondContact O-CB 3.49Å; C348-A352 PolarHBondContact O-N 3.49Å; L349-A352 WeakPolarHBondContact O-CB 3.21Å; L349-A352 PolarHBondContact O-N 3.31Å; L350-A352 VanDerWaalsContact C-N 3.33Å; L350-A352 PolarHBondContact O-N 3.04Å; A352-K355 PolarHBondContact O-N 2.78Å; A352-G356 CarbonylContact O-C 3.52Å; A352-G356 WeakPolarHBondContact O-CA 3.45Å; A352-G356 PolarHBondContact O-N 2.7Å; A352-D357 HydrophobicContact CB-CB 4.49Å; A352-D357 PolarHBondContact O-N 3.13Å; A352-K360 HydrophobicContact CB-CB 3.84Å; A352-K360 HydrophobicContact CB-CD 4.47Å; A352-K360 HydrophobicContact CB-CG 4.02Å; A352-F361 HydrophobicContact CB-CB 4.09Å
353	C	91.6	Very high	86.2	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.8	-46.2	173.1	-64.9	0	0	0	0	111.3	L349 L350 K355 G356 I384 L385 R390	L349-C353 PolarHBondContact O-N 3.1Å; L349-C353 PolarHBondContact O-SG 3.17Å; L350-C353 WeakPolarHBondContact O-CB 3.33Å; L350-C353 PolarHBondContact O-N 3.12Å; C353-K355 VanDerWaalsContact C-N 3.33Å; C353-K355 PolarHBondContact O-N 3.22Å; C353-G356 PolarHBondContact O-N 3.43Å; C353-I384 HydrophobicContact CB-CB 4.42Å; C353-I384 HydrophobicContact CB-CG2 4.05Å; C353-L385 HydrophobicContact CB-CD2 3.8Å; C353-L385 HydrophobicContact CB-CG 3.92Å; C353-R390 PolarHBondContact O-NH2 3.28Å
354	Q	88.7	Confident	87.3	Confident	129 Å²	129	51.3 Å²	51.3	60%	0.603	25%	0.251	S	S	*	.	H	α-helix	trans	-64.1	-36.7	-179.7	-167.3	179.4	12.3	0	0	112.3	L350 T351 I384 R390	L350-Q354 WeakPolarHBondContact O-CB 3.31Å; L350-Q354 PolarHBondContact O-N 3.35Å; T351-Q354 PolarHBondContact O-N 3.38Å; Q354-I384 HydrophobicContact CB-CG2 3.84Å; Q354-I384 HydrophobicContact CG-CG2 4.36Å; Q354-R390 PolarHBondContact O-NH1 2.84Å; Q354-R390 PolarHBondContact O-NH2 3.02Å
355	K	87.1	Confident	88.2	Confident	156 Å²	156	51.7 Å²	51.7	68%	0.678	26%	0.255	S	S	*	.	H	α-helix	trans	-88.9	-14	178.4	-67.4	-174.9	-179.7	-178.7	0	114.3	T351 A352 C353 D357 R390	T351-K355 HydrophobicContact CG2-CD 4.06Å; T351-K355 HydrophobicContact CG2-CG 4.41Å; T351-K355 WeakPolarHBondContact O-CB 3.28Å; T351-K355 WeakPolarHBondContact O-CG 3.48Å; T351-K355 PolarHBondContact O-N 3.31Å; A352-K355 PolarHBondContact O-N 2.78Å; C353-K355 VanDerWaalsContact C-N 3.33Å; C353-K355 PolarHBondContact O-N 3.22Å; K355-D357 VanDerWaalsContact C-N 3.32Å; K355-R390 PolarHBondContact O-NH1 3.33Å; K355-R390 VanDerWaalsContact O-NH1 3.16Å
356	G	87.1	Confident	88.4	Confident	23 Å²	23	51 Å²	51	24%	0.237	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	26.4	-174.2	0	0	0	0	0	112.8	A352 C353 L358	A352-G356 CarbonylContact O-C 3.52Å; A352-G356 WeakPolarHBondContact O-CA 3.45Å; A352-G356 PolarHBondContact O-N 2.7Å; C353-G356 PolarHBondContact O-N 3.43Å; G356-L358 PolarHBondContact O-N 3.3Å
357	D	89	Confident	88.2	Confident	70 Å²	70	59.9 Å²	59.9	37%	0.374	30%	0.298	S	S	.	.			trans	-82.4	97.9	-179.2	-176.5	-17.8	0	0	0	110.6	A352 K355 A359 K360 F361	A352-D357 HydrophobicContact CB-CB 4.49Å; A352-D357 PolarHBondContact O-N 3.13Å; K355-D357 VanDerWaalsContact C-N 3.32Å; D357-A359 VanDerWaalsContact C-N 3.33Å; D357-A359 PolarHBondContact O-N 3.15Å; D357-A359 PolarHBondContact OD1-N 3.24Å; D357-A359 VanDerWaalsContact OD1-N 3.11Å; D357-K360 HydrophobicContact CB-CB 4.08Å; D357-K360 VanDerWaalsContact CG-CB 3.46Å; D357-K360 PolarHBondContact O-N 3.48Å; D357-K360 PolarHBondContact OD1-N 2.91Å; D357-K360 WeakPolarHBondContact OD2-CB 3.35Å; D357-F361 VanDerWaalsContact O-CB 3.23Å; D357-F361 WeakPolarHBondContact O-CB 3.43Å; D357-F361 PolarHBondContact O-N 3.24Å
358	L	87.5	Confident	87.9	Confident	70 Å²	70	61.4 Å²	61.4	37%	0.366	31%	0.31	S	S	.	.	H	α-helix	trans	-66.1	-31.8	-176.5	-168.5	67.7	0	0	0	113.6	G356 F361 K362 F395 M396	G356-L358 PolarHBondContact O-N 3.3Å; L358-F361 HydrophobicContact CD1-CD1 4.36Å; L358-K362 HydrophobicContact CG-CD 4.49Å; L358-K362 WeakPolarHBondContact O-CG 3.5Å; L358-K362 PolarHBondContact O-N 3.3Å; L358-K362 VanDerWaalsContact O-N 3.08Å; L358-F395 HydrophobicContact CD1-CD1 3.72Å; L358-F395 HydrophobicContact CD1-CE1 3.76Å; L358-M396 HydrophobicContact CB-CE 4.05Å; L358-M396 HydrophobicContact CD1-CE 3.78Å; L358-M396 HydrophobicContact CD1-CG 4.23Å
359	A	88.5	Confident	88	Confident	75 Å²	75	61.3 Å²	61.3	62%	0.62	31%	0.309	S	S	*	.	H	α-helix	trans	-71.2	-46.1	-179.9	0	0	0	0	0	110.2	D357 K362 R363	D357-A359 VanDerWaalsContact C-N 3.33Å; D357-A359 PolarHBondContact O-N 3.15Å; D357-A359 PolarHBondContact OD1-N 3.24Å; D357-A359 VanDerWaalsContact OD1-N 3.11Å; A359-K362 PolarHBondContact O-N 2.66Å; A359-R363 PolarHBondContact O-N 3.33Å; A359-R363 VanDerWaalsContact O-N 3.15Å
360	K	88.9	Confident	87.9	Confident	63 Å²	63	61.4 Å²	61.4	27%	0.274	31%	0.31	S	S	.	.	H	α-helix	trans	-65.9	-41.3	175.6	-163	169.6	-177.4	175.8	0	111.2	A352 D357 K362 R363 Y364	A352-K360 HydrophobicContact CB-CB 3.84Å; A352-K360 HydrophobicContact CB-CD 4.47Å; A352-K360 HydrophobicContact CB-CG 4.02Å; D357-K360 HydrophobicContact CB-CB 4.08Å; D357-K360 VanDerWaalsContact CG-CB 3.46Å; D357-K360 PolarHBondContact O-N 3.48Å; D357-K360 PolarHBondContact OD1-N 2.91Å; D357-K360 WeakPolarHBondContact OD2-CB 3.35Å; K360-K362 PolarHBondContact O-N 3.18Å; K360-R363 PolarHBondContact O-N 3.2Å; K360-Y364 HydrophobicContact CD-CD2 4.44Å; K360-Y364 HydrophobicContact CD-CE2 4.17Å; K360-Y364 VanDerWaalsContact CE-CE2 3.48Å; K360-Y364 HydrophobicContact CG-CD2 3.52Å; K360-Y364 HydrophobicContact CG-CE2 3.54Å; K360-Y364 VanDerWaalsContact O-CD2 3.25Å; K360-Y364 WeakPolarHBondContact O-CD2 3.42Å; K360-Y364 PolarHBondContact O-N 3.43Å; K360-Y364 VanDerWaalsContact O-N 3.09Å
361	F	91.7	Very high	87.8	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.009	33%	0.328	C	S	.	.	H	α-helix	trans	-55.6	-50.8	175.5	173.9	-96.7	0	0	0	112	L349 A352 D357 L358 R363 Y364 L365 M396 A399 L400	L349-F361 HydrophobicContact CD1-CD2 3.59Å; L349-F361 HydrophobicContact CD1-CE2 3.89Å; L349-F361 HydrophobicContact CD1-CG 4.43Å; A352-F361 HydrophobicContact CB-CB 4.09Å; D357-F361 VanDerWaalsContact O-CB 3.23Å; D357-F361 WeakPolarHBondContact O-CB 3.43Å; D357-F361 PolarHBondContact O-N 3.24Å; L358-F361 HydrophobicContact CD1-CD1 4.36Å; F361-R363 VanDerWaalsContact C-N 3.28Å; F361-R363 PolarHBondContact O-N 2.89Å; F361-Y364 PolarHBondContact O-N 2.97Å; F361-L365 HydrophobicContact CE1-CD2 3.83Å; F361-L365 HydrophobicContact CE2-CD2 4.44Å; F361-L365 HydrophobicContact CZ-CD2 3.67Å; F361-L365 VanDerWaalsContact O-CB 3.28Å; F361-L365 WeakPolarHBondContact O-CB 3.47Å; F361-L365 PolarHBondContact O-N 3.22Å; F361-M396 HydrophobicContact CB-SD 4.42Å; F361-M396 HydrophobicContact CD1-CG 4.11Å; F361-M396 HydrophobicContact CD2-CB 4.43Å; F361-M396 HydrophobicContact CD2-CG 4.28Å; F361-M396 HydrophobicContact CD2-SD 4.15Å; F361-M396 HydrophobicContact CE1-CB 4.25Å; F361-M396 HydrophobicContact CE1-CG 4.13Å; F361-M396 HydrophobicContact CE2-CB 3.99Å; F361-M396 HydrophobicContact CE2-CG 4.29Å; F361-M396 HydrophobicContact CG-CG 4.18Å; F361-M396 HydrophobicContact CG-SD 4.16Å; F361-M396 HydrophobicContact CZ-CB 3.88Å; F361-M396 HydrophobicContact CZ-CG 4.21Å; F361-A399 HydrophobicContact CE1-CB 3.81Å; F361-A399 HydrophobicContact CZ-CB 3.94Å; F361-L400 HydrophobicContact CE2-CD1 4.42Å; F361-L400 HydrophobicContact CE2-CD2 4Å; F361-L400 HydrophobicContact CE2-CG 3.95Å; F361-L400 HydrophobicContact CZ-CD2 4.26Å; F361-L400 HydrophobicContact CZ-CG 4.01Å
362	K	90.6	Very high	87.7	Confident	130 Å²	130	63.7 Å²	63.7	57%	0.565	32%	0.32	S	S	*	.	H	α-helix	trans	-64.1	-32.5	178.9	-73.9	177	179.3	-179.5	0	113.2	L358 A359 K360	L358-K362 HydrophobicContact CG-CD 4.49Å; L358-K362 WeakPolarHBondContact O-CG 3.5Å; L358-K362 PolarHBondContact O-N 3.3Å; L358-K362 VanDerWaalsContact O-N 3.08Å; A359-K362 PolarHBondContact O-N 2.66Å; K360-K362 PolarHBondContact O-N 3.18Å
363	R	89.6	Confident	87.4	Confident	192 Å²	192	68.4 Å²	68.4	73%	0.725	34%	0.337	S	S	*	.	H	α-helix	trans	-69.4	-40.1	178.8	178.5	178.2	172.8	-179.7	-2.5	112.3	A359 K360 F361	A359-R363 PolarHBondContact O-N 3.33Å; A359-R363 VanDerWaalsContact O-N 3.15Å; K360-R363 PolarHBondContact O-N 3.2Å; F361-R363 VanDerWaalsContact C-N 3.28Å; F361-R363 PolarHBondContact O-N 2.89Å
364	Y	88.8	Confident	86.8	Confident	14 Å²	14	69.8 Å²	69.8	6%	0.055	35%	0.345	C	S	.	.	H	α-helix	trans	-103.5	-6	-171.7	-67.5	-73.4	0	0	0	114.2	Y344 E345 C348 K360 F361 S366 T369	Y344-Y364 HydrophobicContact CE1-CE1 4.41Å; E345-Y364 HydrophobicContact CB-CD1 3.88Å; E345-Y364 HydrophobicContact CB-CE1 4.48Å; E345-Y364 HydrophobicContact CG-CD1 3.86Å; E345-Y364 HydrophobicContact CG-CE1 4.06Å; C348-Y364 HydrophobicContact CB-CD1 3.88Å; C348-Y364 HydrophobicContact CB-CD2 3.64Å; C348-Y364 HydrophobicContact CB-CE1 3.95Å; C348-Y364 HydrophobicContact CB-CE2 3.75Å; C348-Y364 HydrophobicContact CB-CG 3.71Å; K360-Y364 HydrophobicContact CD-CD2 4.44Å; K360-Y364 HydrophobicContact CD-CE2 4.17Å; K360-Y364 VanDerWaalsContact CE-CE2 3.48Å; K360-Y364 HydrophobicContact CG-CD2 3.52Å; K360-Y364 HydrophobicContact CG-CE2 3.54Å; K360-Y364 VanDerWaalsContact O-CD2 3.25Å; K360-Y364 WeakPolarHBondContact O-CD2 3.42Å; K360-Y364 PolarHBondContact O-N 3.43Å; K360-Y364 VanDerWaalsContact O-N 3.09Å; F361-Y364 PolarHBondContact O-N 2.97Å; Y364-S366 PolarHBondContact O-N 3.28Å; Y364-T369 WeakPolarHBondContact O-CB 3.29Å; Y364-T369 PolarHBondContact O-OG1 3.25Å
365	L	90.1	Very high	86	Confident	41 Å²	41	65.8 Å²	65.8	22%	0.215	33%	0.33	C	S	.	.			trans	-75.3	109.4	171.7	178.8	60.7	0	0	0	110.1	L349 F361 V370 A399 L400 A403	L349-L365 HydrophobicContact CD1-CB 4.08Å; L349-L365 HydrophobicContact CD2-CD1 4.25Å; F361-L365 HydrophobicContact CE1-CD2 3.83Å; F361-L365 HydrophobicContact CE2-CD2 4.44Å; F361-L365 HydrophobicContact CZ-CD2 3.67Å; F361-L365 VanDerWaalsContact O-CB 3.28Å; F361-L365 WeakPolarHBondContact O-CB 3.47Å; F361-L365 PolarHBondContact O-N 3.22Å; L365-V370 HydrophobicContact CD1-CB 4.12Å; L365-V370 HydrophobicContact CD1-CG2 4.14Å; L365-A399 HydrophobicContact CD2-CB 4.37Å; L365-L400 HydrophobicContact CD1-CD2 3.65Å; L365-A403 HydrophobicContact CD1-CB 4.09Å; L365-A403 HydrophobicContact CD2-CB 4.28Å; L365-A403 HydrophobicContact CG-CB 4.37Å
366	S	86.6	Confident	85.3	Confident	43 Å²	43	62.5 Å²	62.5	30%	0.301	31%	0.314	S	S	.	.	S	Bend	trans	-139.7	173.1	178.8	71.9	0	0	0	0	110.3	Y364 S368 T369 V370	Y364-S366 PolarHBondContact O-N 3.28Å; S366-S368 PolarHBondContact O-N 3.44Å; S366-S368 PolarHBondContact OG-N 3.04Å; S366-S368 PolarHBondContact OG-OG 2.98Å; S366-T369 PolarHBondContact N-OG1 3.1Å; S366-T369 PolarHBondContact O-N 2.92Å; S366-T369 PolarHBondContact O-OG1 2.9Å; S366-T369 PolarHBondContact OG-N 3.41Å; S366-T369 PolarHBondContact OG-OG1 3.17Å; S366-V370 WeakPolarHBondContact O-CB 3.35Å; S366-V370 PolarHBondContact O-N 3.23Å
367	E	80.7	Confident	84.9	Confident	187 Å²	187	64 Å²	64	87%	0.874	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-29.9	174.1	-168.3	176.5	179.1	0	0	112.3
368	S	76.5	Confident	84.6	Confident	42 Å²	42	61.1 Å²	61.1	29%	0.294	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-31.8	176.9	61.9	0	0	0	0	113	D342 S366	D342-S368 WeakPolarHBondContact OD1-CB 3.3Å; D342-S368 PolarHBondContact OD1-OG 3.3Å; S366-S368 PolarHBondContact O-N 3.44Å; S366-S368 PolarHBondContact OG-N 3.04Å; S366-S368 PolarHBondContact OG-OG 2.98Å
369	T	86	Confident	84.7	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-18.8	-174.1	62.3	0	0	0	0	114.6	E345 Y364 S366 N371 F372	E345-T369 HydrophobicContact CB-CG2 3.63Å; Y364-T369 WeakPolarHBondContact O-CB 3.29Å; Y364-T369 PolarHBondContact O-OG1 3.25Å; S366-T369 PolarHBondContact N-OG1 3.1Å; S366-T369 PolarHBondContact O-N 2.92Å; S366-T369 PolarHBondContact O-OG1 2.9Å; S366-T369 PolarHBondContact OG-N 3.41Å; S366-T369 PolarHBondContact OG-OG1 3.17Å; T369-N371 PolarHBondContact O-N 3.09Å; T369-N371 VanDerWaalsContact O-N 3.14Å; T369-F372 WeakPolarHBondContact O-CB 3.49Å; T369-F372 PolarHBondContact O-N 3Å
370	V	88.5	Confident	84.8	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.018	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-35.3	-173.4	65.7	0	0	0	0	113.2	L365 S366 L400 A403 V405	L365-V370 HydrophobicContact CD1-CB 4.12Å; L365-V370 HydrophobicContact CD1-CG2 4.14Å; S366-V370 WeakPolarHBondContact O-CB 3.35Å; S366-V370 PolarHBondContact O-N 3.23Å; V370-L400 HydrophobicContact CG2-CD2 4.38Å; V370-A403 HydrophobicContact CB-CB 4.36Å; V370-A403 HydrophobicContact CG2-CB 3.69Å; V370-V405 HydrophobicContact CG2-CB 3.83Å; V370-V405 WeakPolarHBondContact O-CG2 3.29Å
371	N	88.5	Confident	85	Confident	77 Å²	77	53.3 Å²	53.3	41%	0.412	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	12.2	178.1	-75.6	-57.3	0	0	0	113.4	T369 R373 G404 V405 N406	T369-N371 PolarHBondContact O-N 3.09Å; T369-N371 VanDerWaalsContact O-N 3.14Å; N371-R373 PolarHBondContact O-N 3.44Å; N371-G404 PolarHBondContact ND2-O 3.25Å; N371-V405 WeakPolarHBondContact OD1-CA 3.38Å; N371-N406 PolarHBondContact OD1-N 3.4Å
372	F	85.9	Confident	85.1	Confident	18 Å²	18	53.2 Å²	53.2	8%	0.079	26%	0.255	C	S	.	.			trans	-59.5	138.2	176.9	-179.5	-101.8	0	0	0	111	E343 G346 H347 L350 T369 N380	E343-F372 HydrophobicContact CB-CE2 4.15Å; E343-F372 HydrophobicContact CG-CE2 4.05Å; E343-F372 HydrophobicContact CG-CZ 4Å; G346-F372 VanDerWaalsContact C-CE1 3.44Å; G346-F372 VanDerWaalsContact CA-CG 3.46Å; H347-F372 AromaticContact CD2-CE1 3.89Å; H347-F372 AromaticContact CD2-CZ 3.53Å; H347-F372 AromaticContact NE2-CZ 3.61Å; L350-F372 HydrophobicContact CD1-CD1 3.83Å; L350-F372 HydrophobicContact CD1-CE1 3.67Å; L350-F372 HydrophobicContact CD2-CD1 4.45Å; L350-F372 HydrophobicContact CG-CD1 3.94Å; L350-F372 HydrophobicContact CG-CE1 4.17Å; T369-F372 WeakPolarHBondContact O-CB 3.49Å; T369-F372 PolarHBondContact O-N 3Å; F372-N380 WeakPolarHBondContact O-CA 3.3Å; F372-N380 VanDerWaalsContact O-CB 3.26Å; F372-N380 WeakPolarHBondContact O-CB 3.45Å
373	R	83.1	Confident	85.2	Confident	100 Å²	100	47 Å²	47	38%	0.377	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-120.8	137	175.5	-56.3	-170.8	-155.9	-170.4	11.8	109.6	N371 P375 E379 N380 E409	N371-R373 PolarHBondContact O-N 3.44Å; R373-P375 VanDerWaalsContact O-CD 3.27Å; R373-P375 WeakPolarHBondContact O-CD 3.4Å; R373-E379 CarbonylContact C-O 3.43Å; R373-E379 WeakPolarHBondContact CA-O 3.23Å; R373-N380 HydrophobicContact CG-CB 4.47Å; R373-E409 IonicContact CZ-OE1 3.76Å; R373-E409 IonicContact CZ-OE2 2.77Å; R373-E409 IonicContact NE-OE1 2.63Å; R373-E409 IonicContact NE-OE2 3.37Å; R373-E409 IonicContact NH1-OE1 2.83Å; R373-E409 PolarHBondContact NH1-OE1 2.92Å; R373-E409 IonicContact NH1-OE2 3.59Å; R373-E409 IonicContact NH2-OE1 3.82Å; R373-E409 PolarHBondContact NH2-OE1 3Å; R373-E409 IonicContact NH2-OE2 3.43Å; R373-E409 PolarHBondContact NH2-OE2 3.11Å
374	N	79.7	Confident	85.3	Confident	30 Å²	30	39 Å²	39	16%	0.16	20%	0.199	C	C	.	.			trans	-58.7	119.5	167.5	-171.3	-59.2	0	0	0	109.1	L350 Y376 T377 G378 E379	L350-N374 HydrophobicContact CD1-CB 3.69Å; N374-Y376 PolarHBondContact O-N 3.43Å; N374-Y376 VanDerWaalsContact O-N 3.16Å; N374-Y376 WeakPolarHBondContact OD1-CA 3.42Å; N374-Y376 WeakPolarHBondContact OD1-CB 3.4Å; N374-Y376 PolarHBondContact OD1-N 3.01Å; N374-T377 WeakPolarHBondContact CB-OG1 3.36Å; N374-T377 PolarHBondContact OD1-N 3.38Å; N374-T377 VanDerWaalsContact OD1-N 3.11Å; N374-G378 WeakPolarHBondContact O-CA 3.38Å; N374-G378 PolarHBondContact O-N 3.16Å; N374-E379 PolarHBondContact N-O 3.45Å
375	P	72.1	Confident	85.5	Confident	45 Å²	45	38.3 Å²	38.3	29%	0.292	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-25.9	-178.4	-24.7	34.6	0	0	0	113.5	R373 K412	R373-P375 VanDerWaalsContact O-CD 3.27Å; R373-P375 WeakPolarHBondContact O-CD 3.4Å; P375-K412 WeakPolarHBondContact O-CE 3.39Å; P375-K412 PolarHBondContact O-NZ 2.91Å
376	Y	72.1	Confident	85.5	Confident	87 Å²	87	36.3 Å²	36.3	34%	0.341	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-45	-175.3	-55.2	-82.9	0	0	0	112.1	C292 A295 N374 K412	C292-Y376 PolarHBondContact N-OH 2.87Å; A295-Y376 HydrophobicContact CB-CE2 4.03Å; N374-Y376 PolarHBondContact O-N 3.43Å; N374-Y376 VanDerWaalsContact O-N 3.16Å; N374-Y376 WeakPolarHBondContact OD1-CA 3.42Å; N374-Y376 WeakPolarHBondContact OD1-CB 3.4Å; N374-Y376 PolarHBondContact OD1-N 3.01Å; Y376-K412 WeakPolarHBondContact O-CD 3.33Å; Y376-K412 WeakPolarHBondContact O-CE 3.3Å; Y376-K412 PolarHBondContact O-NZ 3.46Å
377	T	78.5	Confident	85.6	Confident	53 Å²	53	38.6 Å²	38.6	33%	0.325	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-19.1	-178.8	67.7	0	0	0	0	113.7	N374 E379 K412	N374-T377 WeakPolarHBondContact CB-OG1 3.36Å; N374-T377 PolarHBondContact OD1-N 3.38Å; N374-T377 VanDerWaalsContact OD1-N 3.11Å; T377-E379 WeakPolarHBondContact CB-OE2 3.23Å; T377-E379 PolarHBondContact O-N 2.97Å; T377-E379 WeakPolarHBondContact OG1-CB 3.45Å; T377-E379 WeakPolarHBondContact OG1-CG 3.46Å; T377-E379 PolarHBondContact OG1-N 2.99Å; T377-E379 PolarHBondContact OG1-OE2 2.83Å; T377-K412 WeakPolarHBondContact O-CB 3.07Å; T377-K412 PolarHBondContact O-N 3.41Å
378	G	82.8	Confident	85.7	Confident	10 Å²	10	30.7 Å²	30.7	10%	0.103	16%	0.161	C	C	.	.			trans	73.1	3.4	-170.9	0	0	0	0	0	113.8	N374 N411	N374-G378 WeakPolarHBondContact O-CA 3.38Å; N374-G378 PolarHBondContact O-N 3.16Å; G378-N411 WeakPolarHBondContact O-CA 3.38Å
379	E	88.5	Confident	85.7	Confident	42 Å²	42	33 Å²	33	20%	0.196	18%	0.178	C	C	.	.			trans	-78.3	139.2	-177.5	-65.1	172	142.5	0	0	111.3	R373 N374 T377 H383 N411 M420	R373-E379 CarbonylContact C-O 3.43Å; R373-E379 WeakPolarHBondContact CA-O 3.23Å; N374-E379 PolarHBondContact N-O 3.45Å; T377-E379 WeakPolarHBondContact CB-OE2 3.23Å; T377-E379 PolarHBondContact O-N 2.97Å; T377-E379 WeakPolarHBondContact OG1-CB 3.45Å; T377-E379 WeakPolarHBondContact OG1-CG 3.46Å; T377-E379 PolarHBondContact OG1-N 2.99Å; T377-E379 PolarHBondContact OG1-OE2 2.83Å; E379-H383 HydrophobicContact CB-CB 3.87Å; E379-H383 HydrophobicContact CG-CB 4.07Å; E379-N411 HydrophobicContact CG-CB 3.86Å; E379-M420 WeakPolarHBondContact OE1-CE 3.45Å
380	N	91.2	Very high	85.2	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-98.8	177.2	167	70.6	8.3	0	0	0	110.7	F372 R373 L382 H383 I384	F372-N380 WeakPolarHBondContact O-CA 3.3Å; F372-N380 VanDerWaalsContact O-CB 3.26Å; F372-N380 WeakPolarHBondContact O-CB 3.45Å; R373-N380 HydrophobicContact CG-CB 4.47Å; N380-L382 PolarHBondContact O-N 3.11Å; N380-L382 VanDerWaalsContact O-N 3.16Å; N380-L382 WeakPolarHBondContact OD1-CA 3.22Å; N380-L382 WeakPolarHBondContact OD1-CB 3.33Å; N380-L382 PolarHBondContact OD1-N 3.26Å; N380-L382 VanDerWaalsContact OD1-N 3.09Å; N380-H383 VanDerWaalsContact CG-ND1 3.34Å; N380-H383 PolarHBondContact N-ND1 3.41Å; N380-H383 WeakPolarHBondContact O-CB 3.19Å; N380-H383 PolarHBondContact O-N 2.98Å; N380-H383 VanDerWaalsContact O-N 3.11Å; N380-H383 PolarHBondContact OD1-N 3.08Å; N380-H383 PolarHBondContact OD1-ND1 3.07Å; N380-I384 PolarHBondContact O-N 2.84Å
381	A	92.9	Very high	84	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-54.9	-35.6	179.1	0	0	0	0	0	112.7	L349 L350 I384 L385 L400	L349-A381 HydrophobicContact CD2-CB 4.34Å; L349-A381 HydrophobicContact CG-CB 4.37Å; L350-A381 HydrophobicContact CD2-CB 4.05Å; A381-I384 PolarHBondContact O-N 3.37Å; A381-L385 WeakPolarHBondContact O-CG 3.34Å; A381-L385 PolarHBondContact O-N 3.11Å; A381-L385 VanDerWaalsContact O-N 3.09Å; A381-L400 HydrophobicContact CB-CD1 3.58Å; A381-L400 HydrophobicContact CB-CD2 3.85Å; A381-L400 HydrophobicContact CB-CG 4.39Å
382	L	93.8	Very high	82.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-69.6	-38	179.7	-169.6	63.3	0	0	0	112.5	N380 L385 C386 V397 L400 V405 V407 P417 L433	N380-L382 PolarHBondContact O-N 3.11Å; N380-L382 VanDerWaalsContact O-N 3.16Å; N380-L382 WeakPolarHBondContact OD1-CA 3.22Å; N380-L382 WeakPolarHBondContact OD1-CB 3.33Å; N380-L382 PolarHBondContact OD1-N 3.26Å; N380-L382 VanDerWaalsContact OD1-N 3.09Å; L382-L385 PolarHBondContact O-N 2.73Å; L382-C386 VanDerWaalsContact O-CB 3.31Å; L382-C386 WeakPolarHBondContact O-CB 3.25Å; L382-C386 PolarHBondContact O-N 3.04Å; L382-C386 PolarHBondContact O-SG 3.45Å; L382-V397 HydrophobicContact CD1-CB 4.39Å; L382-V397 HydrophobicContact CD1-CG1 3.88Å; L382-V397 HydrophobicContact CD1-CG2 4.09Å; L382-L400 HydrophobicContact CB-CD1 4.47Å; L382-V405 HydrophobicContact CB-CG1 4.4Å; L382-V405 HydrophobicContact CB-CG2 4.13Å; L382-V405 HydrophobicContact CD2-CG1 3.85Å; L382-V407 HydrophobicContact CD2-CB 4.33Å; L382-V407 HydrophobicContact CD2-CG1 4.11Å; L382-P417 HydrophobicContact CB-CG 4.25Å; L382-P417 HydrophobicContact CD2-CB 3.96Å; L382-P417 HydrophobicContact CD2-CG 3.82Å; L382-P417 HydrophobicContact CG-CB 3.86Å; L382-P417 HydrophobicContact CG-CG 3.92Å; L382-L433 HydrophobicContact CD1-CD2 4.17Å; L382-L433 HydrophobicContact CD2-CD2 3.79Å; L382-L433 HydrophobicContact CG-CD2 4.23Å
383	H	93.5	Very high	82.2	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.1	-48.9	172.4	-71.6	89	0	0	0	111.2	E379 N380 L385 C386 N387 E409 N411 L415 M420	E379-H383 HydrophobicContact CB-CB 3.87Å; E379-H383 HydrophobicContact CG-CB 4.07Å; N380-H383 VanDerWaalsContact CG-ND1 3.34Å; N380-H383 PolarHBondContact N-ND1 3.41Å; N380-H383 WeakPolarHBondContact O-CB 3.19Å; N380-H383 PolarHBondContact O-N 2.98Å; N380-H383 VanDerWaalsContact O-N 3.11Å; N380-H383 PolarHBondContact OD1-N 3.08Å; N380-H383 PolarHBondContact OD1-ND1 3.07Å; H383-L385 VanDerWaalsContact C-N 3.35Å; H383-L385 PolarHBondContact O-N 3.07Å; H383-C386 PolarHBondContact O-N 2.84Å; H383-N387 WeakPolarHBondContact O-CB 3.37Å; H383-N387 PolarHBondContact O-N 3.18Å; H383-E409 PolarHBondContact CE1-O 3.4Å; H383-E409 PolarHBondContact NE2-O 3.45Å; H383-N411 PolarHBondContact NE2-N 2.91Å; H383-L415 PolarHBondContact NE2-O 3.46Å; H383-M420 HydrophobicContact CB-SD 3.75Å; H383-M420 VanDerWaalsContact O-SD 3.37Å
384	I	91.4	Very high	82.3	Confident	23 Å²	23	39.7 Å²	39.7	12%	0.118	22%	0.222	C	C	.	.	H	α-helix	trans	-59.3	-47	-178.7	-63.8	179.8	0	0	0	110.6	L350 C353 Q354 N380 A381 N387 A388	L350-I384 HydrophobicContact CB-CD1 3.63Å; L350-I384 HydrophobicContact CD1-CD1 4.31Å; L350-I384 HydrophobicContact CD2-CD1 3.73Å; L350-I384 HydrophobicContact CG-CD1 4.06Å; C353-I384 HydrophobicContact CB-CB 4.42Å; C353-I384 HydrophobicContact CB-CG2 4.05Å; Q354-I384 HydrophobicContact CB-CG2 3.84Å; Q354-I384 HydrophobicContact CG-CG2 4.36Å; N380-I384 PolarHBondContact O-N 2.84Å; A381-I384 PolarHBondContact O-N 3.37Å; I384-N387 PolarHBondContact O-N 2.92Å; I384-A388 WeakPolarHBondContact O-CB 3.5Å; I384-A388 PolarHBondContact O-N 3.22Å
385	L	92.6	Very high	82.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.4	-38.7	179.1	-66.7	173.3	0	0	0	112.6	C353 A381 L382 H383 N387 A388 D393 M396 V397 L400	C353-L385 HydrophobicContact CB-CD2 3.8Å; C353-L385 HydrophobicContact CB-CG 3.92Å; A381-L385 WeakPolarHBondContact O-CG 3.34Å; A381-L385 PolarHBondContact O-N 3.11Å; A381-L385 VanDerWaalsContact O-N 3.09Å; L382-L385 PolarHBondContact O-N 2.73Å; H383-L385 VanDerWaalsContact C-N 3.35Å; H383-L385 PolarHBondContact O-N 3.07Å; L385-N387 PolarHBondContact O-N 3.06Å; L385-A388 PolarHBondContact O-N 3.34Å; L385-A388 VanDerWaalsContact O-N 3.13Å; L385-D393 HydrophobicContact CB-CB 4.45Å; L385-D393 HydrophobicContact CD2-CB 3.91Å; L385-D393 WeakPolarHBondContact CD2-OD1 3.39Å; L385-M396 HydrophobicContact CD1-CB 3.54Å; L385-M396 HydrophobicContact CD2-CB 4.11Å; L385-M396 HydrophobicContact CD2-SD 4.05Å; L385-V397 HydrophobicContact CB-CG2 3.69Å; L385-V397 HydrophobicContact CD1-CG2 3.91Å; L385-V397 HydrophobicContact CG-CG2 4.45Å; L385-L400 HydrophobicContact CD1-CD1 3.43Å; L385-L400 VanDerWaalsContact CD1-CD1 3.43Å; L385-L400 HydrophobicContact CD1-CG 4.49Å
386	C	90.7	Very high	83.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-66.8	-25.6	176.3	-69	0	0	0	0	112.3	L382 H383 P417 M420 R424	L382-C386 VanDerWaalsContact O-CB 3.31Å; L382-C386 WeakPolarHBondContact O-CB 3.25Å; L382-C386 PolarHBondContact O-N 3.04Å; L382-C386 PolarHBondContact O-SG 3.45Å; H383-C386 PolarHBondContact O-N 2.84Å; C386-P417 HydrophobicContact CB-CB 4.44Å; C386-M420 HydrophobicContact CB-CB 4.05Å; C386-R424 WeakPolarHBondContact O-CD 3.46Å
387	N	87.8	Confident	84.7	Confident	90 Å²	90	37.4 Å²	37.4	48%	0.481	21%	0.209	S	C	.	.	H	α-helix	trans	-86	-16.6	173.5	-166.3	36.5	0	0	0	113.2	H383 I384 L385 M420 R424	H383-N387 WeakPolarHBondContact O-CB 3.37Å; H383-N387 PolarHBondContact O-N 3.18Å; I384-N387 PolarHBondContact O-N 2.92Å; L385-N387 PolarHBondContact O-N 3.06Å; N387-M420 HydrophobicContact CB-CE 4.47Å; N387-M420 HydrophobicContact CB-SD 4.17Å; N387-R424 PolarHBondContact O-NH1 3.32Å
388	A	84.6	Confident	85.3	Confident	21 Å²	21	40.3 Å²	40.3	17%	0.174	22%	0.216	C	C	.	.			trans	-81.2	161.1	-179.7	0	0	0	0	0	112.6	I384 L385 D393 R424	I384-A388 WeakPolarHBondContact O-CB 3.5Å; I384-A388 PolarHBondContact O-N 3.22Å; L385-A388 PolarHBondContact O-N 3.34Å; L385-A388 VanDerWaalsContact O-N 3.13Å; A388-D393 WeakPolarHBondContact CB-OD2 3.38Å; A388-R424 PolarHBondContact O-NE 2.9Å; A388-R424 PolarHBondContact O-NH2 3.12Å
389	S	74.6	Confident	85.7	Confident	92 Å²	92	41 Å²	41	64%	0.643	22%	0.221	S	C	*	.			trans	-113.1	14.4	-169.9	-49.8	0	0	0	0	115.2	R424	S389-R424 VanDerWaalsContact OG-CZ 3.3Å; S389-R424 PolarHBondContact OG-NH1 2.96Å; S389-R424 PolarHBondContact OG-NH2 3.03Å
390	R	77.3	Confident	86	Confident	88 Å²	88	39 Å²	39	33%	0.332	21%	0.212	S	C	.	.			trans	-108.1	144.8	-168.2	-54.7	162.1	-65.2	-152.5	-1.3	111.2	C353 Q354 K355 A392 D393	C353-R390 PolarHBondContact O-NH2 3.28Å; Q354-R390 PolarHBondContact O-NH1 2.84Å; Q354-R390 PolarHBondContact O-NH2 3.02Å; K355-R390 PolarHBondContact O-NH1 3.33Å; K355-R390 VanDerWaalsContact O-NH1 3.16Å; R390-A392 PolarHBondContact O-N 3.27Å; R390-D393 WeakPolarHBondContact CA-OD2 3.27Å; R390-D393 VanDerWaalsContact CB-OD2 3.32Å; R390-D393 WeakPolarHBondContact CB-OD2 3.2Å; R390-D393 IonicContact CZ-OD1 3.34Å; R390-D393 IonicContact CZ-OD2 3.34Å; R390-D393 PolarHBondContact N-OD2 3.39Å; R390-D393 IonicContact NE-OD1 3.11Å; R390-D393 PolarHBondContact NE-OD1 3.13Å; R390-D393 IonicContact NE-OD2 2.8Å; R390-D393 PolarHBondContact NE-OD2 3.31Å; R390-D393 IonicContact NH2-OD1 2.71Å; R390-D393 PolarHBondContact NH2-OD1 2.94Å; R390-D393 IonicContact NH2-OD2 2.96Å; R390-D393 WeakPolarHBondContact O-CB 3.42Å; R390-D393 PolarHBondContact O-N 3.44Å
391	D	62.6	Low	86	Confident	160 Å²	160	40.1 Å²	40.1	86%	0.856	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-33	177.6	-61.7	-26.2	0	0	0	112.9	D393 L394	D391-D393 PolarHBondContact O-N 3.45Å; D391-L394 PolarHBondContact O-N 2.92Å
392	A	60.4	Low	85.9	Confident	53 Å²	53	44.4 Å²	44.4	44%	0.438	25%	0.254	S	S	.	.	H	α-helix	trans	-61	-23.3	176.4	0	0	0	0	0	113.3	R390 L394 F395	R390-A392 PolarHBondContact O-N 3.27Å; A392-L394 VanDerWaalsContact C-N 3.26Å; A392-L394 PolarHBondContact O-N 2.91Å; A392-F395 PolarHBondContact O-N 3.24Å
393	D	75.6	Confident	85.8	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-28.5	-177.9	-58.5	-36.3	0	0	0	110.6	L385 A388 R390 D391 F395 M396 V397	L385-D393 HydrophobicContact CB-CB 4.45Å; L385-D393 HydrophobicContact CD2-CB 3.91Å; L385-D393 WeakPolarHBondContact CD2-OD1 3.39Å; A388-D393 WeakPolarHBondContact CB-OD2 3.38Å; R390-D393 WeakPolarHBondContact CA-OD2 3.27Å; R390-D393 VanDerWaalsContact CB-OD2 3.32Å; R390-D393 WeakPolarHBondContact CB-OD2 3.2Å; R390-D393 IonicContact CZ-OD1 3.34Å; R390-D393 IonicContact CZ-OD2 3.34Å; R390-D393 PolarHBondContact N-OD2 3.39Å; R390-D393 IonicContact NE-OD1 3.11Å; R390-D393 PolarHBondContact NE-OD1 3.13Å; R390-D393 IonicContact NE-OD2 2.8Å; R390-D393 PolarHBondContact NE-OD2 3.31Å; R390-D393 IonicContact NH2-OD1 2.71Å; R390-D393 PolarHBondContact NH2-OD1 2.94Å; R390-D393 IonicContact NH2-OD2 2.96Å; R390-D393 WeakPolarHBondContact O-CB 3.42Å; R390-D393 PolarHBondContact O-N 3.44Å; D391-D393 PolarHBondContact O-N 3.45Å; D393-F395 PolarHBondContact O-N 3.25Å; D393-M396 PolarHBondContact O-N 3.41Å; D393-V397 WeakPolarHBondContact O-CB 3.39Å; D393-V397 VanDerWaalsContact O-CG2 3.22Å; D393-V397 WeakPolarHBondContact O-CG2 3.4Å; D393-V397 PolarHBondContact O-N 3.34Å
394	L	86.3	Confident	85.6	Confident	32 Å²	32	48.7 Å²	48.7	17%	0.168	29%	0.294	C	S	.	.	H	α-helix	trans	-67.7	-38.4	-178.7	-149.5	85.5	0	0	0	113	D391 A392 V397 K398 E428 L429 I432	D391-L394 PolarHBondContact O-N 2.92Å; A392-L394 VanDerWaalsContact C-N 3.26Å; A392-L394 PolarHBondContact O-N 2.91Å; L394-V397 PolarHBondContact O-N 3.42Å; L394-K398 WeakPolarHBondContact O-CG 3.25Å; L394-K398 PolarHBondContact O-N 3.39Å; L394-E428 HydrophobicContact CD1-CG 4.21Å; L394-E428 VanDerWaalsContact CD2-CD 3.47Å; L394-E428 HydrophobicContact CD2-CG 4.12Å; L394-E428 WeakPolarHBondContact CD2-OE1 3.42Å; L394-L429 HydrophobicContact CD1-CD2 3.9Å; L394-L429 HydrophobicContact CD1-CG 4.07Å; L394-I432 HydrophobicContact CD1-CD1 3.67Å; L394-I432 HydrophobicContact CD2-CD1 4.01Å; L394-I432 HydrophobicContact CG-CD1 3.74Å
395	F	88.2	Confident	85.7	Confident	114 Å²	114	48 Å²	48	50%	0.5	29%	0.291	S	S	.	.	H	α-helix	trans	-64.5	-44.3	173.1	173.7	-90.8	0	0	0	110.7	L358 A392 D393 V397 K398 A399	L358-F395 HydrophobicContact CD1-CD1 3.72Å; L358-F395 HydrophobicContact CD1-CE1 3.76Å; A392-F395 PolarHBondContact O-N 3.24Å; D393-F395 PolarHBondContact O-N 3.25Å; F395-V397 VanDerWaalsContact C-N 3.35Å; F395-K398 PolarHBondContact O-N 3.37Å; F395-A399 WeakPolarHBondContact O-CB 3.47Å; F395-A399 PolarHBondContact O-N 2.99Å
396	M	92.7	Very high	85.6	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-64.9	-39	178.4	-64.2	-176.7	-168	0	0	111.6	L358 F361 L385 D393 A399 L400	L358-M396 HydrophobicContact CB-CE 4.05Å; L358-M396 HydrophobicContact CD1-CE 3.78Å; L358-M396 HydrophobicContact CD1-CG 4.23Å; F361-M396 HydrophobicContact CB-SD 4.42Å; F361-M396 HydrophobicContact CD1-CG 4.11Å; F361-M396 HydrophobicContact CD2-CB 4.43Å; F361-M396 HydrophobicContact CD2-CG 4.28Å; F361-M396 HydrophobicContact CD2-SD 4.15Å; F361-M396 HydrophobicContact CE1-CB 4.25Å; F361-M396 HydrophobicContact CE1-CG 4.13Å; F361-M396 HydrophobicContact CE2-CB 3.99Å; F361-M396 HydrophobicContact CE2-CG 4.29Å; F361-M396 HydrophobicContact CG-CG 4.18Å; F361-M396 HydrophobicContact CG-SD 4.16Å; F361-M396 HydrophobicContact CZ-CB 3.88Å; F361-M396 HydrophobicContact CZ-CG 4.21Å; L385-M396 HydrophobicContact CD1-CB 3.54Å; L385-M396 HydrophobicContact CD2-CB 4.11Å; L385-M396 HydrophobicContact CD2-SD 4.05Å; D393-M396 PolarHBondContact O-N 3.41Å; M396-A399 PolarHBondContact O-N 2.99Å; M396-L400 WeakPolarHBondContact O-CG 3.17Å; M396-L400 PolarHBondContact O-N 3.03Å
397	V	92.4	Very high	85.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59	-49.7	173.4	167.1	0	0	0	0	110.5	L382 L385 D393 L394 F395 A399 L400 V401 L429 I432	L382-V397 HydrophobicContact CD1-CB 4.39Å; L382-V397 HydrophobicContact CD1-CG1 3.88Å; L382-V397 HydrophobicContact CD1-CG2 4.09Å; L385-V397 HydrophobicContact CB-CG2 3.69Å; L385-V397 HydrophobicContact CD1-CG2 3.91Å; L385-V397 HydrophobicContact CG-CG2 4.45Å; D393-V397 WeakPolarHBondContact O-CB 3.39Å; D393-V397 VanDerWaalsContact O-CG2 3.22Å; D393-V397 WeakPolarHBondContact O-CG2 3.4Å; D393-V397 PolarHBondContact O-N 3.34Å; L394-V397 PolarHBondContact O-N 3.42Å; F395-V397 VanDerWaalsContact C-N 3.35Å; V397-A399 VanDerWaalsContact C-N 3.31Å; V397-A399 PolarHBondContact O-N 3.3Å; V397-L400 PolarHBondContact O-N 3.2Å; V397-V401 HydrophobicContact CG1-CG2 4.48Å; V397-V401 WeakPolarHBondContact O-CB 3.24Å; V397-V401 VanDerWaalsContact O-CG2 3.28Å; V397-V401 WeakPolarHBondContact O-CG2 3.44Å; V397-V401 PolarHBondContact O-N 3.33Å; V397-L429 HydrophobicContact CB-CD2 4.43Å; V397-L429 HydrophobicContact CG1-CD2 4.18Å; V397-L429 HydrophobicContact CG2-CD2 3.92Å; V397-I432 HydrophobicContact CG1-CG2 3.98Å
398	K	91.7	Very high	86	Confident	113 Å²	113	49.7 Å²	49.7	49%	0.491	30%	0.3	S	S	.	.	H	α-helix	trans	-60.8	-39.8	177.2	-71.7	176.8	-177.2	177.6	0	112.1	L394 F395 A402	L394-K398 WeakPolarHBondContact O-CG 3.25Å; L394-K398 PolarHBondContact O-N 3.39Å; F395-K398 PolarHBondContact O-N 3.37Å; K398-A402 WeakPolarHBondContact O-CB 3.3Å; K398-A402 PolarHBondContact O-N 2.64Å
399	A	92.1	Very high	86.3	Confident	24 Å²	24	50.3 Å²	50.3	20%	0.198	30%	0.3	C	S	.	.	H	α-helix	trans	-66.2	-40.9	177	0	0	0	0	0	112.8	F361 L365 F395 M396 V397 A402 A403	F361-A399 HydrophobicContact CE1-CB 3.81Å; F361-A399 HydrophobicContact CZ-CB 3.94Å; L365-A399 HydrophobicContact CD2-CB 4.37Å; F395-A399 WeakPolarHBondContact O-CB 3.47Å; F395-A399 PolarHBondContact O-N 2.99Å; M396-A399 PolarHBondContact O-N 2.99Å; V397-A399 VanDerWaalsContact C-N 3.31Å; V397-A399 PolarHBondContact O-N 3.3Å; A399-A402 PolarHBondContact O-N 3.48Å; A399-A403 WeakPolarHBondContact O-CB 3.46Å; A399-A403 PolarHBondContact O-N 3.48Å
400	L	93.3	Very high	87.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.1	-42.8	175.4	-74.6	172.2	0	0	0	112.2	F361 L365 V370 A381 L382 L385 M396 V397 A402 A403 G404 V405	F361-L400 HydrophobicContact CE2-CD1 4.42Å; F361-L400 HydrophobicContact CE2-CD2 4Å; F361-L400 HydrophobicContact CE2-CG 3.95Å; F361-L400 HydrophobicContact CZ-CD2 4.26Å; F361-L400 HydrophobicContact CZ-CG 4.01Å; L365-L400 HydrophobicContact CD1-CD2 3.65Å; V370-L400 HydrophobicContact CG2-CD2 4.38Å; A381-L400 HydrophobicContact CB-CD1 3.58Å; A381-L400 HydrophobicContact CB-CD2 3.85Å; A381-L400 HydrophobicContact CB-CG 4.39Å; L382-L400 HydrophobicContact CB-CD1 4.47Å; L385-L400 HydrophobicContact CD1-CD1 3.43Å; L385-L400 VanDerWaalsContact CD1-CD1 3.43Å; L385-L400 HydrophobicContact CD1-CG 4.49Å; M396-L400 WeakPolarHBondContact O-CG 3.17Å; M396-L400 PolarHBondContact O-N 3.03Å; V397-L400 PolarHBondContact O-N 3.2Å; L400-A402 VanDerWaalsContact C-N 3.35Å; L400-A403 CarbonylContact O-C 3.44Å; L400-A403 PolarHBondContact O-N 3.17Å; L400-G404 PolarHBondContact O-N 3.3Å; L400-V405 HydrophobicContact CB-CB 4.25Å; L400-V405 HydrophobicContact CB-CG1 3.88Å; L400-V405 WeakPolarHBondContact O-CG1 3.23Å; L400-V405 PolarHBondContact O-N 2.94Å; L400-V405 VanDerWaalsContact O-N 3.09Å
401	V	91.6	Very high	87.7	Confident	25 Å²	25	47 Å²	47	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-45.4	176.1	169.2	0	0	0	0	110.4	V397 A403 G404 V405 V407 N436	V397-V401 HydrophobicContact CG1-CG2 4.48Å; V397-V401 WeakPolarHBondContact O-CB 3.24Å; V397-V401 VanDerWaalsContact O-CG2 3.28Å; V397-V401 WeakPolarHBondContact O-CG2 3.44Å; V397-V401 PolarHBondContact O-N 3.33Å; V401-A403 VanDerWaalsContact C-N 3.25Å; V401-A403 PolarHBondContact O-N 2.98Å; V401-G404 PolarHBondContact O-N 3.18Å; V401-V405 HydrophobicContact CG2-CG1 4.32Å; V401-V407 HydrophobicContact CG2-CG1 4.36Å; V401-N436 HydrophobicContact CG1-CB 3.65Å; V401-N436 WeakPolarHBondContact CG1-OD1 3.38Å
402	A	90.9	Very high	88.9	Confident	92 Å²	92	45.5 Å²	45.5	76%	0.76	26%	0.259	S	S	*	.	H	α-helix	trans	-63.3	-30.3	175	0	0	0	0	0	113.2	K398 A399 L400 G404	K398-A402 WeakPolarHBondContact O-CB 3.3Å; K398-A402 PolarHBondContact O-N 2.64Å; A399-A402 PolarHBondContact O-N 3.48Å; L400-A402 VanDerWaalsContact C-N 3.35Å; A402-G404 VanDerWaalsContact C-N 3.28Å
403	A	91.2	Very high	90	Very high	43 Å²	43	48.4 Å²	48.4	36%	0.355	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-3.6	175.3	0	0	0	0	0	113.9	L365 V370 A399 L400 V401	L365-A403 HydrophobicContact CD1-CB 4.09Å; L365-A403 HydrophobicContact CD2-CB 4.28Å; L365-A403 HydrophobicContact CG-CB 4.37Å; V370-A403 HydrophobicContact CB-CB 4.36Å; V370-A403 HydrophobicContact CG2-CB 3.69Å; A399-A403 WeakPolarHBondContact O-CB 3.46Å; A399-A403 PolarHBondContact O-N 3.48Å; L400-A403 CarbonylContact O-C 3.44Å; L400-A403 PolarHBondContact O-N 3.17Å; V401-A403 VanDerWaalsContact C-N 3.25Å; V401-A403 PolarHBondContact O-N 2.98Å
404	G	89.9	Confident	90.7	Very high	47 Å²	47	51.7 Å²	51.7	49%	0.485	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	31.9	175.6	0	0	0	0	0	115.3	N371 L400 V401 A402	N371-G404 PolarHBondContact ND2-O 3.25Å; L400-G404 PolarHBondContact O-N 3.3Å; V401-G404 PolarHBondContact O-N 3.18Å; A402-G404 VanDerWaalsContact C-N 3.28Å
405	V	92.5	Very high	91	Very high	9 Å²	9	51 Å²	51	6%	0.055	28%	0.281	C	S	.	.			trans	-62.8	138.7	171.3	71.9	0	0	0	0	111.2	V370 N371 L382 L400 V401 V407	V370-V405 HydrophobicContact CG2-CB 3.83Å; V370-V405 WeakPolarHBondContact O-CG2 3.29Å; N371-V405 WeakPolarHBondContact OD1-CA 3.38Å; L382-V405 HydrophobicContact CB-CG1 4.4Å; L382-V405 HydrophobicContact CB-CG2 4.13Å; L382-V405 HydrophobicContact CD2-CG1 3.85Å; L400-V405 HydrophobicContact CB-CB 4.25Å; L400-V405 HydrophobicContact CB-CG1 3.88Å; L400-V405 WeakPolarHBondContact O-CG1 3.23Å; L400-V405 PolarHBondContact O-N 2.94Å; L400-V405 VanDerWaalsContact O-N 3.09Å; V401-V405 HydrophobicContact CG2-CG1 4.32Å; V405-V407 PolarHBondContact O-N 3.06Å
406	N	91.3	Very high	91.2	Very high	64 Å²	64	45.6 Å²	45.6	34%	0.342	26%	0.257	S	S	.	.			trans	-68.8	105.5	172	-174.2	0.9	0	0	0	110.6	N371 N408 E409	N371-N406 PolarHBondContact OD1-N 3.4Å; N406-N408 VanDerWaalsContact C-N 3.25Å; N406-N408 PolarHBondContact O-N 3Å; N406-N408 PolarHBondContact OD1-N 3.41Å; N406-N408 VanDerWaalsContact OD1-N 3.07Å; N406-E409 HydrophobicContact CB-CB 4.22Å; N406-E409 PolarHBondContact ND2-OE2 3.23Å; N406-E409 WeakPolarHBondContact O-CB 3.33Å; N406-E409 PolarHBondContact O-N 3.02Å
407	V	93.3	Very high	91.3	Very high	13 Å²	13	45.5 Å²	45.5	8%	0.079	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.8	-179.5	-63.2	0	0	0	0	114	L382 V401 V405 P417 A438	L382-V407 HydrophobicContact CD2-CB 4.33Å; L382-V407 HydrophobicContact CD2-CG1 4.11Å; V401-V407 HydrophobicContact CG2-CG1 4.36Å; V405-V407 PolarHBondContact O-N 3.06Å; V407-P417 WeakPolarHBondContact O-CD 3.39Å; V407-A438 HydrophobicContact CG2-CB 4.47Å
408	N	93.8	Very high	91.4	Very high	47 Å²	47	45.6 Å²	45.6	25%	0.251	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	4.5	-175.4	-75.9	-46.8	0	0	0	113.4	N406 G437 A438 N439 L442	N406-N408 VanDerWaalsContact C-N 3.25Å; N406-N408 PolarHBondContact O-N 3Å; N406-N408 PolarHBondContact OD1-N 3.41Å; N406-N408 VanDerWaalsContact OD1-N 3.07Å; N408-G437 PolarHBondContact ND2-O 3.12Å; N408-A438 VanDerWaalsContact OD1-CA 3.32Å; N408-A438 WeakPolarHBondContact OD1-CA 3.29Å; N408-N439 PolarHBondContact OD1-N 3.02Å; N408-L442 HydrophobicContact CB-CD1 3.86Å; N408-L442 VanDerWaalsContact OD1-CD1 3.3Å; N408-L442 WeakPolarHBondContact OD1-CD1 3.11Å
409	E	91.4	Very high	91.5	Very high	34 Å²	34	40.3 Å²	40.3	16%	0.159	24%	0.235	C	C	.	.			trans	-62.8	143.4	-175.3	-161.9	52.9	-113.2	0	0	111.9	R373 H383 N406 S416 P417	R373-E409 IonicContact CZ-OE1 3.76Å; R373-E409 IonicContact CZ-OE2 2.77Å; R373-E409 IonicContact NE-OE1 2.63Å; R373-E409 IonicContact NE-OE2 3.37Å; R373-E409 IonicContact NH1-OE1 2.83Å; R373-E409 PolarHBondContact NH1-OE1 2.92Å; R373-E409 IonicContact NH1-OE2 3.59Å; R373-E409 IonicContact NH2-OE1 3.82Å; R373-E409 PolarHBondContact NH2-OE1 3Å; R373-E409 IonicContact NH2-OE2 3.43Å; R373-E409 PolarHBondContact NH2-OE2 3.11Å; H383-E409 PolarHBondContact CE1-O 3.4Å; H383-E409 PolarHBondContact NE2-O 3.45Å; N406-E409 HydrophobicContact CB-CB 4.22Å; N406-E409 PolarHBondContact ND2-OE2 3.23Å; N406-E409 WeakPolarHBondContact O-CB 3.33Å; N406-E409 PolarHBondContact O-N 3.02Å; E409-S416 WeakPolarHBondContact O-CA 3.36Å; E409-P417 WeakPolarHBondContact O-CD 3.43Å
410	R	91.4	Very high	91.5	Very high	105 Å²	105	39.9 Å²	39.9	40%	0.396	23%	0.229	S	C	.	.			trans	-110.9	134.7	178	-69.4	-177.7	-68	178.3	2.9	111.1	L414 L415 L443	R410-L414 WeakPolarHBondContact CD-O 3.43Å; R410-L415 CarbonylContact C-O 3.55Å; R410-L415 VanDerWaalsContact CA-O 3.29Å; R410-L415 WeakPolarHBondContact CA-O 3.34Å; R410-L443 PolarHBondContact NH1-O 3.01Å
411	N	89.9	Confident	91.4	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.027	23%	0.229	C	C	.	.			trans	-74.7	-178.3	172.2	72.9	10.3	0	0	0	111.9	G378 E379 H383 N413 L414 L415	G378-N411 WeakPolarHBondContact O-CA 3.38Å; E379-N411 HydrophobicContact CG-CB 3.86Å; H383-N411 PolarHBondContact NE2-N 2.91Å; N411-N413 PolarHBondContact O-N 3.45Å; N411-N413 WeakPolarHBondContact OD1-CA 3.44Å; N411-N413 WeakPolarHBondContact OD1-CB 3.2Å; N411-N413 PolarHBondContact OD1-N 2.98Å; N411-L414 WeakPolarHBondContact O-CA 3.27Å; N411-L414 PolarHBondContact O-N 3.01Å; N411-L414 PolarHBondContact OD1-N 3.22Å; N411-L415 PolarHBondContact N-O 3.48Å; N411-L415 WeakPolarHBondContact OD1-CB 3.37Å; N411-L415 PolarHBondContact OD1-N 3.08Å; N411-L415 PolarHBondContact OD1-O 3.24Å
412	K	87	Confident	91.5	Very high	129 Å²	129	38.7 Å²	38.7	56%	0.561	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-22	-179.4	-74.4	-164.1	-170.9	167.1	0	114.2	P375 Y376 T377 L414	P375-K412 WeakPolarHBondContact O-CE 3.39Å; P375-K412 PolarHBondContact O-NZ 2.91Å; Y376-K412 WeakPolarHBondContact O-CD 3.33Å; Y376-K412 WeakPolarHBondContact O-CE 3.3Å; Y376-K412 PolarHBondContact O-NZ 3.46Å; T377-K412 WeakPolarHBondContact O-CB 3.07Å; T377-K412 PolarHBondContact O-N 3.41Å; K412-L414 PolarHBondContact O-N 3.17Å
413	N	83.9	Confident	91.4	Very high	115 Å²	115	35.8 Å²	35.8	62%	0.615	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	9.2	172.6	-61.8	-26.3	0	0	0	112.2	N411 L415	N411-N413 PolarHBondContact O-N 3.45Å; N411-N413 WeakPolarHBondContact OD1-CA 3.44Å; N411-N413 WeakPolarHBondContact OD1-CB 3.2Å; N411-N413 PolarHBondContact OD1-N 2.98Å; N413-L415 HydrophobicContact CB-CD1 4.17Å; N413-L415 HydrophobicContact CB-CG 4Å; N413-L415 PolarHBondContact O-N 3.44Å
414	L	89.6	Confident	91.1	Very high	73 Å²	73	38.1 Å²	38.1	38%	0.382	19%	0.193	S	C	.	.	S	Bend	trans	61	19	-175.5	-59.1	171.4	0	0	0	113.8	R410 N411 K412 D444	R410-L414 WeakPolarHBondContact CD-O 3.43Å; N411-L414 WeakPolarHBondContact O-CA 3.27Å; N411-L414 PolarHBondContact O-N 3.01Å; N411-L414 PolarHBondContact OD1-N 3.22Å; K412-L414 PolarHBondContact O-N 3.17Å; L414-D444 WeakPolarHBondContact O-CA 3.36Å
415	L	92.5	Very high	91	Very high	18 Å²	18	36.9 Å²	36.9	9%	0.094	18%	0.18	C	C	.	.			trans	-84.4	135.8	176.9	-54	177.5	0	0	0	109.8	H383 R410 N411 N413 H419 D444	H383-L415 PolarHBondContact NE2-O 3.46Å; R410-L415 CarbonylContact C-O 3.55Å; R410-L415 VanDerWaalsContact CA-O 3.29Å; R410-L415 WeakPolarHBondContact CA-O 3.34Å; N411-L415 PolarHBondContact N-O 3.48Å; N411-L415 WeakPolarHBondContact OD1-CB 3.37Å; N411-L415 PolarHBondContact OD1-N 3.08Å; N411-L415 PolarHBondContact OD1-O 3.24Å; N413-L415 HydrophobicContact CB-CD1 4.17Å; N413-L415 HydrophobicContact CB-CG 4Å; N413-L415 PolarHBondContact O-N 3.44Å; L415-H419 HydrophobicContact CB-CB 4.33Å; L415-H419 HydrophobicContact CD2-CB 4.3Å; L415-D444 HydrophobicContact CD2-CB 3.65Å
416	S	94	Very high	90.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.191	C	C	.	.			trans	-91.7	164.3	167.7	71.8	0	0	0	0	111.3	E409 L418 H419 M420	E409-S416 WeakPolarHBondContact O-CA 3.36Å; S416-L418 PolarHBondContact O-N 3.13Å; S416-L418 VanDerWaalsContact O-N 3.17Å; S416-H419 PolarHBondContact N-ND1 2.92Å; S416-H419 WeakPolarHBondContact O-CB 3.23Å; S416-H419 PolarHBondContact O-N 3.34Å; S416-H419 PolarHBondContact OG-N 3.04Å; S416-H419 PolarHBondContact OG-ND1 2.82Å; S416-M420 PolarHBondContact O-N 2.98Å
417	P	93.6	Very high	90.9	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-53.6	-35.1	173	-28	35	0	0	0	113	L382 C386 V407 E409 H419 M420 A421 L433	L382-P417 HydrophobicContact CB-CG 4.25Å; L382-P417 HydrophobicContact CD2-CB 3.96Å; L382-P417 HydrophobicContact CD2-CG 3.82Å; L382-P417 HydrophobicContact CG-CB 3.86Å; L382-P417 HydrophobicContact CG-CG 3.92Å; C386-P417 HydrophobicContact CB-CB 4.44Å; V407-P417 WeakPolarHBondContact O-CD 3.39Å; E409-P417 WeakPolarHBondContact O-CD 3.43Å; P417-H419 PolarHBondContact O-N 3.04Å; P417-M420 PolarHBondContact O-N 3.32Å; P417-A421 PolarHBondContact O-N 3.22Å; P417-L433 HydrophobicContact CB-CD1 4.21Å; P417-L433 HydrophobicContact CB-CD2 4.31Å
418	L	94.6	Very high	90.7	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-65.3	-37.2	176.2	-173.6	62.1	0	0	0	112.3	S416 M420 A421 A422 I430 L433 I434 A438 V440 C450	S416-L418 PolarHBondContact O-N 3.13Å; S416-L418 VanDerWaalsContact O-N 3.17Å; L418-M420 VanDerWaalsContact C-N 3.33Å; L418-A421 PolarHBondContact O-N 3.42Å; L418-A422 WeakPolarHBondContact O-CB 3.45Å; L418-A422 PolarHBondContact O-N 3.49Å; L418-I430 HydrophobicContact CD1-CB 4.4Å; L418-I430 HydrophobicContact CD1-CG1 4.32Å; L418-I430 HydrophobicContact CD1-CG2 4.12Å; L418-L433 HydrophobicContact CB-CD1 4.3Å; L418-L433 HydrophobicContact CD1-CB 4.23Å; L418-L433 HydrophobicContact CD1-CD1 4.19Å; L418-I434 HydrophobicContact CD1-CD1 4.46Å; L418-I434 HydrophobicContact CD1-CG1 4.18Å; L418-I434 HydrophobicContact CD2-CG1 4.36Å; L418-A438 HydrophobicContact CB-CB 4.43Å; L418-A438 HydrophobicContact CD2-CB 4.15Å; L418-V440 HydrophobicContact CD2-CG1 4.18Å; L418-C450 HydrophobicContact CG-CB 4.4Å
419	H	94.2	Very high	90.5	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-38.8	172.8	-68.8	102.2	0	0	0	112	L415 S416 P417 A422 D423 L442 Q448 C450	L415-H419 HydrophobicContact CB-CB 4.33Å; L415-H419 HydrophobicContact CD2-CB 4.3Å; S416-H419 PolarHBondContact N-ND1 2.92Å; S416-H419 WeakPolarHBondContact O-CB 3.23Å; S416-H419 PolarHBondContact O-N 3.34Å; S416-H419 PolarHBondContact OG-N 3.04Å; S416-H419 PolarHBondContact OG-ND1 2.82Å; P417-H419 PolarHBondContact O-N 3.04Å; H419-A422 PolarHBondContact O-N 3.17Å; H419-D423 WeakPolarHBondContact O-CB 3.45Å; H419-D423 PolarHBondContact O-N 2.86Å; H419-L442 PolarHBondContact CE1-O 3.27Å; H419-L442 PolarHBondContact NE2-O 3.36Å; H419-L442 VanDerWaalsContact NE2-O 3.13Å; H419-Q448 PolarHBondContact NE2-O 3.44Å; H419-C450 PolarHBondContact NE2-N 3.34Å
420	M	91.7	Very high	90.6	Very high	14 Å²	14	39.3 Å²	39.3	7%	0.069	20%	0.195	C	C	.	.	H	α-helix	trans	-68.9	-42.4	177.6	-66.6	-174.8	142.1	0	0	112.1	E379 H383 C386 N387 S416 P417 L418 A422 D423 R424	E379-M420 WeakPolarHBondContact OE1-CE 3.45Å; H383-M420 HydrophobicContact CB-SD 3.75Å; H383-M420 VanDerWaalsContact O-SD 3.37Å; C386-M420 HydrophobicContact CB-CB 4.05Å; N387-M420 HydrophobicContact CB-CE 4.47Å; N387-M420 HydrophobicContact CB-SD 4.17Å; S416-M420 PolarHBondContact O-N 2.98Å; P417-M420 PolarHBondContact O-N 3.32Å; L418-M420 VanDerWaalsContact C-N 3.33Å; M420-A422 VanDerWaalsContact C-N 3.33Å; M420-A422 PolarHBondContact O-N 3.26Å; M420-D423 PolarHBondContact O-N 2.9Å; M420-R424 WeakPolarHBondContact O-CG 3.49Å; M420-R424 PolarHBondContact O-N 3.4Å
421	A	92	Very high	90.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-40.1	173.8	0	0	0	0	0	111.9	P417 L418 R424 G425 C426 L429 I430 L433	P417-A421 PolarHBondContact O-N 3.22Å; L418-A421 PolarHBondContact O-N 3.42Å; A421-R424 PolarHBondContact O-N 3.25Å; A421-G425 PolarHBondContact O-N 2.8Å; A421-G425 VanDerWaalsContact O-N 3.1Å; A421-C426 PolarHBondContact O-N 3.46Å; A421-L429 HydrophobicContact CB-CB 3.94Å; A421-I430 HydrophobicContact CB-CG1 4.03Å; A421-L433 HydrophobicContact CB-CD1 3.95Å
422	A	91.9	Very high	90.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-63.7	-43.5	174.3	0	0	0	0	0	112.7	L418 H419 M420 R424 G425 C450 C454 L459	L418-A422 WeakPolarHBondContact O-CB 3.45Å; L418-A422 PolarHBondContact O-N 3.49Å; H419-A422 PolarHBondContact O-N 3.17Å; M420-A422 VanDerWaalsContact C-N 3.33Å; M420-A422 PolarHBondContact O-N 3.26Å; A422-R424 PolarHBondContact O-N 3.44Å; A422-R424 VanDerWaalsContact O-N 3.13Å; A422-G425 PolarHBondContact O-N 3.25Å; A422-C450 HydrophobicContact CB-CB 3.75Å; A422-C454 VanDerWaalsContact CB-SG 3.57Å; A422-L459 WeakPolarHBondContact O-CD1 3.48Å
423	D	88.9	Confident	91.1	Very high	31 Å²	31	30.8 Å²	30.8	17%	0.166	16%	0.163	C	C	.	.	H	α-helix	trans	-57.3	-28.4	175.7	-90.8	12.5	0	0	0	113	H419 M420 R453 R457	H419-D423 WeakPolarHBondContact O-CB 3.45Å; H419-D423 PolarHBondContact O-N 2.86Å; M420-D423 PolarHBondContact O-N 2.9Å; D423-R453 WeakPolarHBondContact OD1-CB 3.3Å; D423-R453 IonicContact OD1-CZ 2.73Å; D423-R453 IonicContact OD1-NE 3.37Å; D423-R453 PolarHBondContact OD1-NE 3.1Å; D423-R453 IonicContact OD1-NH2 3.38Å; D423-R453 IonicContact OD2-CZ 2.64Å; D423-R453 IonicContact OD2-NE 2.74Å; D423-R453 PolarHBondContact OD2-NE 3.48Å; D423-R453 IonicContact OD2-NH2 2.73Å; D423-R453 PolarHBondContact OD2-NH2 3.43Å; D423-R457 VanDerWaalsContact CG-NH2 3.3Å; D423-R457 WeakPolarHBondContact O-CD 3.37Å; D423-R457 PolarHBondContact O-NE 3.32Å; D423-R457 IonicContact OD1-CZ 2.62Å; D423-R457 IonicContact OD1-NH1 3.46Å; D423-R457 PolarHBondContact OD1-NH1 3.28Å; D423-R457 IonicContact OD1-NH2 3.39Å; D423-R457 IonicContact OD2-CZ 2.69Å; D423-R457 IonicContact OD2-NH1 3.6Å; D423-R457 PolarHBondContact OD2-NH1 3.37Å; D423-R457 VanDerWaalsContact OD2-NH1 3.16Å; D423-R457 IonicContact OD2-NH2 3.61Å; D423-R457 PolarHBondContact OD2-NH2 2.72Å
424	R	86.6	Confident	91.5	Very high	93 Å²	93	26.5 Å²	26.5	35%	0.351	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-11.8	178.2	-64.5	171.7	64.5	78.2	20	113.7	C386 N387 A388 S389 M420 A421 A422 C426	C386-R424 WeakPolarHBondContact O-CD 3.46Å; N387-R424 PolarHBondContact O-NH1 3.32Å; A388-R424 PolarHBondContact O-NE 2.9Å; A388-R424 PolarHBondContact O-NH2 3.12Å; S389-R424 VanDerWaalsContact OG-CZ 3.3Å; S389-R424 PolarHBondContact OG-NH1 2.96Å; S389-R424 PolarHBondContact OG-NH2 3.03Å; M420-R424 WeakPolarHBondContact O-CG 3.49Å; M420-R424 PolarHBondContact O-N 3.4Å; A421-R424 PolarHBondContact O-N 3.25Å; A422-R424 PolarHBondContact O-N 3.44Å; A422-R424 VanDerWaalsContact O-N 3.13Å; R424-C426 PolarHBondContact O-N 2.93Å
425	G	87.1	Confident	91.7	Very high	21 Å²	21	29.6 Å²	29.6	22%	0.216	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	22.1	-174.5	0	0	0	0	0	114.3	A421 A422 T427	A421-G425 PolarHBondContact O-N 2.8Å; A421-G425 VanDerWaalsContact O-N 3.1Å; A422-G425 PolarHBondContact O-N 3.25Å; G425-T427 PolarHBondContact O-N 2.98Å
426	C	89.5	Confident	91.7	Very high	41 Å²	41	32.5 Å²	32.5	28%	0.277	17%	0.168	S	C	.	.			trans	-78.8	93.3	-178.5	-173.4	0	0	0	0	110.2	A421 R424 E428 L429 I430	A421-C426 PolarHBondContact O-N 3.46Å; R424-C426 PolarHBondContact O-N 2.93Å; C426-E428 VanDerWaalsContact C-N 3.28Å; C426-E428 PolarHBondContact O-N 2.96Å; C426-L429 HydrophobicContact CB-CB 4.09Å; C426-L429 HydrophobicContact CB-CD1 3.96Å; C426-L429 HydrophobicContact CB-CG 4.37Å; C426-L429 PolarHBondContact O-N 3.37Å; C426-I430 VanDerWaalsContact O-CG1 3.31Å; C426-I430 WeakPolarHBondContact O-CG1 3.5Å; C426-I430 PolarHBondContact O-N 3.43Å
427	T	91	Very high	91.7	Very high	58 Å²	58	34.8 Å²	34.8	36%	0.356	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-34.3	-176.1	51.5	0	0	0	0	113.2	G425 I430 N431 E461 L465	G425-T427 PolarHBondContact O-N 2.98Å; T427-I430 PolarHBondContact O-N 3.16Å; T427-N431 WeakPolarHBondContact O-CB 3.3Å; T427-N431 PolarHBondContact O-N 2.87Å; T427-E461 HydrophobicContact CG2-CB 4.2Å; T427-L465 HydrophobicContact CG2-CD2 4.21Å; T427-L465 WeakPolarHBondContact O-CD2 3.39Å
428	E	89.9	Confident	91.7	Very high	107 Å²	107	35.1 Å²	35.1	50%	0.5	19%	0.194	S	C	.	.	H	α-helix	trans	-66.8	-45	177	-168	172	-170.6	0	0	111.9	L394 C426 N431 I432	L394-E428 HydrophobicContact CD1-CG 4.21Å; L394-E428 VanDerWaalsContact CD2-CD 3.47Å; L394-E428 HydrophobicContact CD2-CG 4.12Å; L394-E428 WeakPolarHBondContact CD2-OE1 3.42Å; C426-E428 VanDerWaalsContact C-N 3.28Å; C426-E428 PolarHBondContact O-N 2.96Å; E428-N431 PolarHBondContact O-N 2.89Å; E428-I432 HydrophobicContact CG-CD1 4.27Å; E428-I432 WeakPolarHBondContact O-CG1 3.31Å; E428-I432 PolarHBondContact O-N 3.49Å
429	L	90.5	Very high	91.6	Very high	11 Å²	11	38.7 Å²	38.7	6%	0.058	21%	0.213	C	C	.	.	H	α-helix	trans	-63.5	-43	173.7	-80.9	170.4	0	0	0	111.8	L394 V397 A421 C426 N431 I432 L433	L394-L429 HydrophobicContact CD1-CD2 3.9Å; L394-L429 HydrophobicContact CD1-CG 4.07Å; V397-L429 HydrophobicContact CB-CD2 4.43Å; V397-L429 HydrophobicContact CG1-CD2 4.18Å; V397-L429 HydrophobicContact CG2-CD2 3.92Å; A421-L429 HydrophobicContact CB-CB 3.94Å; C426-L429 HydrophobicContact CB-CB 4.09Å; C426-L429 HydrophobicContact CB-CD1 3.96Å; C426-L429 HydrophobicContact CB-CG 4.37Å; C426-L429 PolarHBondContact O-N 3.37Å; L429-N431 VanDerWaalsContact C-N 3.3Å; L429-N431 PolarHBondContact O-N 3.4Å; L429-I432 PolarHBondContact O-N 3.03Å; L429-L433 WeakPolarHBondContact O-CB 3.25Å; L429-L433 VanDerWaalsContact O-CG 3.25Å; L429-L433 WeakPolarHBondContact O-CG 3.44Å; L429-L433 PolarHBondContact O-N 3.39Å
430	I	92.6	Very high	91.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.9	-46	175.9	-69	167.8	0	0	0	110.2	L418 A421 C426 T427 L433 I434 A462 L465 L466	L418-I430 HydrophobicContact CD1-CB 4.4Å; L418-I430 HydrophobicContact CD1-CG1 4.32Å; L418-I430 HydrophobicContact CD1-CG2 4.12Å; A421-I430 HydrophobicContact CB-CG1 4.03Å; C426-I430 VanDerWaalsContact O-CG1 3.31Å; C426-I430 WeakPolarHBondContact O-CG1 3.5Å; C426-I430 PolarHBondContact O-N 3.43Å; T427-I430 PolarHBondContact O-N 3.16Å; I430-L433 PolarHBondContact O-N 3.36Å; I430-I434 HydrophobicContact CG2-CD1 3.6Å; I430-I434 HydrophobicContact CG2-CG1 4.47Å; I430-I434 WeakPolarHBondContact O-CB 3.42Å; I430-I434 VanDerWaalsContact O-CG1 3.23Å; I430-I434 WeakPolarHBondContact O-CG1 3.4Å; I430-I434 PolarHBondContact O-N 2.78Å; I430-A462 HydrophobicContact CD1-CB 3.85Å; I430-L465 HydrophobicContact CB-CD2 3.99Å; I430-L465 HydrophobicContact CG2-CD2 3.64Å; I430-L465 HydrophobicContact CG2-CG 4.23Å; I430-L466 HydrophobicContact CG2-CD2 3.89Å; I430-L466 HydrophobicContact CG2-CG 4.48Å
431	N	92.8	Very high	91.7	Very high	46 Å²	46	41.2 Å²	41.2	25%	0.246	23%	0.228	C	C	.	.	H	α-helix	trans	-62.4	-49.9	177	-91.7	-34.9	0	0	0	112.7	T427 E428 L429 L433 I434 E435 L465 K469	T427-N431 WeakPolarHBondContact O-CB 3.3Å; T427-N431 PolarHBondContact O-N 2.87Å; E428-N431 PolarHBondContact O-N 2.89Å; L429-N431 VanDerWaalsContact C-N 3.3Å; L429-N431 PolarHBondContact O-N 3.4Å; N431-L433 VanDerWaalsContact C-N 3.28Å; N431-L433 PolarHBondContact O-N 2.94Å; N431-I434 PolarHBondContact O-N 3.14Å; N431-E435 WeakPolarHBondContact O-CB 3.42Å; N431-E435 WeakPolarHBondContact O-CG 3.33Å; N431-E435 PolarHBondContact O-N 3.47Å; N431-L465 WeakPolarHBondContact OD1-CD1 3.32Å; N431-K469 WeakPolarHBondContact OD1-CE 3.47Å
432	I	92.2	Very high	91.8	Very high	14 Å²	14	42.5 Å²	42.5	7%	0.072	24%	0.235	C	C	.	.	H	α-helix	trans	-57.1	-44.5	179.7	-69.1	167.5	0	0	0	110.5	L394 V397 E428 L429 N436	L394-I432 HydrophobicContact CD1-CD1 3.67Å; L394-I432 HydrophobicContact CD2-CD1 4.01Å; L394-I432 HydrophobicContact CG-CD1 3.74Å; V397-I432 HydrophobicContact CG1-CG2 3.98Å; E428-I432 HydrophobicContact CG-CD1 4.27Å; E428-I432 WeakPolarHBondContact O-CG1 3.31Å; E428-I432 PolarHBondContact O-N 3.49Å; L429-I432 PolarHBondContact O-N 3.03Å; I432-N436 WeakPolarHBondContact O-CB 3.41Å; I432-N436 PolarHBondContact O-N 3.13Å; I432-N436 PolarHBondContact O-ND2 3.46Å
433	L	93.6	Very high	91.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.1	-46.8	179.8	-69.5	173.6	0	0	0	111.8	L382 P417 L418 A421 L429 I430 N431 N436 G437 A438	L382-L433 HydrophobicContact CD1-CD2 4.17Å; L382-L433 HydrophobicContact CD2-CD2 3.79Å; L382-L433 HydrophobicContact CG-CD2 4.23Å; P417-L433 HydrophobicContact CB-CD1 4.21Å; P417-L433 HydrophobicContact CB-CD2 4.31Å; L418-L433 HydrophobicContact CB-CD1 4.3Å; L418-L433 HydrophobicContact CD1-CB 4.23Å; L418-L433 HydrophobicContact CD1-CD1 4.19Å; A421-L433 HydrophobicContact CB-CD1 3.95Å; L429-L433 WeakPolarHBondContact O-CB 3.25Å; L429-L433 VanDerWaalsContact O-CG 3.25Å; L429-L433 WeakPolarHBondContact O-CG 3.44Å; L429-L433 PolarHBondContact O-N 3.39Å; I430-L433 PolarHBondContact O-N 3.36Å; N431-L433 VanDerWaalsContact C-N 3.28Å; N431-L433 PolarHBondContact O-N 2.94Å; L433-N436 CarbonylContact O-C 3.58Å; L433-N436 PolarHBondContact O-N 3.47Å; L433-G437 PolarHBondContact O-N 2.92Å; L433-A438 VanDerWaalsContact C-CB 3.43Å; L433-A438 HydrophobicContact CB-CB 3.84Å; L433-A438 WeakPolarHBondContact O-CB 3.45Å; L433-A438 PolarHBondContact O-N 3.14Å
434	I	93.1	Very high	91.9	Very high	26 Å²	26	44.4 Å²	44.4	13%	0.133	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-43	-178.9	-67.2	170.3	0	0	0	111.2	L418 I430 N431 N436 G437 V440 L466 K469	L418-I434 HydrophobicContact CD1-CD1 4.46Å; L418-I434 HydrophobicContact CD1-CG1 4.18Å; L418-I434 HydrophobicContact CD2-CG1 4.36Å; I430-I434 HydrophobicContact CG2-CD1 3.6Å; I430-I434 HydrophobicContact CG2-CG1 4.47Å; I430-I434 WeakPolarHBondContact O-CB 3.42Å; I430-I434 VanDerWaalsContact O-CG1 3.23Å; I430-I434 WeakPolarHBondContact O-CG1 3.4Å; I430-I434 PolarHBondContact O-N 2.78Å; N431-I434 PolarHBondContact O-N 3.14Å; I434-N436 PolarHBondContact O-N 3.33Å; I434-G437 PolarHBondContact O-N 3.46Å; I434-V440 HydrophobicContact CD1-CG1 3.63Å; I434-V440 HydrophobicContact CG1-CG1 3.77Å; I434-V440 HydrophobicContact CG2-CG1 4.47Å; I434-L466 HydrophobicContact CD1-CD2 4.03Å; I434-K469 HydrophobicContact CD1-CB 4.01Å; I434-K469 HydrophobicContact CD1-CG 3.96Å; I434-K469 HydrophobicContact CG2-CB 4.29Å; I434-K469 HydrophobicContact CG2-CD 4Å; I434-K469 HydrophobicContact CG2-CG 4.24Å
435	E	93.2	Very high	91.8	Very high	137 Å²	137	41.6 Å²	41.6	64%	0.64	24%	0.244	S	C	*	.	H	α-helix	trans	-61.6	-25.5	176.8	-74.2	176.4	178.8	0	0	112.7	N431	N431-E435 WeakPolarHBondContact O-CB 3.42Å; N431-E435 WeakPolarHBondContact O-CG 3.33Å; N431-E435 PolarHBondContact O-N 3.47Å
436	N	93.5	Very high	91.8	Very high	80 Å²	80	44.4 Å²	44.4	43%	0.428	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	22.3	176.6	-68.3	-83.8	0	0	0	113.2	V401 I432 L433 I434	V401-N436 HydrophobicContact CG1-CB 3.65Å; V401-N436 WeakPolarHBondContact CG1-OD1 3.38Å; I432-N436 WeakPolarHBondContact O-CB 3.41Å; I432-N436 PolarHBondContact O-N 3.13Å; I432-N436 PolarHBondContact O-ND2 3.46Å; L433-N436 CarbonylContact O-C 3.58Å; L433-N436 PolarHBondContact O-N 3.47Å; I434-N436 PolarHBondContact O-N 3.33Å
437	G	92.2	Very high	91.7	Very high	47 Å²	47	42.9 Å²	42.9	49%	0.485	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	18.4	168.4	0	0	0	0	0	115.8	N408 L433 I434 N439	N408-G437 PolarHBondContact ND2-O 3.12Å; L433-G437 PolarHBondContact O-N 2.92Å; I434-G437 PolarHBondContact O-N 3.46Å; G437-N439 PolarHBondContact O-N 3.42Å
438	A	93.8	Very high	91.7	Very high	8 Å²	8	40.6 Å²	40.6	7%	0.066	23%	0.231	C	C	.	.			trans	-65.5	125.9	171.2	0	0	0	0	0	111.1	V407 N408 L418 L433 V440	V407-A438 HydrophobicContact CG2-CB 4.47Å; N408-A438 VanDerWaalsContact OD1-CA 3.32Å; N408-A438 WeakPolarHBondContact OD1-CA 3.29Å; L418-A438 HydrophobicContact CB-CB 4.43Å; L418-A438 HydrophobicContact CD2-CB 4.15Å; L433-A438 VanDerWaalsContact C-CB 3.43Å; L433-A438 HydrophobicContact CB-CB 3.84Å; L433-A438 WeakPolarHBondContact O-CB 3.45Å; L433-A438 PolarHBondContact O-N 3.14Å; A438-V440 PolarHBondContact O-N 2.84Å
439	N	93.7	Very high	91.9	Very high	77 Å²	77	35.5 Å²	35.5	41%	0.412	21%	0.207	S	C	.	.			trans	-76.5	108.3	177.8	179.4	-1	0	0	0	109.8	N408 G437 N441 L442	N408-N439 PolarHBondContact OD1-N 3.02Å; G437-N439 PolarHBondContact O-N 3.42Å; N439-N441 PolarHBondContact O-N 2.84Å; N439-N441 PolarHBondContact OD1-N 3.38Å; N439-L442 HydrophobicContact CB-CD1 3.91Å; N439-L442 HydrophobicContact CB-CG 4.03Å; N439-L442 PolarHBondContact O-N 3.42Å
440	V	93.4	Very high	92.1	Very high	16 Å²	16	35 Å²	35	10%	0.097	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.7	179.4	-65.2	0	0	0	0	113.9	L418 I434 A438 C450 L466 V471	L418-V440 HydrophobicContact CD2-CG1 4.18Å; I434-V440 HydrophobicContact CD1-CG1 3.63Å; I434-V440 HydrophobicContact CG1-CG1 3.77Å; I434-V440 HydrophobicContact CG2-CG1 4.47Å; A438-V440 PolarHBondContact O-N 2.84Å; V440-C450 PolarHBondContact O-SG 2.77Å; V440-L466 HydrophobicContact CG1-CD2 4.5Å; V440-V471 HydrophobicContact CB-CB 4.17Å; V440-V471 HydrophobicContact CB-CG2 4.19Å; V440-V471 HydrophobicContact CG2-CB 4.23Å; V440-V471 HydrophobicContact CG2-CG2 4.44Å
441	N	94	Very high	92.1	Very high	53 Å²	53	35.4 Å²	35.4	28%	0.283	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	8.7	-176.4	-63.2	-34.9	0	0	0	113.6	N439 D472 I475	N439-N441 PolarHBondContact O-N 2.84Å; N439-N441 PolarHBondContact OD1-N 3.38Å; N441-D472 PolarHBondContact OD1-N 2.97Å; N441-I475 HydrophobicContact CB-CD1 3.94Å
442	L	93.8	Very high	92.1	Very high	27 Å²	27	33.2 Å²	33.2	14%	0.141	19%	0.194	C	C	.	.			trans	-58.4	140.4	171.6	-92.9	160.6	0	0	0	110.6	N408 H419 N439	N408-L442 HydrophobicContact CB-CD1 3.86Å; N408-L442 VanDerWaalsContact OD1-CD1 3.3Å; N408-L442 WeakPolarHBondContact OD1-CD1 3.11Å; H419-L442 PolarHBondContact CE1-O 3.27Å; H419-L442 PolarHBondContact NE2-O 3.36Å; H419-L442 VanDerWaalsContact NE2-O 3.13Å; N439-L442 HydrophobicContact CB-CD1 3.91Å; N439-L442 HydrophobicContact CB-CG 4.03Å; N439-L442 PolarHBondContact O-N 3.42Å
443	L	92.1	Very high	92	Very high	63 Å²	63	34.2 Å²	34.2	33%	0.33	20%	0.197	S	C	.	.			trans	-103.8	138.8	178.3	-49.8	-178	0	0	0	110.9	R410 Q448 T449 I475	R410-L443 PolarHBondContact NH1-O 3.01Å; L443-Q448 WeakPolarHBondContact CA-O 3.45Å; L443-T449 HydrophobicContact CD2-CG2 3.59Å; L443-I475 HydrophobicContact CD2-CG2 3.69Å
444	D	90.4	Very high	92	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.043	20%	0.197	C	C	.	.			trans	-80.8	-173.5	168.3	71.8	14.1	0	0	0	113.2	L414 L415 L446 G447 Q448 R453	L414-D444 WeakPolarHBondContact O-CA 3.36Å; L415-D444 HydrophobicContact CD2-CB 3.65Å; D444-L446 PolarHBondContact O-N 3.47Å; D444-L446 VanDerWaalsContact OD1-CA 3.31Å; D444-L446 WeakPolarHBondContact OD1-CA 3.28Å; D444-L446 WeakPolarHBondContact OD1-CB 3.32Å; D444-L446 PolarHBondContact OD1-N 3.39Å; D444-G447 PolarHBondContact O-N 3.44Å; D444-G447 PolarHBondContact OD1-N 2.87Å; D444-Q448 PolarHBondContact N-O 3.12Å; D444-Q448 WeakPolarHBondContact OD1-CB 3.14Å; D444-Q448 PolarHBondContact OD1-N 3.12Å; D444-R453 WeakPolarHBondContact OD2-CD 3.5Å; D444-R453 IonicContact OD2-CZ 3.96Å; D444-R453 IonicContact OD2-NE 3.94Å; D444-R453 IonicContact OD2-NH1 2.73Å; D444-R453 PolarHBondContact OD2-NH1 3.22Å
445	G	85.8	Confident	91.8	Very high	34 Å²	34	34 Å²	34	35%	0.351	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-10.3	179.7	0	0	0	0	0	115	L478	G445-L478 VanDerWaalsContact O-CD1 3.32Å; G445-L478 WeakPolarHBondContact O-CD1 3.36Å
446	L	85.9	Confident	91.3	Very high	79 Å²	79	34.5 Å²	34.5	41%	0.414	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	7.3	171.6	-60.2	177.9	0	0	0	111.8	D444 Q448 L478	D444-L446 PolarHBondContact O-N 3.47Å; D444-L446 VanDerWaalsContact OD1-CA 3.31Å; D444-L446 WeakPolarHBondContact OD1-CA 3.28Å; D444-L446 WeakPolarHBondContact OD1-CB 3.32Å; D444-L446 PolarHBondContact OD1-N 3.39Å; L446-Q448 HydrophobicContact CB-CG 3.92Å; L446-Q448 PolarHBondContact O-N 2.99Å; L446-L478 WeakPolarHBondContact O-CB 3.3Å; L446-L478 WeakPolarHBondContact O-CG 3.45Å; L446-L478 PolarHBondContact O-N 3.11Å
447	G	87.9	Confident	90.9	Very high	9 Å²	9	36.3 Å²	36.3	9%	0.093	20%	0.198	C	C	.	.	S	Bend	trans	70	15.2	-173.1	0	0	0	0	0	113.1	D444 N477	D444-G447 PolarHBondContact O-N 3.44Å; D444-G447 PolarHBondContact OD1-N 2.87Å; G447-N477 WeakPolarHBondContact O-CA 3.47Å
448	Q	91.8	Very high	90.5	Very high	11 Å²	11	40.5 Å²	40.5	5%	0.051	21%	0.21	C	C	.	.			trans	-90.9	139.3	-174.7	-66.8	177.3	10.1	0	0	110.8	H419 L443 D444 L446 H452 R453 N477	H419-Q448 PolarHBondContact NE2-O 3.44Å; L443-Q448 WeakPolarHBondContact CA-O 3.45Å; D444-Q448 PolarHBondContact N-O 3.12Å; D444-Q448 WeakPolarHBondContact OD1-CB 3.14Å; D444-Q448 PolarHBondContact OD1-N 3.12Å; L446-Q448 HydrophobicContact CB-CG 3.92Å; L446-Q448 PolarHBondContact O-N 2.99Å; Q448-H452 HydrophobicContact CB-CB 3.78Å; Q448-H452 HydrophobicContact CG-CB 4.02Å; Q448-R453 HydrophobicContact CB-CG 4.42Å; Q448-N477 HydrophobicContact CG-CB 3.6Å
449	T	94.1	Very high	90.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.218	C	C	.	.			trans	-79.1	167.3	164.7	65.8	0	0	0	0	110.9	L443 L451 H452 R453 I475	L443-T449 HydrophobicContact CD2-CG2 3.59Å; T449-L451 PolarHBondContact O-N 2.81Å; T449-L451 PolarHBondContact OG1-N 2.87Å; T449-H452 PolarHBondContact N-ND1 3.5Å; T449-H452 WeakPolarHBondContact O-CB 3.28Å; T449-H452 PolarHBondContact O-N 3.03Å; T449-H452 VanDerWaalsContact O-N 3.07Å; T449-H452 PolarHBondContact OG1-ND1 2.9Å; T449-R453 PolarHBondContact O-N 2.88Å; T449-I475 HydrophobicContact CG2-CB 4.04Å; T449-I475 HydrophobicContact CG2-CD1 3.67Å; T449-I475 HydrophobicContact CG2-CG1 4.45Å; T449-I475 HydrophobicContact CG2-CG2 3.8Å
450	C	93.1	Very high	90	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.007	23%	0.228	C	C	.	.	H	α-helix	trans	-54.2	-32.3	169.9	59.1	0	0	0	0	113.1	L418 H419 A422 V440 R453 C454 L466	L418-C450 HydrophobicContact CG-CB 4.4Å; H419-C450 PolarHBondContact NE2-N 3.34Å; A422-C450 HydrophobicContact CB-CB 3.75Å; V440-C450 PolarHBondContact O-SG 2.77Å; C450-R453 PolarHBondContact O-N 3.24Å; C450-C454 PolarHBondContact O-N 3.09Å; C450-C454 PolarHBondContact O-SG 3.08Å; C450-C454 VanDerWaalsContact O-SG 3.36Å; C450-L466 HydrophobicContact CB-CD1 4.13Å; C450-L466 VanDerWaalsContact SG-CD2 3.53Å
451	L	94.5	Very high	89.9	Confident	7 Å²	7	48.4 Å²	48.4	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-64	-42.6	175.4	-175.7	66.3	0	0	0	112.3	T449 R453 C454 T455 C463 L466 L467 V471 A473 A483	T449-L451 PolarHBondContact O-N 2.81Å; T449-L451 PolarHBondContact OG1-N 2.87Å; L451-R453 VanDerWaalsContact C-N 3.29Å; L451-R453 PolarHBondContact O-N 3.27Å; L451-C454 PolarHBondContact O-N 3.48Å; L451-T455 WeakPolarHBondContact O-CB 3.38Å; L451-T455 PolarHBondContact O-N 2.89Å; L451-T455 PolarHBondContact O-OG1 3.48Å; L451-C463 HydrophobicContact CD1-CB 3.99Å; L451-L466 HydrophobicContact CD1-CB 4.46Å; L451-L467 HydrophobicContact CD1-CG 4.3Å; L451-L467 HydrophobicContact CD2-CD2 3.96Å; L451-V471 HydrophobicContact CB-CG1 4Å; L451-V471 HydrophobicContact CB-CG2 4.06Å; L451-V471 HydrophobicContact CD1-CG1 4.31Å; L451-V471 HydrophobicContact CD2-CG1 3.73Å; L451-V471 HydrophobicContact CG-CG1 4.21Å; L451-A473 HydrophobicContact CD2-CB 3.87Å; L451-A483 HydrophobicContact CB-CB 4.33Å; L451-A483 HydrophobicContact CD2-CB 3.81Å; L451-A483 HydrophobicContact CG-CB 3.75Å
452	H	91.6	Very high	89.8	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58.7	-43.4	177	-69.2	78.8	0	0	0	111.1	Q448 T449 T455 K456 I475 F481 A483 L486	Q448-H452 HydrophobicContact CB-CB 3.78Å; Q448-H452 HydrophobicContact CG-CB 4.02Å; T449-H452 PolarHBondContact N-ND1 3.5Å; T449-H452 WeakPolarHBondContact O-CB 3.28Å; T449-H452 PolarHBondContact O-N 3.03Å; T449-H452 VanDerWaalsContact O-N 3.07Å; T449-H452 PolarHBondContact OG1-ND1 2.9Å; H452-T455 PolarHBondContact O-N 3.01Å; H452-K456 WeakPolarHBondContact O-CB 3.49Å; H452-K456 PolarHBondContact O-N 3.22Å; H452-I475 PolarHBondContact CE1-O 3.31Å; H452-I475 PolarHBondContact NE2-O 3.35Å; H452-I475 VanDerWaalsContact NE2-O 3.15Å; H452-F481 PolarHBondContact NE2-O 2.96Å; H452-F481 VanDerWaalsContact NE2-O 3.16Å; H452-A483 HydrophobicContact CB-CB 4.38Å; H452-A483 PolarHBondContact CD2-N 2.72Å; H452-A483 PolarHBondContact NE2-N 2.76Å; H452-A483 VanDerWaalsContact NE2-N 3.13Å; H452-L486 HydrophobicContact CB-CD1 4.01Å
453	R	91.1	Very high	89.7	Confident	36 Å²	36	45.7 Å²	45.7	14%	0.136	24%	0.24	C	C	.	.	H	α-helix	trans	-69.9	-40.5	-179	-60.7	-176.9	77.2	116.3	-7.4	112.4	D423 D444 Q448 T449 C450 L451 T455 R457	D423-R453 WeakPolarHBondContact OD1-CB 3.3Å; D423-R453 IonicContact OD1-CZ 2.73Å; D423-R453 IonicContact OD1-NE 3.37Å; D423-R453 PolarHBondContact OD1-NE 3.1Å; D423-R453 IonicContact OD1-NH2 3.38Å; D423-R453 IonicContact OD2-CZ 2.64Å; D423-R453 IonicContact OD2-NE 2.74Å; D423-R453 PolarHBondContact OD2-NE 3.48Å; D423-R453 IonicContact OD2-NH2 2.73Å; D423-R453 PolarHBondContact OD2-NH2 3.43Å; D444-R453 WeakPolarHBondContact OD2-CD 3.5Å; D444-R453 IonicContact OD2-CZ 3.96Å; D444-R453 IonicContact OD2-NE 3.94Å; D444-R453 IonicContact OD2-NH1 2.73Å; D444-R453 PolarHBondContact OD2-NH1 3.22Å; Q448-R453 HydrophobicContact CB-CG 4.42Å; T449-R453 PolarHBondContact O-N 2.88Å; C450-R453 PolarHBondContact O-N 3.24Å; L451-R453 VanDerWaalsContact C-N 3.29Å; L451-R453 PolarHBondContact O-N 3.27Å; R453-T455 VanDerWaalsContact C-N 3.32Å; R453-T455 PolarHBondContact O-N 2.93Å; R453-R457 PolarHBondContact O-N 3Å
454	C	92	Very high	89.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-42.9	171.9	-73	0	0	0	0	111.6	A422 C450 L451 R457 N458 L459 C463 L466	A422-C454 VanDerWaalsContact CB-SG 3.57Å; C450-C454 PolarHBondContact O-N 3.09Å; C450-C454 PolarHBondContact O-SG 3.08Å; C450-C454 VanDerWaalsContact O-SG 3.36Å; L451-C454 PolarHBondContact O-N 3.48Å; C454-R457 CarbonylContact O-C 3.38Å; C454-R457 PolarHBondContact O-N 3.42Å; C454-N458 PolarHBondContact O-N 2.8Å; C454-N458 VanDerWaalsContact O-N 3.15Å; C454-L459 HydrophobicContact CB-CB 4.27Å; C454-L459 PolarHBondContact O-N 3.09Å; C454-C463 WeakPolarHBondContact CB-SG 3.41Å; C454-L466 HydrophobicContact CB-CD1 4.47Å
455	T	89.1	Confident	89.9	Confident	21 Å²	21	49.1 Å²	49.1	13%	0.129	25%	0.253	C	S	.	.	H	α-helix	trans	-66.8	-44.8	-178.1	-49.3	0	0	0	0	111.2	L451 H452 R453 R457 N458 A483 A487	L451-T455 WeakPolarHBondContact O-CB 3.38Å; L451-T455 PolarHBondContact O-N 2.89Å; L451-T455 PolarHBondContact O-OG1 3.48Å; H452-T455 PolarHBondContact O-N 3.01Å; R453-T455 VanDerWaalsContact C-N 3.32Å; R453-T455 PolarHBondContact O-N 2.93Å; T455-R457 PolarHBondContact O-N 3Å; T455-R457 VanDerWaalsContact O-N 3.13Å; T455-N458 PolarHBondContact O-N 3Å; T455-N458 PolarHBondContact O-OD1 3.05Å; T455-A483 WeakPolarHBondContact CG2-O 3.12Å; T455-A487 HydrophobicContact CG2-CB 3.4Å; T455-A487 VanDerWaalsContact CG2-CB 3.4Å
456	K	83	Confident	90.3	Very high	147 Å²	147	47.5 Å²	47.5	64%	0.639	24%	0.236	S	C	*	.	H	α-helix	trans	-57.4	-28	175.3	-175	176.2	179.2	177.5	0	113.3	H452	H452-K456 WeakPolarHBondContact O-CB 3.49Å; H452-K456 PolarHBondContact O-N 3.22Å
457	R	85	Confident	90.7	Very high	118 Å²	118	48 Å²	48	45%	0.445	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	5.3	179	-71.6	-174.6	168.1	94.8	-19.9	114.1	D423 R453 C454 T455 L459	D423-R457 VanDerWaalsContact CG-NH2 3.3Å; D423-R457 WeakPolarHBondContact O-CD 3.37Å; D423-R457 PolarHBondContact O-NE 3.32Å; D423-R457 IonicContact OD1-CZ 2.62Å; D423-R457 IonicContact OD1-NH1 3.46Å; D423-R457 PolarHBondContact OD1-NH1 3.28Å; D423-R457 IonicContact OD1-NH2 3.39Å; D423-R457 IonicContact OD2-CZ 2.69Å; D423-R457 IonicContact OD2-NH1 3.6Å; D423-R457 PolarHBondContact OD2-NH1 3.37Å; D423-R457 VanDerWaalsContact OD2-NH1 3.16Å; D423-R457 IonicContact OD2-NH2 3.61Å; D423-R457 PolarHBondContact OD2-NH2 2.72Å; R453-R457 PolarHBondContact O-N 3Å; C454-R457 CarbonylContact O-C 3.38Å; C454-R457 PolarHBondContact O-N 3.42Å; T455-R457 PolarHBondContact O-N 3Å; T455-R457 VanDerWaalsContact O-N 3.13Å; R457-L459 VanDerWaalsContact C-N 3.3Å; R457-L459 HydrophobicContact CB-CD1 3.86Å; R457-L459 HydrophobicContact CB-CG 3.85Å; R457-L459 PolarHBondContact O-N 2.8Å
458	N	84.1	Confident	90.9	Very high	136 Å²	136	53.3 Å²	53.3	73%	0.727	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	38.6	-176.8	-63.3	-34.8	0	0	0	114.1	C454 T455 S460	C454-N458 PolarHBondContact O-N 2.8Å; C454-N458 VanDerWaalsContact O-N 3.15Å; T455-N458 PolarHBondContact O-N 3Å; T455-N458 PolarHBondContact O-OD1 3.05Å; N458-S460 PolarHBondContact O-N 3.42Å; N458-S460 VanDerWaalsContact O-N 3.16Å
459	L	88.9	Confident	91	Very high	45 Å²	45	56.6 Å²	56.6	24%	0.236	28%	0.279	C	S	.	.			trans	-88.2	74.9	-178.8	-63.5	171.2	0	0	0	111.3	A422 C454 R457 E461 A462 C463	A422-L459 WeakPolarHBondContact O-CD1 3.48Å; C454-L459 HydrophobicContact CB-CB 4.27Å; C454-L459 PolarHBondContact O-N 3.09Å; R457-L459 VanDerWaalsContact C-N 3.3Å; R457-L459 HydrophobicContact CB-CD1 3.86Å; R457-L459 HydrophobicContact CB-CG 3.85Å; R457-L459 PolarHBondContact O-N 2.8Å; L459-E461 PolarHBondContact O-N 3.04Å; L459-A462 HydrophobicContact CB-CB 4.09Å; L459-A462 PolarHBondContact O-N 3.02Å; L459-C463 PolarHBondContact O-N 3.25Å; L459-C463 PolarHBondContact O-SG 3.12Å
460	S	88.5	Confident	90.8	Very high	90 Å²	90	59 Å²	59	63%	0.629	30%	0.304	S	S	*	.	H	α-helix	trans	-56.1	-46.4	-170.2	-52.1	0	0	0	0	114.5	N458 C463 K464	N458-S460 PolarHBondContact O-N 3.42Å; N458-S460 VanDerWaalsContact O-N 3.16Å; S460-C463 PolarHBondContact O-N 3.45Å; S460-K464 WeakPolarHBondContact O-CB 3.29Å; S460-K464 PolarHBondContact O-N 3.43Å
461	E	90.9	Very high	90.8	Very high	132 Å²	132	59.4 Å²	59.4	62%	0.617	31%	0.306	S	S	*	.	H	α-helix	trans	-65.4	-40.5	179.6	-71	-58	136.5	0	0	112.1	T427 L459 K464 L465	T427-E461 HydrophobicContact CG2-CB 4.2Å; L459-E461 PolarHBondContact O-N 3.04Å; E461-K464 PolarHBondContact O-N 3.12Å; E461-L465 WeakPolarHBondContact O-CB 3.45Å; E461-L465 PolarHBondContact O-N 3.24Å
462	A	92.2	Very high	90.7	Very high	2 Å²	2	62.2 Å²	62.2	2%	0.017	32%	0.321	C	S	.	.	H	α-helix	trans	-67.9	-39.1	175.7	0	0	0	0	0	111.6	I430 L459 L465 L466	I430-A462 HydrophobicContact CD1-CB 3.85Å; L459-A462 HydrophobicContact CB-CB 4.09Å; L459-A462 PolarHBondContact O-N 3.02Å; A462-L465 PolarHBondContact O-N 3.02Å; A462-L466 WeakPolarHBondContact O-CB 3.33Å; A462-L466 VanDerWaalsContact O-CG 3.23Å; A462-L466 WeakPolarHBondContact O-CG 3.49Å; A462-L466 PolarHBondContact O-N 3Å
463	C	91.8	Very high	90.6	Very high	20 Å²	20	64.4 Å²	64.4	14%	0.135	34%	0.339	C	S	.	.	H	α-helix	trans	-60.2	-48.1	174	-65	0	0	0	0	111.1	L451 C454 L459 S460 L465 L466 L467	L451-C463 HydrophobicContact CD1-CB 3.99Å; C454-C463 WeakPolarHBondContact CB-SG 3.41Å; L459-C463 PolarHBondContact O-N 3.25Å; L459-C463 PolarHBondContact O-SG 3.12Å; S460-C463 PolarHBondContact O-N 3.45Å; C463-L465 PolarHBondContact O-N 3.31Å; C463-L466 PolarHBondContact O-N 3Å; C463-L467 VanDerWaalsContact O-CG 3.3Å; C463-L467 WeakPolarHBondContact O-CG 3.45Å; C463-L467 PolarHBondContact O-N 2.95Å
464	K	93.7	Very high	90.5	Very high	119 Å²	119	66.5 Å²	66.5	52%	0.517	36%	0.36	S	S	.	.	H	α-helix	trans	-59.3	-48	177.6	-174.5	-177.9	176.4	-173	0	111.2	S460 E461 L466 L467 D468	S460-K464 WeakPolarHBondContact O-CB 3.29Å; S460-K464 PolarHBondContact O-N 3.43Å; E461-K464 PolarHBondContact O-N 3.12Å; K464-L466 VanDerWaalsContact C-N 3.34Å; K464-L466 PolarHBondContact O-N 2.93Å; K464-L467 PolarHBondContact O-N 3.17Å; K464-D468 WeakPolarHBondContact O-CB 3.4Å; K464-D468 VanDerWaalsContact O-CG 3.27Å; K464-D468 PolarHBondContact O-N 2.89Å
465	L	93.6	Very high	90.5	Very high	25 Å²	25	68.2 Å²	68.2	13%	0.131	37%	0.368	C	S	.	.	H	α-helix	trans	-58.2	-44.4	177.7	-179.1	61.9	0	0	0	112.3	T427 I430 N431 E461 A462 C463 D468 K469	T427-L465 HydrophobicContact CG2-CD2 4.21Å; T427-L465 WeakPolarHBondContact O-CD2 3.39Å; I430-L465 HydrophobicContact CB-CD2 3.99Å; I430-L465 HydrophobicContact CG2-CD2 3.64Å; I430-L465 HydrophobicContact CG2-CG 4.23Å; N431-L465 WeakPolarHBondContact OD1-CD1 3.32Å; E461-L465 WeakPolarHBondContact O-CB 3.45Å; E461-L465 PolarHBondContact O-N 3.24Å; A462-L465 PolarHBondContact O-N 3.02Å; C463-L465 PolarHBondContact O-N 3.31Å; L465-D468 PolarHBondContact O-N 3.4Å; L465-K469 HydrophobicContact CD1-CG 4.3Å; L465-K469 WeakPolarHBondContact O-CB 3.45Å; L465-K469 WeakPolarHBondContact O-CG 3.44Å; L465-K469 PolarHBondContact O-N 3.5Å
466	L	94.4	Very high	90.3	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-66	-39.3	179.2	-70.8	170.4	0	0	0	112.2	I430 I434 V440 C450 L451 C454 A462 C463 K464 K469 G470 V471	I430-L466 HydrophobicContact CG2-CD2 3.89Å; I430-L466 HydrophobicContact CG2-CG 4.48Å; I434-L466 HydrophobicContact CD1-CD2 4.03Å; V440-L466 HydrophobicContact CG1-CD2 4.5Å; C450-L466 HydrophobicContact CB-CD1 4.13Å; C450-L466 VanDerWaalsContact SG-CD2 3.53Å; L451-L466 HydrophobicContact CD1-CB 4.46Å; C454-L466 HydrophobicContact CB-CD1 4.47Å; A462-L466 WeakPolarHBondContact O-CB 3.33Å; A462-L466 VanDerWaalsContact O-CG 3.23Å; A462-L466 WeakPolarHBondContact O-CG 3.49Å; A462-L466 PolarHBondContact O-N 3Å; C463-L466 PolarHBondContact O-N 3Å; K464-L466 VanDerWaalsContact C-N 3.34Å; K464-L466 PolarHBondContact O-N 2.93Å; L466-K469 CarbonylContact O-C 3.41Å; L466-K469 PolarHBondContact O-N 3.32Å; L466-G470 PolarHBondContact O-N 3.01Å; L466-V471 VanDerWaalsContact C-CG1 3.48Å; L466-V471 HydrophobicContact CB-CB 4.25Å; L466-V471 HydrophobicContact CB-CG1 3.86Å; L466-V471 WeakPolarHBondContact O-CB 3.39Å; L466-V471 VanDerWaalsContact O-CG1 3.29Å; L466-V471 WeakPolarHBondContact O-CG1 3.2Å; L466-V471 PolarHBondContact O-N 3.41Å
467	L	92.8	Very high	90.5	Very high	88 Å²	88	64 Å²	64	46%	0.461	36%	0.355	S	S	.	.	H	α-helix	trans	-64	-45.3	174.3	-71	168.2	0	0	0	111.5	L451 C463 K464 K469 G470 V471 A473	L451-L467 HydrophobicContact CD1-CG 4.3Å; L451-L467 HydrophobicContact CD2-CD2 3.96Å; C463-L467 VanDerWaalsContact O-CG 3.3Å; C463-L467 WeakPolarHBondContact O-CG 3.45Å; C463-L467 PolarHBondContact O-N 2.95Å; K464-L467 PolarHBondContact O-N 3.17Å; L467-K469 PolarHBondContact O-N 3.21Å; L467-G470 PolarHBondContact O-N 3.06Å; L467-V471 HydrophobicContact CD2-CG1 4.07Å; L467-V471 HydrophobicContact CG-CG1 4.43Å; L467-A473 HydrophobicContact CD2-CB 4.14Å
468	D	93.3	Very high	90.4	Very high	122 Å²	122	64.6 Å²	64.6	65%	0.652	37%	0.366	S	S	*	.	H	α-helix	trans	-62.1	-30	176.3	-69.6	-14.9	0	0	0	111.8	K464 L465 G470	K464-D468 WeakPolarHBondContact O-CB 3.4Å; K464-D468 VanDerWaalsContact O-CG 3.27Å; K464-D468 PolarHBondContact O-N 2.89Å; L465-D468 PolarHBondContact O-N 3.4Å; D468-G470 VanDerWaalsContact C-N 3.32Å
469	K	93.4	Very high	90	Very high	80 Å²	80	63 Å²	63	35%	0.348	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	6.5	175.3	-64.2	-70.5	-173	169.3	0	113.8	N431 I434 L465 L466 L467	N431-K469 WeakPolarHBondContact OD1-CE 3.47Å; I434-K469 HydrophobicContact CD1-CB 4.01Å; I434-K469 HydrophobicContact CD1-CG 3.96Å; I434-K469 HydrophobicContact CG2-CB 4.29Å; I434-K469 HydrophobicContact CG2-CD 4Å; I434-K469 HydrophobicContact CG2-CG 4.24Å; L465-K469 HydrophobicContact CD1-CG 4.3Å; L465-K469 WeakPolarHBondContact O-CB 3.45Å; L465-K469 WeakPolarHBondContact O-CG 3.44Å; L465-K469 PolarHBondContact O-N 3.5Å; L466-K469 CarbonylContact O-C 3.41Å; L466-K469 PolarHBondContact O-N 3.32Å; L467-K469 PolarHBondContact O-N 3.21Å
470	G	90.4	Very high	89.6	Confident	51 Å²	51	62.9 Å²	62.9	53%	0.526	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	29.2	171.2	0	0	0	0	0	115.6	L466 L467 D468 D472	L466-G470 PolarHBondContact O-N 3.01Å; L467-G470 PolarHBondContact O-N 3.06Å; D468-G470 VanDerWaalsContact C-N 3.32Å; G470-D472 PolarHBondContact O-N 2.72Å
471	V	93	Very high	89.1	Confident	9 Å²	9	60.2 Å²	60.2	6%	0.055	34%	0.341	C	S	.	.			trans	-62.2	134.8	168.9	76	0	0	0	0	110.2	V440 L451 L466 L467 A473	V440-V471 HydrophobicContact CB-CB 4.17Å; V440-V471 HydrophobicContact CB-CG2 4.19Å; V440-V471 HydrophobicContact CG2-CB 4.23Å; V440-V471 HydrophobicContact CG2-CG2 4.44Å; L451-V471 HydrophobicContact CB-CG1 4Å; L451-V471 HydrophobicContact CB-CG2 4.06Å; L451-V471 HydrophobicContact CD1-CG1 4.31Å; L451-V471 HydrophobicContact CD2-CG1 3.73Å; L451-V471 HydrophobicContact CG-CG1 4.21Å; L466-V471 VanDerWaalsContact C-CG1 3.48Å; L466-V471 HydrophobicContact CB-CB 4.25Å; L466-V471 HydrophobicContact CB-CG1 3.86Å; L466-V471 WeakPolarHBondContact O-CB 3.39Å; L466-V471 VanDerWaalsContact O-CG1 3.29Å; L466-V471 WeakPolarHBondContact O-CG1 3.2Å; L466-V471 PolarHBondContact O-N 3.41Å; L467-V471 HydrophobicContact CD2-CG1 4.07Å; L467-V471 HydrophobicContact CG-CG1 4.43Å; V471-A473 PolarHBondContact O-N 3.3Å; V471-A473 VanDerWaalsContact O-N 3.17Å
472	D	92.4	Very high	89	Confident	65 Å²	65	55.5 Å²	55.5	35%	0.348	32%	0.321	S	S	.	.			trans	-77.4	104	178.2	-176.4	-0.3	0	0	0	110.1	N441 G470 S474 I475	N441-D472 PolarHBondContact OD1-N 2.97Å; G470-D472 PolarHBondContact O-N 2.72Å; D472-S474 VanDerWaalsContact CG-OG 3.27Å; D472-S474 PolarHBondContact O-N 3.07Å; D472-S474 WeakPolarHBondContact OD1-CA 3.32Å; D472-S474 VanDerWaalsContact OD1-CB 3.24Å; D472-S474 WeakPolarHBondContact OD1-CB 3.25Å; D472-S474 PolarHBondContact OD1-N 3Å; D472-S474 PolarHBondContact OD1-OG 3.5Å; D472-S474 PolarHBondContact OD2-OG 2.91Å; D472-I475 HydrophobicContact CB-CD1 3.83Å; D472-I475 HydrophobicContact CB-CG1 3.98Å
473	A	89.6	Confident	88.7	Confident	46 Å²	46	55.4 Å²	55.4	38%	0.38	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.7	178.1	0	0	0	0	0	113.7	L451 L467 V471	L451-A473 HydrophobicContact CD2-CB 3.87Å; L467-A473 HydrophobicContact CD2-CB 4.14Å; V471-A473 PolarHBondContact O-N 3.3Å; V471-A473 VanDerWaalsContact O-N 3.17Å
474	S	89.3	Confident	88.2	Confident	81 Å²	81	56.7 Å²	56.7	57%	0.566	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-14	177.9	77.6	0	0	0	0	113.7	D472 V476	D472-S474 VanDerWaalsContact CG-OG 3.27Å; D472-S474 PolarHBondContact O-N 3.07Å; D472-S474 WeakPolarHBondContact OD1-CA 3.32Å; D472-S474 VanDerWaalsContact OD1-CB 3.24Å; D472-S474 WeakPolarHBondContact OD1-CB 3.25Å; D472-S474 PolarHBondContact OD1-N 3Å; D472-S474 PolarHBondContact OD1-OG 3.5Å; D472-S474 PolarHBondContact OD2-OG 2.91Å; S474-V476 PolarHBondContact O-N 3.16Å
475	I	90.7	Very high	87.2	Confident	35 Å²	35	54.9 Å²	54.9	18%	0.179	33%	0.33	C	S	.	.			trans	-59.3	135.7	175.4	-66.8	172.3	0	0	0	109.5	N441 L443 T449 H452 D472 T482	N441-I475 HydrophobicContact CB-CD1 3.94Å; L443-I475 HydrophobicContact CD2-CG2 3.69Å; T449-I475 HydrophobicContact CG2-CB 4.04Å; T449-I475 HydrophobicContact CG2-CD1 3.67Å; T449-I475 HydrophobicContact CG2-CG1 4.45Å; T449-I475 HydrophobicContact CG2-CG2 3.8Å; H452-I475 PolarHBondContact CE1-O 3.31Å; H452-I475 PolarHBondContact NE2-O 3.35Å; H452-I475 VanDerWaalsContact NE2-O 3.15Å; D472-I475 HydrophobicContact CB-CD1 3.83Å; D472-I475 HydrophobicContact CB-CG1 3.98Å; I475-T482 WeakPolarHBondContact O-CA 3.44Å
476	V	85.7	Confident	86.2	Confident	73 Å²	73	55.8 Å²	55.8	44%	0.442	34%	0.335	S	S	.	.	B	Isolated β-bridge	trans	-105.2	144.8	175	-65.2	0	0	0	0	111	S474 G480 F481 T482	S474-V476 PolarHBondContact O-N 3.16Å; V476-G480 WeakPolarHBondContact CG1-O 3.33Å; V476-F481 CarbonylContact C-O 3.51Å; V476-F481 VanDerWaalsContact CA-O 3.31Å; V476-F481 WeakPolarHBondContact CA-O 3.29Å; V476-T482 HydrophobicContact CG1-CG2 3.72Å
477	N	86.5	Confident	85	Confident	7 Å²	7	58.8 Å²	58.8	4%	0.037	36%	0.36	C	S	.	.			trans	-74.1	179	172.1	71.3	8.6	0	0	0	112.3	G447 Q448 H479 G480 F481	G447-N477 WeakPolarHBondContact O-CA 3.47Å; Q448-N477 HydrophobicContact CG-CB 3.6Å; N477-H479 PolarHBondContact O-N 2.91Å; N477-H479 WeakPolarHBondContact OD1-CA 3.43Å; N477-H479 WeakPolarHBondContact OD1-CB 3.23Å; N477-H479 PolarHBondContact OD1-N 3.48Å; N477-G480 PolarHBondContact O-N 3.41Å; N477-G480 PolarHBondContact OD1-N 3.2Å; N477-G480 VanDerWaalsContact OD1-N 3.16Å; N477-F481 PolarHBondContact N-O 3.31Å; N477-F481 PolarHBondContact OD1-N 3.18Å; N477-F481 PolarHBondContact OD1-O 2.79Å
478	L	82	Confident	83.4	Confident	131 Å²	131	59.7 Å²	59.7	69%	0.686	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-16.1	177.2	-75.2	175.8	0	0	0	114	G445 L446 G480	G445-L478 VanDerWaalsContact O-CD1 3.32Å; G445-L478 WeakPolarHBondContact O-CD1 3.36Å; L446-L478 WeakPolarHBondContact O-CB 3.3Å; L446-L478 WeakPolarHBondContact O-CG 3.45Å; L446-L478 PolarHBondContact O-N 3.11Å; L478-G480 VanDerWaalsContact C-N 3.35Å
479	H	75.9	Confident	81.3	Confident	101 Å²	101	56.5 Å²	56.5	47%	0.468	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	3.2	173.6	-55.1	-80.2	0	0	0	112.8	N477 F481	N477-H479 PolarHBondContact O-N 2.91Å; N477-H479 WeakPolarHBondContact OD1-CA 3.43Å; N477-H479 WeakPolarHBondContact OD1-CB 3.23Å; N477-H479 PolarHBondContact OD1-N 3.48Å; H479-F481 HydrophobicContact CB-CD2 3.52Å; H479-F481 HydrophobicContact CB-CE2 3.62Å
480	G	80.9	Confident	78.8	Confident	44 Å²	44	55.9 Å²	55.9	45%	0.454	37%	0.371	S	S	.	.	S	Bend	trans	80.1	11.4	179.3	0	0	0	0	0	114.9	V476 N477 L478	V476-G480 WeakPolarHBondContact CG1-O 3.33Å; N477-G480 PolarHBondContact O-N 3.41Å; N477-G480 PolarHBondContact OD1-N 3.2Å; N477-G480 VanDerWaalsContact OD1-N 3.16Å; L478-G480 VanDerWaalsContact C-N 3.35Å
481	F	79.5	Confident	76.7	Confident	34 Å²	34	57.8 Å²	57.8	15%	0.149	37%	0.372	C	S	.	.			trans	-99.9	136.5	-177.9	-58.1	-63.5	0	0	0	112.3	H452 V476 N477 H479 Q485 L486 S490	H452-F481 PolarHBondContact NE2-O 2.96Å; H452-F481 VanDerWaalsContact NE2-O 3.16Å; V476-F481 CarbonylContact C-O 3.51Å; V476-F481 VanDerWaalsContact CA-O 3.31Å; V476-F481 WeakPolarHBondContact CA-O 3.29Å; N477-F481 PolarHBondContact N-O 3.31Å; N477-F481 PolarHBondContact OD1-N 3.18Å; N477-F481 PolarHBondContact OD1-O 2.79Å; H479-F481 HydrophobicContact CB-CD2 3.52Å; H479-F481 HydrophobicContact CB-CE2 3.62Å; F481-Q485 HydrophobicContact CB-CB 4.3Å; F481-Q485 HydrophobicContact CD1-CB 4.37Å; F481-L486 HydrophobicContact CB-CD2 4.4Å; F481-L486 HydrophobicContact CB-CG 4.17Å; F481-S490 WeakPolarHBondContact CE1-O 3.37Å
482	T	87.9	Confident	74.3	Confident	32 Å²	32	61.3 Å²	61.3	20%	0.196	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-74.2	162.8	166.6	67.3	0	0	0	0	111.3	I475 V476 G484 Q485 L486	I475-T482 WeakPolarHBondContact O-CA 3.44Å; V476-T482 HydrophobicContact CG1-CG2 3.72Å; T482-G484 PolarHBondContact O-N 2.91Å; T482-Q485 PolarHBondContact O-N 3.22Å; T482-Q485 VanDerWaalsContact O-N 3.11Å; T482-Q485 WeakPolarHBondContact OG1-CG 3.32Å; T482-Q485 PolarHBondContact OG1-N 3.15Å; T482-L486 PolarHBondContact O-N 3.01Å; T482-L486 VanDerWaalsContact O-N 3.07Å
483	A	84.9	Confident	72.4	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.008	41%	0.406	C	S	.	.	H	α-helix	trans	-55.9	-38.4	175.3	0	0	0	0	0	112.1	L451 H452 T455 L486 A487	L451-A483 HydrophobicContact CB-CB 4.33Å; L451-A483 HydrophobicContact CD2-CB 3.81Å; L451-A483 HydrophobicContact CG-CB 3.75Å; H452-A483 HydrophobicContact CB-CB 4.38Å; H452-A483 PolarHBondContact CD2-N 2.72Å; H452-A483 PolarHBondContact NE2-N 2.76Å; H452-A483 VanDerWaalsContact NE2-N 3.13Å; T455-A483 WeakPolarHBondContact CG2-O 3.12Å; A483-L486 PolarHBondContact O-N 3.13Å; A483-A487 PolarHBondContact O-N 2.98Å
484	G	81.3	Confident	71.5	Confident	46 Å²	46	63.7 Å²	63.7	47%	0.474	41%	0.412	S	S	.	.	H	α-helix	trans	-66.4	-39	176.5	0	0	0	0	0	113.6	T482 A487 T488	T482-G484 PolarHBondContact O-N 2.91Å; G484-A487 WeakPolarHBondContact O-CB 3.43Å; G484-A487 PolarHBondContact O-N 3.33Å; G484-T488 PolarHBondContact O-N 3.44Å
485	Q	73.5	Confident	71	Confident	81 Å²	81	63.9 Å²	63.9	38%	0.379	41%	0.406	S	S	.	.	H	α-helix	trans	-67	-38.6	176.9	-73.2	169.4	-27.9	0	0	111.9	F481 T482 A487 T488 G489	F481-Q485 HydrophobicContact CB-CB 4.3Å; F481-Q485 HydrophobicContact CD1-CB 4.37Å; T482-Q485 PolarHBondContact O-N 3.22Å; T482-Q485 VanDerWaalsContact O-N 3.11Å; T482-Q485 WeakPolarHBondContact OG1-CG 3.32Å; T482-Q485 PolarHBondContact OG1-N 3.15Å; Q485-A487 PolarHBondContact O-N 3.5Å; Q485-T488 PolarHBondContact O-N 3.32Å; Q485-T488 VanDerWaalsContact O-N 3.09Å; Q485-T488 PolarHBondContact O-OG1 3.35Å; Q485-G489 PolarHBondContact O-N 2.71Å
486	L	73.4	Confident	70.7	Confident	44 Å²	44	66 Å²	66	23%	0.23	41%	0.414	C	S	.	.	H	α-helix	trans	-59.4	-34.5	172	-77	173.9	0	0	0	112.3	H452 F481 T482 A483 T488 G489	H452-L486 HydrophobicContact CB-CD1 4.01Å; F481-L486 HydrophobicContact CB-CD2 4.4Å; F481-L486 HydrophobicContact CB-CG 4.17Å; T482-L486 PolarHBondContact O-N 3.01Å; T482-L486 VanDerWaalsContact O-N 3.07Å; A483-L486 PolarHBondContact O-N 3.13Å; L486-T488 VanDerWaalsContact C-N 3.27Å; L486-T488 PolarHBondContact O-N 3.17Å; L486-G489 PolarHBondContact O-N 3.3Å
487	A	68.6	Low	70.6	Confident	63 Å²	63	69.3 Å²	69.3	52%	0.521	42%	0.419	S	S	.	.	H	α-helix	trans	-63	-34.9	175.5	0	0	0	0	0	112.4	T455 A483 G484 Q485	T455-A487 HydrophobicContact CG2-CB 3.4Å; T455-A487 VanDerWaalsContact CG2-CB 3.4Å; A483-A487 PolarHBondContact O-N 2.98Å; G484-A487 WeakPolarHBondContact O-CB 3.43Å; G484-A487 PolarHBondContact O-N 3.33Å; Q485-A487 PolarHBondContact O-N 3.5Å
488	T	60.3	Low	70.5	Confident	108 Å²	108	72.1 Å²	72.1	66%	0.663	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.2	-175.5	57.2	0	0	0	0	114.5	G484 Q485 L486 S490	G484-T488 PolarHBondContact O-N 3.44Å; Q485-T488 PolarHBondContact O-N 3.32Å; Q485-T488 VanDerWaalsContact O-N 3.09Å; Q485-T488 PolarHBondContact O-OG1 3.35Å; L486-T488 VanDerWaalsContact C-N 3.27Å; L486-T488 PolarHBondContact O-N 3.17Å; T488-S490 VanDerWaalsContact C-N 3.32Å; T488-S490 PolarHBondContact O-N 2.9Å
489	G	47.5	Very low	70.9	Confident	55 Å²	55	65.9 Å²	65.9	57%	0.567	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	15.7	170.8	0	0	0	0	0	116.1	Q485 L486 T491	Q485-G489 PolarHBondContact O-N 2.71Å; L486-G489 PolarHBondContact O-N 3.3Å; G489-T491 VanDerWaalsContact C-N 3.25Å; G489-T491 PolarHBondContact O-N 3.19Å
490	S	41	Very low	71.7	Confident	66 Å²	66	62 Å²	62	46%	0.462	38%	0.382	S	S	.	.			trans	-83.6	64.3	176.9	70.1	0	0	0	0	111.6	F481 T488 A492	F481-S490 WeakPolarHBondContact CE1-O 3.37Å; T488-S490 VanDerWaalsContact C-N 3.32Å; T488-S490 PolarHBondContact O-N 2.9Å; S490-A492 VanDerWaalsContact C-N 3.28Å; S490-A492 PolarHBondContact O-N 3.46Å
491	T	46.9	Very low	72.1	Confident	91 Å²	91	65 Å²	65	56%	0.558	38%	0.384	S	S	*	.			trans	-73.9	79.4	172.5	52.3	0	0	0	0	109.9	G489 E493	G489-T491 VanDerWaalsContact C-N 3.25Å; G489-T491 PolarHBondContact O-N 3.19Å; T491-E493 PolarHBondContact O-N 3.08Å
492	A	42.1	Very low	72.7	Confident	83 Å²	83	63.8 Å²	63.8	69%	0.686	38%	0.381	S	S	*	.			trans	-79.8	62.8	168	0	0	0	0	0	109.7	S490	S490-A492 VanDerWaalsContact C-N 3.28Å; S490-A492 PolarHBondContact O-N 3.46Å
493	E	53.6	Low	73.1	Confident	91 Å²	91	62.3 Å²	62.3	43%	0.425	37%	0.371	S	S	.	.			trans	-59.9	137.5	159.1	-73.5	-176.7	166.3	0	0	107.6	T491 I495 Q498	T491-E493 PolarHBondContact O-N 3.08Å; E493-I495 PolarHBondContact O-N 2.99Å; E493-Q498 HydrophobicContact CB-CG 4.03Å; E493-Q498 PolarHBondContact O-NE2 3.36Å
494	S	71.1	Confident	73.5	Confident	71 Å²	71	65.2 Å²	65.2	50%	0.497	38%	0.384	S	S	.	.			trans	-47.3	128.2	176.8	177.1	0	0	0	0	109.7	E496 R497 Q498	S494-E496 PolarHBondContact O-N 3.25Å; S494-E496 VanDerWaalsContact O-N 3.08Å; S494-R497 WeakPolarHBondContact O-CB 3.14Å; S494-R497 PolarHBondContact O-N 3.32Å; S494-Q498 PolarHBondContact O-N 3.07Å
495	I	78	Confident	74	Confident	85 Å²	85	65.8 Å²	65.8	44%	0.436	38%	0.384	S	S	.	.	H	α-helix	trans	-53.6	-33.5	-176.9	-62.4	175.9	0	0	0	110.4	E493 Q498 M499 I514 I524	E493-I495 PolarHBondContact O-N 2.99Å; I495-Q498 PolarHBondContact O-N 3.14Å; I495-M499 WeakPolarHBondContact O-CB 3.14Å; I495-M499 PolarHBondContact O-N 3.29Å; I495-I514 HydrophobicContact CG2-CG2 3.5Å; I495-I524 HydrophobicContact CB-CD1 4.27Å; I495-I524 HydrophobicContact CG2-CD1 3.73Å; I495-I524 HydrophobicContact CG2-CG1 3.99Å
496	E	83.8	Confident	74.9	Confident	78 Å²	78	63.2 Å²	63.2	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-44.1	175.2	-61.7	177.1	164.9	0	0	112.9	S494 M499 L500 I524 C527	S494-E496 PolarHBondContact O-N 3.25Å; S494-E496 VanDerWaalsContact O-N 3.08Å; E496-M499 WeakPolarHBondContact O-CB 3.47Å; E496-M499 PolarHBondContact O-N 3.42Å; E496-L500 VanDerWaalsContact O-CG 3.31Å; E496-L500 WeakPolarHBondContact O-CG 3.39Å; E496-L500 PolarHBondContact O-N 3.35Å; E496-I524 HydrophobicContact CB-CD1 4.03Å; E496-I524 HydrophobicContact CG-CD1 3.61Å; E496-C527 HydrophobicContact CB-CB 4.03Å; E496-C527 HydrophobicContact CG-CB 3.85Å
497	R	84.3	Confident	75.8	Confident	143 Å²	143	64.1 Å²	64.1	54%	0.54	38%	0.384	S	S	.	.	H	α-helix	trans	-67.6	-39.7	178.7	-165.6	171.6	-173.4	130.9	5	111.1	S494 M499 L500 E501 E531	S494-R497 WeakPolarHBondContact O-CB 3.14Å; S494-R497 PolarHBondContact O-N 3.32Å; R497-M499 VanDerWaalsContact C-N 3.31Å; R497-M499 PolarHBondContact O-N 2.81Å; R497-L500 PolarHBondContact O-N 3.01Å; R497-E501 WeakPolarHBondContact O-CB 3.25Å; R497-E501 PolarHBondContact O-N 3.04Å; R497-E531 IonicContact CZ-OE2 3.44Å; R497-E531 IonicContact NH1-OE1 3.8Å; R497-E531 IonicContact NH1-OE2 3.5Å; R497-E531 PolarHBondContact NH1-OE2 3.46Å; R497-E531 IonicContact NH2-OE2 3.96Å
498	Q	85	Confident	77	Confident	66 Å²	66	62.8 Å²	62.8	31%	0.308	37%	0.368	S	S	.	.	H	α-helix	trans	-62.6	-40.2	174	-60.5	-176.8	29	0	0	111.3	E493 S494 I495 A502 I514	E493-Q498 HydrophobicContact CB-CG 4.03Å; E493-Q498 PolarHBondContact O-NE2 3.36Å; S494-Q498 PolarHBondContact O-N 3.07Å; I495-Q498 PolarHBondContact O-N 3.14Å; Q498-A502 WeakPolarHBondContact O-CB 3.29Å; Q498-A502 PolarHBondContact O-N 2.95Å; Q498-I514 HydrophobicContact CB-CD1 3.73Å
499	M	90.5	Very high	78.5	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-64.5	-47	178	-176.6	62	176.1	0	0	111.8	I495 E496 R497 A502 A503 V511 I514 L515 I524 L525 P537 L553	I495-M499 WeakPolarHBondContact O-CB 3.14Å; I495-M499 PolarHBondContact O-N 3.29Å; E496-M499 WeakPolarHBondContact O-CB 3.47Å; E496-M499 PolarHBondContact O-N 3.42Å; R497-M499 VanDerWaalsContact C-N 3.31Å; R497-M499 PolarHBondContact O-N 2.81Å; M499-A502 PolarHBondContact O-N 2.93Å; M499-A503 WeakPolarHBondContact O-CB 3.25Å; M499-A503 PolarHBondContact O-N 3.45Å; M499-V511 HydrophobicContact CE-CG1 3.91Å; M499-V511 HydrophobicContact SD-CB 4.42Å; M499-V511 HydrophobicContact SD-CG1 4.12Å; M499-V511 HydrophobicContact SD-CG2 4.25Å; M499-I514 HydrophobicContact CB-CD1 4.45Å; M499-I514 HydrophobicContact CB-CG2 4.16Å; M499-I514 HydrophobicContact SD-CB 4.44Å; M499-I514 HydrophobicContact SD-CG2 4.1Å; M499-L515 HydrophobicContact CE-CD1 3.89Å; M499-L515 HydrophobicContact CE-CD2 4.22Å; M499-L515 HydrophobicContact CE-CG 4Å; M499-L515 HydrophobicContact SD-CG 4.46Å; M499-I524 HydrophobicContact CB-CD1 3.97Å; M499-I524 HydrophobicContact CB-CG1 4.13Å; M499-I524 HydrophobicContact CG-CD1 4.43Å; M499-I524 HydrophobicContact CG-CG1 4.18Å; M499-L525 HydrophobicContact CE-CD1 4.33Å; M499-P537 HydrophobicContact CE-CB 4.21Å; M499-P537 HydrophobicContact CE-CG 4.21Å; M499-P537 HydrophobicContact CG-CB 4.48Å; M499-P537 HydrophobicContact CG-CG 3.83Å; M499-L553 HydrophobicContact CE-CD2 3.47Å; M499-L553 VanDerWaalsContact CE-CD2 3.47Å
500	L	92.7	Very high	80.4	Confident	19 Å²	19	61.7 Å²	61.7	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-62.4	-45.7	178.3	-68.3	166.1	0	0	0	111.8	E496 R497 A503 K504 D529 P537 F540	E496-L500 VanDerWaalsContact O-CG 3.31Å; E496-L500 WeakPolarHBondContact O-CG 3.39Å; E496-L500 PolarHBondContact O-N 3.35Å; R497-L500 PolarHBondContact O-N 3.01Å; L500-A503 PolarHBondContact O-N 2.79Å; L500-K504 WeakPolarHBondContact O-CB 3.43Å; L500-K504 PolarHBondContact O-N 2.91Å; L500-D529 HydrophobicContact CD1-CB 4Å; L500-P537 HydrophobicContact CD2-CG 3.94Å; L500-F540 HydrophobicContact CD2-CD2 3.95Å; L500-F540 HydrophobicContact CD2-CE2 3.92Å
501	E	89.3	Confident	82.9	Confident	108 Å²	108	58.5 Å²	58.5	51%	0.505	32%	0.321	S	S	.	.	H	α-helix	trans	-69.1	-39.3	179.9	-167.6	61.3	-156.9	0	0	111.5	R497 A503 K504 A505	R497-E501 WeakPolarHBondContact O-CB 3.25Å; R497-E501 PolarHBondContact O-N 3.04Å; E501-A503 VanDerWaalsContact C-N 3.33Å; E501-A503 PolarHBondContact O-N 3.32Å; E501-K504 PolarHBondContact O-N 3.42Å; E501-K504 IonicContact OE2-NZ 2.7Å; E501-A505 VanDerWaalsContact O-CB 3.22Å; E501-A505 WeakPolarHBondContact O-CB 3.18Å; E501-A505 PolarHBondContact O-N 2.96Å
502	A	92.2	Very high	85	Confident	9 Å²	9	57.1 Å²	57.1	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-61.6	-41.9	174.1	0	0	0	0	0	111.6	Q498 M499 A505 G506 D507 V511	Q498-A502 WeakPolarHBondContact O-CB 3.29Å; Q498-A502 PolarHBondContact O-N 2.95Å; M499-A502 PolarHBondContact O-N 2.93Å; A502-A505 PolarHBondContact O-N 3.37Å; A502-G506 PolarHBondContact O-N 3.17Å; A502-D507 HydrophobicContact CB-CB 4.36Å; A502-D507 PolarHBondContact O-N 3.46Å; A502-V511 HydrophobicContact CB-CG2 3.77Å
503	A	95.2	Very high	87.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.6	-41.3	177.5	0	0	0	0	0	112.7	M499 L500 E501 G506 P537 R546 V549	M499-A503 WeakPolarHBondContact O-CB 3.25Å; M499-A503 PolarHBondContact O-N 3.45Å; L500-A503 PolarHBondContact O-N 2.79Å; E501-A503 VanDerWaalsContact C-N 3.33Å; E501-A503 PolarHBondContact O-N 3.32Å; A503-G506 PolarHBondContact O-N 2.78Å; A503-P537 HydrophobicContact CB-CB 3.73Å; A503-R546 WeakPolarHBondContact O-CG 3.36Å; A503-V549 HydrophobicContact CB-CG1 4.31Å
504	K	94.2	Very high	88.9	Confident	63 Å²	63	55.9 Å²	55.9	27%	0.274	28%	0.281	S	S	.	.	H	α-helix	trans	-65.5	-44.6	174.8	-179.1	-177	172.4	-163.9	0	112.8	L500 E501 G506 F540 Y544 R546	L500-K504 WeakPolarHBondContact O-CB 3.43Å; L500-K504 PolarHBondContact O-N 2.91Å; E501-K504 PolarHBondContact O-N 3.42Å; E501-K504 IonicContact OE2-NZ 2.7Å; K504-G506 VanDerWaalsContact C-N 3.26Å; K504-G506 PolarHBondContact O-N 3.18Å; K504-F540 HydrophobicContact CB-CB 4.08Å; K504-F540 HydrophobicContact CB-CD1 4.12Å; K504-F540 HydrophobicContact CB-CG 4.28Å; K504-F540 HydrophobicContact CD-CD1 4.12Å; K504-F540 HydrophobicContact CD-CE1 4.34Å; K504-F540 HydrophobicContact CG-CD1 4.13Å; K504-Y544 HydrophobicContact CD-CE2 4.23Å; K504-Y544 HydrophobicContact CG-CD2 3.82Å; K504-Y544 HydrophobicContact CG-CE2 3.73Å; K504-Y544 HydrophobicContact CG-CG 4.34Å; K504-R546 PolarHBondContact O-NE 3Å; K504-R546 PolarHBondContact O-NH2 3.31Å
505	A	90	Very high	89.7	Confident	57 Å²	57	53.1 Å²	53.1	47%	0.471	26%	0.261	S	S	.	.	H	α-helix	trans	-70.8	-22.8	178.7	0	0	0	0	0	112.7	E501 A502	E501-A505 VanDerWaalsContact O-CB 3.22Å; E501-A505 WeakPolarHBondContact O-CB 3.18Å; E501-A505 PolarHBondContact O-N 2.96Å; A502-A505 PolarHBondContact O-N 3.37Å
506	G	93	Very high	90	Very high	27 Å²	27	57 Å²	57	28%	0.278	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	19.8	-173.9	0	0	0	0	0	113.5	A502 A503 K504 L508	A502-G506 PolarHBondContact O-N 3.17Å; A503-G506 PolarHBondContact O-N 2.78Å; K504-G506 VanDerWaalsContact C-N 3.26Å; K504-G506 PolarHBondContact O-N 3.18Å; G506-L508 PolarHBondContact O-N 2.87Å
507	D	93	Very high	89.8	Confident	64 Å²	64	59.8 Å²	59.8	34%	0.342	29%	0.291	S	S	.	.			trans	-80.2	83.3	179.3	-175.3	-5.2	0	0	0	111.1	A502 Q509 S510 V511	A502-D507 HydrophobicContact CB-CB 4.36Å; A502-D507 PolarHBondContact O-N 3.46Å; D507-Q509 PolarHBondContact O-N 3.24Å; D507-Q509 PolarHBondContact OD1-N 3.26Å; D507-Q509 VanDerWaalsContact OD1-N 3.12Å; D507-S510 VanDerWaalsContact CG-CB 3.46Å; D507-S510 VanDerWaalsContact CG-OG 3.25Å; D507-S510 PolarHBondContact O-N 3.26Å; D507-S510 PolarHBondContact OD1-N 3.37Å; D507-S510 WeakPolarHBondContact OD2-CB 3.43Å; D507-S510 PolarHBondContact OD2-OG 3.47Å; D507-V511 WeakPolarHBondContact O-CG2 3.31Å; D507-V511 PolarHBondContact O-N 3.39Å
508	L	93.5	Very high	89.5	Confident	34 Å²	34	54 Å²	54	18%	0.178	27%	0.273	C	S	.	.	H	α-helix	trans	-57.2	-33.6	178.3	-178.6	62.1	0	0	0	113	G506 K512 E548 V549 Y552	G506-L508 PolarHBondContact O-N 2.87Å; L508-K512 HydrophobicContact CD1-CD 4.36Å; L508-K512 HydrophobicContact CD1-CG 4.37Å; L508-K512 HydrophobicContact CG-CD 4.1Å; L508-K512 WeakPolarHBondContact O-CB 3.42Å; L508-K512 VanDerWaalsContact O-CG 3.28Å; L508-K512 WeakPolarHBondContact O-CG 3.15Å; L508-K512 PolarHBondContact O-N 3.47Å; L508-E548 HydrophobicContact CD2-CB 4.32Å; L508-V549 HydrophobicContact CB-CG2 4.18Å; L508-V549 HydrophobicContact CD1-CG2 4.43Å; L508-Y552 HydrophobicContact CD1-CD1 4.08Å; L508-Y552 HydrophobicContact CD1-CD2 4.47Å; L508-Y552 HydrophobicContact CD1-CG 3.77Å
509	Q	91.4	Very high	89.1	Confident	122 Å²	122	58.1 Å²	58.1	57%	0.57	30%	0.303	S	S	*	.	H	α-helix	trans	-72	-39.9	-177.9	-65.3	-59.3	-28.6	0	0	111	D507 R513	D507-Q509 PolarHBondContact O-N 3.24Å; D507-Q509 PolarHBondContact OD1-N 3.26Å; D507-Q509 VanDerWaalsContact OD1-N 3.12Å; Q509-R513 VanDerWaalsContact O-CB 3.29Å; Q509-R513 WeakPolarHBondContact O-CB 2.99Å; Q509-R513 PolarHBondContact O-N 3.47Å
510	S	88.2	Confident	88.6	Confident	18 Å²	18	62.3 Å²	62.3	13%	0.126	33%	0.325	C	S	.	.	H	α-helix	trans	-68.1	-41.6	174	-65.6	0	0	0	0	111.6	D507 K512 R513 I514	D507-S510 VanDerWaalsContact CG-CB 3.46Å; D507-S510 VanDerWaalsContact CG-OG 3.25Å; D507-S510 PolarHBondContact O-N 3.26Å; D507-S510 PolarHBondContact OD1-N 3.37Å; D507-S510 WeakPolarHBondContact OD2-CB 3.43Å; D507-S510 PolarHBondContact OD2-OG 3.47Å; S510-K512 PolarHBondContact O-N 2.88Å; S510-R513 PolarHBondContact O-N 3.47Å; S510-R513 PolarHBondContact OG-NH2 2.89Å; S510-R513 VanDerWaalsContact OG-NH2 3.16Å; S510-I514 WeakPolarHBondContact O-CB 3.33Å; S510-I514 WeakPolarHBondContact O-CD1 3.45Å; S510-I514 WeakPolarHBondContact O-CG1 3.41Å; S510-I514 PolarHBondContact O-N 3.3Å
511	V	93	Very high	88.1	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-55.7	-49.5	172.2	169.8	0	0	0	0	111.4	M499 A502 D507 R513 I514 L515 V549 Y552 L553	M499-V511 HydrophobicContact CE-CG1 3.91Å; M499-V511 HydrophobicContact SD-CB 4.42Å; M499-V511 HydrophobicContact SD-CG1 4.12Å; M499-V511 HydrophobicContact SD-CG2 4.25Å; A502-V511 HydrophobicContact CB-CG2 3.77Å; D507-V511 WeakPolarHBondContact O-CG2 3.31Å; D507-V511 PolarHBondContact O-N 3.39Å; V511-R513 VanDerWaalsContact C-N 3.33Å; V511-R513 PolarHBondContact O-N 2.85Å; V511-I514 PolarHBondContact O-N 2.74Å; V511-L515 HydrophobicContact CG1-CD1 3.89Å; V511-L515 WeakPolarHBondContact O-CB 3.36Å; V511-L515 PolarHBondContact O-N 3.25Å; V511-V549 HydrophobicContact CG2-CG1 4.27Å; V511-Y552 HydrophobicContact CG1-CD1 3.95Å; V511-Y552 HydrophobicContact CG1-CE1 4.22Å; V511-L553 HydrophobicContact CG1-CD2 4.02Å
512	K	92	Very high	87.7	Confident	62 Å²	62	64.6 Å²	64.6	27%	0.27	34%	0.344	S	S	.	.	H	α-helix	trans	-59.6	-42.2	176.6	-79.7	175.6	175.8	178.9	0	112.5	L508 S510 K516 Y552	L508-K512 HydrophobicContact CD1-CD 4.36Å; L508-K512 HydrophobicContact CD1-CG 4.37Å; L508-K512 HydrophobicContact CG-CD 4.1Å; L508-K512 WeakPolarHBondContact O-CB 3.42Å; L508-K512 VanDerWaalsContact O-CG 3.28Å; L508-K512 WeakPolarHBondContact O-CG 3.15Å; L508-K512 PolarHBondContact O-N 3.47Å; S510-K512 PolarHBondContact O-N 2.88Å; K512-K516 WeakPolarHBondContact O-CB 3.27Å; K512-K516 VanDerWaalsContact O-CG 3.26Å; K512-K516 WeakPolarHBondContact O-CG 3.45Å; K512-K516 PolarHBondContact O-N 3.07Å; K512-K516 VanDerWaalsContact O-N 3.16Å; K512-Y552 HydrophobicContact CD-CE2 4.28Å; K512-Y552 VanDerWaalsContact CE-CE2 3.46Å; K512-Y552 HydrophobicContact CG-CD1 4.18Å; K512-Y552 HydrophobicContact CG-CD2 4.39Å; K512-Y552 HydrophobicContact CG-CE1 3.65Å; K512-Y552 HydrophobicContact CG-CE2 3.87Å; K512-Y552 VanDerWaalsContact CG-CZ 3.5Å
513	R	88.7	Confident	87.3	Confident	135 Å²	135	66.8 Å²	66.8	51%	0.509	36%	0.359	S	S	.	.	H	α-helix	trans	-66.5	-46.9	-179.7	-166.3	-166.5	-44.8	133.2	15.6	110.9	Q509 S510 V511 K516 L517	Q509-R513 VanDerWaalsContact O-CB 3.29Å; Q509-R513 WeakPolarHBondContact O-CB 2.99Å; Q509-R513 PolarHBondContact O-N 3.47Å; S510-R513 PolarHBondContact O-N 3.47Å; S510-R513 PolarHBondContact OG-NH2 2.89Å; S510-R513 VanDerWaalsContact OG-NH2 3.16Å; V511-R513 VanDerWaalsContact C-N 3.33Å; V511-R513 PolarHBondContact O-N 2.85Å; R513-K516 PolarHBondContact O-N 3.12Å; R513-L517 HydrophobicContact CG-CD1 3.87Å; R513-L517 WeakPolarHBondContact O-CB 3.46Å; R513-L517 VanDerWaalsContact O-CG 3.3Å; R513-L517 WeakPolarHBondContact O-CG 3.4Å; R513-L517 PolarHBondContact O-N 3.45Å
514	I	88.1	Confident	87	Confident	12 Å²	12	67.1 Å²	67.1	6%	0.062	36%	0.361	C	S	.	.	H	α-helix	trans	-61.6	-48.9	-179.6	-70.8	163.8	0	0	0	110.5	I495 Q498 M499 S510 V511 K516 L517 S518 I524	I495-I514 HydrophobicContact CG2-CG2 3.5Å; Q498-I514 HydrophobicContact CB-CD1 3.73Å; M499-I514 HydrophobicContact CB-CD1 4.45Å; M499-I514 HydrophobicContact CB-CG2 4.16Å; M499-I514 HydrophobicContact SD-CB 4.44Å; M499-I514 HydrophobicContact SD-CG2 4.1Å; S510-I514 WeakPolarHBondContact O-CB 3.33Å; S510-I514 WeakPolarHBondContact O-CD1 3.45Å; S510-I514 WeakPolarHBondContact O-CG1 3.41Å; S510-I514 PolarHBondContact O-N 3.3Å; V511-I514 PolarHBondContact O-N 2.74Å; I514-K516 VanDerWaalsContact C-N 3.31Å; I514-K516 PolarHBondContact O-N 3.25Å; I514-L517 PolarHBondContact O-N 2.98Å; I514-S518 PolarHBondContact O-N 2.84Å; I514-I524 HydrophobicContact CG2-CG1 3.88Å
515	L	87.7	Confident	86.9	Confident	14 Å²	14	64.3 Å²	64.3	7%	0.073	35%	0.349	C	S	.	.	H	α-helix	trans	-63.6	-34.4	179.4	-76.9	166.3	0	0	0	113.1	M499 V511 C521 I524 L525 Y552	M499-L515 HydrophobicContact CE-CD1 3.89Å; M499-L515 HydrophobicContact CE-CD2 4.22Å; M499-L515 HydrophobicContact CE-CG 4Å; M499-L515 HydrophobicContact SD-CG 4.46Å; V511-L515 HydrophobicContact CG1-CD1 3.89Å; V511-L515 WeakPolarHBondContact O-CB 3.36Å; V511-L515 PolarHBondContact O-N 3.25Å; L515-C521 PolarHBondContact O-SG 3.01Å; L515-I524 HydrophobicContact CD2-CG2 3.67Å; L515-L525 HydrophobicContact CD1-CD1 4.04Å; L515-L525 HydrophobicContact CD2-CB 4.01Å; L515-L525 HydrophobicContact CD2-CD1 4.04Å; L515-Y552 HydrophobicContact CD1-CD1 4.4Å; L515-Y552 HydrophobicContact CD1-CE1 3.75Å
516	K	84.4	Confident	87	Confident	167 Å²	167	63.7 Å²	63.7	73%	0.726	34%	0.338	S	S	*	.	H	α-helix	trans	-73.6	-29.9	176.5	-77.3	178.7	179.3	-175.2	0	114.1	K512 R513 I514	K512-K516 WeakPolarHBondContact O-CB 3.27Å; K512-K516 VanDerWaalsContact O-CG 3.26Å; K512-K516 WeakPolarHBondContact O-CG 3.45Å; K512-K516 PolarHBondContact O-N 3.07Å; K512-K516 VanDerWaalsContact O-N 3.16Å; R513-K516 PolarHBondContact O-N 3.12Å; I514-K516 VanDerWaalsContact C-N 3.31Å; I514-K516 PolarHBondContact O-N 3.25Å
517	L	79.2	Confident	86.9	Confident	136 Å²	136	62.7 Å²	62.7	71%	0.712	33%	0.326	S	S	*	.	H	α-helix	trans	-90.6	-20.1	-177.4	-69.5	174	0	0	0	112.8	R513 I514	R513-L517 HydrophobicContact CG-CD1 3.87Å; R513-L517 WeakPolarHBondContact O-CB 3.46Å; R513-L517 VanDerWaalsContact O-CG 3.3Å; R513-L517 WeakPolarHBondContact O-CG 3.4Å; R513-L517 PolarHBondContact O-N 3.45Å; I514-L517 PolarHBondContact O-N 2.98Å
518	S	77.6	Confident	86.8	Confident	22 Å²	22	64.2 Å²	64.2	15%	0.154	33%	0.327	C	S	.	.			trans	-70.9	135.4	178.2	-171.8	0	0	0	0	111.3	I514 D520 C521	I514-S518 PolarHBondContact O-N 2.84Å; S518-D520 VanDerWaalsContact C-N 3.32Å; S518-D520 PolarHBondContact OG-N 2.78Å; S518-D520 PolarHBondContact OG-O 3.38Å; S518-C521 PolarHBondContact O-SG 3.05Å
519	T	76.4	Confident	86.5	Confident	152 Å²	152	64.4 Å²	64.4	93%	0.933	33%	0.328	S	S	*	.	S	Bend	trans	-77.1	-21.4	169.9	50.7	0	0	0	0	112.6
520	D	80.7	Confident	86.1	Confident	87 Å²	87	64 Å²	64	47%	0.465	33%	0.334	S	S	.	.			trans	-120.9	81.4	177.4	-172.8	-9.6	0	0	0	108.6	S518 D522 S523 I524	S518-D520 VanDerWaalsContact C-N 3.32Å; S518-D520 PolarHBondContact OG-N 2.78Å; S518-D520 PolarHBondContact OG-O 3.38Å; D520-D522 VanDerWaalsContact C-N 3.34Å; D520-S523 VanDerWaalsContact OD1-CB 3.28Å; D520-S523 WeakPolarHBondContact OD1-CB 3.39Å; D520-S523 PolarHBondContact OD1-N 3.21Å; D520-S523 WeakPolarHBondContact OD2-CB 3.48Å; D520-I524 WeakPolarHBondContact O-CG2 3.2Å; D520-I524 PolarHBondContact O-N 3.16Å
521	C	82.3	Confident	85.5	Confident	56 Å²	56	70.1 Å²	70.1	38%	0.378	36%	0.361	S	S	.	.	H	α-helix	trans	-65.4	-36.6	-177.2	-62.5	0	0	0	0	112.1	L515 S518 I524 L525	L515-C521 PolarHBondContact O-SG 3.01Å; S518-C521 PolarHBondContact O-SG 3.05Å; C521-I524 WeakPolarHBondContact O-CG2 3.49Å; C521-L525 WeakPolarHBondContact O-CB 3.35Å; C521-L525 PolarHBondContact O-N 2.86Å
522	D	80.4	Confident	85.2	Confident	119 Å²	119	71.6 Å²	71.6	64%	0.636	38%	0.376	S	S	*	.	H	α-helix	trans	-72.4	-41.7	-175.2	-71.4	-9.8	0	0	0	111.5	D520 N526	D520-D522 VanDerWaalsContact C-N 3.34Å; D522-N526 PolarHBondContact O-N 3.45Å; D522-N526 PolarHBondContact O-ND2 2.93Å
523	S	84	Confident	85	Confident	56 Å²	56	75 Å²	75	39%	0.392	39%	0.387	S	S	.	.	H	α-helix	trans	-64.3	-43.3	174.9	-174.4	0	0	0	0	111.4	D520 N526 C527	D520-S523 VanDerWaalsContact OD1-CB 3.28Å; D520-S523 WeakPolarHBondContact OD1-CB 3.39Å; D520-S523 PolarHBondContact OD1-N 3.21Å; D520-S523 WeakPolarHBondContact OD2-CB 3.48Å; S523-N526 CarbonylContact O-C 3.54Å; S523-N526 PolarHBondContact O-N 3.32Å; S523-C527 WeakPolarHBondContact O-CA 3.34Å; S523-C527 PolarHBondContact O-N 2.72Å
524	I	89.7	Confident	85.1	Confident	7 Å²	7	71.4 Å²	71.4	4%	0.036	38%	0.378	C	S	.	.	H	α-helix	trans	-71.3	-34.6	-179.8	-166.9	61.6	0	0	0	112.4	I495 E496 M499 I514 L515 D520 C521 N526 C527	I495-I524 HydrophobicContact CB-CD1 4.27Å; I495-I524 HydrophobicContact CG2-CD1 3.73Å; I495-I524 HydrophobicContact CG2-CG1 3.99Å; E496-I524 HydrophobicContact CB-CD1 4.03Å; E496-I524 HydrophobicContact CG-CD1 3.61Å; M499-I524 HydrophobicContact CB-CD1 3.97Å; M499-I524 HydrophobicContact CB-CG1 4.13Å; M499-I524 HydrophobicContact CG-CD1 4.43Å; M499-I524 HydrophobicContact CG-CG1 4.18Å; I514-I524 HydrophobicContact CG2-CG1 3.88Å; L515-I524 HydrophobicContact CD2-CG2 3.67Å; D520-I524 WeakPolarHBondContact O-CG2 3.2Å; D520-I524 PolarHBondContact O-N 3.16Å; C521-I524 WeakPolarHBondContact O-CG2 3.49Å; I524-N526 VanDerWaalsContact C-N 3.3Å; I524-N526 PolarHBondContact O-N 3.07Å; I524-C527 HydrophobicContact CD1-CB 4.41Å; I524-C527 WeakPolarHBondContact O-CB 3.11Å; I524-C527 PolarHBondContact O-N 3.06Å; I524-C527 PolarHBondContact O-SG 3.43Å
525	L	91.1	Very high	85.5	Confident	3 Å²	3	71 Å²	71	2%	0.016	38%	0.377	C	S	.	.	H	α-helix	trans	-64.6	-36.9	178.9	-176.8	66	0	0	0	111.9	M499 L515 C521 L553 S556 G557 A558	M499-L525 HydrophobicContact CE-CD1 4.33Å; L515-L525 HydrophobicContact CD1-CD1 4.04Å; L515-L525 HydrophobicContact CD2-CB 4.01Å; L515-L525 HydrophobicContact CD2-CD1 4.04Å; C521-L525 WeakPolarHBondContact O-CB 3.35Å; C521-L525 PolarHBondContact O-N 2.86Å; L525-L553 HydrophobicContact CD1-CD2 3.56Å; L525-S556 WeakPolarHBondContact CD2-O 3.49Å; L525-G557 VanDerWaalsContact CD2-C 3.41Å; L525-A558 HydrophobicContact CD1-CB 4.2Å; L525-A558 HydrophobicContact CD2-CB 4.37Å; L525-A558 HydrophobicContact CG-CB 4.09Å
526	N	92.5	Very high	85.9	Confident	45 Å²	45	70.4 Å²	70.4	24%	0.241	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	23.5	178.8	-64.9	-65.8	0	0	0	112.9	D522 S523 I524 N559	D522-N526 PolarHBondContact O-N 3.45Å; D522-N526 PolarHBondContact O-ND2 2.93Å; S523-N526 CarbonylContact O-C 3.54Å; S523-N526 PolarHBondContact O-N 3.32Å; I524-N526 VanDerWaalsContact C-N 3.3Å; I524-N526 PolarHBondContact O-N 3.07Å; N526-N559 WeakPolarHBondContact OD1-CB 3.04Å; N526-N559 PolarHBondContact OD1-N 2.76Å
527	C	91.3	Very high	86.5	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.034	34%	0.339	C	S	.	.			trans	-59.1	155.2	178	69.8	0	0	0	0	110	E496 S523 I524 T536 P537	E496-C527 HydrophobicContact CB-CB 4.03Å; E496-C527 HydrophobicContact CG-CB 3.85Å; S523-C527 WeakPolarHBondContact O-CA 3.34Å; S523-C527 PolarHBondContact O-N 2.72Å; I524-C527 HydrophobicContact CD1-CB 4.41Å; I524-C527 WeakPolarHBondContact O-CB 3.11Å; I524-C527 PolarHBondContact O-N 3.06Å; I524-C527 PolarHBondContact O-SG 3.43Å; C527-T536 WeakPolarHBondContact O-CA 3.46Å; C527-P537 VanDerWaalsContact O-CD 3.23Å; C527-P537 WeakPolarHBondContact O-CD 3.3Å
528	R	90	Very high	87.4	Confident	96 Å²	96	56 Å²	56	36%	0.362	31%	0.305	S	S	.	.			trans	-119.1	139.8	-174.9	-67.7	179.7	175	-95.5	8.8	110.6	V530 N534 T536 R563	R528-V530 PolarHBondContact O-N 2.84Å; R528-N534 PolarHBondContact NH1-O 3.24Å; R528-T536 HydrophobicContact CG-CG2 4.34Å; R528-R563 PolarHBondContact NH1-O 3.03Å
529	D	88.7	Confident	88.4	Confident	38 Å²	38	55 Å²	55	20%	0.203	30%	0.298	C	S	.	.			trans	-69.9	83	166	173.8	22.2	0	0	0	110.1	L500 E531 G532 N534 S535 F540	L500-D529 HydrophobicContact CD1-CB 4Å; D529-E531 PolarHBondContact O-N 3.2Å; D529-E531 PolarHBondContact OD1-N 3.02Å; D529-G532 PolarHBondContact O-N 2.98Å; D529-G532 PolarHBondContact OD1-N 3.49Å; D529-G532 VanDerWaalsContact OD2-CA 3.26Å; D529-G532 WeakPolarHBondContact OD2-CA 3.22Å; D529-G532 PolarHBondContact OD2-N 2.84Å; D529-N534 WeakPolarHBondContact O-CA 3.39Å; D529-N534 PolarHBondContact O-N 3.35Å; D529-N534 PolarHBondContact O-OD1 3.44Å; D529-S535 PolarHBondContact N-O 2.93Å; D529-F540 HydrophobicContact CB-CE2 4.02Å; D529-F540 HydrophobicContact CB-CZ 4.25Å
530	V	82.1	Confident	89.3	Confident	113 Å²	113	49.5 Å²	49.5	69%	0.685	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.4	-178.7	-71.3	0	0	0	0	113.6	R528 N534	R528-V530 PolarHBondContact O-N 2.84Å; V530-N534 WeakPolarHBondContact CA-OD1 3.31Å
531	E	76	Confident	90.1	Very high	147 Å²	147	45.3 Å²	45.3	69%	0.687	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-26.2	178.7	-67.4	177.9	176.2	0	0	111.7	R497 D529	R497-E531 IonicContact CZ-OE2 3.44Å; R497-E531 IonicContact NH1-OE1 3.8Å; R497-E531 IonicContact NH1-OE2 3.5Å; R497-E531 PolarHBondContact NH1-OE2 3.46Å; R497-E531 IonicContact NH2-OE2 3.96Å; D529-E531 PolarHBondContact O-N 3.2Å; D529-E531 PolarHBondContact OD1-N 3.02Å
532	G	85.9	Confident	90.9	Very high	32 Å²	32	42.7 Å²	42.7	33%	0.33	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-117.8	-179.2	0	0	0	0	0	114.3	D529	D529-G532 PolarHBondContact O-N 2.98Å; D529-G532 PolarHBondContact OD1-N 3.49Å; D529-G532 VanDerWaalsContact OD2-CA 3.26Å; D529-G532 WeakPolarHBondContact OD2-CA 3.22Å; D529-G532 PolarHBondContact OD2-N 2.84Å
533	R	88.3	Confident	91.6	Very high	133 Å²	133	37.4 Å²	37.4	50%	0.502	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	14	-172.4	-75.8	-167.4	-108.6	138.4	-7.4	113.6	S535 D564 K565	R533-S535 WeakPolarHBondContact CB-OG 3.27Å; R533-S535 PolarHBondContact O-N 3.26Å; R533-S535 VanDerWaalsContact O-N 3.14Å; R533-D564 CarbonylContact O-C 3.58Å; R533-D564 VanDerWaalsContact O-CB 3.32Å; R533-D564 WeakPolarHBondContact O-CB 3.25Å; R533-K565 VanDerWaalsContact O-CB 3.28Å; R533-K565 WeakPolarHBondContact O-CB 3.24Å; R533-K565 PolarHBondContact O-N 2.87Å
534	N	91.3	Very high	92.2	Very high	60 Å²	60	40.2 Å²	40.2	32%	0.321	20%	0.197	S	C	.	.			trans	55.1	25.3	-171	-74.4	-9.8	0	0	0	113.3	R528 D529 V530	R528-N534 PolarHBondContact NH1-O 3.24Å; D529-N534 WeakPolarHBondContact O-CA 3.39Å; D529-N534 PolarHBondContact O-N 3.35Å; D529-N534 PolarHBondContact O-OD1 3.44Å; V530-N534 WeakPolarHBondContact CA-OD1 3.31Å
535	S	96.1	Very high	92.5	Very high	4 Å²	4	43.2 Å²	43.2	3%	0.028	21%	0.214	C	C	.	.			trans	-72.7	145.5	-180	-58.3	0	0	0	0	110.6	D529 R533	D529-S535 PolarHBondContact N-O 2.93Å; R533-S535 WeakPolarHBondContact CB-OG 3.27Å; R533-S535 PolarHBondContact O-N 3.26Å; R533-S535 VanDerWaalsContact O-N 3.14Å
536	T	96.2	Very high	92.9	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	23%	0.229	C	C	.	.			trans	-89.6	166.6	176.2	66.3	0	0	0	0	111.6	C527 R528 L538 H539 F540 A562	C527-T536 WeakPolarHBondContact O-CA 3.46Å; R528-T536 HydrophobicContact CG-CG2 4.34Å; T536-L538 PolarHBondContact O-N 2.89Å; T536-L538 VanDerWaalsContact O-N 3.11Å; T536-H539 PolarHBondContact N-ND1 3.5Å; T536-H539 VanDerWaalsContact N-ND1 3.18Å; T536-H539 WeakPolarHBondContact O-CB 3.43Å; T536-H539 PolarHBondContact O-N 3.16Å; T536-H539 PolarHBondContact OG1-ND1 3.07Å; T536-F540 WeakPolarHBondContact O-CD2 3.19Å; T536-F540 PolarHBondContact O-N 3.26Å; T536-A562 HydrophobicContact CG2-CB 3.73Å
537	P	96.9	Very high	93.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-49.5	-37.3	171.7	-30.9	36.5	0	0	0	113.1	M499 L500 A503 C527 F540 A541 L553	M499-P537 HydrophobicContact CE-CB 4.21Å; M499-P537 HydrophobicContact CE-CG 4.21Å; M499-P537 HydrophobicContact CG-CB 4.48Å; M499-P537 HydrophobicContact CG-CG 3.83Å; L500-P537 HydrophobicContact CD2-CG 3.94Å; A503-P537 HydrophobicContact CB-CB 3.73Å; C527-P537 VanDerWaalsContact O-CD 3.23Å; C527-P537 WeakPolarHBondContact O-CD 3.3Å; P537-F540 PolarHBondContact O-N 3.44Å; P537-A541 WeakPolarHBondContact O-CB 3.5Å; P537-A541 PolarHBondContact O-N 2.9Å; P537-L553 HydrophobicContact CB-CD1 3.96Å; P537-L553 HydrophobicContact CB-CD2 4.4Å
538	L	97.9	Very high	93.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-66.8	-37.3	178.5	-172.1	61.7	0	0	0	112.8	T536 F540 A541 A542 V550 L553 V554 A558 L560 P570 L586	T536-L538 PolarHBondContact O-N 2.89Å; T536-L538 VanDerWaalsContact O-N 3.11Å; L538-F540 VanDerWaalsContact C-N 3.35Å; L538-F540 PolarHBondContact O-N 2.94Å; L538-A541 PolarHBondContact O-N 2.94Å; L538-A542 WeakPolarHBondContact O-CB 3.48Å; L538-A542 PolarHBondContact O-N 3.2Å; L538-V550 HydrophobicContact CD1-CB 4.47Å; L538-V550 HydrophobicContact CD1-CG1 3.9Å; L538-V550 HydrophobicContact CD1-CG2 4.5Å; L538-L553 HydrophobicContact CB-CD1 4.46Å; L538-L553 HydrophobicContact CD1-CB 4.3Å; L538-L553 HydrophobicContact CD1-CD1 4.41Å; L538-V554 HydrophobicContact CD1-CG2 4.02Å; L538-V554 HydrophobicContact CD2-CG2 4.45Å; L538-A558 HydrophobicContact CB-CB 4.37Å; L538-A558 HydrophobicContact CD2-CB 4.12Å; L538-L560 HydrophobicContact CD2-CD2 3.8Å; L538-P570 HydrophobicContact CB-CG 4.22Å; L538-P570 HydrophobicContact CD2-CB 4.2Å; L538-P570 HydrophobicContact CD2-CG 3.85Å; L538-P570 HydrophobicContact CG-CB 3.92Å; L538-P570 HydrophobicContact CG-CG 3.85Å; L538-L586 HydrophobicContact CD1-CD2 4.25Å; L538-L586 HydrophobicContact CD2-CD2 4.31Å
539	H	97.9	Very high	93.7	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-61.9	-42.8	174.2	-73.7	86	0	0	0	112.2	T536 G543 A562 L568 P570 N573	T536-H539 PolarHBondContact N-ND1 3.5Å; T536-H539 VanDerWaalsContact N-ND1 3.18Å; T536-H539 WeakPolarHBondContact O-CB 3.43Å; T536-H539 PolarHBondContact O-N 3.16Å; T536-H539 PolarHBondContact OG1-ND1 3.07Å; H539-G543 PolarHBondContact O-N 3.33Å; H539-A562 PolarHBondContact CE1-O 2.94Å; H539-A562 PolarHBondContact NE2-O 3.3Å; H539-A562 VanDerWaalsContact NE2-O 3.16Å; H539-L568 PolarHBondContact NE2-O 2.97Å; H539-P570 WeakPolarHBondContact NE2-CD 3.41Å; H539-N573 PolarHBondContact O-ND2 2.83Å
540	F	97	Very high	94.1	Very high	35 Å²	35	45.9 Å²	45.9	15%	0.154	22%	0.224	C	C	.	.	H	α-helix	trans	-66.8	-51	177.6	-76.9	-73.1	0	0	0	110.7	L500 K504 D529 T536 P537 L538 A542 G543 Y544	L500-F540 HydrophobicContact CD2-CD2 3.95Å; L500-F540 HydrophobicContact CD2-CE2 3.92Å; K504-F540 HydrophobicContact CB-CB 4.08Å; K504-F540 HydrophobicContact CB-CD1 4.12Å; K504-F540 HydrophobicContact CB-CG 4.28Å; K504-F540 HydrophobicContact CD-CD1 4.12Å; K504-F540 HydrophobicContact CD-CE1 4.34Å; K504-F540 HydrophobicContact CG-CD1 4.13Å; D529-F540 HydrophobicContact CB-CE2 4.02Å; D529-F540 HydrophobicContact CB-CZ 4.25Å; T536-F540 WeakPolarHBondContact O-CD2 3.19Å; T536-F540 PolarHBondContact O-N 3.26Å; P537-F540 PolarHBondContact O-N 3.44Å; L538-F540 VanDerWaalsContact C-N 3.35Å; L538-F540 PolarHBondContact O-N 2.94Å; F540-A542 PolarHBondContact O-N 2.87Å; F540-G543 PolarHBondContact O-N 3.12Å; F540-Y544 HydrophobicContact CD1-CD2 4.27Å; F540-Y544 AromaticContact CD1-CE2 3.9Å; F540-Y544 HydrophobicContact CD1-CE2 3.9Å; F540-Y544 WeakPolarHBondContact O-CB 3.38Å; F540-Y544 VanDerWaalsContact O-CD2 3.3Å; F540-Y544 WeakPolarHBondContact O-CD2 3.49Å; F540-Y544 PolarHBondContact O-N 3.24Å
541	A	97.7	Very high	94.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-58.4	-39.5	178.8	0	0	0	0	0	111.6	P537 L538 N545 R546 V549 V550 L553	P537-A541 WeakPolarHBondContact O-CB 3.5Å; P537-A541 PolarHBondContact O-N 2.9Å; L538-A541 PolarHBondContact O-N 2.94Å; A541-N545 PolarHBondContact O-N 3.22Å; A541-R546 HydrophobicContact CB-CB 4.12Å; A541-R546 PolarHBondContact O-N 2.9Å; A541-V549 HydrophobicContact CB-CB 4.31Å; A541-V549 HydrophobicContact CB-CG1 3.88Å; A541-V550 HydrophobicContact CB-CG2 3.6Å; A541-L553 HydrophobicContact CB-CD1 4.1Å
542	A	97.5	Very high	95.9	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.1	-50.5	177.2	0	0	0	0	0	112.5	L538 F540 Y544 N545 P570 A574 H579 V582 L586	L538-A542 WeakPolarHBondContact O-CB 3.48Å; L538-A542 PolarHBondContact O-N 3.2Å; F540-A542 PolarHBondContact O-N 2.87Å; A542-Y544 VanDerWaalsContact C-N 3.34Å; A542-Y544 PolarHBondContact O-N 3.45Å; A542-N545 PolarHBondContact O-N 2.89Å; A542-P570 HydrophobicContact CB-CB 4.12Å; A542-P570 WeakPolarHBondContact CB-O 3.46Å; A542-A574 HydrophobicContact CB-CB 4.4Å; A542-H579 PolarHBondContact O-CD2 3.14Å; A542-V582 HydrophobicContact CB-CG1 4Å; A542-L586 HydrophobicContact CB-CD1 4.15Å
543	G	96	Very high	96.4	Very high	8 Å²	8	37.5 Å²	37.5	8%	0.082	17%	0.166	C	C	.	.	H	α-helix	trans	-69.1	-26.1	-178.5	0	0	0	0	0	114.8	H539 F540 H579	H539-G543 PolarHBondContact O-N 3.33Å; F540-G543 PolarHBondContact O-N 3.12Å; G543-H579 PolarHBondContact O-CD2 3.29Å; G543-H579 PolarHBondContact O-NE2 3.33Å
544	Y	96.6	Very high	96.8	Very high	115 Å²	115	32.1 Å²	32.1	45%	0.451	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	14.6	179.2	-73.3	-81.5	0	0	0	114	K504 F540 A542 R546	K504-Y544 HydrophobicContact CD-CE2 4.23Å; K504-Y544 HydrophobicContact CG-CD2 3.82Å; K504-Y544 HydrophobicContact CG-CE2 3.73Å; K504-Y544 HydrophobicContact CG-CG 4.34Å; F540-Y544 HydrophobicContact CD1-CD2 4.27Å; F540-Y544 AromaticContact CD1-CE2 3.9Å; F540-Y544 HydrophobicContact CD1-CE2 3.9Å; F540-Y544 WeakPolarHBondContact O-CB 3.38Å; F540-Y544 VanDerWaalsContact O-CD2 3.3Å; F540-Y544 WeakPolarHBondContact O-CD2 3.49Å; F540-Y544 PolarHBondContact O-N 3.24Å; A542-Y544 VanDerWaalsContact C-N 3.34Å; A542-Y544 PolarHBondContact O-N 3.45Å; Y544-R546 WeakPolarHBondContact O-CD 3.43Å; Y544-R546 PolarHBondContact O-N 3.46Å; Y544-R546 PolarHBondContact O-NE 2.94Å
545	N	96.7	Very high	96.9	Very high	70 Å²	70	36.5 Å²	36.5	37%	0.374	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	48.7	178.4	-160	10.7	0	0	0	114.4	A541 A542 L547 H579 V582	A541-N545 PolarHBondContact O-N 3.22Å; A542-N545 PolarHBondContact O-N 2.89Å; N545-L547 PolarHBondContact O-N 2.97Å; N545-H579 HydrophobicContact CB-CB 4.4Å; N545-H579 WeakPolarHBondContact CB-ND1 3.32Å; N545-V582 WeakPolarHBondContact OD1-CG2 3.26Å
546	R	97.8	Very high	96.8	Very high	90 Å²	90	38.4 Å²	38.4	34%	0.34	18%	0.18	S	C	.	.			trans	-98.1	63.6	-178.7	-51.9	-51.4	-170.6	-166.6	0.9	111.1	A503 K504 A541 Y544 E548 V549 V550	A503-R546 WeakPolarHBondContact O-CG 3.36Å; K504-R546 PolarHBondContact O-NE 3Å; K504-R546 PolarHBondContact O-NH2 3.31Å; A541-R546 HydrophobicContact CB-CB 4.12Å; A541-R546 PolarHBondContact O-N 2.9Å; Y544-R546 WeakPolarHBondContact O-CD 3.43Å; Y544-R546 PolarHBondContact O-N 3.46Å; Y544-R546 PolarHBondContact O-NE 2.94Å; R546-E548 VanDerWaalsContact C-N 3.34Å; R546-E548 PolarHBondContact O-N 3.07Å; R546-E548 VanDerWaalsContact O-N 3.17Å; R546-V549 HydrophobicContact CB-CB 4.01Å; R546-V549 HydrophobicContact CB-CG2 4.34Å; R546-V549 WeakPolarHBondContact O-CA 3.45Å; R546-V549 WeakPolarHBondContact O-CB 3.43Å; R546-V549 PolarHBondContact O-N 2.74Å; R546-V550 WeakPolarHBondContact O-CG2 3.38Å; R546-V550 PolarHBondContact O-N 3.47Å
547	L	96.6	Very high	96.6	Very high	47 Å²	47	40.8 Å²	40.8	25%	0.246	21%	0.205	C	C	.	.	H	α-helix	trans	-45.7	-50.9	-171.9	-177.7	64.1	0	0	0	114.3	N545 V549 V550 K551 E581 V582 L585	N545-L547 PolarHBondContact O-N 2.97Å; L547-V549 VanDerWaalsContact C-N 3.29Å; L547-V549 PolarHBondContact O-N 2.99Å; L547-V550 PolarHBondContact O-N 3.29Å; L547-K551 WeakPolarHBondContact O-CG 3.24Å; L547-K551 PolarHBondContact O-N 3.43Å; L547-E581 HydrophobicContact CD1-CB 4.11Å; L547-E581 HydrophobicContact CD2-CB 4.23Å; L547-V582 HydrophobicContact CB-CG2 4.39Å; L547-V582 HydrophobicContact CD1-CG2 4.19Å; L547-L585 HydrophobicContact CD1-CD2 3.99Å
548	E	96.9	Very high	96.6	Very high	104 Å²	104	41.2 Å²	41.2	49%	0.486	21%	0.209	S	C	.	.	H	α-helix	trans	-67.9	-29.4	-177.5	-62.1	-55.8	123.3	0	0	113.1	L508 R546 K551 Y552	L508-E548 HydrophobicContact CD2-CB 4.32Å; R546-E548 VanDerWaalsContact C-N 3.34Å; R546-E548 PolarHBondContact O-N 3.07Å; R546-E548 VanDerWaalsContact O-N 3.17Å; E548-K551 IonicContact OE1-NZ 3.64Å; E548-K551 PolarHBondContact OE1-NZ 3.43Å; E548-Y552 WeakPolarHBondContact O-CB 3.06Å; E548-Y552 PolarHBondContact O-N 3.01Å
549	V	97.8	Very high	96.4	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.012	23%	0.227	C	C	.	.	H	α-helix	trans	-74.8	-43.2	172.3	175.6	0	0	0	0	110.4	A503 L508 V511 A541 R546 L547 K551 Y552 L553	A503-V549 HydrophobicContact CB-CG1 4.31Å; L508-V549 HydrophobicContact CB-CG2 4.18Å; L508-V549 HydrophobicContact CD1-CG2 4.43Å; V511-V549 HydrophobicContact CG2-CG1 4.27Å; A541-V549 HydrophobicContact CB-CB 4.31Å; A541-V549 HydrophobicContact CB-CG1 3.88Å; R546-V549 HydrophobicContact CB-CB 4.01Å; R546-V549 HydrophobicContact CB-CG2 4.34Å; R546-V549 WeakPolarHBondContact O-CA 3.45Å; R546-V549 WeakPolarHBondContact O-CB 3.43Å; R546-V549 PolarHBondContact O-N 2.74Å; L547-V549 VanDerWaalsContact C-N 3.29Å; L547-V549 PolarHBondContact O-N 2.99Å; V549-K551 PolarHBondContact O-N 3.26Å; V549-Y552 PolarHBondContact O-N 3.17Å; V549-L553 HydrophobicContact CG1-CD1 3.71Å; V549-L553 HydrophobicContact CG1-CG 3.98Å; V549-L553 WeakPolarHBondContact O-CB 3.18Å; V549-L553 VanDerWaalsContact O-CG 3.24Å; V549-L553 WeakPolarHBondContact O-CG 3.43Å; V549-L553 PolarHBondContact O-N 2.89Å
550	V	98	Very high	96.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-56.5	-50.4	175.6	177.1	0	0	0	0	110.2	L538 A541 R546 L547 Y552 L553 V554 V582 L585 L586	L538-V550 HydrophobicContact CD1-CB 4.47Å; L538-V550 HydrophobicContact CD1-CG1 3.9Å; L538-V550 HydrophobicContact CD1-CG2 4.5Å; A541-V550 HydrophobicContact CB-CG2 3.6Å; R546-V550 WeakPolarHBondContact O-CG2 3.38Å; R546-V550 PolarHBondContact O-N 3.47Å; L547-V550 PolarHBondContact O-N 3.29Å; V550-Y552 PolarHBondContact O-N 3.2Å; V550-L553 PolarHBondContact O-N 3.26Å; V550-V554 HydrophobicContact CG1-CG2 4.26Å; V550-V554 WeakPolarHBondContact O-CB 3.36Å; V550-V554 VanDerWaalsContact O-CG2 3.27Å; V550-V554 WeakPolarHBondContact O-CG2 3.16Å; V550-V554 PolarHBondContact O-N 3.31Å; V550-V582 HydrophobicContact CG1-CG1 4.46Å; V550-V582 HydrophobicContact CG2-CG1 4.18Å; V550-V582 HydrophobicContact CG2-CG2 4.44Å; V550-L585 HydrophobicContact CB-CD2 4.22Å; V550-L585 HydrophobicContact CG1-CD2 3.71Å; V550-L586 HydrophobicContact CG1-CD2 4.07Å; V550-L586 HydrophobicContact CG1-CG 4.42Å
551	K	97.4	Very high	96.3	Very high	68 Å²	68	48 Å²	48	30%	0.296	24%	0.244	S	C	.	.	H	α-helix	trans	-51.5	-53.9	175.5	-73.4	176.5	-175.3	163.7	0	111.4	L547 E548 V549 L553 V554 E555 L585	L547-K551 WeakPolarHBondContact O-CG 3.24Å; L547-K551 PolarHBondContact O-N 3.43Å; E548-K551 IonicContact OE1-NZ 3.64Å; E548-K551 PolarHBondContact OE1-NZ 3.43Å; V549-K551 PolarHBondContact O-N 3.26Å; K551-L553 PolarHBondContact O-N 2.99Å; K551-V554 PolarHBondContact O-N 2.98Å; K551-E555 WeakPolarHBondContact O-CB 3.23Å; K551-E555 VanDerWaalsContact O-CG 3.27Å; K551-E555 WeakPolarHBondContact O-CG 3.12Å; K551-E555 PolarHBondContact O-N 3.38Å; K551-L585 HydrophobicContact CB-CD2 4.27Å; K551-L585 HydrophobicContact CG-CD1 4.15Å; K551-L585 HydrophobicContact CG-CD2 3.41Å; K551-L585 VanDerWaalsContact CG-CD2 3.41Å; K551-L585 HydrophobicContact CG-CG 4.44Å
552	Y	96.9	Very high	96.1	Very high	48 Å²	48	48.1 Å²	48.1	19%	0.188	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-38.4	-177.1	-173.1	-99.3	0	0	0	113.1	L508 V511 K512 L515 E548 V549 V550 S556	L508-Y552 HydrophobicContact CD1-CD1 4.08Å; L508-Y552 HydrophobicContact CD1-CD2 4.47Å; L508-Y552 HydrophobicContact CD1-CG 3.77Å; V511-Y552 HydrophobicContact CG1-CD1 3.95Å; V511-Y552 HydrophobicContact CG1-CE1 4.22Å; K512-Y552 HydrophobicContact CD-CE2 4.28Å; K512-Y552 VanDerWaalsContact CE-CE2 3.46Å; K512-Y552 HydrophobicContact CG-CD1 4.18Å; K512-Y552 HydrophobicContact CG-CD2 4.39Å; K512-Y552 HydrophobicContact CG-CE1 3.65Å; K512-Y552 HydrophobicContact CG-CE2 3.87Å; K512-Y552 VanDerWaalsContact CG-CZ 3.5Å; L515-Y552 HydrophobicContact CD1-CD1 4.4Å; L515-Y552 HydrophobicContact CD1-CE1 3.75Å; E548-Y552 WeakPolarHBondContact O-CB 3.06Å; E548-Y552 PolarHBondContact O-N 3.01Å; V549-Y552 PolarHBondContact O-N 3.17Å; V550-Y552 PolarHBondContact O-N 3.2Å; Y552-S556 VanDerWaalsContact O-CB 3.25Å; Y552-S556 WeakPolarHBondContact O-CB 3.3Å; Y552-S556 PolarHBondContact O-N 2.89Å; Y552-S556 PolarHBondContact O-OG 3.33Å
553	L	97	Very high	96	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.8	-43.7	177	-71.2	176.3	0	0	0	111.4	M499 V511 L525 P537 L538 A541 V549 V550 K551 S556 G557 A558	M499-L553 HydrophobicContact CE-CD2 3.47Å; M499-L553 VanDerWaalsContact CE-CD2 3.47Å; V511-L553 HydrophobicContact CG1-CD2 4.02Å; L525-L553 HydrophobicContact CD1-CD2 3.56Å; P537-L553 HydrophobicContact CB-CD1 3.96Å; P537-L553 HydrophobicContact CB-CD2 4.4Å; L538-L553 HydrophobicContact CB-CD1 4.46Å; L538-L553 HydrophobicContact CD1-CB 4.3Å; L538-L553 HydrophobicContact CD1-CD1 4.41Å; A541-L553 HydrophobicContact CB-CD1 4.1Å; V549-L553 HydrophobicContact CG1-CD1 3.71Å; V549-L553 HydrophobicContact CG1-CG 3.98Å; V549-L553 WeakPolarHBondContact O-CB 3.18Å; V549-L553 VanDerWaalsContact O-CG 3.24Å; V549-L553 WeakPolarHBondContact O-CG 3.43Å; V549-L553 PolarHBondContact O-N 2.89Å; V550-L553 PolarHBondContact O-N 3.26Å; K551-L553 PolarHBondContact O-N 2.99Å; L553-S556 CarbonylContact O-C 3.39Å; L553-S556 PolarHBondContact O-N 3.25Å; L553-G557 PolarHBondContact O-N 3.03Å; L553-A558 HydrophobicContact CB-CB 3.95Å; L553-A558 WeakPolarHBondContact O-CB 3.28Å; L553-A558 PolarHBondContact O-N 2.99Å
554	V	96.2	Very high	95.9	Very high	20 Å²	20	53.6 Å²	53.6	12%	0.121	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-45.5	177.3	174.9	0	0	0	0	110.7	L538 V550 K551 S556 G557 L560 L586 N589	L538-V554 HydrophobicContact CD1-CG2 4.02Å; L538-V554 HydrophobicContact CD2-CG2 4.45Å; V550-V554 HydrophobicContact CG1-CG2 4.26Å; V550-V554 WeakPolarHBondContact O-CB 3.36Å; V550-V554 VanDerWaalsContact O-CG2 3.27Å; V550-V554 WeakPolarHBondContact O-CG2 3.16Å; V550-V554 PolarHBondContact O-N 3.31Å; K551-V554 PolarHBondContact O-N 2.98Å; V554-S556 PolarHBondContact O-N 3Å; V554-G557 PolarHBondContact O-N 3.33Å; V554-L560 HydrophobicContact CG1-CD2 4.35Å; V554-L560 HydrophobicContact CG2-CD2 3.73Å; V554-L586 HydrophobicContact CG2-CD2 4.35Å; V554-N589 HydrophobicContact CG1-CB 3.69Å; V554-N589 VanDerWaalsContact CG1-CG 3.49Å; V554-N589 WeakPolarHBondContact CG1-OD1 3.47Å
555	E	94.8	Very high	95.7	Very high	152 Å²	152	55.2 Å²	55.2	71%	0.71	27%	0.273	S	S	*	.	H	α-helix	trans	-59.6	-30.8	172.7	-74	171.4	-175.7	0	0	112.7	K551 G557	K551-E555 WeakPolarHBondContact O-CB 3.23Å; K551-E555 VanDerWaalsContact O-CG 3.27Å; K551-E555 WeakPolarHBondContact O-CG 3.12Å; K551-E555 PolarHBondContact O-N 3.38Å; E555-G557 VanDerWaalsContact C-N 3.3Å
556	S	92.9	Very high	95.4	Very high	44 Å²	44	52.4 Å²	52.4	31%	0.308	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-4.1	176.9	-57.8	0	0	0	0	113.4	L525 Y552 L553 V554	L525-S556 WeakPolarHBondContact CD2-O 3.49Å; Y552-S556 VanDerWaalsContact O-CB 3.25Å; Y552-S556 WeakPolarHBondContact O-CB 3.3Å; Y552-S556 PolarHBondContact O-N 2.89Å; Y552-S556 PolarHBondContact O-OG 3.33Å; L553-S556 CarbonylContact O-C 3.39Å; L553-S556 PolarHBondContact O-N 3.25Å; V554-S556 PolarHBondContact O-N 3Å
557	G	93	Very high	95.3	Very high	52 Å²	52	48.2 Å²	48.2	54%	0.536	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.4	25	178.7	0	0	0	0	0	115.6	L525 L553 V554 E555	L525-G557 VanDerWaalsContact CD2-C 3.41Å; L553-G557 PolarHBondContact O-N 3.03Å; V554-G557 PolarHBondContact O-N 3.33Å; E555-G557 VanDerWaalsContact C-N 3.3Å
558	A	95.7	Very high	95.3	Very high	8 Å²	8	47.2 Å²	47.2	7%	0.066	24%	0.24	C	C	.	.			trans	-62.8	138	176.6	0	0	0	0	0	111	L525 L538 L553 L560	L525-A558 HydrophobicContact CD1-CB 4.2Å; L525-A558 HydrophobicContact CD2-CB 4.37Å; L525-A558 HydrophobicContact CG-CB 4.09Å; L538-A558 HydrophobicContact CB-CB 4.37Å; L538-A558 HydrophobicContact CD2-CB 4.12Å; L553-A558 HydrophobicContact CB-CB 3.95Å; L553-A558 WeakPolarHBondContact O-CB 3.28Å; L553-A558 PolarHBondContact O-N 2.99Å; A558-L560 PolarHBondContact O-N 3.48Å; A558-L560 VanDerWaalsContact O-N 3.1Å
559	N	94.9	Very high	95.3	Very high	74 Å²	74	42.5 Å²	42.5	40%	0.396	22%	0.218	S	C	.	.			trans	-71.6	107.5	-177.8	-178.7	3.4	0	0	0	111	N526 H561 A562	N526-N559 WeakPolarHBondContact OD1-CB 3.04Å; N526-N559 PolarHBondContact OD1-N 2.76Å; N559-H561 PolarHBondContact O-N 2.86Å; N559-H561 PolarHBondContact OD1-N 3Å; N559-A562 HydrophobicContact CB-CB 4.2Å; N559-A562 WeakPolarHBondContact O-CB 3.4Å; N559-A562 PolarHBondContact O-N 3.4Å; N559-A562 PolarHBondContact OD1-N 3.12Å
560	L	95.4	Very high	95.3	Very high	20 Å²	20	42.5 Å²	42.5	11%	0.105	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.5	177	-62.3	177.7	0	0	0	113.4	L538 V554 A558 P570 L586 N589	L538-L560 HydrophobicContact CD2-CD2 3.8Å; V554-L560 HydrophobicContact CG1-CD2 4.35Å; V554-L560 HydrophobicContact CG2-CD2 3.73Å; A558-L560 PolarHBondContact O-N 3.48Å; A558-L560 VanDerWaalsContact O-N 3.1Å; L560-P570 VanDerWaalsContact O-CD 3.31Å; L560-P570 WeakPolarHBondContact O-CD 3.42Å; L560-L586 HydrophobicContact CD2-CD2 3.68Å; L560-N589 HydrophobicContact CD1-CB 3.96Å; L560-N589 WeakPolarHBondContact CD1-O 3.36Å
561	H	96.1	Very high	95.3	Very high	86 Å²	86	42.6 Å²	42.6	40%	0.398	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	16.3	-177.3	-53.2	-62.9	0	0	0	112.8	N559 R563 E569 G590	N559-H561 PolarHBondContact O-N 2.86Å; N559-H561 PolarHBondContact OD1-N 3Å; H561-R563 PolarHBondContact O-N 2.84Å; H561-E569 IonicContact CG-OE2 3.01Å; H561-E569 IonicContact ND1-OE2 3.76Å; H561-E569 PolarHBondContact ND1-OE2 2.9Å; H561-G590 PolarHBondContact CE1-O 3.03Å
562	A	94.8	Very high	95.3	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	21%	0.205	C	C	.	.			trans	-61.4	128.3	173.2	0	0	0	0	0	108.9	T536 H539 N559	T536-A562 HydrophobicContact CG2-CB 3.73Å; H539-A562 PolarHBondContact CE1-O 2.94Å; H539-A562 PolarHBondContact NE2-O 3.3Å; H539-A562 VanDerWaalsContact NE2-O 3.16Å; N559-A562 HydrophobicContact CB-CB 4.2Å; N559-A562 WeakPolarHBondContact O-CB 3.4Å; N559-A562 PolarHBondContact O-N 3.4Å; N559-A562 PolarHBondContact OD1-N 3.12Å
563	R	94	Very high	95.3	Very high	113 Å²	113	37.8 Å²	37.8	43%	0.426	20%	0.199	S	C	.	.			trans	-98.8	132.1	176.4	-66.9	-174	-179.6	-142.1	-9.6	111.3	R528 H561 L568 E569 C596	R528-R563 PolarHBondContact NH1-O 3.03Å; H561-R563 PolarHBondContact O-N 2.84Å; R563-L568 WeakPolarHBondContact CA-O 3.31Å; R563-E569 HydrophobicContact CG-CG 4.06Å; R563-E569 IonicContact CZ-OE1 3.67Å; R563-E569 IonicContact NE-OE1 3.75Å; R563-E569 IonicContact NH2-OE1 2.64Å; R563-E569 PolarHBondContact NH2-OE1 3.06Å; R563-C596 PolarHBondContact NH1-O 3.35Å; R563-C596 PolarHBondContact NH2-O 3.46Å
564	D	94.5	Very high	95.4	Very high	10 Å²	10	37.8 Å²	37.8	5%	0.053	20%	0.199	C	C	.	.			trans	-77	-171.7	170.7	90.3	-14.7	0	0	0	111.3	R533 G566 G567 L568	R533-D564 CarbonylContact O-C 3.58Å; R533-D564 VanDerWaalsContact O-CB 3.32Å; R533-D564 WeakPolarHBondContact O-CB 3.25Å; D564-G566 PolarHBondContact O-N 3.42Å; D564-G566 WeakPolarHBondContact OD1-CA 3.47Å; D564-G566 PolarHBondContact OD1-N 3.39Å; D564-G567 PolarHBondContact O-N 2.95Å; D564-G567 PolarHBondContact OD1-N 3.33Å; D564-G567 VanDerWaalsContact OD1-N 3.11Å; D564-L568 PolarHBondContact N-O 3.47Å; D564-L568 WeakPolarHBondContact OD1-CB 3.29Å; D564-L568 PolarHBondContact OD1-N 2.95Å
565	K	91.6	Very high	95.4	Very high	148 Å²	148	36.8 Å²	36.8	64%	0.643	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-28.6	-179.6	-172.9	175.4	-177.7	176.5	0	113.3	R533 G567	R533-K565 VanDerWaalsContact O-CB 3.28Å; R533-K565 WeakPolarHBondContact O-CB 3.24Å; R533-K565 PolarHBondContact O-N 2.87Å; K565-G567 VanDerWaalsContact C-N 3.33Å
566	G	92.1	Very high	95.5	Very high	12 Å²	12	30.6 Å²	30.6	12%	0.124	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-2.9	173.9	0	0	0	0	0	113.3	D564 L568 L598	D564-G566 PolarHBondContact O-N 3.42Å; D564-G566 WeakPolarHBondContact OD1-CA 3.47Å; D564-G566 PolarHBondContact OD1-N 3.39Å; G566-L568 VanDerWaalsContact C-N 3.28Å; G566-L598 WeakPolarHBondContact O-CB 3.33Å; G566-L598 WeakPolarHBondContact O-CD1 3.34Å; G566-L598 PolarHBondContact O-N 3.5Å
567	G	94.6	Very high	95.6	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.01	18%	0.177	C	C	.	.			trans	84.6	5.2	-175.9	0	0	0	0	0	113.5	D564 K565	D564-G567 PolarHBondContact O-N 2.95Å; D564-G567 PolarHBondContact OD1-N 3.33Å; D564-G567 VanDerWaalsContact OD1-N 3.11Å; K565-G567 VanDerWaalsContact C-N 3.33Å
568	L	96.7	Very high	95.7	Very high	26 Å²	26	33.7 Å²	33.7	14%	0.136	17%	0.165	C	C	.	.			trans	-72.4	137.3	-178.4	-60.7	167.6	0	0	0	109.1	H539 R563 D564 G566 H572 D597	H539-L568 PolarHBondContact NE2-O 2.97Å; R563-L568 WeakPolarHBondContact CA-O 3.31Å; D564-L568 PolarHBondContact N-O 3.47Å; D564-L568 WeakPolarHBondContact OD1-CB 3.29Å; D564-L568 PolarHBondContact OD1-N 2.95Å; G566-L568 VanDerWaalsContact C-N 3.28Å; L568-H572 HydrophobicContact CB-CB 4.12Å; L568-H572 HydrophobicContact CD2-CB 3.72Å; L568-H572 HydrophobicContact CG-CB 4.48Å; L568-D597 HydrophobicContact CD2-CB 3.74Å; L568-D597 HydrophobicContact CG-CB 4.35Å
569	E	97.3	Very high	95.8	Very high	6 Å²	6	35 Å²	35	3%	0.028	17%	0.17	C	C	.	.			trans	-91.3	159.2	166.9	-67.6	-179.4	-156.2	0	0	109.7	H561 R563 L571 H572 A595	H561-E569 IonicContact CG-OE2 3.01Å; H561-E569 IonicContact ND1-OE2 3.76Å; H561-E569 PolarHBondContact ND1-OE2 2.9Å; R563-E569 HydrophobicContact CG-CG 4.06Å; R563-E569 IonicContact CZ-OE1 3.67Å; R563-E569 IonicContact NE-OE1 3.75Å; R563-E569 IonicContact NH2-OE1 2.64Å; R563-E569 PolarHBondContact NH2-OE1 3.06Å; E569-L571 PolarHBondContact O-N 3.22Å; E569-H572 PolarHBondContact N-ND1 3.42Å; E569-H572 WeakPolarHBondContact O-CB 3.28Å; E569-H572 PolarHBondContact O-N 2.62Å; E569-A595 HydrophobicContact CG-CB 4.48Å
570	P	97.7	Very high	95.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-50.4	-31.2	178	-28.3	34.4	0	0	0	114.7	L538 H539 A542 L560 H572 N573 A574 L586	L538-P570 HydrophobicContact CB-CG 4.22Å; L538-P570 HydrophobicContact CD2-CB 4.2Å; L538-P570 HydrophobicContact CD2-CG 3.85Å; L538-P570 HydrophobicContact CG-CB 3.92Å; L538-P570 HydrophobicContact CG-CG 3.85Å; H539-P570 WeakPolarHBondContact NE2-CD 3.41Å; A542-P570 HydrophobicContact CB-CB 4.12Å; A542-P570 WeakPolarHBondContact CB-O 3.46Å; L560-P570 VanDerWaalsContact O-CD 3.31Å; L560-P570 WeakPolarHBondContact O-CD 3.42Å; P570-H572 VanDerWaalsContact C-N 3.33Å; P570-H572 PolarHBondContact O-N 2.73Å; P570-N573 PolarHBondContact O-N 3.49Å; P570-A574 PolarHBondContact O-N 3.01Å; P570-L586 HydrophobicContact CB-CD1 4.31Å
571	L	98	Very high	96	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-60.9	-39	175.6	-174.8	61.6	0	0	0	112.4	E569 N573 A574 C575 T583 L586 I587 A591 P603	E569-L571 PolarHBondContact O-N 3.22Å; L571-N573 VanDerWaalsContact C-N 3.33Å; L571-N573 PolarHBondContact O-N 2.86Å; L571-A574 PolarHBondContact O-N 2.94Å; L571-C575 WeakPolarHBondContact O-CB 3.5Å; L571-C575 PolarHBondContact O-N 3.39Å; L571-C575 PolarHBondContact O-SG 3.38Å; L571-T583 HydrophobicContact CD1-CG2 3.8Å; L571-L586 HydrophobicContact CD1-CB 4.17Å; L571-L586 HydrophobicContact CD1-CD1 4.44Å; L571-I587 HydrophobicContact CD1-CD1 4.38Å; L571-I587 HydrophobicContact CD1-CG1 3.94Å; L571-I587 HydrophobicContact CD2-CG1 4.27Å; L571-A591 HydrophobicContact CB-CB 4.29Å; L571-A591 HydrophobicContact CD2-CB 3.99Å; L571-P603 HydrophobicContact CD2-CB 4.31Å; L571-P603 HydrophobicContact CD2-CG 3.81Å; L571-P603 HydrophobicContact CG-CB 4.18Å; L571-P603 HydrophobicContact CG-CG 3.94Å
572	H	98.1	Very high	96.1	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-45	176.7	-69.2	81.4	0	0	0	111.3	L568 E569 P570 A574 C575 S576 A595 F601	L568-H572 HydrophobicContact CB-CB 4.12Å; L568-H572 HydrophobicContact CD2-CB 3.72Å; L568-H572 HydrophobicContact CG-CB 4.48Å; E569-H572 PolarHBondContact N-ND1 3.42Å; E569-H572 WeakPolarHBondContact O-CB 3.28Å; E569-H572 PolarHBondContact O-N 2.62Å; P570-H572 VanDerWaalsContact C-N 3.33Å; P570-H572 PolarHBondContact O-N 2.73Å; H572-A574 PolarHBondContact O-N 3.11Å; H572-C575 PolarHBondContact O-N 3.26Å; H572-S576 VanDerWaalsContact O-CB 3.27Å; H572-S576 WeakPolarHBondContact O-CB 3.33Å; H572-S576 PolarHBondContact O-N 3.1Å; H572-A595 PolarHBondContact CE1-O 3.14Å; H572-A595 VanDerWaalsContact CE1-O 3.28Å; H572-A595 PolarHBondContact NE2-O 3.25Å; H572-F601 PolarHBondContact NE2-O 3.48Å; H572-F601 VanDerWaalsContact NE2-O 3.15Å
573	N	96.7	Very high	96.3	Very high	14 Å²	14	35.7 Å²	35.7	8%	0.075	17%	0.166	C	C	.	.	H	α-helix	trans	-62.5	-44.1	178.4	-72.9	-0.4	0	0	0	111.6	H539 P570 L571 C575 Y577	H539-N573 PolarHBondContact O-ND2 2.83Å; P570-N573 PolarHBondContact O-N 3.49Å; L571-N573 VanDerWaalsContact C-N 3.33Å; L571-N573 PolarHBondContact O-N 2.86Å; N573-C575 VanDerWaalsContact C-N 3.33Å; N573-C575 PolarHBondContact O-N 3.03Å; N573-Y577 VanDerWaalsContact O-CD2 3.25Å; N573-Y577 WeakPolarHBondContact O-CD2 3.4Å; N573-Y577 PolarHBondContact O-N 3.43Å
574	A	97.8	Very high	96.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.6	-43.1	177.7	0	0	0	0	0	111.5	A542 P570 L571 H572 G578 H579 V582 T583 L586	A542-A574 HydrophobicContact CB-CB 4.4Å; P570-A574 PolarHBondContact O-N 3.01Å; L571-A574 PolarHBondContact O-N 2.94Å; H572-A574 PolarHBondContact O-N 3.11Å; A574-G578 PolarHBondContact O-N 3.45Å; A574-H579 PolarHBondContact O-N 3.15Å; A574-V582 HydrophobicContact CB-CB 4.48Å; A574-V582 HydrophobicContact CB-CG1 3.79Å; A574-T583 WeakPolarHBondContact CB-OG1 3.31Å; A574-L586 HydrophobicContact CB-CD1 4.18Å
575	C	97.7	Very high	96.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-69.8	-46	-179.8	-67	0	0	0	0	113.2	L571 H572 N573 Y577 G578 T583 P603 A607 I615	L571-C575 WeakPolarHBondContact O-CB 3.5Å; L571-C575 PolarHBondContact O-N 3.39Å; L571-C575 PolarHBondContact O-SG 3.38Å; H572-C575 PolarHBondContact O-N 3.26Å; N573-C575 VanDerWaalsContact C-N 3.33Å; N573-C575 PolarHBondContact O-N 3.03Å; C575-Y577 VanDerWaalsContact C-N 3.3Å; C575-Y577 PolarHBondContact O-N 3.08Å; C575-G578 PolarHBondContact O-N 3.22Å; C575-G578 VanDerWaalsContact O-N 3.14Å; C575-T583 VanDerWaalsContact SG-CG2 3.57Å; C575-P603 HydrophobicContact CB-CB 4.18Å; C575-A607 HydrophobicContact CB-CB 4.46Å; C575-I615 HydrophobicContact CB-CG2 3.73Å
576	S	96.2	Very high	96.9	Very high	22 Å²	22	27.1 Å²	27.1	15%	0.154	13%	0.134	C	C	.	.	H	α-helix	trans	-59.5	-41.2	-179.5	-165.7	0	0	0	0	111.6	H572 E606 N610 K612	H572-S576 VanDerWaalsContact O-CB 3.27Å; H572-S576 WeakPolarHBondContact O-CB 3.33Å; H572-S576 PolarHBondContact O-N 3.1Å; S576-E606 VanDerWaalsContact CB-OE2 3.31Å; S576-E606 WeakPolarHBondContact CB-OE2 3.47Å; S576-E606 PolarHBondContact OG-OE2 3.09Å; S576-N610 WeakPolarHBondContact O-CB 3.43Å; S576-N610 PolarHBondContact OG-ND2 3.08Å; S576-K612 VanDerWaalsContact O-CE 3.27Å; S576-K612 WeakPolarHBondContact O-CE 3.4Å
577	Y	95.8	Very high	97.1	Very high	134 Å²	134	27.4 Å²	27.4	53%	0.525	13%	0.132	S	C	.	.	H	α-helix	trans	-86.1	-10.7	177.8	-68.9	-65.7	0	0	0	114.8	N573 C575 H579	N573-Y577 VanDerWaalsContact O-CD2 3.25Å; N573-Y577 WeakPolarHBondContact O-CD2 3.4Å; N573-Y577 PolarHBondContact O-N 3.43Å; C575-Y577 VanDerWaalsContact C-N 3.3Å; C575-Y577 PolarHBondContact O-N 3.08Å; Y577-H579 VanDerWaalsContact CB-NE2 3.27Å; Y577-H579 WeakPolarHBondContact CB-NE2 3.43Å
578	G	94.9	Very high	97.2	Very high	27 Å²	27	33.3 Å²	33.3	28%	0.278	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	28.3	174.3	0	0	0	0	0	115.4	A574 C575 Y580	A574-G578 PolarHBondContact O-N 3.45Å; C575-G578 PolarHBondContact O-N 3.22Å; C575-G578 VanDerWaalsContact O-N 3.14Å; G578-Y580 PolarHBondContact O-N 3.01Å
579	H	97.3	Very high	97.1	Very high	35 Å²	35	35.9 Å²	35.9	16%	0.162	17%	0.174	C	C	.	.			trans	-88.1	93.3	-175.9	-56.9	-42.1	0	0	0	111.2	A542 G543 N545 A574 Y577 V582 T583	A542-H579 PolarHBondContact O-CD2 3.14Å; G543-H579 PolarHBondContact O-CD2 3.29Å; G543-H579 PolarHBondContact O-NE2 3.33Å; N545-H579 HydrophobicContact CB-CB 4.4Å; N545-H579 WeakPolarHBondContact CB-ND1 3.32Å; A574-H579 PolarHBondContact O-N 3.15Å; Y577-H579 VanDerWaalsContact CB-NE2 3.27Å; Y577-H579 WeakPolarHBondContact CB-NE2 3.43Å; H579-V582 HydrophobicContact CB-CB 4.08Å; H579-V582 HydrophobicContact CB-CG2 4.43Å; H579-T583 VanDerWaalsContact O-CB 3.31Å; H579-T583 WeakPolarHBondContact O-CB 3.26Å; H579-T583 PolarHBondContact O-N 3.38Å; H579-T583 PolarHBondContact O-OG1 3Å
580	Y	97.5	Very high	97	Very high	93 Å²	93	37.8 Å²	37.8	37%	0.365	19%	0.194	S	C	.	.	H	α-helix	trans	-59.6	-56.5	-171.3	-172	-84.2	0	0	0	113.3	G578 V582 T583 E584 D614 I615 L618	G578-Y580 PolarHBondContact O-N 3.01Å; Y580-V582 VanDerWaalsContact C-N 3.28Å; Y580-V582 PolarHBondContact O-N 2.99Å; Y580-T583 WeakPolarHBondContact O-CB 3.44Å; Y580-T583 PolarHBondContact O-N 3.04Å; Y580-T583 VanDerWaalsContact O-N 3.1Å; Y580-E584 PolarHBondContact O-N 3.32Å; Y580-D614 HydrophobicContact CD2-CB 4.09Å; Y580-D614 HydrophobicContact CE2-CB 4.39Å; Y580-I615 HydrophobicContact CD2-CD1 4.28Å; Y580-L618 HydrophobicContact CD2-CD2 4.17Å; Y580-L618 HydrophobicContact CE2-CB 4.02Å; Y580-L618 HydrophobicContact CE2-CD1 4.37Å; Y580-L618 HydrophobicContact CE2-CD2 3.99Å; Y580-L618 HydrophobicContact CE2-CG 4.36Å
581	E	96.8	Very high	96.9	Very high	104 Å²	104	38 Å²	38	49%	0.486	20%	0.197	S	C	.	.	H	α-helix	trans	-65.5	-33.1	-174	-61.7	86.2	166.6	0	0	112.4	L547 L585	L547-E581 HydrophobicContact CD1-CB 4.11Å; L547-E581 HydrophobicContact CD2-CB 4.23Å; E581-L585 VanDerWaalsContact O-CB 3.22Å; E581-L585 WeakPolarHBondContact O-CB 3.36Å; E581-L585 PolarHBondContact O-N 2.93Å; E581-L585 VanDerWaalsContact O-N 3.08Å
582	V	98.1	Very high	96.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-70.2	-43.6	174.1	169.9	0	0	0	0	110.7	A542 N545 L547 V550 A574 H579 Y580 L585 L586	A542-V582 HydrophobicContact CB-CG1 4Å; N545-V582 WeakPolarHBondContact OD1-CG2 3.26Å; L547-V582 HydrophobicContact CB-CG2 4.39Å; L547-V582 HydrophobicContact CD1-CG2 4.19Å; V550-V582 HydrophobicContact CG1-CG1 4.46Å; V550-V582 HydrophobicContact CG2-CG1 4.18Å; V550-V582 HydrophobicContact CG2-CG2 4.44Å; A574-V582 HydrophobicContact CB-CB 4.48Å; A574-V582 HydrophobicContact CB-CG1 3.79Å; H579-V582 HydrophobicContact CB-CB 4.08Å; H579-V582 HydrophobicContact CB-CG2 4.43Å; Y580-V582 VanDerWaalsContact C-N 3.28Å; Y580-V582 PolarHBondContact O-N 2.99Å; V582-L585 PolarHBondContact O-N 3.23Å; V582-L586 HydrophobicContact CG1-CD1 4.07Å; V582-L586 VanDerWaalsContact O-CG 3.3Å; V582-L586 WeakPolarHBondContact O-CG 3.37Å; V582-L586 PolarHBondContact O-N 2.87Å
583	T	98.1	Very high	96.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-50.7	177.7	-59.8	0	0	0	0	110.3	L571 A574 C575 H579 Y580 L585 L586 I587 I615 L618	L571-T583 HydrophobicContact CD1-CG2 3.8Å; A574-T583 WeakPolarHBondContact CB-OG1 3.31Å; C575-T583 VanDerWaalsContact SG-CG2 3.57Å; H579-T583 VanDerWaalsContact O-CB 3.31Å; H579-T583 WeakPolarHBondContact O-CB 3.26Å; H579-T583 PolarHBondContact O-N 3.38Å; H579-T583 PolarHBondContact O-OG1 3Å; Y580-T583 WeakPolarHBondContact O-CB 3.44Å; Y580-T583 PolarHBondContact O-N 3.04Å; Y580-T583 VanDerWaalsContact O-N 3.1Å; T583-L585 VanDerWaalsContact C-N 3.35Å; T583-L585 PolarHBondContact O-N 3.05Å; T583-L586 PolarHBondContact O-N 3.15Å; T583-I587 HydrophobicContact CG2-CD1 3.87Å; T583-I587 VanDerWaalsContact O-CG1 3.32Å; T583-I587 WeakPolarHBondContact O-CG1 3.38Å; T583-I587 PolarHBondContact O-N 3.46Å; T583-I615 HydrophobicContact CG2-CD1 4.39Å; T583-I615 HydrophobicContact CG2-CG2 4.45Å; T583-L618 HydrophobicContact CG2-CD2 3.75Å
584	E	97.6	Very high	96.7	Very high	64 Å²	64	43.5 Å²	43.5	30%	0.299	23%	0.227	S	C	.	.	H	α-helix	trans	-58.4	-46.2	178.1	-175.1	178.9	-148.5	0	0	111.4	Y580 L586 I587 Q588 L618	Y580-E584 PolarHBondContact O-N 3.32Å; E584-L586 PolarHBondContact O-N 2.86Å; E584-I587 PolarHBondContact O-N 2.94Å; E584-Q588 HydrophobicContact CG-CG 4.4Å; E584-Q588 WeakPolarHBondContact O-CB 3.41Å; E584-Q588 VanDerWaalsContact O-CG 3.27Å; E584-Q588 WeakPolarHBondContact O-CG 3.41Å; E584-Q588 PolarHBondContact O-N 3.23Å; E584-Q588 PolarHBondContact OE1-NE2 2.88Å; E584-L618 HydrophobicContact CB-CD2 3.98Å; E584-L618 HydrophobicContact CG-CD1 4.49Å
585	L	97.2	Very high	96.5	Very high	27 Å²	27	43.6 Å²	43.6	14%	0.141	23%	0.227	C	C	.	.	H	α-helix	trans	-60.2	-43.9	177.8	-178.9	72.6	0	0	0	112.3	L547 V550 K551 E581 V582 T583 Q588 N589	L547-L585 HydrophobicContact CD1-CD2 3.99Å; V550-L585 HydrophobicContact CB-CD2 4.22Å; V550-L585 HydrophobicContact CG1-CD2 3.71Å; K551-L585 HydrophobicContact CB-CD2 4.27Å; K551-L585 HydrophobicContact CG-CD1 4.15Å; K551-L585 HydrophobicContact CG-CD2 3.41Å; K551-L585 VanDerWaalsContact CG-CD2 3.41Å; K551-L585 HydrophobicContact CG-CG 4.44Å; E581-L585 VanDerWaalsContact O-CB 3.22Å; E581-L585 WeakPolarHBondContact O-CB 3.36Å; E581-L585 PolarHBondContact O-N 2.93Å; E581-L585 VanDerWaalsContact O-N 3.08Å; V582-L585 PolarHBondContact O-N 3.23Å; T583-L585 VanDerWaalsContact C-N 3.35Å; T583-L585 PolarHBondContact O-N 3.05Å; L585-Q588 PolarHBondContact O-N 3.31Å; L585-N589 PolarHBondContact O-N 2.99Å; L585-N589 VanDerWaalsContact O-N 3.16Å; L585-N589 PolarHBondContact O-ND2 3.24Å
586	L	97.9	Very high	96.4	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-43.6	178.8	-71.3	171.7	0	0	0	111.3	L538 A542 V550 V554 L560 P570 L571 A574 V582 T583 E584 N589 G590 A591	L538-L586 HydrophobicContact CD1-CD2 4.25Å; L538-L586 HydrophobicContact CD2-CD2 4.31Å; A542-L586 HydrophobicContact CB-CD1 4.15Å; V550-L586 HydrophobicContact CG1-CD2 4.07Å; V550-L586 HydrophobicContact CG1-CG 4.42Å; V554-L586 HydrophobicContact CG2-CD2 4.35Å; L560-L586 HydrophobicContact CD2-CD2 3.68Å; P570-L586 HydrophobicContact CB-CD1 4.31Å; L571-L586 HydrophobicContact CD1-CB 4.17Å; L571-L586 HydrophobicContact CD1-CD1 4.44Å; A574-L586 HydrophobicContact CB-CD1 4.18Å; V582-L586 HydrophobicContact CG1-CD1 4.07Å; V582-L586 VanDerWaalsContact O-CG 3.3Å; V582-L586 WeakPolarHBondContact O-CG 3.37Å; V582-L586 PolarHBondContact O-N 2.87Å; T583-L586 PolarHBondContact O-N 3.15Å; E584-L586 PolarHBondContact O-N 2.86Å; L586-N589 PolarHBondContact O-N 3.08Å; L586-G590 PolarHBondContact O-N 2.98Å; L586-A591 HydrophobicContact CB-CB 4.03Å; L586-A591 WeakPolarHBondContact O-CB 3.3Å; L586-A591 PolarHBondContact O-N 2.81Å
587	I	97.1	Very high	96.3	Very high	17 Å²	17	45.1 Å²	45.1	9%	0.087	24%	0.237	C	C	.	.	H	α-helix	trans	-62.8	-46.3	177.4	-65.2	168.4	0	0	0	110.7	L571 T583 E584 N589 G590 V593 L618 L619 H622	L571-I587 HydrophobicContact CD1-CD1 4.38Å; L571-I587 HydrophobicContact CD1-CG1 3.94Å; L571-I587 HydrophobicContact CD2-CG1 4.27Å; T583-I587 HydrophobicContact CG2-CD1 3.87Å; T583-I587 VanDerWaalsContact O-CG1 3.32Å; T583-I587 WeakPolarHBondContact O-CG1 3.38Å; T583-I587 PolarHBondContact O-N 3.46Å; E584-I587 PolarHBondContact O-N 2.94Å; I587-N589 PolarHBondContact O-N 3.38Å; I587-G590 PolarHBondContact O-N 3.11Å; I587-V593 HydrophobicContact CD1-CG1 3.97Å; I587-V593 HydrophobicContact CG1-CG1 3.9Å; I587-V593 HydrophobicContact CG2-CG1 4.07Å; I587-L618 HydrophobicContact CD1-CG 4.42Å; I587-L619 HydrophobicContact CD1-CD2 3.94Å; I587-H622 HydrophobicContact CG2-CB 3.84Å
588	Q	95.8	Very high	96.2	Very high	125 Å²	125	43.9 Å²	43.9	58%	0.584	24%	0.238	S	C	*	.	H	α-helix	trans	-61.2	-25.5	178.1	-73.9	176.5	3	0	0	113.2	E584 L585	E584-Q588 HydrophobicContact CG-CG 4.4Å; E584-Q588 WeakPolarHBondContact O-CB 3.41Å; E584-Q588 VanDerWaalsContact O-CG 3.27Å; E584-Q588 WeakPolarHBondContact O-CG 3.41Å; E584-Q588 PolarHBondContact O-N 3.23Å; E584-Q588 PolarHBondContact OE1-NE2 2.88Å; L585-Q588 PolarHBondContact O-N 3.31Å
589	N	96	Very high	96.2	Very high	81 Å²	81	48.7 Å²	48.7	43%	0.433	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	5.7	176.2	-74.3	-87.5	0	0	0	113.6	V554 L560 L585 L586 I587	V554-N589 HydrophobicContact CG1-CB 3.69Å; V554-N589 VanDerWaalsContact CG1-CG 3.49Å; V554-N589 WeakPolarHBondContact CG1-OD1 3.47Å; L560-N589 HydrophobicContact CD1-CB 3.96Å; L560-N589 WeakPolarHBondContact CD1-O 3.36Å; L585-N589 PolarHBondContact O-N 2.99Å; L585-N589 VanDerWaalsContact O-N 3.16Å; L585-N589 PolarHBondContact O-ND2 3.24Å; L586-N589 PolarHBondContact O-N 3.08Å; I587-N589 PolarHBondContact O-N 3.38Å
590	G	93.6	Very high	96.1	Very high	45 Å²	45	52.9 Å²	52.9	46%	0.464	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.2	15.9	171.5	0	0	0	0	0	115.8	H561 L586 I587 D592	H561-G590 PolarHBondContact CE1-O 3.03Å; L586-G590 PolarHBondContact O-N 2.98Å; I587-G590 PolarHBondContact O-N 3.11Å; G590-D592 PolarHBondContact O-N 3.42Å
591	A	96.5	Very high	96.1	Very high	7 Å²	7	50.2 Å²	50.2	6%	0.058	26%	0.256	C	S	.	.			trans	-61.9	135.9	169.7	0	0	0	0	0	110.8	L571 L586 V593	L571-A591 HydrophobicContact CB-CB 4.29Å; L571-A591 HydrophobicContact CD2-CB 3.99Å; L586-A591 HydrophobicContact CB-CB 4.03Å; L586-A591 WeakPolarHBondContact O-CB 3.3Å; L586-A591 PolarHBondContact O-N 2.81Å; A591-V593 PolarHBondContact O-N 3.32Å
592	D	95.7	Very high	96.1	Very high	76 Å²	76	45.2 Å²	45.2	41%	0.406	23%	0.233	S	C	.	.			trans	-77.9	113.3	-179	178.2	10.1	0	0	0	110.3	G590 N594 A595	G590-D592 PolarHBondContact O-N 3.42Å; D592-N594 PolarHBondContact O-N 3.26Å; D592-N594 PolarHBondContact OD1-N 3.41Å; D592-A595 HydrophobicContact CB-CB 4.17Å; D592-A595 VanDerWaalsContact O-CB 3.31Å; D592-A595 WeakPolarHBondContact O-CB 3.35Å; D592-A595 PolarHBondContact O-N 2.84Å; D592-A595 VanDerWaalsContact O-N 3.14Å
593	V	95.9	Very high	96.1	Very high	13 Å²	13	45.2 Å²	45.2	8%	0.079	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.9	179.3	-64.6	0	0	0	0	113.4	I587 A591 P603 L619 H622 A624	I587-V593 HydrophobicContact CD1-CG1 3.97Å; I587-V593 HydrophobicContact CG1-CG1 3.9Å; I587-V593 HydrophobicContact CG2-CG1 4.07Å; A591-V593 PolarHBondContact O-N 3.32Å; V593-P603 WeakPolarHBondContact O-CD 3.41Å; V593-L619 HydrophobicContact CB-CD2 4.28Å; V593-L619 HydrophobicContact CG1-CD2 4.15Å; V593-H622 HydrophobicContact CG1-CB 4.05Å; V593-A624 HydrophobicContact CB-CB 4.37Å; V593-A624 HydrophobicContact CG2-CB 4.45Å
594	N	96.3	Very high	96.1	Very high	43 Å²	43	45.2 Å²	45.2	23%	0.23	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	16.1	178.6	-66.3	-49.5	0	0	0	112.6	D592 C596 G623 A624 D625 L628	D592-N594 PolarHBondContact O-N 3.26Å; D592-N594 PolarHBondContact OD1-N 3.41Å; N594-C596 PolarHBondContact O-N 3.32Å; N594-G623 PolarHBondContact ND2-O 3.16Å; N594-G623 VanDerWaalsContact ND2-O 3.11Å; N594-A624 WeakPolarHBondContact OD1-CA 3.41Å; N594-D625 PolarHBondContact OD1-N 3.5Å; N594-L628 HydrophobicContact CB-CD1 4.14Å
595	A	95.2	Very high	96	Very high	2 Å²	2	42.3 Å²	42.3	2%	0.017	22%	0.219	C	C	.	.			trans	-56.4	133.5	174.7	0	0	0	0	0	110.5	E569 H572 D592 T602 P603	E569-A595 HydrophobicContact CG-CB 4.48Å; H572-A595 PolarHBondContact CE1-O 3.14Å; H572-A595 VanDerWaalsContact CE1-O 3.28Å; H572-A595 PolarHBondContact NE2-O 3.25Å; D592-A595 HydrophobicContact CB-CB 4.17Å; D592-A595 VanDerWaalsContact O-CB 3.31Å; D592-A595 WeakPolarHBondContact O-CB 3.35Å; D592-A595 PolarHBondContact O-N 2.84Å; D592-A595 VanDerWaalsContact O-N 3.14Å; A595-T602 WeakPolarHBondContact O-CA 3.47Å; A595-P603 VanDerWaalsContact O-CD 3.28Å; A595-P603 WeakPolarHBondContact O-CD 3.39Å
596	C	93.8	Very high	96	Very high	41 Å²	41	42.6 Å²	42.6	28%	0.277	22%	0.22	S	C	.	.			trans	-108.8	132.4	179.7	-74.6	0	0	0	0	111.2	R563 N594 F601	R563-C596 PolarHBondContact NH1-O 3.35Å; R563-C596 PolarHBondContact NH2-O 3.46Å; N594-C596 PolarHBondContact O-N 3.32Å; C596-F601 WeakPolarHBondContact CA-O 3.45Å
597	D	94.6	Very high	95.9	Very high	13 Å²	13	42.5 Å²	42.5	7%	0.07	22%	0.22	C	C	.	.			trans	-75.6	-169.7	170.3	83.3	-12	0	0	0	112.8	L568 W599 K600 F601	L568-D597 HydrophobicContact CD2-CB 3.74Å; L568-D597 HydrophobicContact CG-CB 4.35Å; D597-W599 PolarHBondContact O-N 3.35Å; D597-W599 VanDerWaalsContact OD1-CA 3.32Å; D597-W599 WeakPolarHBondContact OD1-CA 3.41Å; D597-W599 PolarHBondContact OD1-N 2.92Å; D597-K600 PolarHBondContact O-N 2.83Å; D597-K600 PolarHBondContact OD1-N 3.37Å; D597-F601 PolarHBondContact N-O 3.11Å; D597-F601 PolarHBondContact OD1-N 3.31Å
598	L	94.5	Very high	95.8	Very high	108 Å²	108	41.7 Å²	41.7	57%	0.565	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-20.1	178.9	-95.6	70.3	0	0	0	114	G566	G566-L598 WeakPolarHBondContact O-CB 3.33Å; G566-L598 WeakPolarHBondContact O-CD1 3.34Å; G566-L598 PolarHBondContact O-N 3.5Å
599	W	94.9	Very high	95.8	Very high	128 Å²	128	36.9 Å²	36.9	49%	0.485	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	12.5	176.8	-62.6	-91.3	0	0	0	112.4	D597 F601 R631	D597-W599 PolarHBondContact O-N 3.35Å; D597-W599 VanDerWaalsContact OD1-CA 3.32Å; D597-W599 WeakPolarHBondContact OD1-CA 3.41Å; D597-W599 PolarHBondContact OD1-N 2.92Å; W599-F601 HydrophobicContact CB-CD2 3.95Å; W599-F601 HydrophobicContact CB-CE2 4.41Å; W599-F601 PolarHBondContact O-N 2.93Å; W599-R631 WeakPolarHBondContact O-CB 3.38Å; W599-R631 PolarHBondContact O-N 2.97Å
600	K	94.3	Very high	95.7	Very high	123 Å²	123	36.3 Å²	36.3	54%	0.535	19%	0.194	S	C	.	.			trans	59.3	24	-176.3	-53.9	-175.5	175.7	-174.9	0	114	D597 N630	D597-K600 PolarHBondContact O-N 2.83Å; D597-K600 PolarHBondContact OD1-N 3.37Å; K600-N630 WeakPolarHBondContact O-CA 3.34Å
601	F	97.5	Very high	95.7	Very high	36 Å²	36	35.4 Å²	35.4	16%	0.158	19%	0.185	C	C	.	.			trans	-69.6	134.4	165.7	-85.7	-114.4	0	0	0	108.6	H572 C596 D597 W599 H605 N630 L639	H572-F601 PolarHBondContact NE2-O 3.48Å; H572-F601 VanDerWaalsContact NE2-O 3.15Å; C596-F601 WeakPolarHBondContact CA-O 3.45Å; D597-F601 PolarHBondContact N-O 3.11Å; D597-F601 PolarHBondContact OD1-N 3.31Å; W599-F601 HydrophobicContact CB-CD2 3.95Å; W599-F601 HydrophobicContact CB-CE2 4.41Å; W599-F601 PolarHBondContact O-N 2.93Å; F601-H605 HydrophobicContact CB-CB 4.32Å; F601-H605 HydrophobicContact CD1-CB 3.51Å; F601-H605 HydrophobicContact CE1-CB 4.08Å; F601-H605 HydrophobicContact CG-CB 4.13Å; F601-N630 HydrophobicContact CD2-CB 3.8Å; F601-N630 HydrophobicContact CE2-CB 3.74Å; F601-N630 WeakPolarHBondContact CE2-ND2 3.49Å; F601-N630 HydrophobicContact CZ-CB 4.47Å; F601-N630 WeakPolarHBondContact CZ-ND2 3.46Å; F601-L639 HydrophobicContact CD1-CD1 4.27Å; F601-L639 HydrophobicContact CE1-CD1 3.41Å; F601-L639 VanDerWaalsContact CE1-CD1 3.41Å; F601-L639 HydrophobicContact CZ-CD1 3.77Å
602	T	97.4	Very high	95.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.			trans	-98.5	164.6	169.5	69	0	0	0	0	109.6	A595 L604 H605 E606 L628	A595-T602 WeakPolarHBondContact O-CA 3.47Å; T602-L604 PolarHBondContact O-N 3.26Å; T602-L604 PolarHBondContact OG1-N 3.47Å; T602-H605 PolarHBondContact N-ND1 3.12Å; T602-H605 WeakPolarHBondContact O-CB 3.41Å; T602-H605 PolarHBondContact O-N 3.41Å; T602-H605 PolarHBondContact OG1-N 2.95Å; T602-H605 PolarHBondContact OG1-ND1 3.25Å; T602-E606 PolarHBondContact O-N 3.4Å; T602-E606 VanDerWaalsContact O-N 3.14Å; T602-L628 HydrophobicContact CG2-CB 4.45Å; T602-L628 HydrophobicContact CG2-CD1 3.91Å
603	P	97.9	Very high	95.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-52	-30.2	170.7	-28.3	34.6	0	0	0	113.5	L571 C575 V593 A595 A607 L619	L571-P603 HydrophobicContact CD2-CB 4.31Å; L571-P603 HydrophobicContact CD2-CG 3.81Å; L571-P603 HydrophobicContact CG-CB 4.18Å; L571-P603 HydrophobicContact CG-CG 3.94Å; C575-P603 HydrophobicContact CB-CB 4.18Å; V593-P603 WeakPolarHBondContact O-CD 3.41Å; A595-P603 VanDerWaalsContact O-CD 3.28Å; A595-P603 WeakPolarHBondContact O-CD 3.39Å; P603-A607 WeakPolarHBondContact O-CB 3.31Å; P603-A607 PolarHBondContact O-N 3Å; P603-L619 VanDerWaalsContact C-CD1 3.49Å; P603-L619 HydrophobicContact CB-CD1 3.9Å; P603-L619 HydrophobicContact CB-CD2 4.02Å; P603-L619 WeakPolarHBondContact O-CD1 3.33Å
604	L	97.2	Very high	95.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-71.2	-38.3	176.6	-171.4	62.3	0	0	0	112.4	T602 A607 A608 C616 L619 L620 A624 R626 A636 L651	T602-L604 PolarHBondContact O-N 3.26Å; T602-L604 PolarHBondContact OG1-N 3.47Å; L604-A607 PolarHBondContact O-N 3.42Å; L604-A608 VanDerWaalsContact O-CB 3.28Å; L604-A608 WeakPolarHBondContact O-CB 3.41Å; L604-A608 PolarHBondContact O-N 2.94Å; L604-C616 HydrophobicContact CD1-CB 4.01Å; L604-L619 HydrophobicContact CB-CD1 4.18Å; L604-L619 HydrophobicContact CD1-CB 4.24Å; L604-L619 HydrophobicContact CD1-CD1 4.2Å; L604-L620 HydrophobicContact CD1-CG 4.37Å; L604-L620 HydrophobicContact CD2-CD2 3.98Å; L604-A624 HydrophobicContact CB-CB 4.42Å; L604-A624 HydrophobicContact CD2-CB 4.16Å; L604-R626 HydrophobicContact CD2-CB 4.27Å; L604-A636 HydrophobicContact CB-CB 4.49Å; L604-A636 HydrophobicContact CD2-CB 4.22Å; L604-A636 HydrophobicContact CG-CB 3.88Å; L604-L651 HydrophobicContact CD1-CD2 4.08Å; L604-L651 HydrophobicContact CD2-CD2 3.96Å; L604-L651 HydrophobicContact CG-CD2 4.19Å
605	H	97.3	Very high	95.3	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-46	172.9	-69.1	89.9	0	0	0	110.9	F601 T602 A607 A608 A609 L628 E634 A636 L639	F601-H605 HydrophobicContact CB-CB 4.32Å; F601-H605 HydrophobicContact CD1-CB 3.51Å; F601-H605 HydrophobicContact CE1-CB 4.08Å; F601-H605 HydrophobicContact CG-CB 4.13Å; T602-H605 PolarHBondContact N-ND1 3.12Å; T602-H605 WeakPolarHBondContact O-CB 3.41Å; T602-H605 PolarHBondContact O-N 3.41Å; T602-H605 PolarHBondContact OG1-N 2.95Å; T602-H605 PolarHBondContact OG1-ND1 3.25Å; H605-A607 PolarHBondContact O-N 3.48Å; H605-A608 PolarHBondContact O-N 2.97Å; H605-A609 VanDerWaalsContact O-CB 3.3Å; H605-A609 WeakPolarHBondContact O-CB 3.45Å; H605-A609 PolarHBondContact O-N 3.48Å; H605-L628 PolarHBondContact CE1-O 3.25Å; H605-L628 VanDerWaalsContact CE1-O 3.3Å; H605-L628 PolarHBondContact NE2-O 2.91Å; H605-E634 PolarHBondContact NE2-O 3.18Å; H605-A636 PolarHBondContact CD2-N 3.19Å; H605-A636 PolarHBondContact NE2-N 2.63Å; H605-L639 HydrophobicContact CB-CD1 3.94Å
606	E	96	Very high	95.3	Very high	33 Å²	33	39.2 Å²	39.2	15%	0.154	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-45.9	177.2	-78.1	-66.7	165.1	0	0	112.2	S576 T602 N610	S576-E606 VanDerWaalsContact CB-OE2 3.31Å; S576-E606 WeakPolarHBondContact CB-OE2 3.47Å; S576-E606 PolarHBondContact OG-OE2 3.09Å; T602-E606 PolarHBondContact O-N 3.4Å; T602-E606 VanDerWaalsContact O-N 3.14Å; E606-N610 WeakPolarHBondContact O-CB 3.42Å; E606-N610 PolarHBondContact O-N 2.73Å; E606-N610 PolarHBondContact O-ND2 3.2Å; E606-N610 PolarHBondContact OE2-ND2 3.22Å
607	A	97.1	Very high	95.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-64	-43.2	177.9	0	0	0	0	0	111.9	C575 P603 L604 H605 G611 K612 I615 C616 L619	C575-A607 HydrophobicContact CB-CB 4.46Å; P603-A607 WeakPolarHBondContact O-CB 3.31Å; P603-A607 PolarHBondContact O-N 3Å; L604-A607 PolarHBondContact O-N 3.42Å; H605-A607 PolarHBondContact O-N 3.48Å; A607-G611 PolarHBondContact O-N 2.89Å; A607-G611 VanDerWaalsContact O-N 3.11Å; A607-K612 HydrophobicContact CB-CB 4.19Å; A607-K612 PolarHBondContact O-N 3.22Å; A607-I615 HydrophobicContact CB-CB 4.07Å; A607-I615 HydrophobicContact CB-CG2 3.62Å; A607-C616 VanDerWaalsContact CB-SG 3.56Å; A607-L619 HydrophobicContact CB-CD1 4.27Å
608	A	95.3	Very high	95	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-47.8	-179.5	0	0	0	0	0	112.4	L604 H605 N610 G611 A636 V640 I647 L651	L604-A608 VanDerWaalsContact O-CB 3.28Å; L604-A608 WeakPolarHBondContact O-CB 3.41Å; L604-A608 PolarHBondContact O-N 2.94Å; H605-A608 PolarHBondContact O-N 2.97Å; A608-N610 PolarHBondContact O-N 2.89Å; A608-G611 PolarHBondContact O-N 3.38Å; A608-G611 VanDerWaalsContact O-N 3.11Å; A608-A636 HydrophobicContact CB-CB 4.14Å; A608-A636 WeakPolarHBondContact CB-O 3.46Å; A608-V640 HydrophobicContact CB-CG2 4.09Å; A608-I647 HydrophobicContact CB-CG2 4.34Å; A608-L651 HydrophobicContact CB-CD1 3.96Å
609	A	95.1	Very high	95	Very high	23 Å²	23	35.3 Å²	35.3	19%	0.19	17%	0.172	C	C	.	.	H	α-helix	trans	-61.1	-32.6	178.8	0	0	0	0	0	112.8	H605 L639 K641	H605-A609 VanDerWaalsContact O-CB 3.3Å; H605-A609 WeakPolarHBondContact O-CB 3.45Å; H605-A609 PolarHBondContact O-N 3.48Å; A609-L639 HydrophobicContact CB-CB 4.12Å; A609-L639 HydrophobicContact CB-CD1 4.43Å; A609-K641 WeakPolarHBondContact O-CE 3.09Å
610	N	94.1	Very high	94.7	Very high	69 Å²	69	29.7 Å²	29.7	37%	0.369	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	7.3	179.4	-68.6	-73.7	0	0	0	114.2	S576 E606 A608 K612	S576-N610 WeakPolarHBondContact O-CB 3.43Å; S576-N610 PolarHBondContact OG-ND2 3.08Å; E606-N610 WeakPolarHBondContact O-CB 3.42Å; E606-N610 PolarHBondContact O-N 2.73Å; E606-N610 PolarHBondContact O-ND2 3.2Å; E606-N610 PolarHBondContact OE2-ND2 3.22Å; A608-N610 PolarHBondContact O-N 2.89Å; N610-K612 HydrophobicContact CB-CG 4.15Å; N610-K612 WeakPolarHBondContact O-CE 3.41Å
611	G	93	Very high	94.4	Very high	27 Å²	27	27.3 Å²	27.3	28%	0.278	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	35.4	174	0	0	0	0	0	114.7	A607 A608 F613 N644 I647	A607-G611 PolarHBondContact O-N 2.89Å; A607-G611 VanDerWaalsContact O-N 3.11Å; A608-G611 PolarHBondContact O-N 3.38Å; A608-G611 VanDerWaalsContact O-N 3.11Å; G611-F613 PolarHBondContact O-N 3.18Å; G611-N644 WeakPolarHBondContact CA-ND2 3.27Å; G611-I647 VanDerWaalsContact C-CD1 3.41Å
612	K	95.2	Very high	94	Very high	67 Å²	67	29.4 Å²	29.4	29%	0.291	16%	0.16	S	C	.	.			trans	-96.7	74	-175.4	-52.1	-53.9	-177.2	-175.8	0	111.8	S576 A607 N610 D614 I615 C616	S576-K612 VanDerWaalsContact O-CE 3.27Å; S576-K612 WeakPolarHBondContact O-CE 3.4Å; A607-K612 HydrophobicContact CB-CB 4.19Å; A607-K612 PolarHBondContact O-N 3.22Å; N610-K612 HydrophobicContact CB-CG 4.15Å; N610-K612 WeakPolarHBondContact O-CE 3.41Å; K612-D614 PolarHBondContact O-N 3.37Å; K612-I615 HydrophobicContact CB-CB 3.91Å; K612-I615 HydrophobicContact CB-CG1 3.95Å; K612-I615 WeakPolarHBondContact O-CB 3.37Å; K612-I615 PolarHBondContact O-N 3.17Å; K612-I615 VanDerWaalsContact O-N 3.1Å; K612-C616 PolarHBondContact O-N 3.45Å; K612-C616 PolarHBondContact O-SG 3.11Å
613	F	92.2	Very high	93.5	Very high	46 Å²	46	31.8 Å²	31.8	20%	0.202	18%	0.184	C	C	.	.	H	α-helix	trans	-50.1	-52.4	-175.7	-179.6	-91.1	0	0	0	114	G611 I615 C616 K617 D646 I647 L650	G611-F613 PolarHBondContact O-N 3.18Å; F613-I615 VanDerWaalsContact C-N 3.26Å; F613-I615 PolarHBondContact O-N 3Å; F613-C616 WeakPolarHBondContact O-CB 3.42Å; F613-C616 PolarHBondContact O-N 3.43Å; F613-C616 VanDerWaalsContact O-N 3.16Å; F613-K617 PolarHBondContact O-N 3.21Å; F613-D646 HydrophobicContact CD2-CB 3.95Å; F613-D646 WeakPolarHBondContact CD2-OD2 3.45Å; F613-D646 HydrophobicContact CE2-CB 3.96Å; F613-I647 HydrophobicContact CB-CD1 4.23Å; F613-I647 HydrophobicContact CB-CG1 3.92Å; F613-I647 HydrophobicContact CD2-CG1 3.82Å; F613-I647 HydrophobicContact CG-CG1 4.37Å; F613-L650 HydrophobicContact CD2-CD2 4.35Å; F613-L650 HydrophobicContact CE2-CB 4.25Å; F613-L650 HydrophobicContact CE2-CD2 4.07Å; F613-L650 HydrophobicContact CZ-CD2 4.49Å
614	D	92.8	Very high	93.3	Very high	105 Å²	105	32.2 Å²	32.2	56%	0.561	19%	0.187	S	C	*	.	H	α-helix	trans	-63.2	-32.5	-177.7	-64.7	-40.7	0	0	0	112.7	Y580 K612 L618	Y580-D614 HydrophobicContact CD2-CB 4.09Å; Y580-D614 HydrophobicContact CE2-CB 4.39Å; K612-D614 PolarHBondContact O-N 3.37Å; D614-L618 WeakPolarHBondContact O-CB 3.41Å; D614-L618 PolarHBondContact O-N 2.91Å
615	I	96.6	Very high	92.8	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.015	20%	0.204	C	C	.	.	H	α-helix	trans	-72.1	-43.8	175.5	-60.6	-56.4	0	0	0	110.8	C575 Y580 T583 A607 K612 F613 K617 L618 L619	C575-I615 HydrophobicContact CB-CG2 3.73Å; Y580-I615 HydrophobicContact CD2-CD1 4.28Å; T583-I615 HydrophobicContact CG2-CD1 4.39Å; T583-I615 HydrophobicContact CG2-CG2 4.45Å; A607-I615 HydrophobicContact CB-CB 4.07Å; A607-I615 HydrophobicContact CB-CG2 3.62Å; K612-I615 HydrophobicContact CB-CB 3.91Å; K612-I615 HydrophobicContact CB-CG1 3.95Å; K612-I615 WeakPolarHBondContact O-CB 3.37Å; K612-I615 PolarHBondContact O-N 3.17Å; K612-I615 VanDerWaalsContact O-N 3.1Å; F613-I615 VanDerWaalsContact C-N 3.26Å; F613-I615 PolarHBondContact O-N 3Å; I615-K617 VanDerWaalsContact C-N 3.26Å; I615-K617 PolarHBondContact O-N 3.47Å; I615-L618 PolarHBondContact O-N 3.48Å; I615-L619 HydrophobicContact CG2-CD1 3.85Å; I615-L619 HydrophobicContact CG2-CG 4.19Å; I615-L619 WeakPolarHBondContact O-CB 3.42Å; I615-L619 WeakPolarHBondContact O-CG 3.32Å; I615-L619 PolarHBondContact O-N 3.22Å
616	C	94	Very high	92.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-56.2	-45.7	174.5	-66.6	0	0	0	0	110.5	L604 A607 K612 F613 L619 L620 L650	L604-C616 HydrophobicContact CD1-CB 4.01Å; A607-C616 VanDerWaalsContact CB-SG 3.56Å; K612-C616 PolarHBondContact O-N 3.45Å; K612-C616 PolarHBondContact O-SG 3.11Å; F613-C616 WeakPolarHBondContact O-CB 3.42Å; F613-C616 PolarHBondContact O-N 3.43Å; F613-C616 VanDerWaalsContact O-N 3.16Å; C616-L619 PolarHBondContact O-N 3.09Å; C616-L620 WeakPolarHBondContact O-CB 3.4Å; C616-L620 VanDerWaalsContact O-CG 3.23Å; C616-L620 WeakPolarHBondContact O-CG 3.33Å; C616-L620 PolarHBondContact O-N 2.92Å; C616-L650 HydrophobicContact CB-CD2 3.84Å
617	K	89.3	Confident	91.9	Very high	74 Å²	74	41 Å²	41	32%	0.322	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-47.5	176.9	-172.1	-179	176.9	-171.6	0	111.8	F613 I615 L620 S621 L650 E674	F613-K617 PolarHBondContact O-N 3.21Å; I615-K617 VanDerWaalsContact C-N 3.26Å; I615-K617 PolarHBondContact O-N 3.47Å; K617-L620 PolarHBondContact O-N 3.15Å; K617-S621 PolarHBondContact O-N 2.97Å; K617-L650 HydrophobicContact CB-CD2 4.17Å; K617-E674 VanDerWaalsContact CE-OE2 3.24Å; K617-E674 WeakPolarHBondContact CE-OE2 3.36Å; K617-E674 IonicContact NZ-OE2 3.41Å; K617-E674 PolarHBondContact NZ-OE2 3.36Å
618	L	92.3	Very high	91.6	Very high	6 Å²	6	43.6 Å²	43.6	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-59	-50.1	178.1	179.9	65.4	0	0	0	111.4	Y580 T583 E584 I587 D614 I615 L620 S621 H622	Y580-L618 HydrophobicContact CD2-CD2 4.17Å; Y580-L618 HydrophobicContact CE2-CB 4.02Å; Y580-L618 HydrophobicContact CE2-CD1 4.37Å; Y580-L618 HydrophobicContact CE2-CD2 3.99Å; Y580-L618 HydrophobicContact CE2-CG 4.36Å; T583-L618 HydrophobicContact CG2-CD2 3.75Å; E584-L618 HydrophobicContact CB-CD2 3.98Å; E584-L618 HydrophobicContact CG-CD1 4.49Å; I587-L618 HydrophobicContact CD1-CG 4.42Å; D614-L618 WeakPolarHBondContact O-CB 3.41Å; D614-L618 PolarHBondContact O-N 2.91Å; I615-L618 PolarHBondContact O-N 3.48Å; L618-L620 PolarHBondContact O-N 3.32Å; L618-S621 PolarHBondContact O-N 3.25Å; L618-S621 PolarHBondContact O-OG 3.43Å; L618-H622 PolarHBondContact O-CD2 3.37Å; L618-H622 VanDerWaalsContact O-CD2 3.3Å; L618-H622 PolarHBondContact O-N 3.25Å
619	L	94.8	Very high	91.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-59.2	-45.7	179.1	-73.5	172.3	0	0	0	112.2	I587 V593 P603 L604 A607 I615 C616 S621 H622 G623 A624	I587-L619 HydrophobicContact CD1-CD2 3.94Å; V593-L619 HydrophobicContact CB-CD2 4.28Å; V593-L619 HydrophobicContact CG1-CD2 4.15Å; P603-L619 VanDerWaalsContact C-CD1 3.49Å; P603-L619 HydrophobicContact CB-CD1 3.9Å; P603-L619 HydrophobicContact CB-CD2 4.02Å; P603-L619 WeakPolarHBondContact O-CD1 3.33Å; L604-L619 HydrophobicContact CB-CD1 4.18Å; L604-L619 HydrophobicContact CD1-CB 4.24Å; L604-L619 HydrophobicContact CD1-CD1 4.2Å; A607-L619 HydrophobicContact CB-CD1 4.27Å; I615-L619 HydrophobicContact CG2-CD1 3.85Å; I615-L619 HydrophobicContact CG2-CG 4.19Å; I615-L619 WeakPolarHBondContact O-CB 3.42Å; I615-L619 WeakPolarHBondContact O-CG 3.32Å; I615-L619 PolarHBondContact O-N 3.22Å; C616-L619 PolarHBondContact O-N 3.09Å; L619-S621 VanDerWaalsContact C-N 3.33Å; L619-S621 PolarHBondContact O-N 3.05Å; L619-H622 CarbonylContact O-C 3.52Å; L619-H622 PolarHBondContact O-N 3.23Å; L619-H622 VanDerWaalsContact O-N 3.09Å; L619-G623 PolarHBondContact O-N 2.98Å; L619-A624 VanDerWaalsContact C-CB 3.49Å; L619-A624 HydrophobicContact CB-CB 3.78Å; L619-A624 VanDerWaalsContact O-CB 3.24Å; L619-A624 WeakPolarHBondContact O-CB 3.45Å; L619-A624 PolarHBondContact O-N 3.19Å
620	L	89.8	Confident	91.3	Very high	10 Å²	10	46 Å²	46	5%	0.052	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-40.6	177	-71	169.7	0	0	0	112	L604 C616 K617 L618 H622 G623 R626 L650 L651	L604-L620 HydrophobicContact CD1-CG 4.37Å; L604-L620 HydrophobicContact CD2-CD2 3.98Å; C616-L620 WeakPolarHBondContact O-CB 3.4Å; C616-L620 VanDerWaalsContact O-CG 3.23Å; C616-L620 WeakPolarHBondContact O-CG 3.33Å; C616-L620 PolarHBondContact O-N 2.92Å; K617-L620 PolarHBondContact O-N 3.15Å; L618-L620 PolarHBondContact O-N 3.32Å; L620-H622 PolarHBondContact O-N 3.14Å; L620-G623 PolarHBondContact O-N 3.42Å; L620-G623 VanDerWaalsContact O-N 3.11Å; L620-R626 HydrophobicContact CD2-CB 4.21Å; L620-L650 HydrophobicContact CD1-CD1 4.06Å; L620-L650 HydrophobicContact CD1-CD2 4.05Å; L620-L650 HydrophobicContact CD1-CG 3.75Å; L620-L651 HydrophobicContact CD1-CD2 4.22Å
621	S	87.7	Confident	91.3	Very high	73 Å²	73	50.9 Å²	50.9	51%	0.51	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-22.6	176.5	75.4	0	0	0	0	113.3	K617 L618 L619	K617-S621 PolarHBondContact O-N 2.97Å; L618-S621 PolarHBondContact O-N 3.25Å; L618-S621 PolarHBondContact O-OG 3.43Å; L619-S621 VanDerWaalsContact C-N 3.33Å; L619-S621 PolarHBondContact O-N 3.05Å
622	H	89.4	Confident	91.2	Very high	80 Å²	80	55.3 Å²	55.3	37%	0.37	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	14.1	176.5	-75.8	-76.8	0	0	0	113.8	I587 V593 L618 L619 L620	I587-H622 HydrophobicContact CG2-CB 3.84Å; V593-H622 HydrophobicContact CG1-CB 4.05Å; L618-H622 PolarHBondContact O-CD2 3.37Å; L618-H622 VanDerWaalsContact O-CD2 3.3Å; L618-H622 PolarHBondContact O-N 3.25Å; L619-H622 CarbonylContact O-C 3.52Å; L619-H622 PolarHBondContact O-N 3.23Å; L619-H622 VanDerWaalsContact O-N 3.09Å; L620-H622 PolarHBondContact O-N 3.14Å
623	G	87.2	Confident	90.9	Very high	49 Å²	49	54.4 Å²	54.4	51%	0.505	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	22.9	172	0	0	0	0	0	115.5	N594 L619 L620 D625	N594-G623 PolarHBondContact ND2-O 3.16Å; N594-G623 VanDerWaalsContact ND2-O 3.11Å; L619-G623 PolarHBondContact O-N 2.98Å; L620-G623 PolarHBondContact O-N 3.42Å; L620-G623 VanDerWaalsContact O-N 3.11Å; G623-D625 PolarHBondContact O-N 3.1Å
624	A	92.3	Very high	91	Very high	9 Å²	9	55.6 Å²	55.6	7%	0.074	31%	0.309	C	S	.	.			trans	-62.6	127.6	169.3	0	0	0	0	0	110.8	V593 N594 L604 L619 R626	V593-A624 HydrophobicContact CB-CB 4.37Å; V593-A624 HydrophobicContact CG2-CB 4.45Å; N594-A624 WeakPolarHBondContact OD1-CA 3.41Å; L604-A624 HydrophobicContact CB-CB 4.42Å; L604-A624 HydrophobicContact CD2-CB 4.16Å; L619-A624 VanDerWaalsContact C-CB 3.49Å; L619-A624 HydrophobicContact CB-CB 3.78Å; L619-A624 VanDerWaalsContact O-CB 3.24Å; L619-A624 WeakPolarHBondContact O-CB 3.45Å; L619-A624 PolarHBondContact O-N 3.19Å; A624-R626 PolarHBondContact O-N 2.92Å
625	D	87.5	Confident	91	Very high	65 Å²	65	52 Å²	52	35%	0.348	29%	0.29	S	S	.	.			trans	-83.4	107.6	-179.1	-176.4	-3.2	0	0	0	110	N594 G623 S627 L628	N594-D625 PolarHBondContact OD1-N 3.5Å; G623-D625 PolarHBondContact O-N 3.1Å; D625-S627 VanDerWaalsContact CG-OG 3.3Å; D625-S627 PolarHBondContact O-N 3.12Å; D625-S627 VanDerWaalsContact OD1-CB 3.31Å; D625-S627 WeakPolarHBondContact OD1-CB 3.33Å; D625-S627 PolarHBondContact OD1-N 3.13Å; D625-S627 PolarHBondContact OD1-OG 3.33Å; D625-S627 PolarHBondContact OD2-OG 3.13Å; D625-L628 HydrophobicContact CB-CD1 3.92Å; D625-L628 HydrophobicContact CB-CG 3.85Å
626	R	88.4	Confident	90.8	Very high	74 Å²	74	51.9 Å²	51.9	28%	0.279	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.8	177.8	66.6	178.1	71.1	-151.6	3.6	114.1	L604 L620 A624 L650 L651 G653	L604-R626 HydrophobicContact CD2-CB 4.27Å; L620-R626 HydrophobicContact CD2-CB 4.21Å; A624-R626 PolarHBondContact O-N 2.92Å; R626-L650 PolarHBondContact NH1-O 2.85Å; R626-L651 WeakPolarHBondContact CD-O 3.29Å; R626-L651 PolarHBondContact NH1-O 3.45Å; R626-G653 VanDerWaalsContact NH1-N 3.19Å
627	S	85.5	Confident	90.7	Very high	80 Å²	80	54.3 Å²	54.3	56%	0.559	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-10.8	-176.5	75.2	0	0	0	0	113.7	D625	D625-S627 VanDerWaalsContact CG-OG 3.3Å; D625-S627 PolarHBondContact O-N 3.12Å; D625-S627 VanDerWaalsContact OD1-CB 3.31Å; D625-S627 WeakPolarHBondContact OD1-CB 3.33Å; D625-S627 PolarHBondContact OD1-N 3.13Å; D625-S627 PolarHBondContact OD1-OG 3.33Å; D625-S627 PolarHBondContact OD2-OG 3.13Å
628	L	91.8	Very high	90.8	Very high	55 Å²	55	55.4 Å²	55.4	29%	0.288	31%	0.312	S	S	.	.			trans	-63.8	140.6	176.3	-66	177	0	0	0	110.4	N594 T602 H605 D625	N594-L628 HydrophobicContact CB-CD1 4.14Å; T602-L628 HydrophobicContact CG2-CB 4.45Å; T602-L628 HydrophobicContact CG2-CD1 3.91Å; H605-L628 PolarHBondContact CE1-O 3.25Å; H605-L628 VanDerWaalsContact CE1-O 3.3Å; H605-L628 PolarHBondContact NE2-O 2.91Å; D625-L628 HydrophobicContact CB-CD1 3.92Å; D625-L628 HydrophobicContact CB-CG 3.85Å
629	V	91.1	Very high	90.8	Very high	70 Å²	70	56.7 Å²	56.7	42%	0.424	32%	0.319	S	S	.	.	B	Isolated β-bridge	trans	-112.2	142.8	176.1	-66.1	0	0	0	0	110.7	E634 T635	V629-E634 CarbonylContact C-O 3.59Å; V629-E634 VanDerWaalsContact CA-O 3.26Å; V629-E634 WeakPolarHBondContact CA-O 3.47Å; V629-T635 HydrophobicContact CG1-CG2 3.64Å
630	N	93.1	Very high	90.7	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.021	33%	0.325	C	S	.	.			trans	-68.6	-176.1	170.4	74.2	5.7	0	0	0	111.2	K600 F601 D632 G633 E634	K600-N630 WeakPolarHBondContact O-CA 3.34Å; F601-N630 HydrophobicContact CD2-CB 3.8Å; F601-N630 HydrophobicContact CE2-CB 3.74Å; F601-N630 WeakPolarHBondContact CE2-ND2 3.49Å; F601-N630 HydrophobicContact CZ-CB 4.47Å; F601-N630 WeakPolarHBondContact CZ-ND2 3.46Å; N630-D632 PolarHBondContact O-N 3.5Å; N630-D632 WeakPolarHBondContact OD1-CA 3.4Å; N630-D632 PolarHBondContact OD1-N 3.46Å; N630-G633 PolarHBondContact O-N 3.21Å; N630-G633 VanDerWaalsContact O-N 3.16Å; N630-G633 PolarHBondContact OD1-N 2.82Å; N630-E634 PolarHBondContact N-O 3.02Å; N630-E634 PolarHBondContact ND2-OE2 3.23Å; N630-E634 PolarHBondContact OD1-N 3.22Å; N630-E634 PolarHBondContact OD1-O 3.16Å
631	R	92.9	Very high	90.5	Very high	172 Å²	172	63 Å²	63	65%	0.649	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.9	178.5	-179.7	174.9	176.2	176.1	-2	113.3	W599 G633	W599-R631 WeakPolarHBondContact O-CB 3.38Å; W599-R631 PolarHBondContact O-N 2.97Å; R631-G633 VanDerWaalsContact C-N 3.26Å
632	D	91	Very high	90	Very high	119 Å²	119	67.6 Å²	67.6	64%	0.636	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.1	179.5	-60.1	-43.9	0	0	0	112.4	N630 E634	N630-D632 PolarHBondContact O-N 3.5Å; N630-D632 WeakPolarHBondContact OD1-CA 3.4Å; N630-D632 PolarHBondContact OD1-N 3.46Å; D632-E634 HydrophobicContact CB-CG 4.38Å
633	G	88.5	Confident	89.5	Confident	48 Å²	48	68.4 Å²	68.4	50%	0.495	38%	0.381	S	S	.	.	S	Bend	trans	86	12.2	177.9	0	0	0	0	0	113.8	N630 R631	N630-G633 PolarHBondContact O-N 3.21Å; N630-G633 VanDerWaalsContact O-N 3.16Å; N630-G633 PolarHBondContact OD1-N 2.82Å; R631-G633 VanDerWaalsContact C-N 3.26Å
634	E	94.6	Very high	89.4	Confident	72 Å²	72	67.6 Å²	67.6	34%	0.336	37%	0.365	S	S	.	.			trans	-93.6	134.3	-177.9	-58.4	171.3	129.8	0	0	109.9	H605 V629 N630 D632 D638 L639	H605-E634 PolarHBondContact NE2-O 3.18Å; V629-E634 CarbonylContact C-O 3.59Å; V629-E634 VanDerWaalsContact CA-O 3.26Å; V629-E634 WeakPolarHBondContact CA-O 3.47Å; N630-E634 PolarHBondContact N-O 3.02Å; N630-E634 PolarHBondContact ND2-OE2 3.23Å; N630-E634 PolarHBondContact OD1-N 3.22Å; N630-E634 PolarHBondContact OD1-O 3.16Å; D632-E634 HydrophobicContact CB-CG 4.38Å; E634-D638 HydrophobicContact CB-CB 3.99Å; E634-D638 HydrophobicContact CG-CB 4.49Å; E634-L639 HydrophobicContact CB-CD2 4.26Å; E634-L639 HydrophobicContact CB-CG 4.45Å; E634-L639 WeakPolarHBondContact OE2-CD2 3.19Å
635	T	93.2	Very high	88.7	Confident	29 Å²	29	70.9 Å²	70.9	18%	0.178	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-78.8	168.4	168	64.5	0	0	0	0	110.6	V629 L637 D638 L639	V629-T635 HydrophobicContact CG1-CG2 3.64Å; T635-L637 PolarHBondContact O-N 2.86Å; T635-L637 VanDerWaalsContact O-N 3.15Å; T635-L637 PolarHBondContact OG1-N 2.73Å; T635-D638 WeakPolarHBondContact CB-OD2 3.44Å; T635-D638 PolarHBondContact N-OD2 3.33Å; T635-D638 PolarHBondContact O-N 3.38Å; T635-D638 VanDerWaalsContact OG1-CG 3.3Å; T635-D638 PolarHBondContact OG1-N 2.93Å; T635-D638 PolarHBondContact OG1-OD2 3.1Å; T635-L639 PolarHBondContact O-N 3.49Å
636	A	92.5	Very high	88.4	Confident	1 Å²	1	71.2 Å²	71.2	1%	0.008	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-29.6	172.3	0	0	0	0	0	112.6	L604 H605 A608 V640 L651	L604-A636 HydrophobicContact CB-CB 4.49Å; L604-A636 HydrophobicContact CD2-CB 4.22Å; L604-A636 HydrophobicContact CG-CB 3.88Å; H605-A636 PolarHBondContact CD2-N 3.19Å; H605-A636 PolarHBondContact NE2-N 2.63Å; A608-A636 HydrophobicContact CB-CB 4.14Å; A608-A636 WeakPolarHBondContact CB-O 3.46Å; A636-V640 WeakPolarHBondContact O-CG2 3.2Å; A636-L651 HydrophobicContact CB-CD1 4.09Å
637	L	91.6	Very high	88.3	Confident	51 Å²	51	67.7 Å²	67.7	27%	0.267	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-37.7	176.3	175.2	60.5	0	0	0	111.9	T635 L639 V640 A648 L651 R652	T635-L637 PolarHBondContact O-N 2.86Å; T635-L637 VanDerWaalsContact O-N 3.15Å; T635-L637 PolarHBondContact OG1-N 2.73Å; L637-L639 PolarHBondContact O-N 3.39Å; L637-V640 WeakPolarHBondContact O-CB 3.21Å; L637-V640 WeakPolarHBondContact O-CG2 3.42Å; L637-V640 PolarHBondContact O-N 3.18Å; L637-A648 HydrophobicContact CD1-CB 3.81Å; L637-A648 WeakPolarHBondContact CD1-O 3.25Å; L637-L651 HydrophobicContact CB-CB 4.1Å; L637-L651 HydrophobicContact CB-CD1 4.37Å; L637-L651 HydrophobicContact CD1-CB 4.08Å; L637-R652 HydrophobicContact CD1-CG 4.22Å; L637-R652 HydrophobicContact CD2-CG 3.74Å
638	D	91.5	Very high	88.2	Confident	97 Å²	97	64.6 Å²	64.6	52%	0.519	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-23.5	-177.7	-59.4	-48.7	0	0	0	112.3	E634 T635 V640	E634-D638 HydrophobicContact CB-CB 3.99Å; E634-D638 HydrophobicContact CG-CB 4.49Å; T635-D638 WeakPolarHBondContact CB-OD2 3.44Å; T635-D638 PolarHBondContact N-OD2 3.33Å; T635-D638 PolarHBondContact O-N 3.38Å; T635-D638 VanDerWaalsContact OG1-CG 3.3Å; T635-D638 PolarHBondContact OG1-N 2.93Å; T635-D638 PolarHBondContact OG1-OD2 3.1Å; D638-V640 VanDerWaalsContact C-N 3.35Å
639	L	92.5	Very high	87.5	Confident	32 Å²	32	64.3 Å²	64.3	17%	0.168	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-4.6	177.2	-61.2	-179.9	0	0	0	113.8	F601 H605 A609 E634 T635 L637 K641	F601-L639 HydrophobicContact CD1-CD1 4.27Å; F601-L639 HydrophobicContact CE1-CD1 3.41Å; F601-L639 VanDerWaalsContact CE1-CD1 3.41Å; F601-L639 HydrophobicContact CZ-CD1 3.77Å; H605-L639 HydrophobicContact CB-CD1 3.94Å; A609-L639 HydrophobicContact CB-CB 4.12Å; A609-L639 HydrophobicContact CB-CD1 4.43Å; E634-L639 HydrophobicContact CB-CD2 4.26Å; E634-L639 HydrophobicContact CB-CG 4.45Å; E634-L639 WeakPolarHBondContact OE2-CD2 3.19Å; T635-L639 PolarHBondContact O-N 3.49Å; L637-L639 PolarHBondContact O-N 3.39Å; L639-K641 PolarHBondContact O-N 2.9Å
640	V	91.8	Very high	86.9	Confident	21 Å²	21	61.6 Å²	61.6	13%	0.127	34%	0.337	C	S	.	.			trans	-70.5	124.5	179.9	-178	0	0	0	0	109.5	A608 A636 L637 D638 N644 I647 A648 L651	A608-V640 HydrophobicContact CB-CG2 4.09Å; A636-V640 WeakPolarHBondContact O-CG2 3.2Å; L637-V640 WeakPolarHBondContact O-CB 3.21Å; L637-V640 WeakPolarHBondContact O-CG2 3.42Å; L637-V640 PolarHBondContact O-N 3.18Å; D638-V640 VanDerWaalsContact C-N 3.35Å; V640-N644 HydrophobicContact CG1-CB 3.85Å; V640-N644 VanDerWaalsContact CG1-O 3.23Å; V640-N644 WeakPolarHBondContact CG1-O 3.46Å; V640-I647 HydrophobicContact CG1-CB 4.16Å; V640-I647 HydrophobicContact CG1-CG2 4.38Å; V640-I647 HydrophobicContact CG2-CB 4.4Å; V640-I647 HydrophobicContact CG2-CG2 3.76Å; V640-A648 HydrophobicContact CG1-CB 4.09Å; V640-L651 HydrophobicContact CG2-CD1 3.8Å
641	K	86.8	Confident	86.5	Confident	122 Å²	122	61.8 Å²	61.8	53%	0.53	34%	0.338	S	S	.	.			trans	-68.1	145.8	174.7	-62.7	176.2	-177.4	169.5	0	110.4	A609 L639 S643 N644	A609-K641 WeakPolarHBondContact O-CE 3.09Å; L639-K641 PolarHBondContact O-N 2.9Å; K641-S643 PolarHBondContact O-N 3.22Å; K641-N644 PolarHBondContact O-N 3.36Å
642	D	77.5	Confident	85.6	Confident	170 Å²	170	59.6 Å²	59.6	91%	0.909	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-26.6	-178.8	-65.1	-32.2	0	0	0	114.5	N644	D642-N644 VanDerWaalsContact C-N 3.29Å; D642-N644 PolarHBondContact O-N 3.11Å
643	S	78.9	Confident	84.4	Confident	96 Å²	96	54.4 Å²	54.4	67%	0.671	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-18.5	177.2	62.1	0	0	0	0	114.4	K641	K641-S643 PolarHBondContact O-N 3.22Å
644	N	83.8	Confident	82.8	Confident	32 Å²	32	55.6 Å²	55.6	17%	0.171	30%	0.299	C	S	.	.			trans	-108.3	55.3	-170.1	-56.9	-19.6	0	0	0	110.9	G611 V640 K641 D642 D646 I647 A648	G611-N644 WeakPolarHBondContact CA-ND2 3.27Å; V640-N644 HydrophobicContact CG1-CB 3.85Å; V640-N644 VanDerWaalsContact CG1-O 3.23Å; V640-N644 WeakPolarHBondContact CG1-O 3.46Å; K641-N644 PolarHBondContact O-N 3.36Å; D642-N644 VanDerWaalsContact C-N 3.29Å; D642-N644 PolarHBondContact O-N 3.11Å; N644-D646 WeakPolarHBondContact CA-OD1 3.41Å; N644-D646 PolarHBondContact O-N 2.9Å; N644-I647 HydrophobicContact CB-CB 4.42Å; N644-I647 HydrophobicContact CB-CD1 4.1Å; N644-I647 HydrophobicContact CB-CG1 4.36Å; N644-I647 PolarHBondContact O-N 2.98Å; N644-A648 PolarHBondContact O-N 3.02Å
645	S	79	Confident	81.2	Confident	78 Å²	78	56.7 Å²	56.7	55%	0.545	31%	0.311	S	S	.	.	H	α-helix	trans	-59.6	-32.2	-176.9	60.8	0	0	0	0	112.9	I647 A648 D649	S645-I647 PolarHBondContact O-N 3.2Å; S645-A648 WeakPolarHBondContact O-CB 3.46Å; S645-A648 PolarHBondContact O-N 3.18Å; S645-D649 VanDerWaalsContact O-CG 3.27Å; S645-D649 PolarHBondContact O-N 3.1Å
646	D	80.8	Confident	79.4	Confident	72 Å²	72	56 Å²	56	39%	0.385	31%	0.308	S	S	.	.	H	α-helix	trans	-59.3	-42.6	175.4	58.8	-22.7	0	0	0	113.2	F613 N644 L650	F613-D646 HydrophobicContact CD2-CB 3.95Å; F613-D646 WeakPolarHBondContact CD2-OD2 3.45Å; F613-D646 HydrophobicContact CE2-CB 3.96Å; N644-D646 WeakPolarHBondContact CA-OD1 3.41Å; N644-D646 PolarHBondContact O-N 2.9Å; D646-L650 WeakPolarHBondContact O-CB 3.33Å; D646-L650 PolarHBondContact O-N 3.23Å
647	I	86.3	Confident	77.6	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-69.5	-40.2	175.2	-60.4	178.1	0	0	0	110.3	A608 G611 F613 V640 N644 S645 D649 L650 L651	A608-I647 HydrophobicContact CB-CG2 4.34Å; G611-I647 VanDerWaalsContact C-CD1 3.41Å; F613-I647 HydrophobicContact CB-CD1 4.23Å; F613-I647 HydrophobicContact CB-CG1 3.92Å; F613-I647 HydrophobicContact CD2-CG1 3.82Å; F613-I647 HydrophobicContact CG-CG1 4.37Å; V640-I647 HydrophobicContact CG1-CB 4.16Å; V640-I647 HydrophobicContact CG1-CG2 4.38Å; V640-I647 HydrophobicContact CG2-CB 4.4Å; V640-I647 HydrophobicContact CG2-CG2 3.76Å; N644-I647 HydrophobicContact CB-CB 4.42Å; N644-I647 HydrophobicContact CB-CD1 4.1Å; N644-I647 HydrophobicContact CB-CG1 4.36Å; N644-I647 PolarHBondContact O-N 2.98Å; S645-I647 PolarHBondContact O-N 3.2Å; I647-D649 VanDerWaalsContact C-N 3.31Å; I647-D649 PolarHBondContact O-N 3.42Å; I647-L650 PolarHBondContact O-N 3.27Å; I647-L651 HydrophobicContact CG2-CD1 3.79Å; I647-L651 HydrophobicContact CG2-CG 4.23Å; I647-L651 WeakPolarHBondContact O-CB 3.22Å; I647-L651 WeakPolarHBondContact O-CG 3.35Å; I647-L651 PolarHBondContact O-N 3.45Å
648	A	83.9	Confident	75.8	Confident	15 Å²	15	57 Å²	57	12%	0.124	31%	0.313	C	S	.	.	H	α-helix	trans	-60.3	-44.5	176.9	0	0	0	0	0	111	L637 V640 N644 S645 L651 R652	L637-A648 HydrophobicContact CD1-CB 3.81Å; L637-A648 WeakPolarHBondContact CD1-O 3.25Å; V640-A648 HydrophobicContact CG1-CB 4.09Å; N644-A648 PolarHBondContact O-N 3.02Å; S645-A648 WeakPolarHBondContact O-CB 3.46Å; S645-A648 PolarHBondContact O-N 3.18Å; A648-L651 PolarHBondContact O-N 3.38Å; A648-R652 WeakPolarHBondContact O-CB 3.37Å; A648-R652 VanDerWaalsContact O-CG 3.25Å; A648-R652 WeakPolarHBondContact O-CG 3.5Å; A648-R652 PolarHBondContact O-N 2.83Å
649	D	75.5	Confident	74.3	Confident	49 Å²	49	57 Å²	57	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-66.2	-41.3	177.6	-67.8	-26.2	0	0	0	111.8	S645 I647 L651 R652 G653	S645-D649 VanDerWaalsContact O-CG 3.27Å; S645-D649 PolarHBondContact O-N 3.1Å; I647-D649 VanDerWaalsContact C-N 3.31Å; I647-D649 PolarHBondContact O-N 3.42Å; D649-L651 VanDerWaalsContact C-N 3.34Å; D649-L651 PolarHBondContact O-N 2.79Å; D649-R652 PolarHBondContact O-N 3.26Å; D649-R652 IonicContact OD1-NH1 2.97Å; D649-R652 PolarHBondContact OD1-NH1 3.33Å; D649-G653 PolarHBondContact O-N 3.17Å
650	L	80.3	Confident	72.7	Confident	13 Å²	13	55.8 Å²	55.8	7%	0.068	30%	0.304	C	S	.	.	H	α-helix	trans	-57.9	-44.5	173.4	178.2	66.5	0	0	0	112.1	F613 C616 K617 L620 R626 D646 I647	F613-L650 HydrophobicContact CD2-CD2 4.35Å; F613-L650 HydrophobicContact CE2-CB 4.25Å; F613-L650 HydrophobicContact CE2-CD2 4.07Å; F613-L650 HydrophobicContact CZ-CD2 4.49Å; C616-L650 HydrophobicContact CB-CD2 3.84Å; K617-L650 HydrophobicContact CB-CD2 4.17Å; L620-L650 HydrophobicContact CD1-CD1 4.06Å; L620-L650 HydrophobicContact CD1-CD2 4.05Å; L620-L650 HydrophobicContact CD1-CG 3.75Å; R626-L650 PolarHBondContact NH1-O 2.85Å; D646-L650 WeakPolarHBondContact O-CB 3.33Å; D646-L650 PolarHBondContact O-N 3.23Å; I647-L650 PolarHBondContact O-N 3.27Å
651	L	83.4	Confident	71	Confident	8 Å²	8	54.9 Å²	54.9	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-77.9	-28.2	-177.9	-69.1	175.3	0	0	0	113.2	L604 A608 L620 R626 A636 L637 V640 I647 A648 D649 G653	L604-L651 HydrophobicContact CD1-CD2 4.08Å; L604-L651 HydrophobicContact CD2-CD2 3.96Å; L604-L651 HydrophobicContact CG-CD2 4.19Å; A608-L651 HydrophobicContact CB-CD1 3.96Å; L620-L651 HydrophobicContact CD1-CD2 4.22Å; R626-L651 WeakPolarHBondContact CD-O 3.29Å; R626-L651 PolarHBondContact NH1-O 3.45Å; A636-L651 HydrophobicContact CB-CD1 4.09Å; L637-L651 HydrophobicContact CB-CB 4.1Å; L637-L651 HydrophobicContact CB-CD1 4.37Å; L637-L651 HydrophobicContact CD1-CB 4.08Å; V640-L651 HydrophobicContact CG2-CD1 3.8Å; I647-L651 HydrophobicContact CG2-CD1 3.79Å; I647-L651 HydrophobicContact CG2-CG 4.23Å; I647-L651 WeakPolarHBondContact O-CB 3.22Å; I647-L651 WeakPolarHBondContact O-CG 3.35Å; I647-L651 PolarHBondContact O-N 3.45Å; A648-L651 PolarHBondContact O-N 3.38Å; D649-L651 VanDerWaalsContact C-N 3.34Å; D649-L651 PolarHBondContact O-N 2.79Å; L651-G653 VanDerWaalsContact C-N 3.25Å; L651-G653 PolarHBondContact O-N 2.93Å
652	R	75.1	Confident	69.5	Low	126 Å²	126	54 Å²	54	48%	0.475	30%	0.295	S	S	.	.	H	α-helix	trans	-63.5	-28.3	171.7	-79.3	171.8	-179.1	174.4	-1.4	113.4	L637 A648 D649 A656	L637-R652 HydrophobicContact CD1-CG 4.22Å; L637-R652 HydrophobicContact CD2-CG 3.74Å; A648-R652 WeakPolarHBondContact O-CB 3.37Å; A648-R652 VanDerWaalsContact O-CG 3.25Å; A648-R652 WeakPolarHBondContact O-CG 3.5Å; A648-R652 PolarHBondContact O-N 2.83Å; D649-R652 PolarHBondContact O-N 3.26Å; D649-R652 IonicContact OD1-NH1 2.97Å; D649-R652 PolarHBondContact OD1-NH1 3.33Å; R652-A656 HydrophobicContact CB-CB 3.94Å
653	G	64.7	Low	68.8	Low	10 Å²	10	54.2 Å²	54.2	10%	0.103	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	68	-135.9	174.7	0	0	0	0	0	113.3	R626 D649 L651 V655 A656 I657	R626-G653 VanDerWaalsContact NH1-N 3.19Å; D649-G653 PolarHBondContact O-N 3.17Å; L651-G653 VanDerWaalsContact C-N 3.25Å; L651-G653 PolarHBondContact O-N 2.93Å; G653-V655 PolarHBondContact O-N 3.27Å; G653-V655 VanDerWaalsContact O-N 3.12Å; G653-A656 WeakPolarHBondContact O-CB 3.35Å; G653-A656 PolarHBondContact O-N 3.47Å; G653-I657 PolarHBondContact O-N 3.18Å
654	D	56	Low	67.8	Low	73 Å²	73	51.2 Å²	51.2	39%	0.39	27%	0.267	S	S	.	.	H	α-helix	trans	-59.7	-27.2	-172.1	-60.9	-30.3	0	0	0	113.7	A656 I657 L658	D654-A656 VanDerWaalsContact C-N 3.31Å; D654-A656 PolarHBondContact O-N 3.21Å; D654-I657 WeakPolarHBondContact O-CB 3.33Å; D654-I657 PolarHBondContact O-N 3.14Å; D654-L658 WeakPolarHBondContact O-CG 3.43Å; D654-L658 PolarHBondContact O-N 3Å
655	V	59.2	Low	66.7	Low	95 Å²	95	53.4 Å²	53.4	58%	0.576	28%	0.277	S	S	*	.	H	α-helix	trans	-63.4	-39.2	176.2	-176.9	0	0	0	0	111.1	G653 L658 E659	G653-V655 PolarHBondContact O-N 3.27Å; G653-V655 VanDerWaalsContact O-N 3.12Å; V655-L658 PolarHBondContact O-N 2.79Å; V655-E659 PolarHBondContact O-N 2.84Å; V655-E659 VanDerWaalsContact O-N 3.12Å
656	A	57	Low	65.6	Low	15 Å²	15	52 Å²	52	12%	0.124	26%	0.263	C	S	.	.	H	α-helix	trans	-69	-38.2	176.4	0	0	0	0	0	111.4	R652 G653 D654 L658 E659 A660	R652-A656 HydrophobicContact CB-CB 3.94Å; G653-A656 WeakPolarHBondContact O-CB 3.35Å; G653-A656 PolarHBondContact O-N 3.47Å; D654-A656 VanDerWaalsContact C-N 3.31Å; D654-A656 PolarHBondContact O-N 3.21Å; A656-L658 VanDerWaalsContact C-N 3.33Å; A656-L658 PolarHBondContact O-N 3.38Å; A656-E659 PolarHBondContact O-N 3.18Å; A656-A660 WeakPolarHBondContact O-CB 3.19Å; A656-A660 PolarHBondContact O-N 3.07Å
657	I	54.6	Low	64.4	Low	6 Å²	6	54.8 Å²	54.8	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-45.4	174	-63.4	174.5	0	0	0	110.1	G653 D654 E659 A660 A661 L669 C672 L677	G653-I657 PolarHBondContact O-N 3.18Å; D654-I657 WeakPolarHBondContact O-CB 3.33Å; D654-I657 PolarHBondContact O-N 3.14Å; I657-E659 PolarHBondContact O-N 3.18Å; I657-A660 PolarHBondContact O-N 2.91Å; I657-A661 WeakPolarHBondContact O-CB 3.47Å; I657-A661 PolarHBondContact O-N 2.71Å; I657-L669 HydrophobicContact CG2-CD2 3.82Å; I657-L669 HydrophobicContact CG2-CG 4.07Å; I657-C672 HydrophobicContact CD1-CB 3.83Å; I657-C672 HydrophobicContact CG1-CB 3.85Å; I657-L677 HydrophobicContact CD1-CD2 4.13Å
658	L	54	Low	62.6	Low	65 Å²	65	58.2 Å²	58.2	34%	0.34	30%	0.296	S	S	.	.	H	α-helix	trans	-61.5	-41.6	177.7	-74.7	168.3	0	0	0	112.5	D654 V655 A656 K662 L684	D654-L658 WeakPolarHBondContact O-CG 3.43Å; D654-L658 PolarHBondContact O-N 3Å; V655-L658 PolarHBondContact O-N 2.79Å; A656-L658 VanDerWaalsContact C-N 3.33Å; A656-L658 PolarHBondContact O-N 3.38Å; L658-K662 VanDerWaalsContact O-CG 3.27Å; L658-K662 WeakPolarHBondContact O-CG 3.43Å; L658-K662 PolarHBondContact O-N 3.02Å; L658-L684 HydrophobicContact CD2-CD1 4.17Å
659	E	58.8	Low	61	Low	99 Å²	99	57.5 Å²	57.5	46%	0.463	29%	0.29	S	S	.	.	H	α-helix	trans	-70.3	-44.5	177.2	-71.2	-154.6	157.2	0	0	113	V655 A656 I657 A661 K662 R663	V655-E659 PolarHBondContact O-N 2.84Å; V655-E659 VanDerWaalsContact O-N 3.12Å; A656-E659 PolarHBondContact O-N 3.18Å; I657-E659 PolarHBondContact O-N 3.18Å; E659-A661 VanDerWaalsContact C-N 3.3Å; E659-A661 PolarHBondContact O-N 3.18Å; E659-K662 WeakPolarHBondContact O-CB 3.12Å; E659-K662 PolarHBondContact O-N 2.83Å; E659-R663 WeakPolarHBondContact O-CG 3.17Å; E659-R663 PolarHBondContact O-N 3.26Å; E659-R663 VanDerWaalsContact O-N 3.12Å
660	A	59.3	Low	59.8	Low	6 Å²	6	61 Å²	61	5%	0.05	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-43.6	176.8	0	0	0	0	0	111	A656 I657 K662 R663 G664 E665 N668 L669	A656-A660 WeakPolarHBondContact O-CB 3.19Å; A656-A660 PolarHBondContact O-N 3.07Å; I657-A660 PolarHBondContact O-N 2.91Å; A660-K662 VanDerWaalsContact C-N 3.35Å; A660-K662 PolarHBondContact O-N 3.18Å; A660-R663 CarbonylContact O-C 3.59Å; A660-R663 PolarHBondContact O-N 3.28Å; A660-R663 VanDerWaalsContact O-N 3.11Å; A660-G664 PolarHBondContact O-N 3.3Å; A660-E665 PolarHBondContact O-N 3.43Å; A660-N668 HydrophobicContact CB-CB 3.79Å; A660-L669 HydrophobicContact CB-CD1 4.03Å
661	A	55.9	Low	58.2	Low	2 Å²	2	63.8 Å²	63.8	2%	0.017	32%	0.323	C	S	.	.	H	α-helix	trans	-70.3	-30.1	-179.2	0	0	0	0	0	112.1	I657 E659 R663 L669 L684 N689 V692	I657-A661 WeakPolarHBondContact O-CB 3.47Å; I657-A661 PolarHBondContact O-N 2.71Å; E659-A661 VanDerWaalsContact C-N 3.3Å; E659-A661 PolarHBondContact O-N 3.18Å; A661-R663 VanDerWaalsContact C-N 3.34Å; A661-L669 HydrophobicContact CB-CD1 4.13Å; A661-L684 HydrophobicContact CB-CD2 2.96Å; A661-L684 HydrophobicContact CB-CG 4.44Å; A661-N689 PolarHBondContact O-ND2 2.96Å; A661-V692 HydrophobicContact CB-CG1 3.62Å
662	K	56.3	Low	56.6	Low	104 Å²	104	64.4 Å²	64.4	45%	0.452	33%	0.328	S	S	.	.	H	α-helix	trans	-65	-35.8	168.6	-79	176.8	-175.7	173	0	112.3	L658 E659 A660 L684 Y687	L658-K662 VanDerWaalsContact O-CG 3.27Å; L658-K662 WeakPolarHBondContact O-CG 3.43Å; L658-K662 PolarHBondContact O-N 3.02Å; E659-K662 WeakPolarHBondContact O-CB 3.12Å; E659-K662 PolarHBondContact O-N 2.83Å; A660-K662 VanDerWaalsContact C-N 3.35Å; A660-K662 PolarHBondContact O-N 3.18Å; K662-L684 HydrophobicContact CG-CD1 4Å; K662-Y687 HydrophobicContact CD-CE2 4.47Å; K662-Y687 WeakPolarHBondContact CE-OH 3.39Å; K662-Y687 HydrophobicContact CG-CD1 4.49Å; K662-Y687 HydrophobicContact CG-CD2 4.27Å; K662-Y687 HydrophobicContact CG-CE1 4.07Å; K662-Y687 HydrophobicContact CG-CE2 3.78Å
663	R	62.1	Low	55.1	Low	173 Å²	173	59.1 Å²	59.1	65%	0.653	31%	0.31	S	S	*	.	H	α-helix	trans	-84.8	-13.8	-179.4	-66.3	-179.3	-175.2	-150.4	4.6	113.8	E659 A660 A661 E665	E659-R663 WeakPolarHBondContact O-CG 3.17Å; E659-R663 PolarHBondContact O-N 3.26Å; E659-R663 VanDerWaalsContact O-N 3.12Å; A660-R663 CarbonylContact O-C 3.59Å; A660-R663 PolarHBondContact O-N 3.28Å; A660-R663 VanDerWaalsContact O-N 3.11Å; A661-R663 VanDerWaalsContact C-N 3.34Å; R663-E665 HydrophobicContact CB-CG 4.01Å
664	G	57.4	Low	54.2	Low	33 Å²	33	66.1 Å²	66.1	34%	0.34	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	19.6	-176.1	0	0	0	0	0	113.7	A660 L666	A660-G664 PolarHBondContact O-N 3.3Å; G664-L666 PolarHBondContact O-N 3.38Å
665	E	61.7	Low	53.7	Low	79 Å²	79	66 Å²	66	37%	0.369	34%	0.339	S	S	.	.			trans	-88.4	84.6	-176.7	-67.9	170.5	-170.6	0	0	110.3	A660 R663 D667 N668	A660-E665 PolarHBondContact O-N 3.43Å; R663-E665 HydrophobicContact CB-CG 4.01Å; E665-D667 VanDerWaalsContact C-N 3.27Å; E665-D667 PolarHBondContact O-N 3.24Å; E665-N668 PolarHBondContact O-N 3.09Å; E665-N668 PolarHBondContact OE2-ND2 2.84Å
666	L	55.8	Low	52.7	Low	49 Å²	49	67.4 Å²	67.4	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-60.6	-35.1	-177.1	-149.5	79.3	0	0	0	112.7	G664 N668 L669 F670 E691 V692 F695	G664-L666 PolarHBondContact O-N 3.38Å; L666-N668 VanDerWaalsContact C-N 3.26Å; L666-N668 PolarHBondContact O-N 3.05Å; L666-L669 WeakPolarHBondContact O-CB 3.24Å; L666-L669 PolarHBondContact O-N 3.38Å; L666-L669 VanDerWaalsContact O-N 3.07Å; L666-F670 HydrophobicContact CD2-CE2 3.87Å; L666-F670 HydrophobicContact CD2-CZ 4.44Å; L666-F670 HydrophobicContact CG-CE2 4.03Å; L666-F670 VanDerWaalsContact O-CD2 3.28Å; L666-F670 WeakPolarHBondContact O-CD2 3.43Å; L666-F670 PolarHBondContact O-N 3.02Å; L666-E691 HydrophobicContact CD1-CB 4.2Å; L666-V692 HydrophobicContact CD1-CB 4.19Å; L666-V692 HydrophobicContact CD1-CG2 3.66Å; L666-F695 HydrophobicContact CD1-CB 4.22Å
667	D	54.9	Low	52	Low	130 Å²	130	68.9 Å²	68.9	70%	0.695	36%	0.356	S	S	*	.	H	α-helix	trans	-59.9	-36.3	-177.4	-66.1	-23.5	0	0	0	112.2	E665 L669 F670	E665-D667 VanDerWaalsContact C-N 3.27Å; E665-D667 PolarHBondContact O-N 3.24Å; D667-L669 VanDerWaalsContact C-N 3.32Å; D667-L669 PolarHBondContact O-N 3.43Å; D667-F670 PolarHBondContact O-N 3.42Å
668	N	49.6	Very low	51.2	Low	73 Å²	73	72.4 Å²	72.4	39%	0.39	38%	0.381	S	S	.	.	H	α-helix	trans	-72.4	-25.3	179.2	-71.6	-15.9	0	0	0	112.4	A660 E665 L666	A660-N668 HydrophobicContact CB-CB 3.79Å; E665-N668 PolarHBondContact O-N 3.09Å; E665-N668 PolarHBondContact OE2-ND2 2.84Å; L666-N668 VanDerWaalsContact C-N 3.26Å; L666-N668 PolarHBondContact O-N 3.05Å
669	L	49.7	Very low	50.6	Low	0 Å²	0	75.4 Å²	75.4	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-71	-36.3	172.9	-85.9	96.5	0	0	0	112.1	I657 A660 A661 L666 D667 C671 C672 C673 F695 L696	I657-L669 HydrophobicContact CG2-CD2 3.82Å; I657-L669 HydrophobicContact CG2-CG 4.07Å; A660-L669 HydrophobicContact CB-CD1 4.03Å; A661-L669 HydrophobicContact CB-CD1 4.13Å; L666-L669 WeakPolarHBondContact O-CB 3.24Å; L666-L669 PolarHBondContact O-N 3.38Å; L666-L669 VanDerWaalsContact O-N 3.07Å; D667-L669 VanDerWaalsContact C-N 3.32Å; D667-L669 PolarHBondContact O-N 3.43Å; L669-C671 PolarHBondContact O-N 2.91Å; L669-C672 PolarHBondContact O-N 2.72Å; L669-C672 VanDerWaalsContact O-N 3.08Å; L669-C673 PolarHBondContact O-SG 3.35Å; L669-F695 HydrophobicContact CB-CD1 4.31Å; L669-F695 HydrophobicContact CB-CE1 3.9Å; L669-F695 HydrophobicContact CD2-CD1 3.94Å; L669-F695 HydrophobicContact CD2-CE1 4.1Å; L669-L696 HydrophobicContact CD2-CD2 3.7Å; L669-L696 HydrophobicContact CD2-CG 4.17Å
670	F	50.2	Low	50.2	Low	121 Å²	121	75.6 Å²	75.6	53%	0.531	40%	0.397	S	S	.	.	H	α-helix	trans	-59.6	-31.4	-176.2	-81.3	-79.5	0	0	0	113.2	L666 D667 C672 F695	L666-F670 HydrophobicContact CD2-CE2 3.87Å; L666-F670 HydrophobicContact CD2-CZ 4.44Å; L666-F670 HydrophobicContact CG-CE2 4.03Å; L666-F670 VanDerWaalsContact O-CD2 3.28Å; L666-F670 WeakPolarHBondContact O-CD2 3.43Å; L666-F670 PolarHBondContact O-N 3.02Å; D667-F670 PolarHBondContact O-N 3.42Å; F670-C672 VanDerWaalsContact C-N 3.35Å; F670-C672 PolarHBondContact O-N 2.76Å; F670-F695 AromaticContact CD1-CE2 3.89Å; F670-F695 HydrophobicContact CD1-CE2 3.89Å; F670-F695 AromaticContact CD1-CZ 3.98Å; F670-F695 HydrophobicContact CD1-CZ 3.98Å; F670-F695 HydrophobicContact CE1-CD2 4.24Å; F670-F695 AromaticContact CE1-CE2 3.38Å; F670-F695 HydrophobicContact CE1-CE2 3.38Å; F670-F695 AromaticContact CE1-CZ 3.96Å; F670-F695 HydrophobicContact CE1-CZ 3.96Å; F670-F695 HydrophobicContact CE2-CE2 4.32Å; F670-F695 HydrophobicContact CG-CZ 4.4Å; F670-F695 HydrophobicContact CZ-CD2 4.06Å; F670-F695 AromaticContact CZ-CE2 3.62Å; F670-F695 HydrophobicContact CZ-CE2 3.62Å; F670-F695 HydrophobicContact CZ-CZ 4.35Å
671	C	47.1	Very low	49.8	Very low	72 Å²	72	76.1 Å²	76.1	49%	0.486	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-23.6	179.1	-76	0	0	0	0	114	L669	L669-C671 PolarHBondContact O-N 2.91Å
672	C	48.4	Very low	49.5	Very low	22 Å²	22	76.3 Å²	76.3	15%	0.149	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-15.8	-168.9	-59.4	0	0	0	0	114.5	I657 L669 F670 E674	I657-C672 HydrophobicContact CD1-CB 3.83Å; I657-C672 HydrophobicContact CG1-CB 3.85Å; L669-C672 PolarHBondContact O-N 2.72Å; L669-C672 VanDerWaalsContact O-N 3.08Å; F670-C672 VanDerWaalsContact C-N 3.35Å; F670-C672 PolarHBondContact O-N 2.76Å; C672-E674 PolarHBondContact O-N 3.45Å
673	C	43.9	Very low	49.4	Very low	15 Å²	15	73.8 Å²	73.8	10%	0.101	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	24	-158.3	-65.6	0	0	0	0	117.8	L669 F695	L669-C673 PolarHBondContact O-SG 3.35Å; C673-F695 HydrophobicContact CB-CE1 4.47Å
674	E	45.5	Very low	48.9	Very low	156 Å²	156	66.5 Å²	66.5	73%	0.729	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-1.5	170.4	-75.9	-174.1	152.7	0	0	113.9	K617 C672	K617-E674 VanDerWaalsContact CE-OE2 3.24Å; K617-E674 WeakPolarHBondContact CE-OE2 3.36Å; K617-E674 IonicContact NZ-OE2 3.41Å; K617-E674 PolarHBondContact NZ-OE2 3.36Å; C672-E674 PolarHBondContact O-N 3.45Å
675	L	45.5	Very low	48.5	Very low	71 Å²	71	65.1 Å²	65.1	37%	0.372	36%	0.355	S	S	.	.	S	Bend	trans	-93.9	142.8	171.9	-70.2	163.3	0	0	0	110.5	L677	L675-L677 PolarHBondContact O-N 3.4Å
676	P	38.9	Very low	48	Very low	124 Å²	124	62 Å²	62	81%	0.805	35%	0.345	S	S	*	.			trans	-62.3	109.3	178.4	23	-29.7	0	0	0	109.7	S678	P676-S678 PolarHBondContact O-N 3.11Å
677	L	43	Very low	48.3	Very low	47 Å²	47	65.3 Å²	65.3	25%	0.246	36%	0.355	C	S	.	.			trans	-57.9	107.1	179.8	-76.6	157.1	0	0	0	110	I657 L675 P681 K699	I657-L677 HydrophobicContact CD1-CD2 4.13Å; L675-L677 PolarHBondContact O-N 3.4Å; L677-P681 HydrophobicContact CD2-CG 4.45Å; L677-K699 HydrophobicContact CD1-CB 4.08Å
678	S	36.9	Very low	48.9	Very low	79 Å²	79	63.1 Å²	63.1	55%	0.552	34%	0.343	S	S	*	.			trans	-90.8	104.2	163.8	59.4	0	0	0	0	108.9	P676	P676-S678 PolarHBondContact O-N 3.11Å
679	I	41.5	Very low	50.2	Low	128 Å²	128	61.5 Å²	61.5	66%	0.656	33%	0.334	S	S	*	.	S	Bend	trans	85.4	126.6	147	-54.6	162.9	0	0	0	117.4	P681	I679-P681 VanDerWaalsContact C-CD 3.41Å; I679-P681 WeakPolarHBondContact O-CD 3.41Å
680	E	51.5	Low	51.7	Low	104 Å²	104	65.2 Å²	65.2	49%	0.486	35%	0.349	S	S	.	.			trans	80.9	5.1	159.6	-73.5	160.9	-145.3	0	0	124.6	L682	E680-L682 VanDerWaalsContact C-N 3.34Å; E680-L682 PolarHBondContact O-N 3.06Å
681	P	49.8	Very low	52.8	Low	17 Å²	17	65.1 Å²	65.1	11%	0.11	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-73.5	-16.1	-177.7	-18.2	33	0	0	0	115.4	L677 I679 S683 L684 L696	L677-P681 HydrophobicContact CD2-CG 4.45Å; I679-P681 VanDerWaalsContact C-CD 3.41Å; I679-P681 WeakPolarHBondContact O-CD 3.41Å; P681-S683 VanDerWaalsContact C-N 3.34Å; P681-S683 PolarHBondContact O-N 2.93Å; P681-L684 WeakPolarHBondContact O-CB 3.34Å; P681-L684 PolarHBondContact O-N 2.95Å; P681-L696 HydrophobicContact CB-CD1 3.99Å; P681-L696 HydrophobicContact CB-CD2 4.1Å
682	L	49.2	Very low	54	Low	5 Å²	5	61.9 Å²	61.9	3%	0.026	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-83.5	-8.6	-175	-139	79.4	0	0	0	114.1	E680 L684 A685 L696 I697 A701 V703 P713 L729	E680-L682 VanDerWaalsContact C-N 3.34Å; E680-L682 PolarHBondContact O-N 3.06Å; L682-L684 PolarHBondContact O-N 3.2Å; L682-A685 PolarHBondContact O-N 3.06Å; L682-A685 VanDerWaalsContact O-N 3.08Å; L682-L696 HydrophobicContact CD1-CB 3.8Å; L682-L696 HydrophobicContact CD1-CD1 4.34Å; L682-I697 HydrophobicContact CD1-CG1 3.83Å; L682-I697 HydrophobicContact CD2-CD1 4.18Å; L682-I697 HydrophobicContact CD2-CG1 3.9Å; L682-A701 HydrophobicContact CD1-CB 3.97Å; L682-V703 HydrophobicContact CD2-CB 4.14Å; L682-V703 HydrophobicContact CD2-CG1 3.84Å; L682-P713 HydrophobicContact CB-CB 4.39Å; L682-P713 HydrophobicContact CB-CG 3.64Å; L682-P713 HydrophobicContact CD2-CB 4.13Å; L682-P713 HydrophobicContact CD2-CG 3.88Å; L682-P713 HydrophobicContact CG-CB 4.29Å; L682-P713 HydrophobicContact CG-CG 4.01Å; L682-P713 WeakPolarHBondContact O-CB 3.35Å; L682-P713 WeakPolarHBondContact O-CG 3.47Å; L682-L729 HydrophobicContact CD2-CD2 3.33Å; L682-L729 HydrophobicContact CG-CD2 4.28Å
683	S	54.3	Low	55.3	Low	51 Å²	51	61.2 Å²	61.2	36%	0.357	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-57.1	-17.6	166.3	-173.7	0	0	0	0	111.9	P681 A685 N716	P681-S683 VanDerWaalsContact C-N 3.34Å; P681-S683 PolarHBondContact O-N 2.93Å; S683-A685 PolarHBondContact O-N 2.67Å; S683-N716 PolarHBondContact O-ND2 3.37Å; S683-N716 VanDerWaalsContact O-ND2 3.15Å; S683-N716 PolarHBondContact OG-ND2 2.93Å
684	L	52.6	Low	57	Low	21 Å²	21	63.8 Å²	63.8	11%	0.11	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-70.5	-3.4	175.4	-133.3	78.2	0	0	0	116.2	L658 A661 K662 P681 L682 G686 Y687	L658-L684 HydrophobicContact CD2-CD1 4.17Å; A661-L684 HydrophobicContact CB-CD2 2.96Å; A661-L684 HydrophobicContact CB-CG 4.44Å; K662-L684 HydrophobicContact CG-CD1 4Å; P681-L684 WeakPolarHBondContact O-CB 3.34Å; P681-L684 PolarHBondContact O-N 2.95Å; L682-L684 PolarHBondContact O-N 3.2Å; L684-G686 PolarHBondContact O-N 2.86Å; L684-Y687 HydrophobicContact CB-CD2 4.49Å; L684-Y687 HydrophobicContact CD1-CD2 3.85Å; L684-Y687 HydrophobicContact CD1-CE2 3.73Å; L684-Y687 HydrophobicContact CG-CD2 3.63Å; L684-Y687 HydrophobicContact CG-CE2 4.06Å; L684-Y687 PolarHBondContact O-N 2.9Å
685	A	48.5	Very low	58.3	Low	3 Å²	3	57.1 Å²	57.1	3%	0.025	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-49.9	-20.6	166.7	0	0	0	0	0	113	L682 S683 Y687 P713 H722 I725 L729	L682-A685 PolarHBondContact O-N 3.06Å; L682-A685 VanDerWaalsContact O-N 3.08Å; S683-A685 PolarHBondContact O-N 2.67Å; A685-Y687 VanDerWaalsContact C-N 3.28Å; A685-Y687 PolarHBondContact O-N 2.74Å; A685-P713 HydrophobicContact CB-CB 4.1Å; A685-H722 PolarHBondContact O-CD2 3.26Å; A685-I725 HydrophobicContact CB-CG2 3.65Å; A685-I725 WeakPolarHBondContact O-CD1 3.2Å; A685-L729 HydrophobicContact CB-CD1 4.28Å
686	G	50.6	Low	59.5	Low	15 Å²	15	53.8 Å²	53.8	16%	0.155	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-64.9	-18.1	174.1	0	0	0	0	0	116.2	L684 H722	L684-G686 PolarHBondContact O-N 2.86Å; G686-H722 PolarHBondContact O-NE2 3.18Å
687	Y	62.4	Low	61.3	Low	118 Å²	118	48.7 Å²	48.7	46%	0.463	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-93.9	6.7	-173.9	-67.5	-86.3	0	0	0	115	K662 L684 A685 N689	K662-Y687 HydrophobicContact CD-CE2 4.47Å; K662-Y687 WeakPolarHBondContact CE-OH 3.39Å; K662-Y687 HydrophobicContact CG-CD1 4.49Å; K662-Y687 HydrophobicContact CG-CD2 4.27Å; K662-Y687 HydrophobicContact CG-CE1 4.07Å; K662-Y687 HydrophobicContact CG-CE2 3.78Å; L684-Y687 HydrophobicContact CB-CD2 4.49Å; L684-Y687 HydrophobicContact CD1-CD2 3.85Å; L684-Y687 HydrophobicContact CD1-CE2 3.73Å; L684-Y687 HydrophobicContact CG-CD2 3.63Å; L684-Y687 HydrophobicContact CG-CE2 4.06Å; L684-Y687 PolarHBondContact O-N 2.9Å; A685-Y687 VanDerWaalsContact C-N 3.28Å; A685-Y687 PolarHBondContact O-N 2.74Å; Y687-N689 PolarHBondContact O-N 3.24Å
688	N	68.2	Low	63	Low	83 Å²	83	52.7 Å²	52.7	44%	0.444	27%	0.269	S	S	.	.			trans	55.5	29	178.9	-156.5	39.9	0	0	0	115.8	H722	N688-H722 PolarHBondContact OD1-ND1 3.47Å
689	N	77.1	Confident	64.4	Low	40 Å²	40	53.9 Å²	53.9	21%	0.214	26%	0.264	C	S	.	.			trans	-97.7	91.8	176.7	-66.4	-31.2	0	0	0	109.7	A661 Y687 V692 A693	A661-N689 PolarHBondContact O-ND2 2.96Å; Y687-N689 PolarHBondContact O-N 3.24Å; N689-V692 HydrophobicContact CB-CB 3.97Å; N689-V692 HydrophobicContact CB-CG2 3.9Å; N689-V692 PolarHBondContact O-N 3.14Å; N689-A693 PolarHBondContact O-N 2.87Å; N689-A693 VanDerWaalsContact O-N 3.11Å
690	Y	80	Confident	65.7	Low	78 Å²	78	50.8 Å²	50.8	31%	0.306	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-45.9	-175.5	-178.7	-87.9	0	0	0	112.1	V692 A693 E694 E724 L728	Y690-V692 VanDerWaalsContact C-N 3.31Å; Y690-V692 PolarHBondContact O-N 3.01Å; Y690-A693 PolarHBondContact O-N 2.92Å; Y690-E694 HydrophobicContact CE1-CB 4.39Å; Y690-E694 WeakPolarHBondContact O-CB 3.16Å; Y690-E694 PolarHBondContact O-N 3.47Å; Y690-E724 HydrophobicContact CD2-CB 3.9Å; Y690-E724 HydrophobicContact CE2-CB 4.24Å; Y690-L728 HydrophobicContact CD2-CD2 4.33Å; Y690-L728 HydrophobicContact CE2-CB 3.94Å; Y690-L728 HydrophobicContact CE2-CD1 4.39Å; Y690-L728 HydrophobicContact CE2-CD2 4.1Å; Y690-L728 HydrophobicContact CE2-CG 4.37Å
691	E	74.6	Confident	66.7	Low	118 Å²	118	46.6 Å²	46.6	55%	0.551	25%	0.247	S	C	*	.	H	α-helix	trans	-63	-39.7	-176.4	-61.6	77.9	-173.9	0	0	111.4	L666 F695	L666-E691 HydrophobicContact CD1-CB 4.2Å; E691-F695 VanDerWaalsContact O-CB 3.28Å; E691-F695 WeakPolarHBondContact O-CB 3.33Å; E691-F695 PolarHBondContact O-N 3.1Å
692	V	70.8	Confident	67.9	Low	5 Å²	5	50.2 Å²	50.2	3%	0.03	27%	0.266	C	S	.	.	H	α-helix	trans	-68	-44.3	176.6	178.4	0	0	0	0	110.6	A661 L666 N689 Y690 F695 L696	A661-V692 HydrophobicContact CB-CG1 3.62Å; L666-V692 HydrophobicContact CD1-CB 4.19Å; L666-V692 HydrophobicContact CD1-CG2 3.66Å; N689-V692 HydrophobicContact CB-CB 3.97Å; N689-V692 HydrophobicContact CB-CG2 3.9Å; N689-V692 PolarHBondContact O-N 3.14Å; Y690-V692 VanDerWaalsContact C-N 3.31Å; Y690-V692 PolarHBondContact O-N 3.01Å; V692-F695 PolarHBondContact O-N 3.42Å; V692-L696 HydrophobicContact CG1-CD1 4.01Å; V692-L696 HydrophobicContact CG1-CG 4.47Å; V692-L696 WeakPolarHBondContact O-CB 3.48Å; V692-L696 VanDerWaalsContact O-CG 3.29Å; V692-L696 WeakPolarHBondContact O-CG 3.27Å; V692-L696 PolarHBondContact O-N 3.1Å
693	A	75.7	Confident	69.6	Low	8 Å²	8	50.5 Å²	50.5	7%	0.066	27%	0.268	C	S	.	.	H	α-helix	trans	-62.9	-44.1	177.8	0	0	0	0	0	111.5	N689 Y690 L696 I697 L728	N689-A693 PolarHBondContact O-N 2.87Å; N689-A693 VanDerWaalsContact O-N 3.11Å; Y690-A693 PolarHBondContact O-N 2.92Å; A693-L696 PolarHBondContact O-N 3.06Å; A693-I697 VanDerWaalsContact O-CG1 3.25Å; A693-I697 WeakPolarHBondContact O-CG1 3.22Å; A693-I697 PolarHBondContact O-N 2.87Å; A693-L728 HydrophobicContact CB-CD2 3.9Å
694	E	80.1	Confident	71.1	Confident	68 Å²	68	50 Å²	50	32%	0.318	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-46.3	176.7	-175.3	177.1	-142.2	0	0	111	Y690 L696 I697 Q698 L728	Y690-E694 HydrophobicContact CE1-CB 4.39Å; Y690-E694 WeakPolarHBondContact O-CB 3.16Å; Y690-E694 PolarHBondContact O-N 3.47Å; E694-L696 PolarHBondContact O-N 3.18Å; E694-I697 PolarHBondContact O-N 3.01Å; E694-Q698 WeakPolarHBondContact O-CB 3.39Å; E694-Q698 VanDerWaalsContact O-CG 3.3Å; E694-Q698 WeakPolarHBondContact O-CG 3.46Å; E694-Q698 PolarHBondContact O-N 3.14Å; E694-L728 HydrophobicContact CB-CD1 4.4Å; E694-L728 HydrophobicContact CB-CD2 3.95Å; E694-L728 HydrophobicContact CG-CD1 4.36Å
695	F	72.3	Confident	72.4	Confident	16 Å²	16	50.3 Å²	50.3	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-60.1	-46.4	177.5	-179.2	-99	0	0	0	112.4	L666 L669 F670 C673 E691 V692 I697 Q698 K699	L666-F695 HydrophobicContact CD1-CB 4.22Å; L669-F695 HydrophobicContact CB-CD1 4.31Å; L669-F695 HydrophobicContact CB-CE1 3.9Å; L669-F695 HydrophobicContact CD2-CD1 3.94Å; L669-F695 HydrophobicContact CD2-CE1 4.1Å; F670-F695 AromaticContact CD1-CE2 3.89Å; F670-F695 HydrophobicContact CD1-CE2 3.89Å; F670-F695 AromaticContact CD1-CZ 3.98Å; F670-F695 HydrophobicContact CD1-CZ 3.98Å; F670-F695 HydrophobicContact CE1-CD2 4.24Å; F670-F695 AromaticContact CE1-CE2 3.38Å; F670-F695 HydrophobicContact CE1-CE2 3.38Å; F670-F695 AromaticContact CE1-CZ 3.96Å; F670-F695 HydrophobicContact CE1-CZ 3.96Å; F670-F695 HydrophobicContact CE2-CE2 4.32Å; F670-F695 HydrophobicContact CG-CZ 4.4Å; F670-F695 HydrophobicContact CZ-CD2 4.06Å; F670-F695 AromaticContact CZ-CE2 3.62Å; F670-F695 HydrophobicContact CZ-CE2 3.62Å; F670-F695 HydrophobicContact CZ-CZ 4.35Å; C673-F695 HydrophobicContact CB-CE1 4.47Å; E691-F695 VanDerWaalsContact O-CB 3.28Å; E691-F695 WeakPolarHBondContact O-CB 3.33Å; E691-F695 PolarHBondContact O-N 3.1Å; V692-F695 PolarHBondContact O-N 3.42Å; F695-I697 PolarHBondContact O-N 3.14Å; F695-Q698 PolarHBondContact O-N 3.47Å; F695-K699 HydrophobicContact CD1-CG 4.31Å; F695-K699 HydrophobicContact CE1-CG 3.95Å; F695-K699 HydrophobicContact CE2-CG 4.38Å; F695-K699 HydrophobicContact CZ-CD 4.36Å; F695-K699 VanDerWaalsContact CZ-CE 3.45Å; F695-K699 HydrophobicContact CZ-CG 4.01Å; F695-K699 VanDerWaalsContact O-CG 3.32Å; F695-K699 WeakPolarHBondContact O-CG 3.17Å; F695-K699 PolarHBondContact O-N 3.42Å
696	L	72.2	Confident	73.9	Confident	2 Å²	2	56 Å²	56	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-62.1	-42.5	179	-73	171	0	0	0	112	L669 P681 L682 V692 A693 E694 K699 G700 A701	L669-L696 HydrophobicContact CD2-CD2 3.7Å; L669-L696 HydrophobicContact CD2-CG 4.17Å; P681-L696 HydrophobicContact CB-CD1 3.99Å; P681-L696 HydrophobicContact CB-CD2 4.1Å; L682-L696 HydrophobicContact CD1-CB 3.8Å; L682-L696 HydrophobicContact CD1-CD1 4.34Å; V692-L696 HydrophobicContact CG1-CD1 4.01Å; V692-L696 HydrophobicContact CG1-CG 4.47Å; V692-L696 WeakPolarHBondContact O-CB 3.48Å; V692-L696 VanDerWaalsContact O-CG 3.29Å; V692-L696 WeakPolarHBondContact O-CG 3.27Å; V692-L696 PolarHBondContact O-N 3.1Å; A693-L696 PolarHBondContact O-N 3.06Å; E694-L696 PolarHBondContact O-N 3.18Å; L696-K699 CarbonylContact O-C 3.46Å; L696-K699 PolarHBondContact O-N 2.87Å; L696-K699 VanDerWaalsContact O-N 3.15Å; L696-G700 PolarHBondContact O-N 3.28Å; L696-A701 HydrophobicContact CB-CB 4.08Å; L696-A701 WeakPolarHBondContact O-CB 3.46Å; L696-A701 PolarHBondContact O-N 3.25Å
697	I	76.9	Confident	75.1	Confident	16 Å²	16	57.6 Å²	57.6	8%	0.082	30%	0.296	C	S	.	.	H	α-helix	trans	-64.3	-43.7	176.7	-66.7	167.5	0	0	0	110.8	L682 A693 E694 F695 K699 G700 V703 L728 L729 H732	L682-I697 HydrophobicContact CD1-CG1 3.83Å; L682-I697 HydrophobicContact CD2-CD1 4.18Å; L682-I697 HydrophobicContact CD2-CG1 3.9Å; A693-I697 VanDerWaalsContact O-CG1 3.25Å; A693-I697 WeakPolarHBondContact O-CG1 3.22Å; A693-I697 PolarHBondContact O-N 2.87Å; E694-I697 PolarHBondContact O-N 3.01Å; F695-I697 PolarHBondContact O-N 3.14Å; I697-K699 PolarHBondContact O-N 3.29Å; I697-G700 PolarHBondContact O-N 3.3Å; I697-V703 HydrophobicContact CD1-CG1 4.03Å; I697-V703 HydrophobicContact CG1-CG1 3.94Å; I697-V703 HydrophobicContact CG2-CG1 4.33Å; I697-L728 HydrophobicContact CD1-CD2 4Å; I697-L728 HydrophobicContact CD1-CG 3.92Å; I697-L729 HydrophobicContact CD1-CD2 4.16Å; I697-H732 HydrophobicContact CG2-CB 3.84Å; I697-H732 WeakPolarHBondContact CG2-CD2 3.36Å; I697-H732 VanDerWaalsContact CG2-CG 3.49Å
698	Q	78.1	Confident	75.6	Confident	132 Å²	132	63.4 Å²	63.4	62%	0.617	32%	0.317	S	S	*	.	H	α-helix	trans	-60.7	-28	174.8	-72.8	177.1	9.9	0	0	112.6	E694 F695 G700	E694-Q698 WeakPolarHBondContact O-CB 3.39Å; E694-Q698 VanDerWaalsContact O-CG 3.3Å; E694-Q698 WeakPolarHBondContact O-CG 3.46Å; E694-Q698 PolarHBondContact O-N 3.14Å; F695-Q698 PolarHBondContact O-N 3.47Å; Q698-G700 VanDerWaalsContact C-N 3.27Å
699	K	66.4	Low	76.1	Confident	103 Å²	103	60.1 Å²	60.1	45%	0.448	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	6	173.5	-65.7	-64.7	-178.2	175.1	0	114.1	L677 F695 L696 I697	L677-K699 HydrophobicContact CD1-CB 4.08Å; F695-K699 HydrophobicContact CD1-CG 4.31Å; F695-K699 HydrophobicContact CE1-CG 3.95Å; F695-K699 HydrophobicContact CE2-CG 4.38Å; F695-K699 HydrophobicContact CZ-CD 4.36Å; F695-K699 VanDerWaalsContact CZ-CE 3.45Å; F695-K699 HydrophobicContact CZ-CG 4.01Å; F695-K699 VanDerWaalsContact O-CG 3.32Å; F695-K699 WeakPolarHBondContact O-CG 3.17Å; F695-K699 PolarHBondContact O-N 3.42Å; L696-K699 CarbonylContact O-C 3.46Å; L696-K699 PolarHBondContact O-N 2.87Å; L696-K699 VanDerWaalsContact O-N 3.15Å; I697-K699 PolarHBondContact O-N 3.29Å
700	G	68.4	Low	76.4	Confident	64 Å²	64	58.6 Å²	58.6	66%	0.66	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	17.4	174.3	0	0	0	0	0	114.6	L696 I697 Q698 D702	L696-G700 PolarHBondContact O-N 3.28Å; I697-G700 PolarHBondContact O-N 3.3Å; Q698-G700 VanDerWaalsContact C-N 3.27Å; G700-D702 PolarHBondContact O-N 3.47Å
701	A	72.1	Confident	76.7	Confident	15 Å²	15	56.6 Å²	56.6	12%	0.124	29%	0.291	C	S	.	.			trans	-60.5	128.7	172.3	0	0	0	0	0	110.7	L682 L696 V703	L682-A701 HydrophobicContact CD1-CB 3.97Å; L696-A701 HydrophobicContact CB-CB 4.08Å; L696-A701 WeakPolarHBondContact O-CB 3.46Å; L696-A701 PolarHBondContact O-N 3.25Å; A701-V703 PolarHBondContact O-N 3.01Å
702	D	75.8	Confident	77.4	Confident	94 Å²	94	51 Å²	51	50%	0.503	27%	0.265	S	S	.	.			trans	-69.3	116.2	178.2	179	11.8	0	0	0	110.8	G700 N704 A705	G700-D702 PolarHBondContact O-N 3.47Å; D702-N704 PolarHBondContact O-N 3.06Å; D702-N704 PolarHBondContact OD1-N 3.5Å; D702-A705 HydrophobicContact CB-CB 4.23Å; D702-A705 WeakPolarHBondContact O-CB 3.3Å; D702-A705 PolarHBondContact O-N 2.87Å; D702-A705 PolarHBondContact OD2-N 2.92Å
703	V	83.6	Confident	78.3	Confident	11 Å²	11	50.9 Å²	50.9	7%	0.067	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-14.5	178.3	-61.3	0	0	0	0	113.7	L682 I697 A701 P713 L729 H732 A734	L682-V703 HydrophobicContact CD2-CB 4.14Å; L682-V703 HydrophobicContact CD2-CG1 3.84Å; I697-V703 HydrophobicContact CD1-CG1 4.03Å; I697-V703 HydrophobicContact CG1-CG1 3.94Å; I697-V703 HydrophobicContact CG2-CG1 4.33Å; A701-V703 PolarHBondContact O-N 3.01Å; V703-P713 WeakPolarHBondContact O-CD 3.26Å; V703-L729 HydrophobicContact CB-CD2 4.28Å; V703-L729 HydrophobicContact CG1-CD2 4.21Å; V703-H732 HydrophobicContact CG1-CB 3.94Å; V703-H732 WeakPolarHBondContact CG2-O 3.34Å; V703-A734 HydrophobicContact CB-CB 4.36Å; V703-A734 HydrophobicContact CG2-CB 4.32Å
704	N	86	Confident	79	Confident	39 Å²	39	50.5 Å²	50.5	21%	0.209	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	14	179.2	-64.8	-57.7	0	0	0	112.9	D702 K706 I712 G733 A734 L735	D702-N704 PolarHBondContact O-N 3.06Å; D702-N704 PolarHBondContact OD1-N 3.5Å; N704-K706 PolarHBondContact O-N 3.28Å; N704-I712 WeakPolarHBondContact O-CG2 3.28Å; N704-G733 PolarHBondContact ND2-O 2.87Å; N704-A734 WeakPolarHBondContact OD1-CA 3.5Å; N704-L735 WeakPolarHBondContact OD1-CG 3.21Å; N704-L735 PolarHBondContact OD1-N 2.94Å
705	A	81.4	Confident	79.6	Confident	28 Å²	28	47.3 Å²	47.3	23%	0.231	25%	0.245	C	C	.	.			trans	-58.1	125.3	173.5	0	0	0	0	0	110	D702 P713	D702-A705 HydrophobicContact CB-CB 4.23Å; D702-A705 WeakPolarHBondContact O-CB 3.3Å; D702-A705 PolarHBondContact O-N 2.87Å; D702-A705 PolarHBondContact OD2-N 2.92Å; A705-P713 WeakPolarHBondContact O-CD 3.48Å
706	K	78.9	Confident	80.3	Confident	123 Å²	123	47.7 Å²	47.7	54%	0.535	25%	0.248	S	C	.	.			trans	-92.8	133.5	179.6	-66.2	-170.8	180	-160.6	0	110.3	N704 L711 I712 Q739	N704-K706 PolarHBondContact O-N 3.28Å; K706-L711 WeakPolarHBondContact CA-O 3.44Å; K706-I712 HydrophobicContact CG-CG2 3.83Å; K706-Q739 PolarHBondContact NZ-O 3.17Å
707	D	77.1	Confident	81.1	Confident	49 Å²	49	47.6 Å²	47.6	26%	0.262	25%	0.248	S	C	.	.			trans	-76.6	-174.1	169.2	76.1	-0.3	0	0	0	112.1	G709 G710 L711	D707-G709 PolarHBondContact O-N 3.25Å; D707-G709 WeakPolarHBondContact OD1-CA 3.48Å; D707-G709 PolarHBondContact OD1-N 3.43Å; D707-G710 PolarHBondContact O-N 3.35Å; D707-G710 PolarHBondContact OD1-N 3.18Å; D707-L711 PolarHBondContact N-O 3.4Å; D707-L711 WeakPolarHBondContact OD1-CB 3.36Å; D707-L711 PolarHBondContact OD1-N 2.85Å
708	R	72.7	Confident	81.8	Confident	240 Å²	240	46.8 Å²	46.8	91%	0.906	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.9	176.9	-64	-176.2	-176.3	-177.1	0.9	113.8	L741	R708-L741 WeakPolarHBondContact O-CD1 3.49Å
709	G	77.1	Confident	82.3	Confident	13 Å²	13	41.7 Å²	41.7	13%	0.134	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-5.2	174.7	0	0	0	0	0	113.6	D707 L741	D707-G709 PolarHBondContact O-N 3.25Å; D707-G709 WeakPolarHBondContact OD1-CA 3.48Å; D707-G709 PolarHBondContact OD1-N 3.43Å; G709-L741 VanDerWaalsContact C-CD1 3.45Å; G709-L741 WeakPolarHBondContact O-CB 3.24Å; G709-L741 WeakPolarHBondContact O-CD1 3.25Å; G709-L741 WeakPolarHBondContact O-CG 3.37Å; G709-L741 PolarHBondContact O-N 2.96Å
710	G	83.7	Confident	83.3	Confident	9 Å²	9	43.4 Å²	43.4	9%	0.093	23%	0.227	C	C	.	.	S	Bend	trans	79.5	4.9	-170.8	0	0	0	0	0	113.5	D707	D707-G710 PolarHBondContact O-N 3.35Å; D707-G710 PolarHBondContact OD1-N 3.18Å
711	L	87.8	Confident	84.1	Confident	36 Å²	36	41.7 Å²	41.7	19%	0.188	21%	0.209	C	C	.	.			trans	-76.8	129.5	-177.6	-61.4	164.1	0	0	0	109.7	K706 D707 H715 D740	K706-L711 WeakPolarHBondContact CA-O 3.44Å; D707-L711 PolarHBondContact N-O 3.4Å; D707-L711 WeakPolarHBondContact OD1-CB 3.36Å; D707-L711 PolarHBondContact OD1-N 2.85Å; L711-H715 HydrophobicContact CB-CB 4.22Å; L711-H715 HydrophobicContact CD2-CB 3.66Å; L711-D740 HydrophobicContact CD2-CB 3.72Å; L711-D740 HydrophobicContact CG-CB 4.25Å
712	I	88.9	Confident	84.8	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.21	C	C	.	.			trans	-87.5	159.7	166.4	65	159.3	0	0	0	110.7	N704 K706 L714 H715 L735 A738	N704-I712 WeakPolarHBondContact O-CG2 3.28Å; K706-I712 HydrophobicContact CG-CG2 3.83Å; I712-L714 HydrophobicContact CD1-CB 3.82Å; I712-L714 HydrophobicContact CG1-CB 4.15Å; I712-L714 PolarHBondContact O-N 2.72Å; I712-H715 VanDerWaalsContact CG1-ND1 3.26Å; I712-H715 WeakPolarHBondContact CG1-ND1 3.5Å; I712-H715 PolarHBondContact N-ND1 2.81Å; I712-H715 WeakPolarHBondContact O-CB 3.42Å; I712-H715 PolarHBondContact O-N 2.96Å; I712-L735 HydrophobicContact CD1-CB 4.49Å; I712-L735 WeakPolarHBondContact CD1-O 3.3Å; I712-A738 HydrophobicContact CD1-CB 3.63Å; I712-A738 HydrophobicContact CG1-CB 4Å; I712-A738 HydrophobicContact CG2-CB 4.33Å
713	P	88.3	Confident	85.4	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-46.3	-34.8	176.9	-32.9	35.3	0	0	0	115.3	L682 A685 V703 A705 H715 N716 A717 L729	L682-P713 HydrophobicContact CB-CB 4.39Å; L682-P713 HydrophobicContact CB-CG 3.64Å; L682-P713 HydrophobicContact CD2-CB 4.13Å; L682-P713 HydrophobicContact CD2-CG 3.88Å; L682-P713 HydrophobicContact CG-CB 4.29Å; L682-P713 HydrophobicContact CG-CG 4.01Å; L682-P713 WeakPolarHBondContact O-CB 3.35Å; L682-P713 WeakPolarHBondContact O-CG 3.47Å; A685-P713 HydrophobicContact CB-CB 4.1Å; V703-P713 WeakPolarHBondContact O-CD 3.26Å; A705-P713 WeakPolarHBondContact O-CD 3.48Å; P713-H715 VanDerWaalsContact C-N 3.32Å; P713-H715 PolarHBondContact O-N 3.42Å; P713-N716 PolarHBondContact O-N 3.14Å; P713-A717 PolarHBondContact O-N 3.47Å; P713-L729 HydrophobicContact CB-CD1 3.75Å; P713-L729 HydrophobicContact CB-CD2 3.85Å; P713-L729 HydrophobicContact CB-CG 4.48Å
714	L	91.9	Very high	85.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67	-28.8	179.3	-170.1	59.9	0	0	0	113.1	I712 A718 L729 I730 A734 P746 L762	I712-L714 HydrophobicContact CD1-CB 3.82Å; I712-L714 HydrophobicContact CG1-CB 4.15Å; I712-L714 PolarHBondContact O-N 2.72Å; L714-A718 VanDerWaalsContact O-CB 3.22Å; L714-A718 WeakPolarHBondContact O-CB 3.16Å; L714-A718 PolarHBondContact O-N 3.13Å; L714-L729 HydrophobicContact CB-CD1 4.31Å; L714-L729 HydrophobicContact CD1-CB 4.35Å; L714-L729 HydrophobicContact CD1-CD1 4.35Å; L714-I730 HydrophobicContact CD1-CD1 4.31Å; L714-I730 HydrophobicContact CD1-CG1 4.18Å; L714-I730 HydrophobicContact CD2-CD1 4.1Å; L714-I730 HydrophobicContact CD2-CG1 3.9Å; L714-A734 HydrophobicContact CB-CB 4.33Å; L714-A734 HydrophobicContact CD2-CB 4.1Å; L714-P746 HydrophobicContact CB-CG 4.15Å; L714-P746 HydrophobicContact CD2-CB 4.27Å; L714-P746 HydrophobicContact CD2-CG 4.03Å; L714-P746 HydrophobicContact CG-CB 3.91Å; L714-P746 HydrophobicContact CG-CG 3.91Å; L714-L762 HydrophobicContact CD1-CD2 4.43Å; L714-L762 HydrophobicContact CD2-CD2 4.02Å; L714-L762 HydrophobicContact CG-CD2 4.36Å
715	H	91.8	Very high	85.7	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-63.9	-44.5	171.5	-72.1	87.4	0	0	0	111.1	L711 I712 P713 A718 S719 A738 F744 P746	L711-H715 HydrophobicContact CB-CB 4.22Å; L711-H715 HydrophobicContact CD2-CB 3.66Å; I712-H715 VanDerWaalsContact CG1-ND1 3.26Å; I712-H715 WeakPolarHBondContact CG1-ND1 3.5Å; I712-H715 PolarHBondContact N-ND1 2.81Å; I712-H715 WeakPolarHBondContact O-CB 3.42Å; I712-H715 PolarHBondContact O-N 2.96Å; P713-H715 VanDerWaalsContact C-N 3.32Å; P713-H715 PolarHBondContact O-N 3.42Å; H715-A718 CarbonylContact O-C 3.45Å; H715-A718 WeakPolarHBondContact O-CB 3.31Å; H715-A718 PolarHBondContact O-N 3.27Å; H715-A718 VanDerWaalsContact O-N 3.17Å; H715-S719 PolarHBondContact O-N 3.33Å; H715-A738 PolarHBondContact CE1-O 3.26Å; H715-A738 VanDerWaalsContact CE1-O 3.23Å; H715-A738 PolarHBondContact NE2-O 2.97Å; H715-F744 PolarHBondContact NE2-O 3.5Å; H715-P746 WeakPolarHBondContact NE2-CD 3.11Å
716	N	87.8	Confident	86.1	Confident	24 Å²	24	41.4 Å²	41.4	13%	0.128	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-46.8	179.1	-69.4	-16.5	0	0	0	110.5	S683 P713 A718 S719 Y720	S683-N716 PolarHBondContact O-ND2 3.37Å; S683-N716 VanDerWaalsContact O-ND2 3.15Å; S683-N716 PolarHBondContact OG-ND2 2.93Å; P713-N716 PolarHBondContact O-N 3.14Å; N716-A718 PolarHBondContact O-N 3.21Å; N716-S719 PolarHBondContact O-N 2.92Å; N716-Y720 VanDerWaalsContact O-CD2 3.25Å; N716-Y720 WeakPolarHBondContact O-CD2 3.47Å; N716-Y720 PolarHBondContact O-N 3.05Å
717	A	89.3	Confident	86.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-56.2	-38.6	173.5	0	0	0	0	0	111.5	P713 G721 H722 I725 L729	P713-A717 PolarHBondContact O-N 3.47Å; A717-G721 CarbonylContact O-C 3.54Å; A717-G721 WeakPolarHBondContact O-CA 3.31Å; A717-G721 PolarHBondContact O-N 3.48Å; A717-H722 PolarHBondContact O-N 3.33Å; A717-I725 HydrophobicContact CB-CG2 4.25Å; A717-L729 HydrophobicContact CB-CD1 4.2Å
718	A	91.6	Very high	87.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69.4	-42.3	176.6	0	0	0	0	0	115.4	L714 H715 N716 P746 E749 A750 R755 L758	L714-A718 VanDerWaalsContact O-CB 3.22Å; L714-A718 WeakPolarHBondContact O-CB 3.16Å; L714-A718 PolarHBondContact O-N 3.13Å; H715-A718 CarbonylContact O-C 3.45Å; H715-A718 WeakPolarHBondContact O-CB 3.31Å; H715-A718 PolarHBondContact O-N 3.27Å; H715-A718 VanDerWaalsContact O-N 3.17Å; N716-A718 PolarHBondContact O-N 3.21Å; A718-P746 HydrophobicContact CB-CB 4.08Å; A718-P746 WeakPolarHBondContact CB-O 3.4Å; A718-E749 HydrophobicContact CB-CB 4.07Å; A718-A750 HydrophobicContact CB-CB 4.03Å; A718-R755 WeakPolarHBondContact O-CG 3.48Å; A718-L758 HydrophobicContact CB-CD2 3.72Å
719	S	88.4	Confident	88.1	Confident	24 Å²	24	25 Å²	25	17%	0.168	13%	0.129	C	C	.	.	H	α-helix	trans	-69	-44.2	179.4	-152	0	0	0	0	111.1	H715 N716 E749 K753 R755	H715-S719 PolarHBondContact O-N 3.33Å; N716-S719 PolarHBondContact O-N 2.92Å; S719-E749 WeakPolarHBondContact CB-OE2 3.25Å; S719-E749 PolarHBondContact OG-OE2 3.31Å; S719-K753 WeakPolarHBondContact O-CG 2.99Å; S719-K753 WeakPolarHBondContact OG-CE 3.5Å; S719-R755 PolarHBondContact O-NE 2.98Å; S719-R755 PolarHBondContact O-NH2 3.01Å
720	Y	86	Confident	88.7	Confident	139 Å²	139	25.5 Å²	25.5	55%	0.545	13%	0.128	S	C	.	.	H	α-helix	trans	-80.3	-18.6	179.8	-67.6	-71.7	0	0	0	114	N716 H722 R755	N716-Y720 VanDerWaalsContact O-CD2 3.25Å; N716-Y720 WeakPolarHBondContact O-CD2 3.47Å; N716-Y720 PolarHBondContact O-N 3.05Å; Y720-H722 VanDerWaalsContact CB-NE2 3.27Å; Y720-H722 WeakPolarHBondContact CB-NE2 3.28Å; Y720-H722 AromaticContact CG-NE2 3.98Å; Y720-R755 VanDerWaalsContact O-CZ 3.27Å; Y720-R755 PolarHBondContact O-NH2 2.96Å
721	G	85.3	Confident	89	Confident	28 Å²	28	30.7 Å²	30.7	29%	0.289	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	32.1	177.5	0	0	0	0	0	113.9	A717 F723	A717-G721 CarbonylContact O-C 3.54Å; A717-G721 WeakPolarHBondContact O-CA 3.31Å; A717-G721 PolarHBondContact O-N 3.48Å; G721-F723 PolarHBondContact O-N 3.17Å
722	H	88.4	Confident	89	Confident	29 Å²	29	33.1 Å²	33.1	13%	0.134	16%	0.161	C	C	.	.			trans	-84.2	86.2	179.9	-58.5	-33.8	0	0	0	109.6	A685 G686 N688 A717 Y720 E724 I725 G726	A685-H722 PolarHBondContact O-CD2 3.26Å; G686-H722 PolarHBondContact O-NE2 3.18Å; N688-H722 PolarHBondContact OD1-ND1 3.47Å; A717-H722 PolarHBondContact O-N 3.33Å; Y720-H722 VanDerWaalsContact CB-NE2 3.27Å; Y720-H722 WeakPolarHBondContact CB-NE2 3.28Å; Y720-H722 AromaticContact CG-NE2 3.98Å; H722-E724 PolarHBondContact O-N 2.84Å; H722-I725 HydrophobicContact CB-CB 4.1Å; H722-I725 HydrophobicContact CB-CD1 4.34Å; H722-I725 HydrophobicContact CB-CG1 4.37Å; H722-I725 PolarHBondContact O-N 3.45Å; H722-G726 PolarHBondContact O-N 2.93Å
723	F	88	Confident	89	Confident	49 Å²	49	35.2 Å²	35.2	22%	0.215	18%	0.182	C	C	.	.	H	α-helix	trans	-59.1	-48.7	-172.1	178.9	-93.4	0	0	0	112.6	G721 I725 G726 Q727 Q757 L758 F761	G721-F723 PolarHBondContact O-N 3.17Å; F723-I725 VanDerWaalsContact C-N 3.33Å; F723-I725 PolarHBondContact O-N 3.27Å; F723-G726 PolarHBondContact O-N 2.92Å; F723-Q727 WeakPolarHBondContact O-CB 3.48Å; F723-Q727 PolarHBondContact O-N 3.43Å; F723-Q757 HydrophobicContact CD2-CB 3.87Å; F723-Q757 HydrophobicContact CE2-CB 4.18Å; F723-L758 HydrophobicContact CD2-CD1 4.15Å; F723-F761 HydrophobicContact CE2-CB 3.72Å; F723-F761 HydrophobicContact CE2-CD2 4.05Å; F723-F761 AromaticContact CE2-CG 3.94Å; F723-F761 HydrophobicContact CE2-CG 3.94Å; F723-F761 HydrophobicContact CZ-CB 4.43Å; F723-F761 AromaticContact CZ-CD2 3.9Å; F723-F761 HydrophobicContact CZ-CD2 3.9Å; F723-F761 HydrophobicContact CZ-CE2 4.47Å; F723-F761 HydrophobicContact CZ-CG 4.24Å
724	E	88.1	Confident	89.2	Confident	103 Å²	103	35.6 Å²	35.6	48%	0.481	19%	0.186	S	C	.	.	H	α-helix	trans	-64.9	-38.5	-176.2	-63.7	77.8	-173.2	0	0	111.5	Y690 H722 Q727 L728	Y690-E724 HydrophobicContact CD2-CB 3.9Å; Y690-E724 HydrophobicContact CE2-CB 4.24Å; H722-E724 PolarHBondContact O-N 2.84Å; E724-Q727 PolarHBondContact O-N 3.48Å; E724-L728 WeakPolarHBondContact O-CB 3.36Å; E724-L728 PolarHBondContact O-N 3.41Å
725	I	87.4	Confident	89.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-69.1	-43.1	174.1	-63.2	-174.6	0	0	0	110.5	A685 A717 H722 F723 Q727 L728 L729	A685-I725 HydrophobicContact CB-CG2 3.65Å; A685-I725 WeakPolarHBondContact O-CD1 3.2Å; A717-I725 HydrophobicContact CB-CG2 4.25Å; H722-I725 HydrophobicContact CB-CB 4.1Å; H722-I725 HydrophobicContact CB-CD1 4.34Å; H722-I725 HydrophobicContact CB-CG1 4.37Å; H722-I725 PolarHBondContact O-N 3.45Å; F723-I725 VanDerWaalsContact C-N 3.33Å; F723-I725 PolarHBondContact O-N 3.27Å; I725-Q727 VanDerWaalsContact C-N 3.26Å; I725-Q727 PolarHBondContact O-N 3.18Å; I725-L728 PolarHBondContact O-N 3.43Å; I725-L729 HydrophobicContact CG2-CD1 3.88Å; I725-L729 HydrophobicContact CG2-CG 4.2Å; I725-L729 WeakPolarHBondContact O-CB 3.17Å; I725-L729 WeakPolarHBondContact O-CG 3.26Å; I725-L729 PolarHBondContact O-N 2.93Å
726	G	89.4	Confident	89.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-40.8	174.4	0	0	0	0	0	112.4	H722 F723 I730	H722-G726 PolarHBondContact O-N 2.93Å; F723-G726 PolarHBondContact O-N 2.92Å; G726-I730 PolarHBondContact O-N 3.18Å; G726-I730 VanDerWaalsContact O-N 3.1Å
727	Q	90.7	Very high	89.5	Confident	65 Å²	65	42.6 Å²	42.6	30%	0.304	22%	0.224	S	C	.	.	H	α-helix	trans	-63.3	-49.6	173.8	177	175.3	-5.2	0	0	112	F723 E724 I725 L729 I730 Q731 F761	F723-Q727 WeakPolarHBondContact O-CB 3.48Å; F723-Q727 PolarHBondContact O-N 3.43Å; E724-Q727 PolarHBondContact O-N 3.48Å; I725-Q727 VanDerWaalsContact C-N 3.26Å; I725-Q727 PolarHBondContact O-N 3.18Å; Q727-L729 VanDerWaalsContact C-N 3.3Å; Q727-L729 PolarHBondContact O-N 3.44Å; Q727-I730 PolarHBondContact O-N 2.95Å; Q727-Q731 HydrophobicContact CG-CG 4.47Å; Q727-Q731 WeakPolarHBondContact O-CB 3.21Å; Q727-Q731 VanDerWaalsContact O-CG 3.28Å; Q727-Q731 WeakPolarHBondContact O-CG 3.28Å; Q727-Q731 PolarHBondContact O-N 2.66Å; Q727-F761 HydrophobicContact CB-CE1 4.05Å; Q727-F761 HydrophobicContact CB-CE2 4.43Å; Q727-F761 HydrophobicContact CB-CZ 3.82Å; Q727-F761 HydrophobicContact CG-CE1 4.44Å; Q727-F761 HydrophobicContact CG-CE2 4.22Å; Q727-F761 HydrophobicContact CG-CZ 3.73Å
728	L	89.4	Confident	89.6	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-43.6	178.3	179.3	69	0	0	0	111.6	Y690 A693 E694 I697 E724 I725 Q731 H732	Y690-L728 HydrophobicContact CD2-CD2 4.33Å; Y690-L728 HydrophobicContact CE2-CB 3.94Å; Y690-L728 HydrophobicContact CE2-CD1 4.39Å; Y690-L728 HydrophobicContact CE2-CD2 4.1Å; Y690-L728 HydrophobicContact CE2-CG 4.37Å; A693-L728 HydrophobicContact CB-CD2 3.9Å; E694-L728 HydrophobicContact CB-CD1 4.4Å; E694-L728 HydrophobicContact CB-CD2 3.95Å; E694-L728 HydrophobicContact CG-CD1 4.36Å; I697-L728 HydrophobicContact CD1-CD2 4Å; I697-L728 HydrophobicContact CD1-CG 3.92Å; E724-L728 WeakPolarHBondContact O-CB 3.36Å; E724-L728 PolarHBondContact O-N 3.41Å; I725-L728 PolarHBondContact O-N 3.43Å; L728-Q731 PolarHBondContact O-N 2.82Å; L728-H732 PolarHBondContact O-N 3.1Å; L728-H732 PolarHBondContact O-ND1 2.92Å
729	L	90.8	Very high	89.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-47.1	178.9	-71.4	171.7	0	0	0	111.9	L682 A685 I697 V703 P713 L714 A717 I725 Q727 Q731 H732 G733 A734	L682-L729 HydrophobicContact CD2-CD2 3.33Å; L682-L729 HydrophobicContact CG-CD2 4.28Å; A685-L729 HydrophobicContact CB-CD1 4.28Å; I697-L729 HydrophobicContact CD1-CD2 4.16Å; V703-L729 HydrophobicContact CB-CD2 4.28Å; V703-L729 HydrophobicContact CG1-CD2 4.21Å; P713-L729 HydrophobicContact CB-CD1 3.75Å; P713-L729 HydrophobicContact CB-CD2 3.85Å; P713-L729 HydrophobicContact CB-CG 4.48Å; L714-L729 HydrophobicContact CB-CD1 4.31Å; L714-L729 HydrophobicContact CD1-CB 4.35Å; L714-L729 HydrophobicContact CD1-CD1 4.35Å; A717-L729 HydrophobicContact CB-CD1 4.2Å; I725-L729 HydrophobicContact CG2-CD1 3.88Å; I725-L729 HydrophobicContact CG2-CG 4.2Å; I725-L729 WeakPolarHBondContact O-CB 3.17Å; I725-L729 WeakPolarHBondContact O-CG 3.26Å; I725-L729 PolarHBondContact O-N 2.93Å; Q727-L729 VanDerWaalsContact C-N 3.3Å; Q727-L729 PolarHBondContact O-N 3.44Å; L729-Q731 PolarHBondContact O-N 3.25Å; L729-H732 CarbonylContact O-C 3.32Å; L729-H732 PolarHBondContact O-N 3.44Å; L729-H732 VanDerWaalsContact O-N 3.16Å; L729-G733 PolarHBondContact O-N 2.88Å; L729-A734 VanDerWaalsContact C-CB 3.46Å; L729-A734 HydrophobicContact CB-CB 3.78Å; L729-A734 WeakPolarHBondContact O-CB 3.35Å; L729-A734 PolarHBondContact O-N 3.32Å
730	I	90.4	Very high	89.9	Confident	24 Å²	24	46.7 Å²	46.7	12%	0.123	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-40.4	178.5	-75.1	179.4	0	0	0	111.3	L714 G726 Q727 H732 G733 F761 L762 H765	L714-I730 HydrophobicContact CD1-CD1 4.31Å; L714-I730 HydrophobicContact CD1-CG1 4.18Å; L714-I730 HydrophobicContact CD2-CD1 4.1Å; L714-I730 HydrophobicContact CD2-CG1 3.9Å; G726-I730 PolarHBondContact O-N 3.18Å; G726-I730 VanDerWaalsContact O-N 3.1Å; Q727-I730 PolarHBondContact O-N 2.95Å; I730-H732 PolarHBondContact O-N 3.45Å; I730-G733 PolarHBondContact O-N 3.06Å; I730-F761 HydrophobicContact CB-CE1 4.17Å; I730-F761 HydrophobicContact CD1-CD1 4.03Å; I730-F761 HydrophobicContact CD1-CE1 3.75Å; I730-F761 HydrophobicContact CG1-CE1 4.44Å; I730-F761 HydrophobicContact CG2-CE1 4.36Å; I730-L762 HydrophobicContact CD1-CD2 3.75Å; I730-H765 HydrophobicContact CD1-CB 4.26Å; I730-H765 HydrophobicContact CG2-CB 4.02Å
731	Q	89.6	Confident	90.1	Very high	119 Å²	119	45.3 Å²	45.3	56%	0.556	24%	0.244	S	C	*	.	H	α-helix	trans	-58.4	-30.4	175.1	-75.5	175.6	-11.1	0	0	112.7	Q727 L728 L729	Q727-Q731 HydrophobicContact CG-CG 4.47Å; Q727-Q731 WeakPolarHBondContact O-CB 3.21Å; Q727-Q731 VanDerWaalsContact O-CG 3.28Å; Q727-Q731 WeakPolarHBondContact O-CG 3.28Å; Q727-Q731 PolarHBondContact O-N 2.66Å; L728-Q731 PolarHBondContact O-N 2.82Å; L729-Q731 PolarHBondContact O-N 3.25Å
732	H	88.2	Confident	90.5	Very high	87 Å²	87	51.2 Å²	51.2	40%	0.403	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	15.1	178	-67.1	88.7	0	0	0	113.6	I697 V703 L728 L729 I730	I697-H732 HydrophobicContact CG2-CB 3.84Å; I697-H732 WeakPolarHBondContact CG2-CD2 3.36Å; I697-H732 VanDerWaalsContact CG2-CG 3.49Å; V703-H732 HydrophobicContact CG1-CB 3.94Å; V703-H732 WeakPolarHBondContact CG2-O 3.34Å; L728-H732 PolarHBondContact O-N 3.1Å; L728-H732 PolarHBondContact O-ND1 2.92Å; L729-H732 CarbonylContact O-C 3.32Å; L729-H732 PolarHBondContact O-N 3.44Å; L729-H732 VanDerWaalsContact O-N 3.16Å; I730-H732 PolarHBondContact O-N 3.45Å
733	G	89.2	Confident	90.7	Very high	44 Å²	44	49.9 Å²	49.9	45%	0.454	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	22.7	170.3	0	0	0	0	0	115.7	N704 L729 I730 L735	N704-G733 PolarHBondContact ND2-O 2.87Å; L729-G733 PolarHBondContact O-N 2.88Å; I730-G733 PolarHBondContact O-N 3.06Å; G733-L735 PolarHBondContact O-N 3.29Å
734	A	90.7	Very high	91.1	Very high	10 Å²	10	48.8 Å²	48.8	8%	0.083	25%	0.247	C	C	.	.			trans	-63.8	134.1	171.9	0	0	0	0	0	111.6	V703 N704 L714 L729 A736	V703-A734 HydrophobicContact CB-CB 4.36Å; V703-A734 HydrophobicContact CG2-CB 4.32Å; N704-A734 WeakPolarHBondContact OD1-CA 3.5Å; L714-A734 HydrophobicContact CB-CB 4.33Å; L714-A734 HydrophobicContact CD2-CB 4.1Å; L729-A734 VanDerWaalsContact C-CB 3.46Å; L729-A734 HydrophobicContact CB-CB 3.78Å; L729-A734 WeakPolarHBondContact O-CB 3.35Å; L729-A734 PolarHBondContact O-N 3.32Å; A734-A736 PolarHBondContact O-N 3.3Å
735	L	91.6	Very high	91.5	Very high	101 Å²	101	43.9 Å²	43.9	53%	0.529	22%	0.224	S	C	.	.			trans	-76.5	103	-176.7	-65.8	172.9	0	0	0	110.9	N704 I712 G733 N737 A738	N704-L735 WeakPolarHBondContact OD1-CG 3.21Å; N704-L735 PolarHBondContact OD1-N 2.94Å; I712-L735 HydrophobicContact CD1-CB 4.49Å; I712-L735 WeakPolarHBondContact CD1-O 3.3Å; G733-L735 PolarHBondContact O-N 3.29Å; L735-N737 PolarHBondContact O-N 2.61Å; L735-N737 VanDerWaalsContact O-N 3.1Å; L735-A738 HydrophobicContact CB-CB 3.91Å; L735-A738 WeakPolarHBondContact O-CB 3.35Å; L735-A738 PolarHBondContact O-N 2.99Å; L735-A738 VanDerWaalsContact O-N 3.08Å
736	A	92	Very high	91.9	Very high	11 Å²	11	43.9 Å²	43.9	9%	0.091	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.9	-179.6	0	0	0	0	0	114.6	A734 P746 L762 A767	A734-A736 PolarHBondContact O-N 3.3Å; A736-P746 WeakPolarHBondContact O-CD 3.33Å; A736-L762 HydrophobicContact CB-CD2 4.25Å; A736-A767 HydrophobicContact CB-CB 4.19Å
737	N	94.5	Very high	92.2	Very high	60 Å²	60	43.9 Å²	43.9	32%	0.321	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	15	179.2	-67.1	-39.2	0	0	0	113.6	L735 Q739 G766 A767 D768 I771	L735-N737 PolarHBondContact O-N 2.61Å; L735-N737 VanDerWaalsContact O-N 3.1Å; N737-Q739 PolarHBondContact O-N 3.34Å; N737-G766 PolarHBondContact ND2-O 3Å; N737-A767 VanDerWaalsContact OD1-CA 3.26Å; N737-A767 WeakPolarHBondContact OD1-CA 3.4Å; N737-D768 PolarHBondContact OD1-N 3.35Å; N737-I771 HydrophobicContact CB-CD1 3.83Å
738	A	92.6	Very high	92.5	Very high	11 Å²	11	40.8 Å²	40.8	9%	0.091	21%	0.21	C	C	.	.			trans	-58.8	134.7	174	0	0	0	0	0	110.1	I712 H715 L735 T745 P746	I712-A738 HydrophobicContact CD1-CB 3.63Å; I712-A738 HydrophobicContact CG1-CB 4Å; I712-A738 HydrophobicContact CG2-CB 4.33Å; H715-A738 PolarHBondContact CE1-O 3.26Å; H715-A738 VanDerWaalsContact CE1-O 3.23Å; H715-A738 PolarHBondContact NE2-O 2.97Å; L735-A738 HydrophobicContact CB-CB 3.91Å; L735-A738 WeakPolarHBondContact O-CB 3.35Å; L735-A738 PolarHBondContact O-N 2.99Å; L735-A738 VanDerWaalsContact O-N 3.08Å; A738-T745 WeakPolarHBondContact O-CA 3.27Å; A738-P746 WeakPolarHBondContact O-CD 3.4Å
739	Q	93.6	Very high	92.7	Very high	84 Å²	84	42 Å²	42	39%	0.393	22%	0.216	S	C	.	.			trans	-102.2	136.7	174.7	-70.8	177.5	6.8	0	0	110.6	K706 N737 F744 T745 I771	K706-Q739 PolarHBondContact NZ-O 3.17Å; N737-Q739 PolarHBondContact O-N 3.34Å; Q739-F744 VanDerWaalsContact CA-O 3.3Å; Q739-F744 WeakPolarHBondContact CA-O 3.46Å; Q739-T745 HydrophobicContact CG-CG2 3.83Å; Q739-I771 HydrophobicContact CG-CG2 4.48Å
740	D	91.3	Very high	92.9	Very high	15 Å²	15	42 Å²	42	8%	0.08	22%	0.216	C	C	.	.			trans	-76.9	-173.8	168.7	76.9	-4.7	0	0	0	111.9	L711 W742 G743 F744	L711-D740 HydrophobicContact CD2-CB 3.72Å; L711-D740 HydrophobicContact CG-CB 4.25Å; D740-W742 PolarHBondContact O-N 3.42Å; D740-W742 VanDerWaalsContact OD1-C 3.24Å; D740-W742 WeakPolarHBondContact OD1-CA 3.37Å; D740-W742 PolarHBondContact OD1-N 2.78Å; D740-G743 PolarHBondContact O-N 3.06Å; D740-G743 VanDerWaalsContact O-N 3.16Å; D740-G743 PolarHBondContact OD1-N 3.15Å; D740-F744 PolarHBondContact N-O 3.49Å; D740-F744 PolarHBondContact OD1-N 3.22Å
741	L	91.2	Very high	93.1	Very high	110 Å²	110	40.9 Å²	40.9	58%	0.576	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-20.6	178.2	-82.9	159	0	0	0	113.9	R708 G709 H774	R708-L741 WeakPolarHBondContact O-CD1 3.49Å; G709-L741 VanDerWaalsContact C-CD1 3.45Å; G709-L741 WeakPolarHBondContact O-CB 3.24Å; G709-L741 WeakPolarHBondContact O-CD1 3.25Å; G709-L741 WeakPolarHBondContact O-CG 3.37Å; G709-L741 PolarHBondContact O-N 2.96Å; L741-H774 PolarHBondContact O-CE1 3.23Å
742	W	93.2	Very high	93.3	Very high	151 Å²	151	38.1 Å²	38.1	57%	0.572	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.9	8.1	178.8	-60.7	-83.3	0	0	0	112.7	D740 F744 H774	D740-W742 PolarHBondContact O-N 3.42Å; D740-W742 VanDerWaalsContact OD1-C 3.24Å; D740-W742 WeakPolarHBondContact OD1-CA 3.37Å; D740-W742 PolarHBondContact OD1-N 2.78Å; W742-F744 HydrophobicContact CB-CD2 3.79Å; W742-F744 HydrophobicContact CB-CE2 4.13Å; W742-F744 PolarHBondContact O-N 3.4Å; W742-H774 PolarHBondContact O-N 3.45Å; W742-H774 PolarHBondContact O-ND1 3.14Å
743	G	92.4	Very high	93.5	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.01	20%	0.197	C	C	.	.	S	Bend	trans	76.4	9.8	177.7	0	0	0	0	0	113.7	D740 N773 H774	D740-G743 PolarHBondContact O-N 3.06Å; D740-G743 VanDerWaalsContact O-N 3.16Å; D740-G743 PolarHBondContact OD1-N 3.15Å; G743-N773 WeakPolarHBondContact O-CA 3.43Å; G743-H774 PolarHBondContact N-ND1 3.38Å; G743-H774 VanDerWaalsContact N-ND1 3.15Å
744	F	96.6	Very high	93.6	Very high	27 Å²	27	37.4 Å²	37.4	12%	0.118	19%	0.187	C	C	.	.			trans	-73.7	141.5	173.5	-77	-112.3	0	0	0	109.3	H715 Q739 D740 W742 H748 N773 L782	H715-F744 PolarHBondContact NE2-O 3.5Å; Q739-F744 VanDerWaalsContact CA-O 3.3Å; Q739-F744 WeakPolarHBondContact CA-O 3.46Å; D740-F744 PolarHBondContact N-O 3.49Å; D740-F744 PolarHBondContact OD1-N 3.22Å; W742-F744 HydrophobicContact CB-CD2 3.79Å; W742-F744 HydrophobicContact CB-CE2 4.13Å; W742-F744 PolarHBondContact O-N 3.4Å; F744-H748 HydrophobicContact CB-CB 4.28Å; F744-H748 HydrophobicContact CD1-CB 3.65Å; F744-H748 HydrophobicContact CE1-CB 4.43Å; F744-H748 HydrophobicContact CG-CB 4.3Å; F744-N773 HydrophobicContact CD2-CB 3.89Å; F744-N773 HydrophobicContact CE2-CB 3.96Å; F744-N773 WeakPolarHBondContact CE2-ND2 3.2Å; F744-N773 HydrophobicContact CG-CB 4.44Å; F744-N773 WeakPolarHBondContact CZ-ND2 3.26Å; F744-L782 HydrophobicContact CD1-CD1 4.14Å; F744-L782 HydrophobicContact CE1-CD1 3.45Å; F744-L782 VanDerWaalsContact CE1-CD1 3.45Å; F744-L782 HydrophobicContact CZ-CD1 4.18Å
745	T	96.5	Very high	93.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.199	C	C	.	.			trans	-106.2	165.4	171.4	66	0	0	0	0	109.8	A738 Q739 L747 H748 E749 I771	A738-T745 WeakPolarHBondContact O-CA 3.27Å; Q739-T745 HydrophobicContact CG-CG2 3.83Å; T745-L747 PolarHBondContact O-N 2.89Å; T745-L747 VanDerWaalsContact O-N 3.1Å; T745-L747 PolarHBondContact OG1-N 3.46Å; T745-H748 PolarHBondContact N-ND1 3.26Å; T745-H748 VanDerWaalsContact N-ND1 3.14Å; T745-H748 WeakPolarHBondContact O-CA 3.23Å; T745-H748 WeakPolarHBondContact O-CB 3.42Å; T745-H748 PolarHBondContact O-N 3.13Å; T745-H748 PolarHBondContact OG1-N 2.87Å; T745-H748 PolarHBondContact OG1-ND1 3.15Å; T745-E749 PolarHBondContact O-N 3.04Å; T745-I771 HydrophobicContact CG2-CB 4.34Å; T745-I771 HydrophobicContact CG2-CD1 4.02Å; T745-I771 HydrophobicContact CG2-CG2 3.79Å
746	P	95.7	Very high	93.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-54	-31.8	171.4	-27.1	35.4	0	0	0	113	L714 H715 A718 A736 A738 E749 A750 L762	L714-P746 HydrophobicContact CB-CG 4.15Å; L714-P746 HydrophobicContact CD2-CB 4.27Å; L714-P746 HydrophobicContact CD2-CG 4.03Å; L714-P746 HydrophobicContact CG-CB 3.91Å; L714-P746 HydrophobicContact CG-CG 3.91Å; H715-P746 WeakPolarHBondContact NE2-CD 3.11Å; A718-P746 HydrophobicContact CB-CB 4.08Å; A718-P746 WeakPolarHBondContact CB-O 3.4Å; A736-P746 WeakPolarHBondContact O-CD 3.33Å; A738-P746 WeakPolarHBondContact O-CD 3.4Å; P746-E749 PolarHBondContact O-N 3.07Å; P746-A750 WeakPolarHBondContact O-CB 3.49Å; P746-A750 PolarHBondContact O-N 3.42Å; P746-L762 HydrophobicContact CB-CD1 4.23Å; P746-L762 HydrophobicContact CB-CD2 4.29Å
747	L	95.9	Very high	93.4	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-68	-36.3	174.8	-170.2	63.6	0	0	0	112.5	T745 S751 V759 L762 L763 A767 P769 P779 L792	T745-L747 PolarHBondContact O-N 2.89Å; T745-L747 VanDerWaalsContact O-N 3.1Å; T745-L747 PolarHBondContact OG1-N 3.46Å; L747-S751 VanDerWaalsContact O-CB 3.24Å; L747-S751 WeakPolarHBondContact O-CB 3.48Å; L747-S751 PolarHBondContact O-N 3.48Å; L747-S751 PolarHBondContact O-OG 3.37Å; L747-V759 HydrophobicContact CD1-CB 4.35Å; L747-V759 HydrophobicContact CD1-CG1 3.87Å; L747-V759 HydrophobicContact CD1-CG2 4.46Å; L747-L762 HydrophobicContact CD1-CB 4.1Å; L747-L762 HydrophobicContact CD1-CD1 4.35Å; L747-L763 HydrophobicContact CD1-CD2 4.33Å; L747-L763 HydrophobicContact CD1-CG 4.18Å; L747-L763 HydrophobicContact CD2-CD2 3.76Å; L747-L763 HydrophobicContact CD2-CG 4.49Å; L747-A767 HydrophobicContact CB-CB 4.25Å; L747-A767 HydrophobicContact CD2-CB 4Å; L747-P769 HydrophobicContact CD2-CB 4.11Å; L747-P779 HydrophobicContact CB-CG 4.4Å; L747-P779 HydrophobicContact CD2-CB 4.45Å; L747-P779 HydrophobicContact CD2-CG 4.09Å; L747-P779 HydrophobicContact CG-CB 4.11Å; L747-P779 HydrophobicContact CG-CG 4.04Å; L747-L792 HydrophobicContact CD1-CD2 4.3Å; L747-L792 HydrophobicContact CD2-CD2 4.26Å; L747-L792 HydrophobicContact CG-CD2 4.38Å
748	H	96.2	Very high	93.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.8	-47.7	172.8	-71.4	89.9	0	0	0	111.1	F744 T745 S751 Q752 I771 Q777 P779 L782	F744-H748 HydrophobicContact CB-CB 4.28Å; F744-H748 HydrophobicContact CD1-CB 3.65Å; F744-H748 HydrophobicContact CE1-CB 4.43Å; F744-H748 HydrophobicContact CG-CB 4.3Å; T745-H748 PolarHBondContact N-ND1 3.26Å; T745-H748 VanDerWaalsContact N-ND1 3.14Å; T745-H748 WeakPolarHBondContact O-CA 3.23Å; T745-H748 WeakPolarHBondContact O-CB 3.42Å; T745-H748 PolarHBondContact O-N 3.13Å; T745-H748 PolarHBondContact OG1-N 2.87Å; T745-H748 PolarHBondContact OG1-ND1 3.15Å; H748-S751 PolarHBondContact O-N 3.37Å; H748-Q752 WeakPolarHBondContact O-CB 3.23Å; H748-Q752 PolarHBondContact O-N 3.22Å; H748-I771 PolarHBondContact CE1-O 3.22Å; H748-I771 PolarHBondContact NE2-O 2.81Å; H748-Q777 PolarHBondContact NE2-O 3.29Å; H748-P779 WeakPolarHBondContact NE2-CD 3.43Å; H748-L782 HydrophobicContact CB-CD1 4.12Å
749	E	94	Very high	93.1	Very high	28 Å²	28	43.2 Å²	43.2	13%	0.131	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-51.8	178.2	-78.7	-62.3	150.1	0	0	111.6	A718 S719 T745 P746 S751 Q752 K753	A718-E749 HydrophobicContact CB-CB 4.07Å; S719-E749 WeakPolarHBondContact CB-OE2 3.25Å; S719-E749 PolarHBondContact OG-OE2 3.31Å; T745-E749 PolarHBondContact O-N 3.04Å; P746-E749 PolarHBondContact O-N 3.07Å; E749-S751 VanDerWaalsContact C-N 3.26Å; E749-S751 PolarHBondContact O-N 2.99Å; E749-Q752 PolarHBondContact O-N 3.43Å; E749-K753 WeakPolarHBondContact O-CG 2.98Å; E749-K753 PolarHBondContact O-N 3.23Å
750	A	95.1	Very high	93	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.4	-39.1	177.5	0	0	0	0	0	112	A718 P746 G754 R755 L758 V759 L762	A718-A750 HydrophobicContact CB-CB 4.03Å; P746-A750 WeakPolarHBondContact O-CB 3.49Å; P746-A750 PolarHBondContact O-N 3.42Å; A750-G754 PolarHBondContact O-N 3.29Å; A750-G754 VanDerWaalsContact O-N 3.12Å; A750-R755 HydrophobicContact CB-CB 4.21Å; A750-R755 PolarHBondContact O-N 2.84Å; A750-L758 HydrophobicContact CB-CD2 4.45Å; A750-V759 HydrophobicContact CB-CG2 3.61Å; A750-L762 HydrophobicContact CB-CD1 4.01Å
751	S	94.4	Very high	93	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-47	179.2	-54.3	0	0	0	0	112	L747 H748 E749 K753 G754 P779 A783 L792	L747-S751 VanDerWaalsContact O-CB 3.24Å; L747-S751 WeakPolarHBondContact O-CB 3.48Å; L747-S751 PolarHBondContact O-N 3.48Å; L747-S751 PolarHBondContact O-OG 3.37Å; H748-S751 PolarHBondContact O-N 3.37Å; E749-S751 VanDerWaalsContact C-N 3.26Å; E749-S751 PolarHBondContact O-N 2.99Å; S751-K753 VanDerWaalsContact C-N 3.28Å; S751-K753 PolarHBondContact O-N 3.4Å; S751-G754 PolarHBondContact O-N 3.01Å; S751-G754 VanDerWaalsContact O-N 3.11Å; S751-P779 VanDerWaalsContact CB-O 3.31Å; S751-P779 WeakPolarHBondContact CB-O 3.07Å; S751-P779 WeakPolarHBondContact OG-CB 3.37Å; S751-A783 WeakPolarHBondContact O-CA 3.49Å; S751-L792 WeakPolarHBondContact OG-CD1 3.47Å
752	Q	94	Very high	93.1	Very high	60 Å²	60	36.9 Å²	36.9	28%	0.28	17%	0.171	S	C	.	.	H	α-helix	trans	-60.3	-40.1	179.2	-164.8	-164.2	54.7	0	0	111.6	H748 E749 G754 L782 T784	H748-Q752 WeakPolarHBondContact O-CB 3.23Å; H748-Q752 PolarHBondContact O-N 3.22Å; E749-Q752 PolarHBondContact O-N 3.43Å; Q752-G754 VanDerWaalsContact C-N 3.33Å; Q752-L782 WeakPolarHBondContact CA-O 3.41Å; Q752-L782 HydrophobicContact CB-CB 4.12Å; Q752-L782 HydrophobicContact CG-CB 4.32Å; Q752-T784 VanDerWaalsContact O-CG2 3.23Å; Q752-T784 WeakPolarHBondContact O-CG2 3.42Å; Q752-T784 PolarHBondContact O-OG1 3.35Å
753	K	93.3	Very high	93	Very high	94 Å²	94	31.2 Å²	31.2	41%	0.409	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	2.8	179.4	-53.3	-53.7	-175.5	-150.2	0	114	S719 E749 S751 R755	S719-K753 WeakPolarHBondContact O-CG 2.99Å; S719-K753 WeakPolarHBondContact OG-CE 3.5Å; E749-K753 WeakPolarHBondContact O-CG 2.98Å; E749-K753 PolarHBondContact O-N 3.23Å; S751-K753 VanDerWaalsContact C-N 3.28Å; S751-K753 PolarHBondContact O-N 3.4Å; K753-R755 HydrophobicContact CB-CG 4.07Å
754	G	90	Very high	92.8	Very high	23 Å²	23	35.2 Å²	35.2	24%	0.237	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	35.3	176.2	0	0	0	0	0	114.3	A750 S751 Q752 F756	A750-G754 PolarHBondContact O-N 3.29Å; A750-G754 VanDerWaalsContact O-N 3.12Å; S751-G754 PolarHBondContact O-N 3.01Å; S751-G754 VanDerWaalsContact O-N 3.11Å; Q752-G754 VanDerWaalsContact C-N 3.33Å; G754-F756 PolarHBondContact O-N 3.06Å; G754-F756 VanDerWaalsContact O-N 3.14Å
755	R	92.5	Very high	92.5	Very high	92 Å²	92	38.3 Å²	38.3	35%	0.347	19%	0.194	S	C	.	.			trans	-86.5	68.8	-176.7	-52.2	-51.1	-173.1	170.4	1.3	112.2	A718 S719 Y720 A750 K753 Q757 L758 V759	A718-R755 WeakPolarHBondContact O-CG 3.48Å; S719-R755 PolarHBondContact O-NE 2.98Å; S719-R755 PolarHBondContact O-NH2 3.01Å; Y720-R755 VanDerWaalsContact O-CZ 3.27Å; Y720-R755 PolarHBondContact O-NH2 2.96Å; A750-R755 HydrophobicContact CB-CB 4.21Å; A750-R755 PolarHBondContact O-N 2.84Å; K753-R755 HydrophobicContact CB-CG 4.07Å; R755-Q757 PolarHBondContact O-N 3.46Å; R755-L758 HydrophobicContact CB-CB 4.27Å; R755-L758 PolarHBondContact O-N 2.97Å; R755-V759 WeakPolarHBondContact O-CG2 3.21Å; R755-V759 PolarHBondContact O-N 3.32Å
756	F	89.6	Confident	92	Very high	84 Å²	84	40.7 Å²	40.7	37%	0.368	22%	0.219	S	C	.	.	H	α-helix	trans	-45	-51.8	-174.1	-178.4	-90	0	0	0	115.2	G754 L758 V759 S760 D787 V788 L791	G754-F756 PolarHBondContact O-N 3.06Å; G754-F756 VanDerWaalsContact O-N 3.14Å; F756-L758 VanDerWaalsContact C-N 3.31Å; F756-L758 PolarHBondContact O-N 3.13Å; F756-V759 PolarHBondContact O-N 2.64Å; F756-S760 WeakPolarHBondContact O-CB 3.25Å; F756-S760 PolarHBondContact O-N 3.03Å; F756-D787 HydrophobicContact CD2-CB 3.85Å; F756-D787 HydrophobicContact CE2-CB 4.09Å; F756-V788 HydrophobicContact CB-CG2 4.05Å; F756-V788 HydrophobicContact CD2-CG2 4.29Å; F756-L791 HydrophobicContact CD2-CD2 4.11Å; F756-L791 HydrophobicContact CE2-CB 4.16Å; F756-L791 HydrophobicContact CE2-CD2 3.81Å; F756-L791 HydrophobicContact CE2-CG 4.47Å; F756-L791 HydrophobicContact CZ-CD2 4.22Å
757	Q	89.1	Confident	91.9	Very high	136 Å²	136	41 Å²	41	64%	0.636	22%	0.221	S	C	*	.	H	α-helix	trans	-59.9	-42.1	-178.1	-73	178	-24.2	0	0	112.2	F723 R755 F761	F723-Q757 HydrophobicContact CD2-CB 3.87Å; F723-Q757 HydrophobicContact CE2-CB 4.18Å; R755-Q757 PolarHBondContact O-N 3.46Å; Q757-F761 WeakPolarHBondContact O-CB 3.42Å; Q757-F761 PolarHBondContact O-N 2.69Å
758	L	89.8	Confident	91.6	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.016	24%	0.236	C	C	.	.	H	α-helix	trans	-77.9	-34.4	-179.4	-163.1	78	0	0	0	112	A718 F723 A750 R755 F756 S760 F761 L762	A718-L758 HydrophobicContact CB-CD2 3.72Å; F723-L758 HydrophobicContact CD2-CD1 4.15Å; A750-L758 HydrophobicContact CB-CD2 4.45Å; R755-L758 HydrophobicContact CB-CB 4.27Å; R755-L758 PolarHBondContact O-N 2.97Å; F756-L758 VanDerWaalsContact C-N 3.31Å; F756-L758 PolarHBondContact O-N 3.13Å; L758-S760 VanDerWaalsContact C-N 3.34Å; L758-F761 HydrophobicContact CD1-CD1 4.42Å; L758-F761 PolarHBondContact O-N 3.2Å; L758-L762 HydrophobicContact CD2-CD1 4.26Å; L758-L762 HydrophobicContact CG-CD1 4.09Å; L758-L762 HydrophobicContact CG-CG 4.28Å; L758-L762 VanDerWaalsContact O-CB 3.28Å; L758-L762 WeakPolarHBondContact O-CB 3.38Å; L758-L762 WeakPolarHBondContact O-CG 3.2Å; L758-L762 PolarHBondContact O-N 2.95Å
759	V	91.8	Very high	91.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.2	-50.4	170.4	172.4	0	0	0	0	109.9	L747 A750 R755 F756 F761 L762 L763 V788 L791 L792	L747-V759 HydrophobicContact CD1-CB 4.35Å; L747-V759 HydrophobicContact CD1-CG1 3.87Å; L747-V759 HydrophobicContact CD1-CG2 4.46Å; A750-V759 HydrophobicContact CB-CG2 3.61Å; R755-V759 WeakPolarHBondContact O-CG2 3.21Å; R755-V759 PolarHBondContact O-N 3.32Å; F756-V759 PolarHBondContact O-N 2.64Å; V759-F761 VanDerWaalsContact C-N 3.33Å; V759-F761 PolarHBondContact O-N 3.04Å; V759-L762 PolarHBondContact O-N 3.36Å; V759-L763 HydrophobicContact CG1-CD1 3.9Å; V759-L763 HydrophobicContact CG1-CG 4.49Å; V759-L763 WeakPolarHBondContact O-CB 3.42Å; V759-L763 VanDerWaalsContact O-CG 3.24Å; V759-L763 WeakPolarHBondContact O-CG 3.14Å; V759-L763 PolarHBondContact O-N 3.47Å; V759-V788 HydrophobicContact CG1-CG1 4.3Å; V759-V788 HydrophobicContact CG2-CG1 4.06Å; V759-V788 HydrophobicContact CG2-CG2 4.43Å; V759-L791 HydrophobicContact CB-CD2 4.29Å; V759-L791 HydrophobicContact CG1-CD2 3.79Å; V759-L792 HydrophobicContact CG1-CD2 4.03Å; V759-L792 HydrophobicContact CG1-CG 4.24Å
760	S	91	Very high	91.1	Very high	50 Å²	50	44.8 Å²	44.8	35%	0.35	24%	0.244	S	C	.	.	H	α-helix	trans	-58	-45.9	176.4	-177.1	0	0	0	0	111.9	F756 L758 L763 S764	F756-S760 WeakPolarHBondContact O-CB 3.25Å; F756-S760 PolarHBondContact O-N 3.03Å; L758-S760 VanDerWaalsContact C-N 3.34Å; S760-L763 PolarHBondContact O-N 3.19Å; S760-S764 PolarHBondContact O-N 3.03Å; S760-S764 PolarHBondContact O-OG 3.35Å
761	F	91.1	Very high	90.9	Very high	26 Å²	26	46 Å²	46	11%	0.114	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-48.6	178.2	-171.9	-100.5	0	0	0	112.3	F723 Q727 I730 Q757 L758 V759 L763 S764 H765	F723-F761 HydrophobicContact CE2-CB 3.72Å; F723-F761 HydrophobicContact CE2-CD2 4.05Å; F723-F761 AromaticContact CE2-CG 3.94Å; F723-F761 HydrophobicContact CE2-CG 3.94Å; F723-F761 HydrophobicContact CZ-CB 4.43Å; F723-F761 AromaticContact CZ-CD2 3.9Å; F723-F761 HydrophobicContact CZ-CD2 3.9Å; F723-F761 HydrophobicContact CZ-CE2 4.47Å; F723-F761 HydrophobicContact CZ-CG 4.24Å; Q727-F761 HydrophobicContact CB-CE1 4.05Å; Q727-F761 HydrophobicContact CB-CE2 4.43Å; Q727-F761 HydrophobicContact CB-CZ 3.82Å; Q727-F761 HydrophobicContact CG-CE1 4.44Å; Q727-F761 HydrophobicContact CG-CE2 4.22Å; Q727-F761 HydrophobicContact CG-CZ 3.73Å; I730-F761 HydrophobicContact CB-CE1 4.17Å; I730-F761 HydrophobicContact CD1-CD1 4.03Å; I730-F761 HydrophobicContact CD1-CE1 3.75Å; I730-F761 HydrophobicContact CG1-CE1 4.44Å; I730-F761 HydrophobicContact CG2-CE1 4.36Å; Q757-F761 WeakPolarHBondContact O-CB 3.42Å; Q757-F761 PolarHBondContact O-N 2.69Å; L758-F761 HydrophobicContact CD1-CD1 4.42Å; L758-F761 PolarHBondContact O-N 3.2Å; V759-F761 VanDerWaalsContact C-N 3.33Å; V759-F761 PolarHBondContact O-N 3.04Å; F761-L763 PolarHBondContact O-N 3.02Å; F761-S764 WeakPolarHBondContact CA-OG 2.99Å; F761-S764 PolarHBondContact O-N 3.38Å; F761-S764 PolarHBondContact O-OG 3.18Å; F761-H765 AromaticContact CD2-CE1 3.53Å; F761-H765 AromaticContact CD2-ND1 3.83Å; F761-H765 AromaticContact CE1-CE1 3.95Å; F761-H765 AromaticContact CE1-ND1 3.9Å; F761-H765 AromaticContact CE2-CE1 3.09Å; F761-H765 WeakPolarHBondContact CE2-CE1 3.1Å; F761-H765 AromaticContact CE2-ND1 3.73Å; F761-H765 AromaticContact CE2-NE2 3.73Å; F761-H765 AromaticContact CG-ND1 3.96Å; F761-H765 AromaticContact CZ-CE1 3.31Å; F761-H765 WeakPolarHBondContact CZ-CE1 3.42Å; F761-H765 AromaticContact CZ-ND1 3.74Å; F761-H765 AromaticContact CZ-NE2 3.59Å; F761-H765 PolarHBondContact O-N 3.27Å; F761-H765 VanDerWaalsContact O-N 3.08Å; F761-H765 PolarHBondContact O-ND1 2.82Å
762	L	93.4	Very high	90.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.2	-47.6	176.9	-75.9	167	0	0	0	111.5	L714 I730 A736 P746 L747 A750 L758 V759 S764 H765 G766 A767	L714-L762 HydrophobicContact CD1-CD2 4.43Å; L714-L762 HydrophobicContact CD2-CD2 4.02Å; L714-L762 HydrophobicContact CG-CD2 4.36Å; I730-L762 HydrophobicContact CD1-CD2 3.75Å; A736-L762 HydrophobicContact CB-CD2 4.25Å; P746-L762 HydrophobicContact CB-CD1 4.23Å; P746-L762 HydrophobicContact CB-CD2 4.29Å; L747-L762 HydrophobicContact CD1-CB 4.1Å; L747-L762 HydrophobicContact CD1-CD1 4.35Å; A750-L762 HydrophobicContact CB-CD1 4.01Å; L758-L762 HydrophobicContact CD2-CD1 4.26Å; L758-L762 HydrophobicContact CG-CD1 4.09Å; L758-L762 HydrophobicContact CG-CG 4.28Å; L758-L762 VanDerWaalsContact O-CB 3.28Å; L758-L762 WeakPolarHBondContact O-CB 3.38Å; L758-L762 WeakPolarHBondContact O-CG 3.2Å; L758-L762 PolarHBondContact O-N 2.95Å; V759-L762 PolarHBondContact O-N 3.36Å; L762-S764 VanDerWaalsContact C-N 3.35Å; L762-S764 PolarHBondContact O-N 2.7Å; L762-H765 CarbonylContact O-C 3.45Å; L762-H765 PolarHBondContact O-N 2.93Å; L762-G766 PolarHBondContact O-N 3.32Å; L762-A767 VanDerWaalsContact C-CB 3.43Å; L762-A767 HydrophobicContact CB-CB 3.75Å; L762-A767 WeakPolarHBondContact O-CB 3.5Å; L762-A767 PolarHBondContact O-N 3.01Å
763	L	90.1	Very high	90.7	Very high	32 Å²	32	49.1 Å²	49.1	17%	0.168	26%	0.26	C	S	.	.	H	α-helix	trans	-59.3	-44.8	177	-70.5	168.8	0	0	0	111.7	L747 V759 S760 F761 H765 G766 P769 L791 L792 A795	L747-L763 HydrophobicContact CD1-CD2 4.33Å; L747-L763 HydrophobicContact CD1-CG 4.18Å; L747-L763 HydrophobicContact CD2-CD2 3.76Å; L747-L763 HydrophobicContact CD2-CG 4.49Å; V759-L763 HydrophobicContact CG1-CD1 3.9Å; V759-L763 HydrophobicContact CG1-CG 4.49Å; V759-L763 WeakPolarHBondContact O-CB 3.42Å; V759-L763 VanDerWaalsContact O-CG 3.24Å; V759-L763 WeakPolarHBondContact O-CG 3.14Å; V759-L763 PolarHBondContact O-N 3.47Å; S760-L763 PolarHBondContact O-N 3.19Å; F761-L763 PolarHBondContact O-N 3.02Å; L763-H765 PolarHBondContact O-N 2.67Å; L763-G766 PolarHBondContact O-N 3.24Å; L763-G766 VanDerWaalsContact O-N 3.17Å; L763-P769 HydrophobicContact CD2-CB 4.04Å; L763-P769 HydrophobicContact CD2-CG 4.13Å; L763-L791 HydrophobicContact CD1-CD2 4.27Å; L763-L791 HydrophobicContact CD1-CG 3.99Å; L763-L792 HydrophobicContact CD1-CD2 4.26Å; L763-L792 HydrophobicContact CD2-CD2 4.44Å; L763-A795 HydrophobicContact CD1-CB 3.95Å; L763-A795 HydrophobicContact CD2-CB 3.9Å; L763-A795 HydrophobicContact CG-CB 4.47Å
764	S	88.6	Confident	90.6	Very high	85 Å²	85	51 Å²	51	59%	0.594	27%	0.27	S	S	*	.	H	α-helix	trans	-65.5	-18.2	176.9	68	0	0	0	0	113.9	S760 F761 L762	S760-S764 PolarHBondContact O-N 3.03Å; S760-S764 PolarHBondContact O-OG 3.35Å; F761-S764 WeakPolarHBondContact CA-OG 2.99Å; F761-S764 PolarHBondContact O-N 3.38Å; F761-S764 PolarHBondContact O-OG 3.18Å; L762-S764 VanDerWaalsContact C-N 3.35Å; L762-S764 PolarHBondContact O-N 2.7Å
765	H	90.5	Very high	90.6	Very high	91 Å²	91	55.5 Å²	55.5	42%	0.421	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	24.6	177.3	-65	74.4	0	0	0	112.5	I730 F761 L762 L763	I730-H765 HydrophobicContact CD1-CB 4.26Å; I730-H765 HydrophobicContact CG2-CB 4.02Å; F761-H765 AromaticContact CD2-CE1 3.53Å; F761-H765 AromaticContact CD2-ND1 3.83Å; F761-H765 AromaticContact CE1-CE1 3.95Å; F761-H765 AromaticContact CE1-ND1 3.9Å; F761-H765 AromaticContact CE2-CE1 3.09Å; F761-H765 WeakPolarHBondContact CE2-CE1 3.1Å; F761-H765 AromaticContact CE2-ND1 3.73Å; F761-H765 AromaticContact CE2-NE2 3.73Å; F761-H765 AromaticContact CG-ND1 3.96Å; F761-H765 AromaticContact CZ-CE1 3.31Å; F761-H765 WeakPolarHBondContact CZ-CE1 3.42Å; F761-H765 AromaticContact CZ-ND1 3.74Å; F761-H765 AromaticContact CZ-NE2 3.59Å; F761-H765 PolarHBondContact O-N 3.27Å; F761-H765 VanDerWaalsContact O-N 3.08Å; F761-H765 PolarHBondContact O-ND1 2.82Å; L762-H765 CarbonylContact O-C 3.45Å; L762-H765 PolarHBondContact O-N 2.93Å; L763-H765 PolarHBondContact O-N 2.67Å
766	G	86.7	Confident	90.4	Very high	51 Å²	51	56.5 Å²	56.5	53%	0.526	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	16.9	169.4	0	0	0	0	0	115.4	N737 L762 L763 D768	N737-G766 PolarHBondContact ND2-O 3Å; L762-G766 PolarHBondContact O-N 3.32Å; L763-G766 PolarHBondContact O-N 3.24Å; L763-G766 VanDerWaalsContact O-N 3.17Å; G766-D768 PolarHBondContact O-N 2.75Å
767	A	92.9	Very high	90.6	Very high	5 Å²	5	55.6 Å²	55.6	4%	0.041	30%	0.298	C	S	.	.			trans	-65.4	128.2	168.5	0	0	0	0	0	110.3	A736 N737 L747 L762 P769	A736-A767 HydrophobicContact CB-CB 4.19Å; N737-A767 VanDerWaalsContact OD1-CA 3.26Å; N737-A767 WeakPolarHBondContact OD1-CA 3.4Å; L747-A767 HydrophobicContact CB-CB 4.25Å; L747-A767 HydrophobicContact CD2-CB 4Å; L762-A767 VanDerWaalsContact C-CB 3.43Å; L762-A767 HydrophobicContact CB-CB 3.75Å; L762-A767 WeakPolarHBondContact O-CB 3.5Å; L762-A767 PolarHBondContact O-N 3.01Å; A767-P769 WeakPolarHBondContact O-CD 3.27Å
768	D	89.7	Confident	90.9	Very high	59 Å²	59	49.7 Å²	49.7	32%	0.316	27%	0.271	S	S	.	.			trans	-88	114.3	-176.7	-179	-5	0	0	0	110.2	N737 G766 T770 I771	N737-D768 PolarHBondContact OD1-N 3.35Å; G766-D768 PolarHBondContact O-N 2.75Å; D768-T770 VanDerWaalsContact CG-OG1 3.32Å; D768-T770 PolarHBondContact O-N 2.82Å; D768-T770 WeakPolarHBondContact OD1-CA 3.43Å; D768-T770 WeakPolarHBondContact OD1-CB 3.37Å; D768-T770 PolarHBondContact OD1-N 3.06Å; D768-T770 PolarHBondContact OD1-OG1 2.96Å; D768-T770 PolarHBondContact OD2-OG1 3.19Å; D768-I771 HydrophobicContact CB-CD1 3.81Å; D768-I771 HydrophobicContact CB-CG1 3.89Å
769	P	91	Very high	91	Very high	13 Å²	13	49.6 Å²	49.6	8%	0.084	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-0.5	179.4	32.5	-36	0	0	0	113.9	L747 L763 A767 P779 L792 A795 M796	L747-P769 HydrophobicContact CD2-CB 4.11Å; L763-P769 HydrophobicContact CD2-CB 4.04Å; L763-P769 HydrophobicContact CD2-CG 4.13Å; A767-P769 WeakPolarHBondContact O-CD 3.27Å; P769-P779 WeakPolarHBondContact O-CD 3.42Å; P769-L792 HydrophobicContact CB-CD2 4.19Å; P769-A795 HydrophobicContact CG-CB 4.23Å; P769-M796 HydrophobicContact CB-CG 3.85Å; P769-M796 HydrophobicContact CG-CG 3.76Å
770	T	88.6	Confident	91	Very high	36 Å²	36	50.8 Å²	50.8	22%	0.221	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-8.6	-176.6	72.9	0	0	0	0	114.1	D768 R772 M796 Y800	D768-T770 VanDerWaalsContact CG-OG1 3.32Å; D768-T770 PolarHBondContact O-N 2.82Å; D768-T770 WeakPolarHBondContact OD1-CA 3.43Å; D768-T770 WeakPolarHBondContact OD1-CB 3.37Å; D768-T770 PolarHBondContact OD1-N 3.06Å; D768-T770 PolarHBondContact OD1-OG1 2.96Å; D768-T770 PolarHBondContact OD2-OG1 3.19Å; T770-R772 PolarHBondContact O-N 2.96Å; T770-M796 HydrophobicContact CG2-CE 4.06Å; T770-Y800 HydrophobicContact CG2-CE2 4.41Å
771	I	91.4	Very high	91.1	Very high	26 Å²	26	52.6 Å²	52.6	13%	0.133	28%	0.282	C	S	.	.			trans	-60.4	135.6	177.2	-66.9	174.8	0	0	0	109.6	N737 Q739 T745 H748 D768	N737-I771 HydrophobicContact CB-CD1 3.83Å; Q739-I771 HydrophobicContact CG-CG2 4.48Å; T745-I771 HydrophobicContact CG2-CB 4.34Å; T745-I771 HydrophobicContact CG2-CD1 4.02Å; T745-I771 HydrophobicContact CG2-CG2 3.79Å; H748-I771 PolarHBondContact CE1-O 3.22Å; H748-I771 PolarHBondContact NE2-O 2.81Å; D768-I771 HydrophobicContact CB-CD1 3.81Å; D768-I771 HydrophobicContact CB-CG1 3.89Å
772	R	91.5	Very high	91.1	Very high	120 Å²	120	52.3 Å²	52.3	45%	0.453	28%	0.282	S	S	.	.			trans	-105	136.9	176.5	-66.8	179.2	-175.6	-83.8	-5	110.9	T770 N776 Q777 I778	T770-R772 PolarHBondContact O-N 2.96Å; R772-N776 PolarHBondContact NH1-O 2.79Å; R772-Q777 WeakPolarHBondContact CA-O 3.38Å; R772-I778 HydrophobicContact CG-CG2 3.66Å
773	N	92.2	Very high	91	Very high	5 Å²	5	52.4 Å²	52.4	3%	0.027	28%	0.282	C	S	.	.			trans	-74.4	179.9	167.7	71.9	2.6	0	0	0	111.5	G743 F744 D775 N776 Q777	G743-N773 WeakPolarHBondContact O-CA 3.43Å; F744-N773 HydrophobicContact CD2-CB 3.89Å; F744-N773 HydrophobicContact CE2-CB 3.96Å; F744-N773 WeakPolarHBondContact CE2-ND2 3.2Å; F744-N773 HydrophobicContact CG-CB 4.44Å; F744-N773 WeakPolarHBondContact CZ-ND2 3.26Å; N773-D775 PolarHBondContact O-N 2.8Å; N773-D775 WeakPolarHBondContact OD1-CA 3.38Å; N773-D775 PolarHBondContact OD1-N 2.89Å; N773-D775 VanDerWaalsContact OD1-N 3.07Å; N773-N776 WeakPolarHBondContact O-CA 3.35Å; N773-N776 PolarHBondContact O-N 2.84Å; N773-N776 PolarHBondContact OD1-N 2.9Å; N773-Q777 PolarHBondContact N-O 3.39Å; N773-Q777 PolarHBondContact ND2-OE1 2.93Å; N773-Q777 WeakPolarHBondContact OD1-CB 3.49Å; N773-Q777 PolarHBondContact OD1-N 3.16Å; N773-Q777 PolarHBondContact OD1-O 3.49Å
774	H	90.5	Very high	90.8	Very high	133 Å²	133	55.8 Å²	55.8	62%	0.616	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-22.4	179.4	-74.2	73.9	0	0	0	113.6	L741 W742 G743 N776	L741-H774 PolarHBondContact O-CE1 3.23Å; W742-H774 PolarHBondContact O-N 3.45Å; W742-H774 PolarHBondContact O-ND1 3.14Å; G743-H774 PolarHBondContact N-ND1 3.38Å; G743-H774 VanDerWaalsContact N-ND1 3.15Å; H774-N776 PolarHBondContact O-N 3.45Å
775	D	90	Very high	90.7	Very high	118 Å²	118	53 Å²	53	63%	0.631	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	10.5	172.8	-64.7	-39.5	0	0	0	112.7	N773 Q777	N773-D775 PolarHBondContact O-N 2.8Å; N773-D775 WeakPolarHBondContact OD1-CA 3.38Å; N773-D775 PolarHBondContact OD1-N 2.89Å; N773-D775 VanDerWaalsContact OD1-N 3.07Å; D775-Q777 HydrophobicContact CB-CG 4.23Å; D775-Q777 PolarHBondContact O-N 2.75Å
776	N	89.4	Confident	90.6	Very high	113 Å²	113	54.6 Å²	54.6	60%	0.604	29%	0.294	S	S	*	.	S	Bend	trans	61.1	19.4	-177	-75.4	-54.8	0	0	0	115.4	R772 N773 H774	R772-N776 PolarHBondContact NH1-O 2.79Å; N773-N776 WeakPolarHBondContact O-CA 3.35Å; N773-N776 PolarHBondContact O-N 2.84Å; N773-N776 PolarHBondContact OD1-N 2.9Å; H774-N776 PolarHBondContact O-N 3.45Å
777	Q	94.2	Very high	90.5	Very high	65 Å²	65	56 Å²	56	30%	0.304	29%	0.289	S	S	.	.			trans	-90.6	139.7	179.6	-61.2	169	-32.8	0	0	110.7	H748 R772 N773 D775 D781 L782	H748-Q777 PolarHBondContact NE2-O 3.29Å; R772-Q777 WeakPolarHBondContact CA-O 3.38Å; N773-Q777 PolarHBondContact N-O 3.39Å; N773-Q777 PolarHBondContact ND2-OE1 2.93Å; N773-Q777 WeakPolarHBondContact OD1-CB 3.49Å; N773-Q777 PolarHBondContact OD1-N 3.16Å; N773-Q777 PolarHBondContact OD1-O 3.49Å; D775-Q777 HydrophobicContact CB-CG 4.23Å; D775-Q777 PolarHBondContact O-N 2.75Å; Q777-D781 WeakPolarHBondContact CA-OD2 3.48Å; Q777-D781 HydrophobicContact CB-CB 4.18Å; Q777-L782 HydrophobicContact CB-CG 4.41Å; Q777-L782 VanDerWaalsContact OE1-CD2 3.32Å
778	I	94.2	Very high	90.2	Very high	13 Å²	13	55.7 Å²	55.7	7%	0.067	29%	0.287	C	S	.	.			trans	-93.1	165.7	168.4	57.4	166.3	0	0	0	110.6	R772 L780 D781 L782 M796	R772-I778 HydrophobicContact CG-CG2 3.66Å; I778-L780 HydrophobicContact CD1-CB 3.85Å; I778-L780 HydrophobicContact CD1-CD2 4.48Å; I778-L780 HydrophobicContact CG1-CB 4.15Å; I778-L780 PolarHBondContact O-N 3.34Å; I778-L780 VanDerWaalsContact O-N 3.08Å; I778-D781 HydrophobicContact CG1-CB 4.42Å; I778-D781 VanDerWaalsContact CG1-OD2 3.25Å; I778-D781 WeakPolarHBondContact CG1-OD2 3.4Å; I778-D781 PolarHBondContact N-OD2 3.29Å; I778-D781 WeakPolarHBondContact O-CB 3.26Å; I778-D781 PolarHBondContact O-N 2.8Å; I778-L782 PolarHBondContact O-N 3.02Å; I778-M796 HydrophobicContact CD1-CE 3.44Å; I778-M796 VanDerWaalsContact CD1-CE 3.44Å; I778-M796 HydrophobicContact CD1-SD 3.96Å
779	P	93	Very high	90.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-54.4	-32.6	178.5	-27.3	35.5	0	0	0	114	L747 H748 S751 P769 L782 A783 L792	L747-P779 HydrophobicContact CB-CG 4.4Å; L747-P779 HydrophobicContact CD2-CB 4.45Å; L747-P779 HydrophobicContact CD2-CG 4.09Å; L747-P779 HydrophobicContact CG-CB 4.11Å; L747-P779 HydrophobicContact CG-CG 4.04Å; H748-P779 WeakPolarHBondContact NE2-CD 3.43Å; S751-P779 VanDerWaalsContact CB-O 3.31Å; S751-P779 WeakPolarHBondContact CB-O 3.07Å; S751-P779 WeakPolarHBondContact OG-CB 3.37Å; P769-P779 WeakPolarHBondContact O-CD 3.42Å; P779-L782 PolarHBondContact O-N 3.27Å; P779-A783 PolarHBondContact O-N 3.08Å; P779-L792 HydrophobicContact CB-CD1 4.24Å; P779-L792 HydrophobicContact CB-CD2 4.27Å
780	L	91	Very high	90	Very high	25 Å²	25	60.5 Å²	60.5	13%	0.131	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-35.3	176.9	178.6	61.6	0	0	0	113	I778 L782 A783 R789 L792 Q793 M796	I778-L780 HydrophobicContact CD1-CB 3.85Å; I778-L780 HydrophobicContact CD1-CD2 4.48Å; I778-L780 HydrophobicContact CG1-CB 4.15Å; I778-L780 PolarHBondContact O-N 3.34Å; I778-L780 VanDerWaalsContact O-N 3.08Å; L780-L782 PolarHBondContact O-N 3.28Å; L780-A783 WeakPolarHBondContact O-CB 3.16Å; L780-A783 PolarHBondContact O-N 3.47Å; L780-R789 HydrophobicContact CD1-CB 4Å; L780-R789 HydrophobicContact CD1-CG 4.08Å; L780-R789 WeakPolarHBondContact CD1-O 3.24Å; L780-L792 HydrophobicContact CB-CB 4.3Å; L780-L792 HydrophobicContact CB-CD1 4.37Å; L780-L792 HydrophobicContact CD1-CB 4.08Å; L780-Q793 HydrophobicContact CD1-CG 3.89Å; L780-Q793 HydrophobicContact CD2-CG 3.67Å; L780-Q793 HydrophobicContact CG-CG 4.47Å; L780-M796 HydrophobicContact CB-SD 4.48Å; L780-M796 HydrophobicContact CD2-SD 4.16Å
781	D	92.3	Very high	89.8	Confident	88 Å²	88	60.7 Å²	60.7	47%	0.471	30%	0.304	S	S	.	.	H	α-helix	trans	-67	-33.3	179	-62.4	-32.4	0	0	0	111	Q777 I778	Q777-D781 WeakPolarHBondContact CA-OD2 3.48Å; Q777-D781 HydrophobicContact CB-CB 4.18Å; I778-D781 HydrophobicContact CG1-CB 4.42Å; I778-D781 VanDerWaalsContact CG1-OD2 3.25Å; I778-D781 WeakPolarHBondContact CG1-OD2 3.4Å; I778-D781 PolarHBondContact N-OD2 3.29Å; I778-D781 WeakPolarHBondContact O-CB 3.26Å; I778-D781 PolarHBondContact O-N 2.8Å
782	L	92.3	Very high	89.6	Confident	21 Å²	21	59.5 Å²	59.5	11%	0.11	30%	0.298	C	S	.	.	H	α-helix	trans	-84.7	-17	178.5	-64.3	-177.4	0	0	0	113.6	F744 H748 Q752 Q777 I778 P779 L780 T784	F744-L782 HydrophobicContact CD1-CD1 4.14Å; F744-L782 HydrophobicContact CE1-CD1 3.45Å; F744-L782 VanDerWaalsContact CE1-CD1 3.45Å; F744-L782 HydrophobicContact CZ-CD1 4.18Å; H748-L782 HydrophobicContact CB-CD1 4.12Å; Q752-L782 WeakPolarHBondContact CA-O 3.41Å; Q752-L782 HydrophobicContact CB-CB 4.12Å; Q752-L782 HydrophobicContact CG-CB 4.32Å; Q777-L782 HydrophobicContact CB-CG 4.41Å; Q777-L782 VanDerWaalsContact OE1-CD2 3.32Å; I778-L782 PolarHBondContact O-N 3.02Å; P779-L782 PolarHBondContact O-N 3.27Å; L780-L782 PolarHBondContact O-N 3.28Å; L782-T784 PolarHBondContact O-N 3.35Å; L782-T784 VanDerWaalsContact O-N 3.16Å
783	A	91.3	Very high	89.2	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.008	29%	0.294	C	S	.	.			trans	-60.3	119.1	-173.5	0	0	0	0	0	111.4	S751 P779 L780 V788 R789 L792	S751-A783 WeakPolarHBondContact O-CA 3.49Å; P779-A783 PolarHBondContact O-N 3.08Å; L780-A783 WeakPolarHBondContact O-CB 3.16Å; L780-A783 PolarHBondContact O-N 3.47Å; A783-V788 HydrophobicContact CB-CG1 3.98Å; A783-R789 HydrophobicContact CB-CG 3.55Å; A783-R789 VanDerWaalsContact O-CZ 3.32Å; A783-R789 PolarHBondContact O-NE 3.34Å; A783-R789 PolarHBondContact O-NH2 3.44Å; A783-L792 HydrophobicContact CB-CD1 4.02Å
784	T	86.5	Confident	88.6	Confident	104 Å²	104	62.5 Å²	62.5	64%	0.638	32%	0.32	S	S	*	.			trans	-93.6	-24.1	-178.9	54.8	0	0	0	0	112.9	Q752 L782	Q752-T784 VanDerWaalsContact O-CG2 3.23Å; Q752-T784 WeakPolarHBondContact O-CG2 3.42Å; Q752-T784 PolarHBondContact O-OG1 3.35Å; L782-T784 PolarHBondContact O-N 3.35Å; L782-T784 VanDerWaalsContact O-N 3.16Å
785	A	86.6	Confident	88.2	Confident	25 Å²	25	58.4 Å²	58.4	21%	0.207	31%	0.309	C	S	.	.	S	Bend	trans	-100.3	136.5	179.9	0	0	0	0	0	111.2	D787 V788 R789	A785-D787 WeakPolarHBondContact CB-OD1 3.47Å; A785-V788 HydrophobicContact CB-CB 4.26Å; A785-V788 HydrophobicContact CB-CG2 4.11Å; A785-V788 WeakPolarHBondContact O-CB 3.33Å; A785-V788 PolarHBondContact O-N 2.73Å; A785-R789 PolarHBondContact O-N 3.2Å
786	E	86.4	Confident	87.6	Confident	125 Å²	125	53.2 Å²	53.2	58%	0.584	28%	0.281	S	S	*	.	H	α-helix	trans	-69	-37.8	-172.2	-172.1	60.1	-162.5	0	0	113	V788 R789 I790	E786-V788 VanDerWaalsContact C-N 3.32Å; E786-V788 PolarHBondContact O-N 3.03Å; E786-R789 WeakPolarHBondContact O-CB 3.09Å; E786-R789 PolarHBondContact O-N 3.05Å; E786-R789 WeakPolarHBondContact OE2-CD 3.41Å; E786-I790 HydrophobicContact CG-CD1 4.21Å; E786-I790 VanDerWaalsContact O-CG1 3.31Å; E786-I790 WeakPolarHBondContact O-CG1 3.47Å; E786-I790 PolarHBondContact O-N 3.08Å
787	D	85.2	Confident	86.1	Confident	80 Å²	80	51.4 Å²	51.4	43%	0.428	28%	0.276	S	S	.	.	H	α-helix	trans	-61.1	-40.8	173.7	55.7	-13	0	0	0	112.2	F756 A785 L791	F756-D787 HydrophobicContact CD2-CB 3.85Å; F756-D787 HydrophobicContact CE2-CB 4.09Å; A785-D787 WeakPolarHBondContact CB-OD1 3.47Å; D787-L791 VanDerWaalsContact O-CB 3.31Å; D787-L791 WeakPolarHBondContact O-CB 3.28Å; D787-L791 PolarHBondContact O-N 2.78Å
788	V	87.6	Confident	84.3	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-41.6	172.9	171.9	0	0	0	0	111.2	F756 V759 A783 A785 E786 L791 L792	F756-V788 HydrophobicContact CB-CG2 4.05Å; F756-V788 HydrophobicContact CD2-CG2 4.29Å; V759-V788 HydrophobicContact CG1-CG1 4.3Å; V759-V788 HydrophobicContact CG2-CG1 4.06Å; V759-V788 HydrophobicContact CG2-CG2 4.43Å; A783-V788 HydrophobicContact CB-CG1 3.98Å; A785-V788 HydrophobicContact CB-CB 4.26Å; A785-V788 HydrophobicContact CB-CG2 4.11Å; A785-V788 WeakPolarHBondContact O-CB 3.33Å; A785-V788 PolarHBondContact O-N 2.73Å; E786-V788 VanDerWaalsContact C-N 3.32Å; E786-V788 PolarHBondContact O-N 3.03Å; V788-L791 PolarHBondContact O-N 2.69Å; V788-L792 HydrophobicContact CG1-CD1 3.76Å; V788-L792 HydrophobicContact CG1-CG 4.36Å; V788-L792 WeakPolarHBondContact O-CB 3.44Å; V788-L792 VanDerWaalsContact O-CG 3.3Å; V788-L792 WeakPolarHBondContact O-CG 3.3Å; V788-L792 PolarHBondContact O-N 2.98Å
789	R	89.8	Confident	82.4	Confident	91 Å²	91	58.1 Å²	58.1	34%	0.343	32%	0.322	S	S	.	.	H	α-helix	trans	-58.2	-50.5	175.3	-76.6	177	169.7	-110.6	-14.3	111.5	L780 A783 A785 E786 L791 L792 Q793	L780-R789 HydrophobicContact CD1-CB 4Å; L780-R789 HydrophobicContact CD1-CG 4.08Å; L780-R789 WeakPolarHBondContact CD1-O 3.24Å; A783-R789 HydrophobicContact CB-CG 3.55Å; A783-R789 VanDerWaalsContact O-CZ 3.32Å; A783-R789 PolarHBondContact O-NE 3.34Å; A783-R789 PolarHBondContact O-NH2 3.44Å; A785-R789 PolarHBondContact O-N 3.2Å; E786-R789 WeakPolarHBondContact O-CB 3.09Å; E786-R789 PolarHBondContact O-N 3.05Å; E786-R789 WeakPolarHBondContact OE2-CD 3.41Å; R789-L791 VanDerWaalsContact C-N 3.35Å; R789-L791 PolarHBondContact O-N 3.3Å; R789-L792 PolarHBondContact O-N 3.42Å; R789-Q793 VanDerWaalsContact O-CG 3.3Å; R789-Q793 WeakPolarHBondContact O-CG 3.48Å; R789-Q793 PolarHBondContact O-N 3.37Å
790	I	86.1	Confident	80.2	Confident	81 Å²	81	63.7 Å²	63.7	42%	0.415	34%	0.344	S	S	.	.	H	α-helix	trans	-59.4	-47.5	178.8	-65.8	164.4	0	0	0	110.1	E786 L792 Q793 D794	E786-I790 HydrophobicContact CG-CD1 4.21Å; E786-I790 VanDerWaalsContact O-CG1 3.31Å; E786-I790 WeakPolarHBondContact O-CG1 3.47Å; E786-I790 PolarHBondContact O-N 3.08Å; I790-L792 VanDerWaalsContact C-N 3.35Å; I790-L792 PolarHBondContact O-N 3.45Å; I790-Q793 PolarHBondContact O-N 2.78Å; I790-D794 PolarHBondContact O-N 3.29Å
791	L	83.7	Confident	78	Confident	40 Å²	40	68.9 Å²	68.9	21%	0.209	36%	0.362	C	S	.	.	H	α-helix	trans	-59	-43.2	179.2	-179.1	65.1	0	0	0	112.7	F756 V759 L763 D787 V788 R789 D794 A795	F756-L791 HydrophobicContact CD2-CD2 4.11Å; F756-L791 HydrophobicContact CE2-CB 4.16Å; F756-L791 HydrophobicContact CE2-CD2 3.81Å; F756-L791 HydrophobicContact CE2-CG 4.47Å; F756-L791 HydrophobicContact CZ-CD2 4.22Å; V759-L791 HydrophobicContact CB-CD2 4.29Å; V759-L791 HydrophobicContact CG1-CD2 3.79Å; L763-L791 HydrophobicContact CD1-CD2 4.27Å; L763-L791 HydrophobicContact CD1-CG 3.99Å; D787-L791 VanDerWaalsContact O-CB 3.31Å; D787-L791 WeakPolarHBondContact O-CB 3.28Å; D787-L791 PolarHBondContact O-N 2.78Å; V788-L791 PolarHBondContact O-N 2.69Å; R789-L791 VanDerWaalsContact C-N 3.35Å; R789-L791 PolarHBondContact O-N 3.3Å; L791-D794 PolarHBondContact O-N 3.2Å; L791-A795 PolarHBondContact O-N 2.93Å; L791-A795 VanDerWaalsContact O-N 3.1Å
792	L	87.3	Confident	75.5	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-68.4	-40.9	177.4	-71.1	166.4	0	0	0	111.9	L747 S751 V759 L763 P769 P779 L780 A783 V788 R789 I790 D794 A795 M796	L747-L792 HydrophobicContact CD1-CD2 4.3Å; L747-L792 HydrophobicContact CD2-CD2 4.26Å; L747-L792 HydrophobicContact CG-CD2 4.38Å; S751-L792 WeakPolarHBondContact OG-CD1 3.47Å; V759-L792 HydrophobicContact CG1-CD2 4.03Å; V759-L792 HydrophobicContact CG1-CG 4.24Å; L763-L792 HydrophobicContact CD1-CD2 4.26Å; L763-L792 HydrophobicContact CD2-CD2 4.44Å; P769-L792 HydrophobicContact CB-CD2 4.19Å; P779-L792 HydrophobicContact CB-CD1 4.24Å; P779-L792 HydrophobicContact CB-CD2 4.27Å; L780-L792 HydrophobicContact CB-CB 4.3Å; L780-L792 HydrophobicContact CB-CD1 4.37Å; L780-L792 HydrophobicContact CD1-CB 4.08Å; A783-L792 HydrophobicContact CB-CD1 4.02Å; V788-L792 HydrophobicContact CG1-CD1 3.76Å; V788-L792 HydrophobicContact CG1-CG 4.36Å; V788-L792 WeakPolarHBondContact O-CB 3.44Å; V788-L792 VanDerWaalsContact O-CG 3.3Å; V788-L792 WeakPolarHBondContact O-CG 3.3Å; V788-L792 PolarHBondContact O-N 2.98Å; R789-L792 PolarHBondContact O-N 3.42Å; I790-L792 VanDerWaalsContact C-N 3.35Å; I790-L792 PolarHBondContact O-N 3.45Å; L792-D794 PolarHBondContact O-N 2.97Å; L792-A795 PolarHBondContact O-N 3.03Å; L792-M796 VanDerWaalsContact O-CG 3.28Å; L792-M796 WeakPolarHBondContact O-CG 3.31Å; L792-M796 PolarHBondContact O-N 3.36Å
793	Q	84	Confident	72.6	Confident	82 Å²	82	72.8 Å²	72.8	38%	0.383	41%	0.408	S	S	.	.	H	α-helix	trans	-61.2	-33.1	175	-73.7	171.6	-3.7	0	0	112.8	L780 R789 I790 R801	L780-Q793 HydrophobicContact CD1-CG 3.89Å; L780-Q793 HydrophobicContact CD2-CG 3.67Å; L780-Q793 HydrophobicContact CG-CG 4.47Å; R789-Q793 VanDerWaalsContact O-CG 3.3Å; R789-Q793 WeakPolarHBondContact O-CG 3.48Å; R789-Q793 PolarHBondContact O-N 3.37Å; I790-Q793 PolarHBondContact O-N 2.78Å; Q793-R801 PolarHBondContact O-NE 2.71Å; Q793-R801 PolarHBondContact O-NH2 3.43Å
794	D	79.9	Confident	69.6	Low	106 Å²	106	77.2 Å²	77.2	57%	0.567	44%	0.439	S	S	*	.	H	α-helix	trans	-75.6	-31.1	175.9	-77.7	-21.1	0	0	0	113.4	I790 L791 L792 M796 R801	I790-D794 PolarHBondContact O-N 3.29Å; L791-D794 PolarHBondContact O-N 3.2Å; L792-D794 PolarHBondContact O-N 2.97Å; D794-M796 VanDerWaalsContact C-N 3.35Å; D794-R801 IonicContact OD1-CZ 2.82Å; D794-R801 IonicContact OD1-NH2 3.58Å; D794-R801 PolarHBondContact OD1-NH2 2.97Å
795	A	80.4	Confident	66.8	Low	47 Å²	47	77.3 Å²	77.3	39%	0.388	44%	0.444	S	S	.	.	H	α-helix	trans	-76.8	-18.4	176	0	0	0	0	0	114	L763 P769 L791 L792	L763-A795 HydrophobicContact CD1-CB 3.95Å; L763-A795 HydrophobicContact CD2-CB 3.9Å; L763-A795 HydrophobicContact CG-CB 4.47Å; P769-A795 HydrophobicContact CG-CB 4.23Å; L791-A795 PolarHBondContact O-N 2.93Å; L791-A795 VanDerWaalsContact O-N 3.1Å; L792-A795 PolarHBondContact O-N 3.03Å
796	M	77.3	Confident	64.2	Low	9 Å²	9	82 Å²	82	4%	0.044	47%	0.472	C	S	.	.	S	Bend	trans	-90.2	142	-176.5	-69.3	176.5	84.1	0	0	113.2	P769 T770 I778 L780 L792 D794 Y800	P769-M796 HydrophobicContact CB-CG 3.85Å; P769-M796 HydrophobicContact CG-CG 3.76Å; T770-M796 HydrophobicContact CG2-CE 4.06Å; I778-M796 HydrophobicContact CD1-CE 3.44Å; I778-M796 VanDerWaalsContact CD1-CE 3.44Å; I778-M796 HydrophobicContact CD1-SD 3.96Å; L780-M796 HydrophobicContact CB-SD 4.48Å; L780-M796 HydrophobicContact CD2-SD 4.16Å; L792-M796 VanDerWaalsContact O-CG 3.28Å; L792-M796 WeakPolarHBondContact O-CG 3.31Å; L792-M796 PolarHBondContact O-N 3.36Å; D794-M796 VanDerWaalsContact C-N 3.35Å; M796-Y800 HydrophobicContact CE-CD1 4.14Å; M796-Y800 HydrophobicContact CE-CD2 4.47Å; M796-Y800 HydrophobicContact CE-CG 3.84Å
797	P	58.5	Low	61.5	Low	75 Å²	75	81.6 Å²	81.6	49%	0.487	48%	0.478	S	S	.	.			trans	-57.2	145.1	171.5	-22.4	32	0	0	0	112.4	T799 Y800	P797-T799 PolarHBondContact O-N 3.2Å; P797-Y800 PolarHBondContact O-N 2.89Å
798	T	56.5	Low	58.8	Low	109 Å²	109	82.1 Å²	82.1	67%	0.669	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-53.7	-24	-171.1	-7.7	0	0	0	0	114.6	Y800 R801	T798-Y800 PolarHBondContact O-N 3.14Å; T798-R801 PolarHBondContact O-N 3.31Å
799	T	55.1	Low	55.9	Low	111 Å²	111	89.3 Å²	89.3	68%	0.681	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-63.2	-18.1	177.5	48.6	0	0	0	0	114.3	P797	P797-T799 PolarHBondContact O-N 3.2Å
800	Y	46.1	Very low	53	Low	116 Å²	116	90.1 Å²	90.1	46%	0.455	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-99.5	-4.9	178.6	-65.4	-88.5	0	0	0	113.7	T770 M796 P797 T798 T802	T770-Y800 HydrophobicContact CG2-CE2 4.41Å; M796-Y800 HydrophobicContact CE-CD1 4.14Å; M796-Y800 HydrophobicContact CE-CD2 4.47Å; M796-Y800 HydrophobicContact CE-CG 3.84Å; P797-Y800 PolarHBondContact O-N 2.89Å; T798-Y800 PolarHBondContact O-N 3.14Å; Y800-T802 VanDerWaalsContact C-N 3.29Å; Y800-T802 PolarHBondContact O-N 3.18Å
801	R	45.4	Very low	50.1	Low	135 Å²	135	95 Å²	95	51%	0.509	57%	0.57	S	S	.	*	S	Bend	trans	-75.3	-15.5	-178.4	-68.6	-175.5	175	-159.3	-11.2	113.8	Q793 D794 T798	Q793-R801 PolarHBondContact O-NE 2.71Å; Q793-R801 PolarHBondContact O-NH2 3.43Å; D794-R801 IonicContact OD1-CZ 2.82Å; D794-R801 IonicContact OD1-NH2 3.58Å; D794-R801 PolarHBondContact OD1-NH2 2.97Å; T798-R801 PolarHBondContact O-N 3.31Å
802	T	39.6	Very low	47.2	Very low	100 Å²	100	102 Å²	102	61%	0.613	60%	0.601	S	S	*	*	S	Bend	trans	-118.9	108.5	-177.9	52.9	0	0	0	0	110.1	Y800 S804	Y800-T802 VanDerWaalsContact C-N 3.29Å; Y800-T802 PolarHBondContact O-N 3.18Å; T802-S804 PolarHBondContact O-N 3.03Å
803	G	31.5	Very low	44.1	Very low	90 Å²	90	110.2 Å²	110.2	93%	0.928	64%	0.64	S	S	*	*			trans	-62.9	90.6	175.1	0	0	0	0	0	111.9
804	S	28.8	Very low	41.1	Very low	95 Å²	95	111.5 Å²	111.5	66%	0.664	66%	0.657	S	S	*	*			trans	-162.5	104.1	157	56.4	0	0	0	0	108.2	T802	T802-S804 PolarHBondContact O-N 3.03Å
805	S	27.3	Very low	38.4	Very low	105 Å²	105	114.4 Å²	114.4	73%	0.734	67%	0.668	S	S	*	*			trans	-54.3	124.9	175.6	29.8	0	0	0	0	111.3	V807	S805-V807 PolarHBondContact O-N 3.21Å; S805-V807 VanDerWaalsContact O-N 3.15Å
806	P	30.8	Very low	35.7	Very low	123 Å²	123	119.8 Å²	119.8	80%	0.799	68%	0.684	S	S	*	*			trans	-77.4	101.7	164.5	29.4	-26.1	0	0	0	107.5	A808	P806-A808 PolarHBondContact O-N 2.9Å
807	V	30.3	Very low	33.1	Very low	118 Å²	118	126.2 Å²	126.2	72%	0.715	72%	0.719	S	S	*	*			trans	-63.5	96.5	169.4	179.1	0	0	0	0	107.7	S805 N809	S805-V807 PolarHBondContact O-N 3.21Å; S805-V807 VanDerWaalsContact O-N 3.15Å; V807-N809 PolarHBondContact O-N 3.34Å
808	A	28.5	Very low	31.5	Very low	90 Å²	90	132.1 Å²	132.1	74%	0.744	74%	0.737	S	S	*	*			trans	-75.3	100.3	169.3	0	0	0	0	0	108.3	P806 S810	P806-A808 PolarHBondContact O-N 2.9Å; A808-S810 PolarHBondContact O-N 3.08Å; A808-S810 VanDerWaalsContact O-N 3.08Å
809	N	26.6	Very low	29.8	Very low	151 Å²	151	130 Å²	130	81%	0.807	74%	0.737	S	S	*	*			trans	-64.5	97.5	165.7	-85.9	-28.1	0	0	0	109.4	V807	V807-N809 PolarHBondContact O-N 3.34Å
810	S	28.6	Very low	28.7	Very low	108 Å²	108	131.8 Å²	131.8	76%	0.755	74%	0.739	S	S	*	*			trans	-112.6	96.7	155.9	53.8	0	0	0	0	107.9	A808 E812	A808-S810 PolarHBondContact O-N 3.08Å; A808-S810 VanDerWaalsContact O-N 3.08Å; S810-E812 PolarHBondContact O-N 3.11Å
811	K	24.9	Very low	28.1	Very low	185 Å²	185	131.9 Å²	131.9	80%	0.804	75%	0.754	S	S	*	*			trans	-67.2	108.7	163.9	-70.8	178.4	173.3	-174.5	0	107.8
812	E	24.6	Very low	27.1	Very low	187 Å²	187	131.9 Å²	131.9	87%	0.874	76%	0.764	S	S	*	*			trans	-131.9	107.7	150.5	-72.9	-169.4	163	0	0	107.3	S810	S810-E812 PolarHBondContact O-N 3.11Å
813	E	21.2	Very low	26.3	Very low	173 Å²	173	132 Å²	132	81%	0.808	77%	0.769	S	S	*	*			trans	-68.9	169.9	172.1	-66	167.3	162.6	0	0	110
814	S	22	Very low	25.9	Very low	108 Å²	108	135 Å²	135	76%	0.755	76%	0.764	S	S	*	*			trans	92.9	128.3	-179.8	85.4	0	0	0	0	112
815	E	22.3	Very low	25.6	Very low	168 Å²	168	135.2 Å²	135.2	79%	0.785	77%	0.765	S	S	*	*			cis	-153.4	148.1	24.6	-71.5	-176.7	143.4	0	0	111.5
816	H	24.4	Very low	25.4	Very low	160 Å²	160	135.4 Å²	135.4	74%	0.741	77%	0.767	S	S	*	*			trans	39	99.5	137.7	-68.3	-74.8	0	0	0	120.9	F818	H816-F818 PolarHBondContact O-N 2.83Å
817	D	21.5	Very low	25.6	Very low	144 Å²	144	135.4 Å²	135.4	77%	0.77	77%	0.767	S	S	*	*				-3.5	113.4	122.4	-170.5	18.6	0	0	0	116
818	F	25.4	Very low	25.2	Very low	199 Å²	199	139.7 Å²	139.7	87%	0.873	78%	0.776	S	S	*	*			trans	-156	98.3	144.9	-91.4	-69.8	0	0	0	111	H816	H816-F818 PolarHBondContact O-N 2.83Å
819	G	21.6	Very low	25	Very low	64 Å²	64	146.8 Å²	146.8	66%	0.66	78%	0.783	S	S	*	*				57.5	104.2	119.4	0	0	0	0	0	120.5
820	M	31.1	Very low	25	Very low	148 Å²	148	145 Å²	145	73%	0.729	78%	0.78	S	S	*	*			trans	-26	152.6	141	-78.6	-166.8	87	0	0	115.2	N822	M820-N822 VanDerWaalsContact CE-OD1 3.3Å; M820-N822 WeakPolarHBondContact CE-OD1 3.46Å
821	P	33.4	Very low	24.8	Very low	118 Å²	118	145 Å²	145	77%	0.766	78%	0.78	S	S	*	*				-153.7	138.4	75.8	36	-13.4	0	0	0	119.5
822	N	24.8	Very low	24.6	Very low	135 Å²	135	142 Å²	142	72%	0.722	78%	0.781	S	S	*	*				20.5	128.5	125.1	-77.6	-17.1	0	0	0	119.5	M820	M820-N822 VanDerWaalsContact CE-OD1 3.3Å; M820-N822 WeakPolarHBondContact CE-OD1 3.46Å
823	S	23.3	Very low	24.5	Very low	102 Å²	102	140 Å²	140	71%	0.713	78%	0.776	S	S	*	*				-162.8	128.3	124.8	50.5	0	0	0	0	113.1
824	N	22.1	Very low	24.7	Very low	153 Å²	153	137 Å²	137	82%	0.818	77%	0.774	S	S	*	*			trans	59.5	136.6	132.8	-59.7	-17.2	0	0	0	120.1
825	S	23.2	Very low	25	Very low	100 Å²	100	136.4 Å²	136.4	70%	0.699	78%	0.776	S	S	*	*			cis	176.8	163.3	-0.1	44.8	0	0	0	0	108.4
826	S	22.5	Very low	25.8	Very low	109 Å²	109	134 Å²	134	76%	0.762	78%	0.775	S	S	*	*			trans	92	150.2	149.8	81.8	0	0	0	0	119.4
827	P	34.6	Very low	25.9	Very low	123 Å²	123	131.2 Å²	131.2	80%	0.799	78%	0.78	S	S	*	*			cis	-133.3	155	-31.7	30.2	-10.8	0	0	0	114.8
828	K	22.5	Very low	26.1	Very low	208 Å²	208	132.8 Å²	132.8	90%	0.904	79%	0.787	S	S	*	*			trans	-60.1	140	176.8	-68.1	170.3	173.6	175	0	113.3
829	R	23.7	Very low	26.3	Very low	240 Å²	240	132.6 Å²	132.6	91%	0.906	79%	0.786	S	S	*	*			trans	-121.5	155.5	152.1	-103.7	-166.4	177.9	-173.3	0.8	109.6
830	P	26.7	Very low	26.8	Very low	112 Å²	112	137.1 Å²	137.1	73%	0.727	80%	0.795	S	S	*	*				-99.7	152.4	-125.9	34.8	-31.4	0	0	0	114.6
831	S	24.4	Very low	26.7	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	80%	0.798	S	S	*	*			trans	-45.1	135	166	50.5	0	0	0	0	115.3
832	C	21.4	Very low	26.9	Very low	122 Å²	122	133.7 Å²	133.7	82%	0.824	79%	0.786	S	S	*	*			trans	-137.8	96.5	148.2	57.6	0	0	0	0	110.3
833	N	22.7	Very low	27.7	Very low	145 Å²	145	137.9 Å²	137.9	78%	0.775	79%	0.791	S	S	*	*			trans	30.1	108	140.8	-63.9	-8.2	0	0	0	120.4
834	S	24.2	Very low	28.9	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	79%	0.792	S	S	*	*				18.6	128.2	126.6	59.7	0	0	0	0	121.2
835	A	28.4	Very low	30.3	Very low	97 Å²	97	133.3 Å²	133.3	80%	0.802	76%	0.757	S	S	*	*			trans	94.3	152.2	142.5	0	0	0	0	0	118.1
836	P	38.9	Very low	31.7	Very low	116 Å²	116	131.6 Å²	131.6	75%	0.753	74%	0.74	S	S	*	*			cis	-127.9	167.1	-6.7	33.1	-13.5	0	0	0	114.9	L838	P836-L838 PolarHBondContact O-N 3.12Å
837	A	27.8	Very low	33.3	Very low	103 Å²	103	132.6 Å²	132.6	85%	0.851	73%	0.732	S	S	*	*			trans	-52.3	114.9	174.4	0	0	0	0	0	113.5
838	L	25.7	Very low	34.4	Very low	177 Å²	177	133.8 Å²	133.8	93%	0.927	73%	0.727	S	S	*	*			trans	-94	125.4	166.3	-90.9	159.7	0	0	0	110.2	P836	P836-L838 PolarHBondContact O-N 3.12Å
839	K	28.3	Very low	36.2	Very low	194 Å²	194	124.6 Å²	124.6	84%	0.843	69%	0.687	S	S	*	*			trans	-66.3	143	-172.6	-69.8	162.5	169	173.8	0	112.7
840	N	32.2	Very low	37.8	Very low	159 Å²	159	118 Å²	118	85%	0.85	66%	0.662	S	S	*	*			trans	42.6	83.1	154.2	-69.4	-3.8	0	0	0	117.8
841	C	28.9	Very low	39.1	Very low	118 Å²	118	120 Å²	120	80%	0.797	67%	0.667	S	S	*	*			trans	-63.9	135.1	156.3	-77.2	0	0	0	0	110.6	R843	C841-R843 VanDerWaalsContact C-N 3.31Å; C841-R843 PolarHBondContact O-N 3.29Å
842	P	37.5	Very low	40.8	Very low	77 Å²	77	119.2 Å²	119.2	50%	0.5	65%	0.65	S	S	.	*			trans	-81.6	76.7	-175.8	34.1	-33.1	0	0	0	110.3	N844 W845	P842-N844 PolarHBondContact O-N 2.75Å; P842-W845 HydrophobicContact CB-CB 4.45Å; P842-W845 PolarHBondContact O-N 3.42Å; P842-W845 VanDerWaalsContact O-N 3.08Å
843	R	43.1	Very low	42.8	Very low	222 Å²	222	117 Å²	117	84%	0.838	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-16	172.2	-133.2	176.2	-178.5	159.4	-0.3	112.8	C841	C841-R843 VanDerWaalsContact C-N 3.31Å; C841-R843 PolarHBondContact O-N 3.29Å
844	N	49	Very low	44.8	Very low	136 Å²	136	111.8 Å²	111.8	73%	0.727	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	-23.4	175	-77.7	0.4	0	0	0	114.3	P842	P842-N844 PolarHBondContact O-N 2.75Å
845	W	50.4	Low	46.9	Very low	24 Å²	24	108.9 Å²	108.9	9%	0.091	59%	0.589	C	S	.	*	H	α-helix	trans	-68.9	-42.3	-178.4	-177.3	80.7	0	0	0	112.2	P842 H847 Q848 E849 M857 L861 F862	P842-W845 HydrophobicContact CB-CB 4.45Å; P842-W845 PolarHBondContact O-N 3.42Å; P842-W845 VanDerWaalsContact O-N 3.08Å; W845-H847 PolarHBondContact O-N 2.96Å; W845-H847 VanDerWaalsContact O-N 3.11Å; W845-Q848 PolarHBondContact O-N 3.16Å; W845-E849 HydrophobicContact CD2-CG 3.85Å; W845-E849 HydrophobicContact CE3-CG 4.4Å; W845-E849 HydrophobicContact CG-CG 4.33Å; W845-E849 HydrophobicContact CH2-CG 4.1Å; W845-E849 HydrophobicContact CZ2-CB 4.41Å; W845-E849 HydrophobicContact CZ2-CG 3.52Å; W845-E849 HydrophobicContact CZ3-CG 4.5Å; W845-E849 PolarHBondContact O-N 2.81Å; W845-M857 HydrophobicContact CH2-CE 4.39Å; W845-L861 HydrophobicContact CD2-CB 4.14Å; W845-L861 HydrophobicContact CD2-CD2 4.25Å; W845-L861 VanDerWaalsContact CE2-CB 3.48Å; W845-L861 HydrophobicContact CG-CD2 3.96Å; W845-L861 HydrophobicContact CH2-CB 4.25Å; W845-L861 HydrophobicContact CZ2-CB 3.53Å; W845-F862 HydrophobicContact CH2-CB 3.93Å; W845-F862 HydrophobicContact CZ3-CB 4.49Å
846	L	53.6	Low	48.9	Very low	64 Å²	64	110.6 Å²	110.6	34%	0.335	58%	0.58	S	S	.	*	H	α-helix	trans	-61.9	-24.6	-177.6	-140	90.8	0	0	0	113.5	R850 L923	L846-R850 WeakPolarHBondContact O-CG 3.38Å; L846-L923 HydrophobicContact CD1-CD2 3.86Å; L846-L923 HydrophobicContact CG-CD2 3.79Å
847	H	55.6	Low	50.6	Low	129 Å²	129	105.7 Å²	105.7	60%	0.597	55%	0.547	S	S	*	.	H	α-helix	trans	-82.8	-26.7	174.9	-82.1	-69.2	0	0	0	112.8	W845	W845-H847 PolarHBondContact O-N 2.96Å; W845-H847 VanDerWaalsContact O-N 3.11Å
848	Q	56.8	Low	52.9	Low	149 Å²	149	104.5 Å²	104.5	70%	0.696	53%	0.526	S	S	*	.	H	α-helix	trans	-86.1	-24	-174.2	-143.8	168.7	22.1	0	0	112.9	W845	W845-Q848 PolarHBondContact O-N 3.16Å
849	E	61	Low	55.4	Low	14 Å²	14	96.9 Å²	96.9	7%	0.065	49%	0.487	C	S	.	.	S	Bend	trans	-96.7	-9.1	-177.5	-65.8	-72.4	140.9	0	0	114.7	W845 D851 K852 M857	W845-E849 HydrophobicContact CD2-CG 3.85Å; W845-E849 HydrophobicContact CE3-CG 4.4Å; W845-E849 HydrophobicContact CG-CG 4.33Å; W845-E849 HydrophobicContact CH2-CG 4.1Å; W845-E849 HydrophobicContact CZ2-CB 4.41Å; W845-E849 HydrophobicContact CZ2-CG 3.52Å; W845-E849 HydrophobicContact CZ3-CG 4.5Å; W845-E849 PolarHBondContact O-N 2.81Å; E849-D851 PolarHBondContact O-N 2.87Å; E849-K852 PolarHBondContact O-N 3.04Å; E849-K852 VanDerWaalsContact O-N 3.09Å; E849-K852 IonicContact OE1-NZ 3.6Å; E849-K852 PolarHBondContact OE1-NZ 3.35Å; E849-K852 WeakPolarHBondContact OE2-CD 3.17Å; E849-K852 IonicContact OE2-NZ 3.87Å; E849-K852 PolarHBondContact OE2-NZ 2.89Å; E849-M857 HydrophobicContact CB-CE 3.9Å
850	R	56.9	Low	57.6	Low	101 Å²	101	89.4 Å²	89.4	38%	0.381	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-23.7	-176.4	-92.2	172.7	179.3	-163.9	-1.2	114.6	L846 I925	L846-R850 WeakPolarHBondContact O-CG 3.38Å; R850-I925 HydrophobicContact CG-CD1 4.49Å
851	D	55	Low	59.8	Low	155 Å²	155	84.6 Å²	84.6	83%	0.829	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	3.1	-175.5	-60.1	-32.4	0	0	0	113.4	E849	E849-D851 PolarHBondContact O-N 2.87Å
852	K	58.8	Low	62.2	Low	93 Å²	93	79 Å²	79	40%	0.404	40%	0.395	S	S	.	.	S	Bend	trans	-91.9	145.3	178.8	-66.6	-167.2	-165.4	159.7	0	112.4	E849 M857	E849-K852 PolarHBondContact O-N 3.04Å; E849-K852 VanDerWaalsContact O-N 3.09Å; E849-K852 IonicContact OE1-NZ 3.6Å; E849-K852 PolarHBondContact OE1-NZ 3.35Å; E849-K852 WeakPolarHBondContact OE2-CD 3.17Å; E849-K852 IonicContact OE2-NZ 3.87Å; E849-K852 PolarHBondContact OE2-NZ 2.89Å; K852-M857 HydrophobicContact CB-CG 4.48Å
853	P	63.3	Low	64.2	Low	74 Å²	74	75.4 Å²	75.4	48%	0.481	37%	0.372	S	S	.	.			trans	-57.5	143.6	169.2	-17.9	29.2	0	0	0	111	A855 E856	P853-A855 PolarHBondContact O-N 3.37Å; P853-A855 VanDerWaalsContact O-N 3.12Å; P853-E856 HydrophobicContact CG-CG 4.44Å; P853-E856 PolarHBondContact O-N 3.25Å
854	L	66.3	Low	65.9	Low	37 Å²	37	69.8 Å²	69.8	19%	0.194	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-50.2	-40.8	179.4	-84.6	157.1	0	0	0	112.3	E856 M857 M891 D892 I920 T924	L854-E856 PolarHBondContact O-N 3.24Å; L854-E856 VanDerWaalsContact O-N 3.11Å; L854-M857 HydrophobicContact CD2-SD 4.08Å; L854-M857 PolarHBondContact O-N 2.61Å; L854-M891 HydrophobicContact CB-CB 4.31Å; L854-M891 HydrophobicContact CD2-CB 3.93Å; L854-M891 HydrophobicContact CD2-CG 4.38Å; L854-M891 WeakPolarHBondContact O-CB 3.32Å; L854-D892 HydrophobicContact CB-CB 4.01Å; L854-I920 HydrophobicContact CD2-CG2 3.97Å; L854-T924 HydrophobicContact CD1-CG2 4.36Å; L854-T924 HydrophobicContact CG-CG2 4.43Å
855	A	67	Low	67.1	Low	48 Å²	48	66 Å²	66	40%	0.397	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-60.7	-21	179.1	0	0	0	0	0	114.9	P853	P853-A855 PolarHBondContact O-N 3.37Å; P853-A855 VanDerWaalsContact O-N 3.12Å
856	E	70.8	Confident	68.4	Low	133 Å²	133	65.9 Å²	65.9	62%	0.621	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-100	-5.7	-177.7	-62.9	-177.3	-175.4	0	0	113.6	P853 L854	P853-E856 HydrophobicContact CG-CG 4.44Å; P853-E856 PolarHBondContact O-N 3.25Å; L854-E856 PolarHBondContact O-N 3.24Å; L854-E856 VanDerWaalsContact O-N 3.11Å
857	M	74.1	Confident	69.5	Low	12 Å²	12	69.5 Å²	69.5	6%	0.059	36%	0.359	C	S	.	.	S	Bend	trans	-76.1	135.1	-178.2	-64.7	-177.7	81.7	0	0	111.2	W845 E849 K852 L854 V859 M891 L923	W845-M857 HydrophobicContact CH2-CE 4.39Å; E849-M857 HydrophobicContact CB-CE 3.9Å; K852-M857 HydrophobicContact CB-CG 4.48Å; L854-M857 HydrophobicContact CD2-SD 4.08Å; L854-M857 PolarHBondContact O-N 2.61Å; M857-V859 PolarHBondContact O-N 2.67Å; M857-V859 VanDerWaalsContact O-N 3.08Å; M857-M891 HydrophobicContact CB-CB 4.24Å; M857-M891 HydrophobicContact CB-CG 3.99Å; M857-L923 HydrophobicContact CE-CB 4.39Å; M857-L923 HydrophobicContact CE-CD1 4.01Å; M857-L923 HydrophobicContact CE-CD2 4.07Å; M857-L923 HydrophobicContact CE-CG 4.38Å
858	D	76.5	Confident	70.6	Confident	78 Å²	78	64 Å²	64	42%	0.417	33%	0.334	S	S	.	.			trans	-71.9	105.5	177.8	-171.2	-24.2	0	0	0	110.9	S860 L861 F862	D858-S860 PolarHBondContact O-N 3.1Å; D858-S860 WeakPolarHBondContact OD1-CB 3.35Å; D858-S860 PolarHBondContact OD1-N 2.69Å; D858-L861 HydrophobicContact CB-CB 4.21Å; D858-L861 HydrophobicContact CB-CD1 4.18Å; D858-L861 PolarHBondContact O-N 3.38Å; D858-L861 PolarHBondContact OD1-N 3.14Å; D858-F862 PolarHBondContact O-N 3.31Å
859	V	77.5	Confident	71.4	Confident	18 Å²	18	60.9 Å²	60.9	11%	0.109	32%	0.319	C	S	.	.	H	α-helix	trans	-57.9	-34.6	179.8	178.3	0	0	0	0	111.8	M857 F862 L863 L875 I889 M891	M857-V859 PolarHBondContact O-N 2.67Å; M857-V859 VanDerWaalsContact O-N 3.08Å; V859-F862 PolarHBondContact O-N 2.95Å; V859-L863 HydrophobicContact CG1-CD1 3.83Å; V859-L863 HydrophobicContact CG1-CG 4.25Å; V859-L863 WeakPolarHBondContact O-CB 3.26Å; V859-L863 VanDerWaalsContact O-CG 3.22Å; V859-L863 WeakPolarHBondContact O-CG 3.36Å; V859-L863 PolarHBondContact O-N 3.34Å; V859-L875 HydrophobicContact CG1-CD1 4.24Å; V859-I889 WeakPolarHBondContact CG2-O 3.46Å; V859-M891 HydrophobicContact CB-CE 4.27Å; V859-M891 HydrophobicContact CG1-CE 4Å; V859-M891 HydrophobicContact CG2-CB 4.48Å; V859-M891 HydrophobicContact CG2-CE 4.07Å; V859-M891 HydrophobicContact CG2-CG 4.19Å
860	S	75.9	Confident	71.9	Confident	37 Å²	37	64.7 Å²	64.7	26%	0.259	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-48.3	179.2	171.9	0	0	0	0	111.4	D858 F862 L863 K864 Q872	D858-S860 PolarHBondContact O-N 3.1Å; D858-S860 WeakPolarHBondContact OD1-CB 3.35Å; D858-S860 PolarHBondContact OD1-N 2.69Å; S860-F862 VanDerWaalsContact C-N 3.33Å; S860-F862 PolarHBondContact O-N 3.08Å; S860-L863 PolarHBondContact O-N 2.76Å; S860-K864 WeakPolarHBondContact O-CB 3.31Å; S860-K864 PolarHBondContact O-N 2.64Å; S860-Q872 PolarHBondContact OG-NE2 3.06Å
861	L	77.2	Confident	72.5	Confident	57 Å²	57	60.4 Å²	60.4	30%	0.298	33%	0.33	S	S	.	.	H	α-helix	trans	-65.3	-37.2	176.8	-94.3	145.4	0	0	0	112	W845 D858 K864 S865	W845-L861 HydrophobicContact CD2-CB 4.14Å; W845-L861 HydrophobicContact CD2-CD2 4.25Å; W845-L861 VanDerWaalsContact CE2-CB 3.48Å; W845-L861 HydrophobicContact CG-CD2 3.96Å; W845-L861 HydrophobicContact CH2-CB 4.25Å; W845-L861 HydrophobicContact CZ2-CB 3.53Å; D858-L861 HydrophobicContact CB-CB 4.21Å; D858-L861 HydrophobicContact CB-CD1 4.18Å; D858-L861 PolarHBondContact O-N 3.38Å; D858-L861 PolarHBondContact OD1-N 3.14Å; L861-K864 PolarHBondContact O-N 2.95Å; L861-S865 PolarHBondContact O-N 3.06Å
862	F	80.8	Confident	73.3	Confident	1 Å²	1	56.2 Å²	56.2	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-61.4	-50.5	173.4	171.9	-97.1	0	0	0	111.9	W845 D858 V859 S860 K864 S865 I866 M891 L916 I920 L923	W845-F862 HydrophobicContact CH2-CB 3.93Å; W845-F862 HydrophobicContact CZ3-CB 4.49Å; D858-F862 PolarHBondContact O-N 3.31Å; V859-F862 PolarHBondContact O-N 2.95Å; S860-F862 VanDerWaalsContact C-N 3.33Å; S860-F862 PolarHBondContact O-N 3.08Å; F862-K864 VanDerWaalsContact C-N 3.26Å; F862-K864 PolarHBondContact O-N 2.9Å; F862-S865 WeakPolarHBondContact O-CA 3.4Å; F862-S865 WeakPolarHBondContact O-CB 3.43Å; F862-S865 PolarHBondContact O-N 2.98Å; F862-S865 PolarHBondContact O-OG 2.95Å; F862-I866 HydrophobicContact CD1-CD1 4.11Å; F862-I866 HydrophobicContact CE1-CD1 3.41Å; F862-I866 VanDerWaalsContact CE1-CD1 3.41Å; F862-I866 HydrophobicContact CE1-CG1 4.28Å; F862-I866 HydrophobicContact CE2-CG2 4.27Å; F862-I866 HydrophobicContact CZ-CD1 3.73Å; F862-I866 HydrophobicContact CZ-CG2 4.3Å; F862-I866 PolarHBondContact O-N 3.46Å; F862-M891 HydrophobicContact CB-CE 3.76Å; F862-M891 HydrophobicContact CD1-CE 3.02Å; F862-M891 HydrophobicContact CD1-SD 4.15Å; F862-M891 HydrophobicContact CD2-CE 4.3Å; F862-M891 HydrophobicContact CE1-CE 3.55Å; F862-M891 HydrophobicContact CE1-SD 4.29Å; F862-M891 HydrophobicContact CG-CE 3.42Å; F862-M891 VanDerWaalsContact CG-CE 3.42Å; F862-M891 HydrophobicContact CG-SD 4.31Å; F862-M891 HydrophobicContact CZ-CE 4.37Å; F862-L916 HydrophobicContact CE1-CD2 3.67Å; F862-L916 HydrophobicContact CZ-CD2 4.31Å; F862-I920 HydrophobicContact CE1-CG1 4.34Å; F862-I920 HydrophobicContact CE2-CG1 4.06Å; F862-I920 HydrophobicContact CZ-CD1 4.38Å; F862-I920 HydrophobicContact CZ-CG1 3.62Å; F862-L923 HydrophobicContact CD2-CD1 3.35Å; F862-L923 HydrophobicContact CE2-CD1 3.36Å
863	L	79.3	Confident	73.6	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	31%	0.308	C	S	.	.	H	α-helix	trans	-61.5	-37.8	-179.5	-70.7	169.3	0	0	0	111.5	V859 S860 S865 I866 D867 L868 L871 L875	V859-L863 HydrophobicContact CG1-CD1 3.83Å; V859-L863 HydrophobicContact CG1-CG 4.25Å; V859-L863 WeakPolarHBondContact O-CB 3.26Å; V859-L863 VanDerWaalsContact O-CG 3.22Å; V859-L863 WeakPolarHBondContact O-CG 3.36Å; V859-L863 PolarHBondContact O-N 3.34Å; S860-L863 PolarHBondContact O-N 2.76Å; L863-S865 VanDerWaalsContact C-N 3.31Å; L863-S865 PolarHBondContact O-N 3.27Å; L863-I866 HydrophobicContact CD2-CD1 4.39Å; L863-I866 WeakPolarHBondContact O-CG1 3.37Å; L863-I866 PolarHBondContact O-N 3.33Å; L863-D867 PolarHBondContact O-N 2.93Å; L863-L868 HydrophobicContact CD2-CB 4.07Å; L863-L868 PolarHBondContact O-N 3.42Å; L863-L871 HydrophobicContact CD1-CB 4.36Å; L863-L871 HydrophobicContact CD2-CD1 4.26Å; L863-L875 HydrophobicContact CD1-CD1 3.34Å
864	K	77.7	Confident	73.7	Confident	103 Å²	103	54.5 Å²	54.5	45%	0.448	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-35.9	171.3	-171.6	173.9	-164.5	126.4	0	113.1	S860 L861 F862 I866 D867 E869	S860-K864 WeakPolarHBondContact O-CB 3.31Å; S860-K864 PolarHBondContact O-N 2.64Å; L861-K864 PolarHBondContact O-N 2.95Å; F862-K864 VanDerWaalsContact C-N 3.26Å; F862-K864 PolarHBondContact O-N 2.9Å; K864-I866 VanDerWaalsContact C-N 3.26Å; K864-I866 PolarHBondContact O-N 3.01Å; K864-D867 PolarHBondContact O-N 3.48Å; K864-E869 HydrophobicContact CB-CG 3.79Å; K864-E869 WeakPolarHBondContact CD-OE1 3.46Å; K864-E869 WeakPolarHBondContact CE-OE1 3.36Å; K864-E869 HydrophobicContact CG-CG 3.95Å; K864-E869 WeakPolarHBondContact CG-OE1 3.36Å; K864-E869 IonicContact NZ-OE1 2.79Å; K864-E869 PolarHBondContact NZ-OE1 3.08Å
865	S	75.4	Confident	73.6	Confident	58 Å²	58	54.1 Å²	54.1	41%	0.406	30%	0.299	S	S	.	.	H	α-helix	trans	-69.9	-20.9	178.4	81	0	0	0	0	114.1	L861 F862 L863	L861-S865 PolarHBondContact O-N 3.06Å; F862-S865 WeakPolarHBondContact O-CA 3.4Å; F862-S865 WeakPolarHBondContact O-CB 3.43Å; F862-S865 PolarHBondContact O-N 2.98Å; F862-S865 PolarHBondContact O-OG 2.95Å; L863-S865 VanDerWaalsContact C-N 3.31Å; L863-S865 PolarHBondContact O-N 3.27Å
866	I	78	Confident	73.4	Confident	21 Å²	21	57.1 Å²	57.1	11%	0.108	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	16.4	-179.3	64.2	170.9	0	0	0	113.3	F862 L863 K864 L868	F862-I866 HydrophobicContact CD1-CD1 4.11Å; F862-I866 HydrophobicContact CE1-CD1 3.41Å; F862-I866 VanDerWaalsContact CE1-CD1 3.41Å; F862-I866 HydrophobicContact CE1-CG1 4.28Å; F862-I866 HydrophobicContact CE2-CG2 4.27Å; F862-I866 HydrophobicContact CZ-CD1 3.73Å; F862-I866 HydrophobicContact CZ-CG2 4.3Å; F862-I866 PolarHBondContact O-N 3.46Å; L863-I866 HydrophobicContact CD2-CD1 4.39Å; L863-I866 WeakPolarHBondContact O-CG1 3.37Å; L863-I866 PolarHBondContact O-N 3.33Å; K864-I866 VanDerWaalsContact C-N 3.26Å; K864-I866 PolarHBondContact O-N 3.01Å; I866-L868 VanDerWaalsContact C-N 3.29Å; I866-L868 HydrophobicContact CD1-CB 4.35Å; I866-L868 HydrophobicContact CD1-CD1 3.58Å; I866-L868 HydrophobicContact CD1-CG 4.13Å; I866-L868 HydrophobicContact CG1-CB 4.06Å; I866-L868 HydrophobicContact CG1-CD1 4.06Å; I866-L868 HydrophobicContact CG1-CG 4.03Å; I866-L868 PolarHBondContact O-N 3.36Å
867	D	75.2	Confident	72.5	Confident	140 Å²	140	57.7 Å²	57.7	75%	0.749	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	37.6	-178.5	-59.8	-43.2	0	0	0	113.7	L863 K864	L863-D867 PolarHBondContact O-N 2.93Å; K864-D867 PolarHBondContact O-N 3.48Å
868	L	78.3	Confident	71	Confident	14 Å²	14	63 Å²	63	7%	0.073	33%	0.333	C	S	.	.			trans	-118.4	29.9	176.8	-65.7	-177.7	0	0	0	112.9	L863 I866 C870 L871 V912	L863-L868 HydrophobicContact CD2-CB 4.07Å; L863-L868 PolarHBondContact O-N 3.42Å; I866-L868 VanDerWaalsContact C-N 3.29Å; I866-L868 HydrophobicContact CD1-CB 4.35Å; I866-L868 HydrophobicContact CD1-CD1 3.58Å; I866-L868 HydrophobicContact CD1-CG 4.13Å; I866-L868 HydrophobicContact CG1-CB 4.06Å; I866-L868 HydrophobicContact CG1-CD1 4.06Å; I866-L868 HydrophobicContact CG1-CG 4.03Å; I866-L868 PolarHBondContact O-N 3.36Å; L868-C870 PolarHBondContact O-N 3.01Å; L868-C870 VanDerWaalsContact O-N 3.09Å; L868-L871 HydrophobicContact CB-CD1 3.88Å; L868-L871 HydrophobicContact CB-CG 4.21Å; L868-L871 HydrophobicContact CD1-CD1 3.96Å; L868-L871 HydrophobicContact CD2-CD1 4.47Å; L868-L871 HydrophobicContact CG-CD1 4.34Å; L868-L871 WeakPolarHBondContact O-CB 3.43Å; L868-L871 WeakPolarHBondContact O-CG 3.22Å; L868-L871 PolarHBondContact O-N 3.28Å; L868-V912 HydrophobicContact CD1-CG1 3.94Å
869	E	74.1	Confident	69.3	Low	83 Å²	83	67 Å²	67	39%	0.388	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-53.3	-28.9	175.7	-97.6	-179.1	159.8	0	0	113.4	K864 L871 Q872	K864-E869 HydrophobicContact CB-CG 3.79Å; K864-E869 WeakPolarHBondContact CD-OE1 3.46Å; K864-E869 WeakPolarHBondContact CE-OE1 3.36Å; K864-E869 HydrophobicContact CG-CG 3.95Å; K864-E869 WeakPolarHBondContact CG-OE1 3.36Å; K864-E869 IonicContact NZ-OE1 2.79Å; K864-E869 PolarHBondContact NZ-OE1 3.08Å; E869-L871 PolarHBondContact O-N 2.91Å; E869-Q872 WeakPolarHBondContact O-CB 3.21Å; E869-Q872 PolarHBondContact O-N 2.88Å
870	C	71.8	Confident	67.4	Low	93 Å²	93	71.8 Å²	71.8	63%	0.628	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-61.3	-15.9	177.5	63.4	0	0	0	0	114	L868 P873	L868-C870 PolarHBondContact O-N 3.01Å; L868-C870 VanDerWaalsContact O-N 3.09Å; C870-P873 WeakPolarHBondContact O-CD 3.45Å
871	L	70	Confident	65.6	Low	11 Å²	11	78.2 Å²	78.2	6%	0.058	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-86.1	-16.4	176.6	-54.6	-177.2	0	0	0	112.8	L863 L868 E869 L874 L875 L907 V912	L863-L871 HydrophobicContact CD1-CB 4.36Å; L863-L871 HydrophobicContact CD2-CD1 4.26Å; L868-L871 HydrophobicContact CB-CD1 3.88Å; L868-L871 HydrophobicContact CB-CG 4.21Å; L868-L871 HydrophobicContact CD1-CD1 3.96Å; L868-L871 HydrophobicContact CD2-CD1 4.47Å; L868-L871 HydrophobicContact CG-CD1 4.34Å; L868-L871 WeakPolarHBondContact O-CB 3.43Å; L868-L871 WeakPolarHBondContact O-CG 3.22Å; L868-L871 PolarHBondContact O-N 3.28Å; E869-L871 PolarHBondContact O-N 2.91Å; L871-L874 HydrophobicContact CD2-CD1 4.1Å; L871-L874 PolarHBondContact O-N 3.43Å; L871-L874 VanDerWaalsContact O-N 3.13Å; L871-L875 HydrophobicContact CB-CD1 4.33Å; L871-L875 WeakPolarHBondContact O-CG 3.47Å; L871-L875 PolarHBondContact O-N 3.46Å; L871-L907 HydrophobicContact CD1-CD1 4.11Å; L871-L907 HydrophobicContact CD1-CD2 3.72Å; L871-L907 HydrophobicContact CD1-CG 4.42Å; L871-L907 HydrophobicContact CD2-CD1 4.44Å; L871-L907 HydrophobicContact CD2-CD2 3.22Å; L871-L907 HydrophobicContact CD2-CG 3.95Å; L871-L907 HydrophobicContact CG-CD2 4.08Å; L871-V912 HydrophobicContact CD1-CG1 4.08Å
872	Q	70.7	Confident	63.5	Low	67 Å²	67	83.2 Å²	83.2	31%	0.313	43%	0.429	S	S	.	.	H	α-helix	trans	-58.4	-43.9	-179	-167.2	-175	0.1	0	0	112.2	S860 E869 M876	S860-Q872 PolarHBondContact OG-NE2 3.06Å; E869-Q872 WeakPolarHBondContact O-CB 3.21Å; E869-Q872 PolarHBondContact O-N 2.88Å; Q872-M876 WeakPolarHBondContact O-CB 3.47Å; Q872-M876 VanDerWaalsContact O-CG 3.24Å; Q872-M876 WeakPolarHBondContact O-CG 3.39Å; Q872-M876 PolarHBondContact O-N 3.49Å; Q872-M876 VanDerWaalsContact O-N 3.17Å
873	P	65.6	Low	61.2	Low	70 Å²	70	89 Å²	89	46%	0.455	46%	0.463	S	S	.	.	H	α-helix	trans	-61.3	-45.1	173.8	-19.8	32.5	0	0	0	111.7	C870 L875 M876 Q877	C870-P873 WeakPolarHBondContact O-CD 3.45Å; P873-L875 PolarHBondContact O-N 3.38Å; P873-M876 CarbonylContact O-C 3.5Å; P873-M876 PolarHBondContact O-N 3.17Å; P873-Q877 VanDerWaalsContact O-CB 3.25Å; P873-Q877 WeakPolarHBondContact O-CB 3.24Å; P873-Q877 PolarHBondContact O-N 2.84Å
874	L	65.6	Low	59	Low	62 Å²	62	97.1 Å²	97.1	33%	0.325	50%	0.504	S	S	.	.	H	α-helix	trans	-61.3	-43.3	-178	-72.4	163.6	0	0	0	112.1	L871 M876	L871-L874 HydrophobicContact CD2-CD1 4.1Å; L871-L874 PolarHBondContact O-N 3.43Å; L871-L874 VanDerWaalsContact O-N 3.13Å; L874-M876 PolarHBondContact O-N 3.31Å
875	L	65.2	Low	56.9	Low	29 Å²	29	97.5 Å²	97.5	15%	0.152	51%	0.51	C	S	.	.	H	α-helix	trans	-70	-17.2	176.4	-66.4	165.3	0	0	0	113.2	V859 L863 L871 P873 I889 L894 I905	V859-L875 HydrophobicContact CG1-CD1 4.24Å; L863-L875 HydrophobicContact CD1-CD1 3.34Å; L871-L875 HydrophobicContact CB-CD1 4.33Å; L871-L875 WeakPolarHBondContact O-CG 3.47Å; L871-L875 PolarHBondContact O-N 3.46Å; P873-L875 PolarHBondContact O-N 3.38Å; L875-I889 HydrophobicContact CD2-CD1 3.75Å; L875-I889 HydrophobicContact CD2-CG2 4.45Å; L875-L894 HydrophobicContact CD2-CD1 4.21Å; L875-I905 HydrophobicContact CD2-CD1 3.63Å
876	M	61.5	Low	55	Low	110 Å²	110	103.2 Å²	103.2	54%	0.542	54%	0.536	S	S	.	.	H	α-helix	trans	-102.9	-24.4	176.2	-64.2	-133.9	103.8	0	0	114.2	Q872 P873 L874 L888	Q872-M876 WeakPolarHBondContact O-CB 3.47Å; Q872-M876 VanDerWaalsContact O-CG 3.24Å; Q872-M876 WeakPolarHBondContact O-CG 3.39Å; Q872-M876 PolarHBondContact O-N 3.49Å; Q872-M876 VanDerWaalsContact O-N 3.17Å; P873-M876 CarbonylContact O-C 3.5Å; P873-M876 PolarHBondContact O-N 3.17Å; L874-M876 PolarHBondContact O-N 3.31Å; M876-L888 HydrophobicContact CE-CD1 3.78Å
877	Q	52.2	Low	53.5	Low	145 Å²	145	110.3 Å²	110.3	68%	0.678	57%	0.566	S	S	*	*	H	α-helix	trans	-81.1	-18.8	-171.6	-120.5	173.8	-9.1	0	0	113.4	P873 Q879	P873-Q877 VanDerWaalsContact O-CB 3.25Å; P873-Q877 WeakPolarHBondContact O-CB 3.24Å; P873-Q877 PolarHBondContact O-N 2.84Å; Q877-Q879 PolarHBondContact O-N 2.93Å
878	E	42.3	Very low	52.7	Low	125 Å²	125	109.4 Å²	109.4	58%	0.584	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	55.7	170.2	-69.6	-155.5	152	0	0	112	V880	E878-V880 VanDerWaalsContact C-N 3.33Å
879	Q	41.2	Very low	52.1	Low	160 Å²	160	110.7 Å²	110.7	75%	0.748	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-5.2	160	-77.7	-162.9	-10.2	0	0	112.8	Q877	Q877-Q879 PolarHBondContact O-N 2.93Å
880	V	38.3	Very low	52.1	Low	120 Å²	120	108.6 Å²	108.6	73%	0.727	56%	0.561	S	S	*	*	S	Bend	trans	-105.6	-8.1	-162.5	-171.8	0	0	0	0	115.5	E878	E878-V880 VanDerWaalsContact C-N 3.33Å
881	L	36.9	Very low	52	Low	171 Å²	171	104.3 Å²	104.3	90%	0.895	53%	0.531	S	S	*	.	S	Bend	trans	-131.1	3.8	176.7	-145.6	69.4	0	0	0	117.6
882	F	33.4	Very low	52	Low	163 Å²	163	106.7 Å²	106.7	72%	0.715	54%	0.544	S	S	*	.			trans	-122.8	53.9	171	-152.3	-97.5	0	0	0	111.9	M884	F882-M884 PolarHBondContact O-N 3.22Å
883	V	33	Very low	52	Low	121 Å²	121	106.6 Å²	106.6	73%	0.733	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	52.1	-179.3	-174.4	0	0	0	0	112.2
884	M	33.6	Very low	52.4	Low	173 Å²	173	103.6 Å²	103.6	85%	0.852	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.3	-15	163.7	-78.6	-149.3	84.3	0	0	117.1	F882	F882-M884 PolarHBondContact O-N 3.22Å
885	L	33.5	Very low	52.5	Low	112 Å²	112	101.3 Å²	101.3	59%	0.586	52%	0.517	S	S	*	.	S	Bend	trans	-145.8	115.2	170.3	-73.5	163.1	0	0	0	108.4	F887	L885-F887 HydrophobicContact CB-CD2 3.6Å; L885-F887 HydrophobicContact CB-CE2 3.78Å; L885-F887 HydrophobicContact CD1-CE2 4.21Å; L885-F887 HydrophobicContact CD2-CE2 4.29Å; L885-F887 HydrophobicContact CG-CE2 4.31Å; L885-F887 PolarHBondContact O-N 2.89Å
886	N	33.9	Very low	52.5	Low	178 Å²	178	107.7 Å²	107.7	95%	0.952	55%	0.546	S	S	*	.			trans	-62.4	70.2	176.7	-83	-25.1	0	0	0	111.7
887	F	47.6	Very low	52.8	Low	169 Å²	169	103.5 Å²	103.5	74%	0.741	53%	0.525	S	S	*	.			trans	-100.8	109.3	172.5	-78.6	-76.1	0	0	0	109.7	L885	L885-F887 HydrophobicContact CB-CD2 3.6Å; L885-F887 HydrophobicContact CB-CE2 3.78Å; L885-F887 HydrophobicContact CD1-CE2 4.21Å; L885-F887 HydrophobicContact CD2-CE2 4.29Å; L885-F887 HydrophobicContact CG-CE2 4.31Å; L885-F887 PolarHBondContact O-N 2.89Å
888	L	58.3	Low	53.4	Low	121 Å²	121	98.6 Å²	98.6	63%	0.634	51%	0.507	S	S	*	.			trans	-57.3	134.8	160.5	-149.1	85.6	0	0	0	107.6	M876 T890	M876-L888 HydrophobicContact CE-CD1 3.78Å; L888-T890 PolarHBondContact O-N 3.39Å
889	I	66.6	Low	54.6	Low	42 Å²	42	96.7 Å²	96.7	22%	0.215	50%	0.498	C	S	.	.			trans	-64.6	107.4	171.2	-63.9	173	0	0	0	107.5	V859 L875 V893 L894	V859-I889 WeakPolarHBondContact CG2-O 3.46Å; L875-I889 HydrophobicContact CD2-CD1 3.75Å; L875-I889 HydrophobicContact CD2-CG2 4.45Å; I889-V893 HydrophobicContact CG2-CG1 4.45Å; I889-L894 HydrophobicContact CG2-CB 4.22Å; I889-L894 HydrophobicContact CG2-CD1 4.04Å
890	T	73	Confident	55.9	Low	39 Å²	39	96.5 Å²	96.5	24%	0.239	50%	0.497	C	S	.	.			trans	-86.7	165.8	174.9	47.1	0	0	0	0	110.8	L888 D892 V893 L894	L888-T890 PolarHBondContact O-N 3.39Å; T890-D892 VanDerWaalsContact C-N 3.3Å; T890-D892 WeakPolarHBondContact CB-OD1 3.48Å; T890-D892 PolarHBondContact O-N 3.02Å; T890-D892 PolarHBondContact OG1-OD1 3.4Å; T890-V893 PolarHBondContact O-N 3.19Å; T890-L894 PolarHBondContact O-N 3.44Å
891	M	70.3	Confident	57.3	Low	2 Å²	2	94.3 Å²	94.3	1%	0.01	48%	0.481	C	S	.	.	H	α-helix	trans	-63.1	-33.2	-173.4	-111.7	-51.2	131.3	0	0	113.3	L854 M857 V859 F862 L894 V895 I920	L854-M891 HydrophobicContact CB-CB 4.31Å; L854-M891 HydrophobicContact CD2-CB 3.93Å; L854-M891 HydrophobicContact CD2-CG 4.38Å; L854-M891 WeakPolarHBondContact O-CB 3.32Å; M857-M891 HydrophobicContact CB-CB 4.24Å; M857-M891 HydrophobicContact CB-CG 3.99Å; V859-M891 HydrophobicContact CB-CE 4.27Å; V859-M891 HydrophobicContact CG1-CE 4Å; V859-M891 HydrophobicContact CG2-CB 4.48Å; V859-M891 HydrophobicContact CG2-CE 4.07Å; V859-M891 HydrophobicContact CG2-CG 4.19Å; F862-M891 HydrophobicContact CB-CE 3.76Å; F862-M891 HydrophobicContact CD1-CE 3.02Å; F862-M891 HydrophobicContact CD1-SD 4.15Å; F862-M891 HydrophobicContact CD2-CE 4.3Å; F862-M891 HydrophobicContact CE1-CE 3.55Å; F862-M891 HydrophobicContact CE1-SD 4.29Å; F862-M891 HydrophobicContact CG-CE 3.42Å; F862-M891 VanDerWaalsContact CG-CE 3.42Å; F862-M891 HydrophobicContact CG-SD 4.31Å; F862-M891 HydrophobicContact CZ-CE 4.37Å; M891-L894 HydrophobicContact CE-CD2 3.52Å; M891-L894 PolarHBondContact O-N 2.94Å; M891-L894 HydrophobicContact SD-CD2 4.13Å; M891-V895 WeakPolarHBondContact O-CG2 3.27Å; M891-V895 PolarHBondContact O-N 3.35Å; M891-I920 HydrophobicContact SD-CD1 3.77Å; M891-I920 HydrophobicContact SD-CG1 4.06Å
892	D	69.2	Low	58.9	Low	61 Å²	61	86.6 Å²	86.6	33%	0.326	44%	0.441	S	S	.	.	H	α-helix	trans	-65.7	-44.4	174.4	57.7	-34	0	0	0	112.2	L854 T890 L894 V895 E896	L854-D892 HydrophobicContact CB-CB 4.01Å; T890-D892 VanDerWaalsContact C-N 3.3Å; T890-D892 WeakPolarHBondContact CB-OD1 3.48Å; T890-D892 PolarHBondContact O-N 3.02Å; T890-D892 PolarHBondContact OG1-OD1 3.4Å; D892-L894 VanDerWaalsContact C-N 3.33Å; D892-L894 PolarHBondContact O-N 3.3Å; D892-V895 PolarHBondContact O-N 3.31Å; D892-E896 PolarHBondContact O-N 3.13Å
893	V	71.5	Confident	60.5	Low	65 Å²	65	83 Å²	83	39%	0.394	43%	0.428	S	S	.	.	H	α-helix	trans	-62.9	-42.8	175.1	178.9	0	0	0	0	110.4	I889 T890 V895 E896 M897	I889-V893 HydrophobicContact CG2-CG1 4.45Å; T890-V893 PolarHBondContact O-N 3.19Å; V893-V895 PolarHBondContact O-N 3.18Å; V893-E896 PolarHBondContact O-N 3.19Å; V893-E896 VanDerWaalsContact O-N 3.07Å; V893-M897 WeakPolarHBondContact O-CG 3.12Å; V893-M897 PolarHBondContact O-N 3.1Å; V893-M897 VanDerWaalsContact O-N 3.09Å
894	L	73.3	Confident	62	Low	8 Å²	8	80.7 Å²	80.7	4%	0.042	42%	0.422	C	S	.	.	H	α-helix	trans	-61.3	-28.7	-180	-164.5	71.4	0	0	0	113.1	L875 I889 T890 M891 D892 M897 L916	L875-L894 HydrophobicContact CD2-CD1 4.21Å; I889-L894 HydrophobicContact CG2-CB 4.22Å; I889-L894 HydrophobicContact CG2-CD1 4.04Å; T890-L894 PolarHBondContact O-N 3.44Å; M891-L894 HydrophobicContact CE-CD2 3.52Å; M891-L894 PolarHBondContact O-N 2.94Å; M891-L894 HydrophobicContact SD-CD2 4.13Å; D892-L894 VanDerWaalsContact C-N 3.33Å; D892-L894 PolarHBondContact O-N 3.3Å; L894-M897 HydrophobicContact CD1-SD 4.16Å; L894-L916 HydrophobicContact CD2-CD2 3.39Å; L894-L916 HydrophobicContact CG-CD2 4.01Å
895	V	68.1	Low	63.5	Low	14 Å²	14	73.1 Å²	73.1	9%	0.085	39%	0.385	C	S	.	.	H	α-helix	trans	-72.7	-36.5	175.7	171.1	0	0	0	0	111.8	M891 D892 V893 M917 I920	M891-V895 WeakPolarHBondContact O-CG2 3.27Å; M891-V895 PolarHBondContact O-N 3.35Å; D892-V895 PolarHBondContact O-N 3.31Å; V893-V895 PolarHBondContact O-N 3.18Å; V895-M917 HydrophobicContact CG1-CE 4.21Å; V895-M917 HydrophobicContact CG1-SD 4.4Å; V895-I920 HydrophobicContact CG2-CD1 3.46Å; V895-I920 VanDerWaalsContact CG2-CD1 3.46Å; V895-I920 HydrophobicContact CG2-CG1 4.49Å; V895-I920 HydrophobicContact CG2-CG2 3.84Å
896	E	65	Low	64.8	Low	163 Å²	163	69.6 Å²	69.6	76%	0.762	38%	0.376	S	S	*	.	H	α-helix	trans	-82.2	-24.6	-176.8	-67.2	-167.4	169.3	0	0	113.5	D892 V893 S898	D892-E896 PolarHBondContact O-N 3.13Å; V893-E896 PolarHBondContact O-N 3.19Å; V893-E896 VanDerWaalsContact O-N 3.07Å; E896-S898 PolarHBondContact O-N 3.41Å
897	M	67.5	Low	66.3	Low	21 Å²	21	61.9 Å²	61.9	10%	0.103	33%	0.334	C	S	.	.			trans	-52.2	128.9	178	-74.5	-177.2	80.1	0	0	111.1	V893 L894 D901 L902 I905 R913	V893-M897 WeakPolarHBondContact O-CG 3.12Å; V893-M897 PolarHBondContact O-N 3.1Å; V893-M897 VanDerWaalsContact O-N 3.09Å; L894-M897 HydrophobicContact CD1-SD 4.16Å; M897-D901 HydrophobicContact CB-CB 3.96Å; M897-D901 HydrophobicContact CE-CB 3.65Å; M897-D901 WeakPolarHBondContact CE-O 3.45Å; M897-D901 HydrophobicContact CG-CB 4.2Å; M897-L902 HydrophobicContact CB-CD2 4.32Å; M897-L902 HydrophobicContact CB-CG 4.35Å; M897-L902 HydrophobicContact CE-CD2 4.34Å; M897-L902 HydrophobicContact SD-CD2 4.35Å; M897-I905 HydrophobicContact CE-CD1 3.87Å; M897-I905 HydrophobicContact CE-CG1 4.18Å; M897-I905 HydrophobicContact CE-CG2 3.9Å; M897-I905 HydrophobicContact SD-CD1 4.49Å; M897-R913 PolarHBondContact O-NH1 3.22Å
898	S	64.8	Low	66.9	Low	43 Å²	43	59.4 Å²	59.4	30%	0.301	33%	0.333	S	S	.	.			trans	-71.2	172.2	174.2	72	0	0	0	0	111.5	E896 E900 D901 L902	E896-S898 PolarHBondContact O-N 3.41Å; S898-E900 PolarHBondContact O-N 3.44Å; S898-E900 PolarHBondContact OG-N 3.27Å; S898-D901 VanDerWaalsContact CB-OD2 3.26Å; S898-D901 WeakPolarHBondContact CB-OD2 3.47Å; S898-D901 PolarHBondContact N-OD2 3.11Å; S898-D901 PolarHBondContact O-N 3.03Å; S898-D901 PolarHBondContact OG-N 3.41Å; S898-D901 VanDerWaalsContact OG-N 3.1Å; S898-D901 PolarHBondContact OG-OD2 2.94Å; S898-L902 WeakPolarHBondContact O-CG 3.43Å; S898-L902 PolarHBondContact O-N 3.23Å; S898-L902 VanDerWaalsContact O-N 3.08Å
899	Q	68	Low	66.9	Low	84 Å²	84	57 Å²	57	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-29.1	173.8	-172.4	148.7	-24	0	0	111.9	I903	Q899-I903 HydrophobicContact CG-CD1 4.32Å; Q899-I903 WeakPolarHBondContact O-CD1 3.45Å; Q899-I903 VanDerWaalsContact O-CG1 3.23Å; Q899-I903 WeakPolarHBondContact O-CG1 3.44Å; Q899-I903 PolarHBondContact O-N 2.96Å
900	E	68.3	Low	66.4	Low	156 Å²	156	65.3 Å²	65.3	73%	0.729	36%	0.357	S	S	*	.	H	α-helix	trans	-71.2	-41	175	-64.2	-176.6	173	0	0	111.4	S898 L902 I903 A904	S898-E900 PolarHBondContact O-N 3.44Å; S898-E900 PolarHBondContact OG-N 3.27Å; E900-L902 VanDerWaalsContact C-N 3.31Å; E900-L902 PolarHBondContact O-N 3.21Å; E900-I903 PolarHBondContact O-N 3.38Å; E900-I903 VanDerWaalsContact O-N 3.15Å; E900-A904 PolarHBondContact O-N 3Å
901	D	68.1	Low	66	Low	75 Å²	75	65.5 Å²	65.5	40%	0.401	37%	0.367	S	S	.	.	H	α-helix	trans	-62.6	-39.6	175.5	-58.1	-43.1	0	0	0	111.4	M897 S898 A904 I905	M897-D901 HydrophobicContact CB-CB 3.96Å; M897-D901 HydrophobicContact CE-CB 3.65Å; M897-D901 WeakPolarHBondContact CE-O 3.45Å; M897-D901 HydrophobicContact CG-CB 4.2Å; S898-D901 VanDerWaalsContact CB-OD2 3.26Å; S898-D901 WeakPolarHBondContact CB-OD2 3.47Å; S898-D901 PolarHBondContact N-OD2 3.11Å; S898-D901 PolarHBondContact O-N 3.03Å; S898-D901 PolarHBondContact OG-N 3.41Å; S898-D901 VanDerWaalsContact OG-N 3.1Å; S898-D901 PolarHBondContact OG-OD2 2.94Å; D901-A904 WeakPolarHBondContact O-CB 3.47Å; D901-A904 PolarHBondContact O-N 3.33Å; D901-I905 PolarHBondContact O-N 3.48Å
902	L	69.1	Low	65.9	Low	8 Å²	8	66.4 Å²	66.4	4%	0.042	37%	0.372	C	S	.	.	H	α-helix	trans	-64.3	-42.6	174.1	-68.4	172.3	0	0	0	111.2	M897 S898 E900 A904 I905 L907 R913	M897-L902 HydrophobicContact CB-CD2 4.32Å; M897-L902 HydrophobicContact CB-CG 4.35Å; M897-L902 HydrophobicContact CE-CD2 4.34Å; M897-L902 HydrophobicContact SD-CD2 4.35Å; S898-L902 WeakPolarHBondContact O-CG 3.43Å; S898-L902 PolarHBondContact O-N 3.23Å; S898-L902 VanDerWaalsContact O-N 3.08Å; E900-L902 VanDerWaalsContact C-N 3.31Å; E900-L902 PolarHBondContact O-N 3.21Å; L902-A904 VanDerWaalsContact C-N 3.27Å; L902-A904 PolarHBondContact O-N 2.95Å; L902-I905 HydrophobicContact CD2-CD1 4.1Å; L902-I905 WeakPolarHBondContact O-CG1 3.21Å; L902-I905 PolarHBondContact O-N 3.37Å; L902-L907 HydrophobicContact CB-CB 4.26Å; L902-L907 HydrophobicContact CD2-CD1 3.97Å; L902-L907 VanDerWaalsContact O-CB 3.25Å; L902-L907 WeakPolarHBondContact O-CB 3.31Å; L902-L907 PolarHBondContact O-N 2.99Å; L902-R913 HydrophobicContact CD1-CB 3.86Å; L902-R913 HydrophobicContact CD1-CG 4Å
903	I	68.1	Low	65.8	Low	88 Å²	88	67.3 Å²	67.3	45%	0.451	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-38.8	175.7	-70.5	163.8	0	0	0	110.6	Q899 E900 I905 G906	Q899-I903 HydrophobicContact CG-CD1 4.32Å; Q899-I903 WeakPolarHBondContact O-CD1 3.45Å; Q899-I903 VanDerWaalsContact O-CG1 3.23Å; Q899-I903 WeakPolarHBondContact O-CG1 3.44Å; Q899-I903 PolarHBondContact O-N 2.96Å; E900-I903 PolarHBondContact O-N 3.38Å; E900-I903 VanDerWaalsContact O-N 3.15Å; I903-I905 VanDerWaalsContact C-N 3.34Å; I903-I905 PolarHBondContact O-N 2.99Å; I903-G906 PolarHBondContact O-N 2.95Å
904	A	65.3	Low	65.5	Low	73 Å²	73	70.2 Å²	70.2	60%	0.603	38%	0.38	S	S	*	.	H	α-helix	trans	-60.6	-40.2	179.3	0	0	0	0	0	112.6	E900 D901 L902 G906	E900-A904 PolarHBondContact O-N 3Å; D901-A904 WeakPolarHBondContact O-CB 3.47Å; D901-A904 PolarHBondContact O-N 3.33Å; L902-A904 VanDerWaalsContact C-N 3.27Å; L902-A904 PolarHBondContact O-N 2.95Å; A904-G906 PolarHBondContact O-N 3.18Å
905	I	63.9	Low	65.3	Low	13 Å²	13	76.8 Å²	76.8	7%	0.067	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	8.3	175	63.6	164.7	0	0	0	113.9	L875 M897 D901 L902 I903 L907	L875-I905 HydrophobicContact CD2-CD1 3.63Å; M897-I905 HydrophobicContact CE-CD1 3.87Å; M897-I905 HydrophobicContact CE-CG1 4.18Å; M897-I905 HydrophobicContact CE-CG2 3.9Å; M897-I905 HydrophobicContact SD-CD1 4.49Å; D901-I905 PolarHBondContact O-N 3.48Å; L902-I905 HydrophobicContact CD2-CD1 4.1Å; L902-I905 WeakPolarHBondContact O-CG1 3.21Å; L902-I905 PolarHBondContact O-N 3.37Å; I903-I905 VanDerWaalsContact C-N 3.34Å; I903-I905 PolarHBondContact O-N 2.99Å; I905-L907 HydrophobicContact CD1-CD1 3.93Å; I905-L907 HydrophobicContact CG1-CD1 4.38Å
906	G	60.8	Low	65.4	Low	39 Å²	39	76.5 Å²	76.5	40%	0.402	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.1	7.6	175.5	0	0	0	0	0	116	I903 A904 T908	I903-G906 PolarHBondContact O-N 2.95Å; A904-G906 PolarHBondContact O-N 3.18Å; G906-T908 PolarHBondContact O-N 3.46Å
907	L	66.5	Low	65.5	Low	16 Å²	16	71.4 Å²	71.4	8%	0.084	38%	0.379	C	S	.	.			trans	-86.6	86.8	177.3	-86.1	162.7	0	0	0	112	L871 L902 I905 V912	L871-L907 HydrophobicContact CD1-CD1 4.11Å; L871-L907 HydrophobicContact CD1-CD2 3.72Å; L871-L907 HydrophobicContact CD1-CG 4.42Å; L871-L907 HydrophobicContact CD2-CD1 4.44Å; L871-L907 HydrophobicContact CD2-CD2 3.22Å; L871-L907 HydrophobicContact CD2-CG 3.95Å; L871-L907 HydrophobicContact CG-CD2 4.08Å; L902-L907 HydrophobicContact CB-CB 4.26Å; L902-L907 HydrophobicContact CD2-CD1 3.97Å; L902-L907 VanDerWaalsContact O-CB 3.25Å; L902-L907 WeakPolarHBondContact O-CB 3.31Å; L902-L907 PolarHBondContact O-N 2.99Å; I905-L907 HydrophobicContact CD1-CD1 3.93Å; I905-L907 HydrophobicContact CG1-CD1 4.38Å; L907-V912 HydrophobicContact CD2-CB 4.34Å; L907-V912 HydrophobicContact CD2-CG1 3.81Å; L907-V912 HydrophobicContact CD2-CG2 4.45Å
908	T	59.5	Low	65.4	Low	117 Å²	117	77.3 Å²	77.3	72%	0.718	40%	0.4	S	S	*	.			trans	-90	-8.2	-179.4	55.5	0	0	0	0	114.7	G906 Y910	G906-T908 PolarHBondContact O-N 3.46Å; T908-Y910 PolarHBondContact O-N 2.92Å
909	S	58.8	Low	65.5	Low	71 Å²	71	76.2 Å²	76.2	50%	0.497	39%	0.393	S	S	.	.			trans	-81.7	117.4	-173.3	38.5	0	0	0	0	113	G911 V912	S909-G911 PolarHBondContact O-N 3.09Å; S909-V912 PolarHBondContact O-N 3.31Å; S909-V912 WeakPolarHBondContact OG-CG2 3.3Å
910	Y	56.3	Low	65.5	Low	216 Å²	216	72.6 Å²	72.6	85%	0.847	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	123.8	175.2	-117.8	-95.6	0	0	0	110.8	T908	T908-Y910 PolarHBondContact O-N 2.92Å
911	G	63.6	Low	65.1	Low	43 Å²	43	71 Å²	71	44%	0.443	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.2	-15.1	177	0	0	0	0	0	115.6	S909 R913 H914 R915	S909-G911 PolarHBondContact O-N 3.09Å; G911-R913 PolarHBondContact O-N 2.92Å; G911-H914 PolarHBondContact O-N 3.13Å; G911-R915 PolarHBondContact O-N 2.98Å
912	V	67.5	Low	64.8	Low	21 Å²	21	74.2 Å²	74.2	13%	0.127	38%	0.379	C	S	.	.	H	α-helix	trans	-62.9	-42	177.7	175.6	0	0	0	0	111.5	L868 L871 L907 S909 H914 R915 L916	L868-V912 HydrophobicContact CD1-CG1 3.94Å; L871-V912 HydrophobicContact CD1-CG1 4.08Å; L907-V912 HydrophobicContact CD2-CB 4.34Å; L907-V912 HydrophobicContact CD2-CG1 3.81Å; L907-V912 HydrophobicContact CD2-CG2 4.45Å; S909-V912 PolarHBondContact O-N 3.31Å; S909-V912 WeakPolarHBondContact OG-CG2 3.3Å; V912-H914 VanDerWaalsContact C-N 3.33Å; V912-H914 PolarHBondContact O-N 3.12Å; V912-R915 WeakPolarHBondContact O-CB 3.43Å; V912-R915 PolarHBondContact O-N 3.09Å; V912-R915 VanDerWaalsContact O-N 3.13Å; V912-L916 HydrophobicContact CG1-CD1 4.05Å; V912-L916 WeakPolarHBondContact O-CB 3.5Å; V912-L916 PolarHBondContact O-N 3.29Å
913	R	68.6	Low	64.2	Low	79 Å²	79	74.2 Å²	74.2	30%	0.298	38%	0.379	S	S	.	.	H	α-helix	trans	-54.8	-47.7	173.1	-179.4	178	176.1	72.6	-1.4	112	M897 L902 G911 R915 L916 M917	M897-R913 PolarHBondContact O-NH1 3.22Å; L902-R913 HydrophobicContact CD1-CB 3.86Å; L902-R913 HydrophobicContact CD1-CG 4Å; G911-R913 PolarHBondContact O-N 2.92Å; R913-R915 VanDerWaalsContact C-N 3.29Å; R913-R915 PolarHBondContact O-N 3.07Å; R913-L916 WeakPolarHBondContact O-CB 3.48Å; R913-L916 PolarHBondContact O-N 3.41Å; R913-M917 HydrophobicContact CG-CG 4.4Å; R913-M917 WeakPolarHBondContact O-CG 3Å; R913-M917 PolarHBondContact O-N 3.27Å
914	H	64.6	Low	63.3	Low	127 Å²	127	71.8 Å²	71.8	59%	0.588	37%	0.368	S	S	*	.	H	α-helix	trans	-63.3	-38.6	179.9	-172.2	72.9	0	0	0	111.4	G911 V912 R918	G911-H914 PolarHBondContact O-N 3.13Å; V912-H914 VanDerWaalsContact C-N 3.33Å; V912-H914 PolarHBondContact O-N 3.12Å; H914-R918 WeakPolarHBondContact O-CB 3.48Å; H914-R918 PolarHBondContact O-N 3.24Å
915	R	69.2	Low	62.4	Low	146 Å²	146	74.1 Å²	74.1	55%	0.551	37%	0.369	S	S	*	.	H	α-helix	trans	-68.3	-40.2	177.2	-147.7	-178.8	-139.9	-179.4	4	112.4	G911 V912 R913 S919	G911-R915 PolarHBondContact O-N 2.98Å; V912-R915 WeakPolarHBondContact O-CB 3.43Å; V912-R915 PolarHBondContact O-N 3.09Å; V912-R915 VanDerWaalsContact O-N 3.13Å; R913-R915 VanDerWaalsContact C-N 3.29Å; R913-R915 PolarHBondContact O-N 3.07Å; R915-S919 VanDerWaalsContact O-CB 3.31Å; R915-S919 WeakPolarHBondContact O-CB 3.29Å; R915-S919 PolarHBondContact O-N 3.11Å; R915-S919 VanDerWaalsContact O-N 3.14Å; R915-S919 PolarHBondContact O-OG 3.23Å
916	L	70.6	Confident	61.4	Low	8 Å²	8	76.9 Å²	76.9	4%	0.042	40%	0.401	C	S	.	.	H	α-helix	trans	-58.7	-59.7	173.2	-105	152.5	0	0	0	110.8	F862 L894 V912 R913 R918 S919 I920	F862-L916 HydrophobicContact CE1-CD2 3.67Å; F862-L916 HydrophobicContact CZ-CD2 4.31Å; L894-L916 HydrophobicContact CD2-CD2 3.39Å; L894-L916 HydrophobicContact CG-CD2 4.01Å; V912-L916 HydrophobicContact CG1-CD1 4.05Å; V912-L916 WeakPolarHBondContact O-CB 3.5Å; V912-L916 PolarHBondContact O-N 3.29Å; R913-L916 WeakPolarHBondContact O-CB 3.48Å; R913-L916 PolarHBondContact O-N 3.41Å; L916-R918 PolarHBondContact O-N 3.34Å; L916-S919 PolarHBondContact O-N 2.92Å; L916-I920 HydrophobicContact CD2-CD1 4.13Å; L916-I920 WeakPolarHBondContact O-CG1 3.31Å; L916-I920 PolarHBondContact O-N 3.22Å
917	M	66.8	Low	60	Low	55 Å²	55	82 Å²	82	27%	0.271	41%	0.414	S	S	.	.	H	α-helix	trans	-57.4	-47.6	-178.1	-67.5	-58.3	-67.5	0	0	112	V895 R913 S919 I920 E921	V895-M917 HydrophobicContact CG1-CE 4.21Å; V895-M917 HydrophobicContact CG1-SD 4.4Å; R913-M917 HydrophobicContact CG-CG 4.4Å; R913-M917 WeakPolarHBondContact O-CG 3Å; R913-M917 PolarHBondContact O-N 3.27Å; M917-S919 PolarHBondContact O-N 3.27Å; M917-I920 PolarHBondContact O-N 3.49Å; M917-E921 WeakPolarHBondContact O-CB 3.39Å; M917-E921 WeakPolarHBondContact O-CG 3.2Å; M917-E921 PolarHBondContact O-N 3.04Å
918	R	65.1	Low	58.6	Low	146 Å²	146	83.7 Å²	83.7	55%	0.551	43%	0.426	S	S	*	.	H	α-helix	trans	-65.4	-25.5	-179.7	-167.4	175.3	-175.7	-178.2	1.3	113.3	H914 L916 K922	H914-R918 WeakPolarHBondContact O-CB 3.48Å; H914-R918 PolarHBondContact O-N 3.24Å; L916-R918 PolarHBondContact O-N 3.34Å; R918-K922 WeakPolarHBondContact O-CG 3.49Å
919	S	66.9	Low	57.5	Low	20 Å²	20	82.5 Å²	82.5	14%	0.14	42%	0.418	C	S	.	.	H	α-helix	trans	-85.2	-34.7	177.6	-56.6	0	0	0	0	111.7	R915 L916 M917 K922 L923	R915-S919 VanDerWaalsContact O-CB 3.31Å; R915-S919 WeakPolarHBondContact O-CB 3.29Å; R915-S919 PolarHBondContact O-N 3.11Å; R915-S919 VanDerWaalsContact O-N 3.14Å; R915-S919 PolarHBondContact O-OG 3.23Å; L916-S919 PolarHBondContact O-N 2.92Å; M917-S919 PolarHBondContact O-N 3.27Å; S919-K922 WeakPolarHBondContact O-CB 3.47Å; S919-K922 PolarHBondContact O-N 2.98Å; S919-L923 PolarHBondContact O-N 3.23Å
920	I	67.1	Low	56.6	Low	7 Å²	7	82.6 Å²	82.6	4%	0.036	43%	0.431	C	S	.	.	H	α-helix	trans	-65.7	-44.3	172	-64.3	172.4	0	0	0	110.1	L854 F862 M891 V895 L916 M917 K922 L923 T924	L854-I920 HydrophobicContact CD2-CG2 3.97Å; F862-I920 HydrophobicContact CE1-CG1 4.34Å; F862-I920 HydrophobicContact CE2-CG1 4.06Å; F862-I920 HydrophobicContact CZ-CD1 4.38Å; F862-I920 HydrophobicContact CZ-CG1 3.62Å; M891-I920 HydrophobicContact SD-CD1 3.77Å; M891-I920 HydrophobicContact SD-CG1 4.06Å; V895-I920 HydrophobicContact CG2-CD1 3.46Å; V895-I920 VanDerWaalsContact CG2-CD1 3.46Å; V895-I920 HydrophobicContact CG2-CG1 4.49Å; V895-I920 HydrophobicContact CG2-CG2 3.84Å; L916-I920 HydrophobicContact CD2-CD1 4.13Å; L916-I920 WeakPolarHBondContact O-CG1 3.31Å; L916-I920 PolarHBondContact O-N 3.22Å; M917-I920 PolarHBondContact O-N 3.49Å; I920-K922 PolarHBondContact O-N 2.92Å; I920-K922 VanDerWaalsContact O-N 3.13Å; I920-L923 WeakPolarHBondContact O-CB 3.45Å; I920-L923 PolarHBondContact O-N 3.08Å; I920-T924 PolarHBondContact O-N 3.26Å; I920-T924 PolarHBondContact O-OG1 3.08Å; I920-T924 VanDerWaalsContact O-OG1 3.12Å
921	E	60	Low	55.9	Low	123 Å²	123	75 Å²	75	58%	0.575	41%	0.408	S	S	*	.	H	α-helix	trans	-56.6	-27.9	172.5	-77.9	177.8	169.9	0	0	113.5	M917	M917-E921 WeakPolarHBondContact O-CB 3.39Å; M917-E921 WeakPolarHBondContact O-CG 3.2Å; M917-E921 PolarHBondContact O-N 3.04Å
922	K	61.8	Low	54.9	Low	143 Å²	143	78.1 Å²	78.1	62%	0.622	42%	0.419	S	S	*	.	H	α-helix	trans	-78.7	-25.7	175.1	-77.1	175.5	-179.3	179.9	0	113.1	R918 S919 I920	R918-K922 WeakPolarHBondContact O-CG 3.49Å; S919-K922 WeakPolarHBondContact O-CB 3.47Å; S919-K922 PolarHBondContact O-N 2.98Å; I920-K922 PolarHBondContact O-N 2.92Å; I920-K922 VanDerWaalsContact O-N 3.13Å
923	L	56.9	Low	54	Low	8 Å²	8	78.5 Å²	78.5	4%	0.042	42%	0.42	C	S	.	.	H	α-helix	trans	-81.4	-40.5	177	-78	157.3	0	0	0	110.8	L846 M857 F862 S919 I920 I925	L846-L923 HydrophobicContact CD1-CD2 3.86Å; L846-L923 HydrophobicContact CG-CD2 3.79Å; M857-L923 HydrophobicContact CE-CB 4.39Å; M857-L923 HydrophobicContact CE-CD1 4.01Å; M857-L923 HydrophobicContact CE-CD2 4.07Å; M857-L923 HydrophobicContact CE-CG 4.38Å; F862-L923 HydrophobicContact CD2-CD1 3.35Å; F862-L923 HydrophobicContact CE2-CD1 3.36Å; S919-L923 PolarHBondContact O-N 3.23Å; I920-L923 WeakPolarHBondContact O-CB 3.45Å; I920-L923 PolarHBondContact O-N 3.08Å; L923-I925 PolarHBondContact O-N 3.45Å
924	T	49.8	Very low	53.1	Low	37 Å²	37	79.4 Å²	79.4	23%	0.227	44%	0.436	C	S	.	.	S	Bend	trans	-87.9	84.8	176.2	53.8	0	0	0	0	110.1	L854 I920 G926	L854-T924 HydrophobicContact CD1-CG2 4.36Å; L854-T924 HydrophobicContact CG-CG2 4.43Å; I920-T924 PolarHBondContact O-N 3.26Å; I920-T924 PolarHBondContact O-OG1 3.08Å; I920-T924 VanDerWaalsContact O-OG1 3.12Å; T924-G926 PolarHBondContact O-N 3.07Å
925	I	45.4	Very low	52.4	Low	122 Å²	122	76.6 Å²	76.6	63%	0.626	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	99.2	176.3	-60.8	170.6	0	0	0	109.8	R850 L923 Q927	R850-I925 HydrophobicContact CG-CD1 4.49Å; L923-I925 PolarHBondContact O-N 3.45Å; I925-Q927 PolarHBondContact O-N 2.92Å
926	G	43.5	Very low	51.6	Low	71 Å²	71	73.1 Å²	73.1	73%	0.732	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	7.9	162	0	0	0	0	0	118.1	T924 P928	T924-G926 PolarHBondContact O-N 3.07Å; G926-P928 WeakPolarHBondContact O-CD 3.32Å
927	Q	32.3	Very low	50.7	Low	145 Å²	145	75 Å²	75	68%	0.678	44%	0.443	S	S	*	.			trans	-109.9	96.7	170.5	-72	-172.4	-3.9	0	0	110.6	I925 V929	I925-Q927 PolarHBondContact O-N 2.92Å; Q927-V929 PolarHBondContact O-N 3.09Å; Q927-V929 VanDerWaalsContact O-N 3.17Å
928	P	35.6	Very low	49.7	Very low	52 Å²	52	79.1 Å²	79.1	34%	0.338	47%	0.474	S	S	.	.			trans	-66.5	115.4	166	27	-29	0	0	0	108.2	G926 G930 C931	G926-P928 WeakPolarHBondContact O-CD 3.32Å; P928-G930 PolarHBondContact O-N 3.33Å; P928-C931 HydrophobicContact CG-CB 4.4Å; P928-C931 PolarHBondContact O-N 3.48Å
929	V	37.5	Very low	48.4	Very low	92 Å²	92	75.1 Å²	75.1	56%	0.558	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	121.2	179	-171	0	0	0	0	108.6	Q927	Q927-V929 PolarHBondContact O-N 3.09Å; Q927-V929 VanDerWaalsContact O-N 3.17Å
930	G	40.5	Very low	47	Very low	74 Å²	74	79.2 Å²	79.2	76%	0.763	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.3	-4.9	176.8	0	0	0	0	0	117.8	P928	P928-G930 PolarHBondContact O-N 3.33Å
931	C	40.5	Very low	45.6	Very low	55 Å²	55	85 Å²	85	37%	0.372	54%	0.538	S	S	.	.			trans	-125.1	41.7	-175.1	-75.2	0	0	0	0	114.1	P928 M933	P928-C931 HydrophobicContact CG-CB 4.4Å; P928-C931 PolarHBondContact O-N 3.48Å; C931-M933 PolarHBondContact O-N 3.32Å
932	T	42.8	Very low	44.9	Very low	110 Å²	110	82.5 Å²	82.5	68%	0.675	55%	0.545	S	S	*	.			trans	-74.6	111.2	176.4	48.4	0	0	0	0	110.8	P934	T932-P934 VanDerWaalsContact O-CD 3.32Å; T932-P934 WeakPolarHBondContact O-CD 3.4Å
933	M	48.3	Very low	44	Very low	29 Å²	29	81.1 Å²	81.1	14%	0.143	54%	0.539	C	S	.	.			trans	-68.8	117.1	163.5	-97.9	-70.9	-113.2	0	0	109	C931 G935 F936 F1011 W1016 Y1165	C931-M933 PolarHBondContact O-N 3.32Å; M933-G935 PolarHBondContact O-N 3.32Å; M933-F936 HydrophobicContact CB-CB 3.97Å; M933-F936 HydrophobicContact CB-CD2 3.82Å; M933-F936 HydrophobicContact CB-CG 4.31Å; M933-F936 HydrophobicContact CG-CD2 4.24Å; M933-F936 PolarHBondContact O-N 3.37Å; M933-F1011 HydrophobicContact CE-CD1 4.25Å; M933-W1016 HydrophobicContact CE-CB 4.17Å; M933-W1016 HydrophobicContact CE-CD2 3.61Å; M933-W1016 HydrophobicContact CE-CE3 3.63Å; M933-W1016 HydrophobicContact CE-CG 3.85Å; M933-W1016 HydrophobicContact CE-CZ3 4.2Å; M933-W1016 HydrophobicContact CG-CB 4.34Å; M933-W1016 HydrophobicContact CG-CD2 3.91Å; M933-W1016 HydrophobicContact CG-CG 3.61Å; M933-W1016 HydrophobicContact SD-CB 4.44Å; M933-W1016 HydrophobicContact SD-CD2 3.17Å; M933-W1016 HydrophobicContact SD-CE3 3.62Å; M933-W1016 HydrophobicContact SD-CG 3.55Å; M933-W1016 VanDerWaalsContact SD-CG 3.55Å; M933-W1016 HydrophobicContact SD-CH2 3.93Å; M933-W1016 HydrophobicContact SD-CZ2 3.52Å; M933-W1016 VanDerWaalsContact SD-CZ2 3.52Å; M933-W1016 HydrophobicContact SD-CZ3 3.98Å; M933-W1016 PolarHBondContact SD-NE1 2.53Å; M933-Y1165 HydrophobicContact CE-CE1 4.12Å; M933-Y1165 WeakPolarHBondContact CE-OH 3.49Å
934	P	49.3	Very low	43.8	Very low	97 Å²	97	86.9 Å²	86.9	63%	0.63	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	123.9	177	-19.8	32	0	0	0	110.7	T932	T932-P934 VanDerWaalsContact O-CD 3.32Å; T932-P934 WeakPolarHBondContact O-CD 3.4Å
935	G	50.5	Low	44.7	Very low	68 Å²	68	86.5 Å²	86.5	70%	0.701	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	82.3	13.3	176.5	0	0	0	0	0	116	M933 P937 F1011	M933-G935 PolarHBondContact O-N 3.32Å; G935-P937 WeakPolarHBondContact O-CD 3.4Å; G935-F1011 WeakPolarHBondContact O-CZ 3.49Å
936	F	53.3	Low	46.3	Very low	73 Å²	73	82.5 Å²	82.5	32%	0.32	56%	0.559	S	S	.	*			trans	-66.9	120	174.7	-150.2	-85.8	0	0	0	110.2	M933 F1011	M933-F936 HydrophobicContact CB-CB 3.97Å; M933-F936 HydrophobicContact CB-CD2 3.82Å; M933-F936 HydrophobicContact CB-CG 4.31Å; M933-F936 HydrophobicContact CG-CD2 4.24Å; M933-F936 PolarHBondContact O-N 3.37Å; F936-F1011 HydrophobicContact CD2-CB 4.3Å; F936-F1011 AromaticContact CD2-CD1 3.44Å; F936-F1011 HydrophobicContact CD2-CD1 3.44Å; F936-F1011 VanDerWaalsContact CD2-CD1 3.44Å; F936-F1011 HydrophobicContact CD2-CE1 4.14Å; F936-F1011 HydrophobicContact CD2-CG 4.24Å; F936-F1011 HydrophobicContact CE2-CB 3.79Å; F936-F1011 AromaticContact CE2-CD1 3.83Å; F936-F1011 HydrophobicContact CE2-CD1 3.83Å; F936-F1011 HydrophobicContact CE2-CG 4.24Å; F936-F1011 HydrophobicContact CG-CD1 4.24Å; F936-F1011 HydrophobicContact CZ-CB 4.4Å
937	P	50.1	Low	48	Very low	48 Å²	48	81.8 Å²	81.8	31%	0.312	54%	0.538	S	S	.	.			trans	-65.9	142.7	178.4	23.6	-30.1	0	0	0	110.8	G935 C939 M947	G935-P937 WeakPolarHBondContact O-CD 3.4Å; P937-C939 PolarHBondContact O-N 3.12Å; P937-M947 HydrophobicContact CG-CE 4.39Å
938	P	46.3	Very low	50.5	Low	141 Å²	141	78.3 Å²	78.3	92%	0.916	52%	0.523	S	S	*	.			trans	-62.7	105.9	179.3	23.3	-30.9	0	0	0	109.6
939	C	38.3	Very low	52.9	Low	63 Å²	63	78.3 Å²	78.3	43%	0.426	52%	0.522	S	S	.	.			trans	-103.8	138	-174.5	-139.3	0	0	0	0	110.3	P937	P937-C939 PolarHBondContact O-N 3.12Å
940	S	36.3	Very low	55.2	Low	105 Å²	105	77.8 Å²	77.8	73%	0.734	52%	0.52	S	S	*	.			trans	-59.4	141.3	178.9	-50.2	0	0	0	0	110.9	G942	S940-G942 PolarHBondContact O-N 2.99Å; S940-G942 VanDerWaalsContact O-N 3.09Å
941	S	39.4	Very low	57.3	Low	129 Å²	129	75.2 Å²	75.2	90%	0.902	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.3	114.9	-178.8	52.9	0	0	0	0	112
942	G	43.9	Very low	59.3	Low	71 Å²	71	75.3 Å²	75.3	73%	0.732	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.8	-1.9	169.6	0	0	0	0	0	117.2	S940 V944	S940-G942 PolarHBondContact O-N 2.99Å; S940-G942 VanDerWaalsContact O-N 3.09Å; G942-V944 PolarHBondContact O-N 2.97Å
943	F	43.4	Very low	60.9	Low	114 Å²	114	75.7 Å²	75.7	50%	0.5	49%	0.486	S	S	.	.			trans	-75.8	110.7	175	-168.8	-95.8	0	0	0	111.6	G945 M947	F943-G945 VanDerWaalsContact CE1-CA 3.4Å; F943-G945 WeakPolarHBondContact CE1-O 3.43Å; F943-M947 HydrophobicContact CD1-CG 4.26Å; F943-M947 HydrophobicContact CD1-SD 4.33Å; F943-M947 HydrophobicContact CE1-CG 3.48Å; F943-M947 VanDerWaalsContact CE1-CG 3.48Å; F943-M947 HydrophobicContact CE1-SD 4.11Å; F943-M947 HydrophobicContact CZ-CG 3.87Å
944	V	53.6	Low	62.3	Low	128 Å²	128	80.4 Å²	80.4	78%	0.776	51%	0.512	S	S	*	.			trans	-104.5	13.5	179.4	-162.3	0	0	0	0	111.9	G942	G942-V944 PolarHBondContact O-N 2.97Å
945	G	67.5	Low	63.7	Low	30 Å²	30	79.6 Å²	79.6	31%	0.309	50%	0.5	S	S	.	.	S	Bend	trans	-94.1	-178	-174.2	0	0	0	0	0	115.5	F943	F943-G945 VanDerWaalsContact CE1-CA 3.4Å; F943-G945 WeakPolarHBondContact CE1-O 3.43Å
946	T	79.6	Confident	64.8	Low	37 Å²	37	83.2 Å²	83.2	23%	0.227	50%	0.501	C	S	.	.			trans	-95.3	129.7	168.2	-54.2	0	0	0	0	109.9	V1010 F1011 N1012 V1050 Q1051	T946-V1010 HydrophobicContact CG2-CG1 3.76Å; T946-F1011 WeakPolarHBondContact CA-O 3.1Å; T946-N1012 HydrophobicContact CG2-CB 4.13Å; T946-N1012 PolarHBondContact OG1-ND2 3.48Å; T946-V1050 HydrophobicContact CG2-CG1 3.62Å; T946-V1050 PolarHBondContact OG1-O 3.1Å; T946-Q1051 WeakPolarHBondContact OG1-CA 3.37Å
947	M	79.2	Confident	66	Low	57 Å²	57	82.3 Å²	82.3	28%	0.281	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	139.3	169.7	-64.5	177.7	65.8	0	0	110.1	P937 F943 F1011	P937-M947 HydrophobicContact CG-CE 4.39Å; F943-M947 HydrophobicContact CD1-CG 4.26Å; F943-M947 HydrophobicContact CD1-SD 4.33Å; F943-M947 HydrophobicContact CE1-CG 3.48Å; F943-M947 VanDerWaalsContact CE1-CG 3.48Å; F943-M947 HydrophobicContact CE1-SD 4.11Å; F943-M947 HydrophobicContact CZ-CG 3.87Å; M947-F1011 HydrophobicContact CB-CB 4.19Å; M947-F1011 PolarHBondContact N-O 2.92Å; M947-F1011 PolarHBondContact O-N 2.92Å
948	L	85.3	Confident	67.5	Low	72 Å²	72	80.2 Å²	80.2	38%	0.377	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	117.3	172.1	-67.7	-178.5	0	0	0	108	D1008 K1009 V1010 V1050 L1169	L948-D1008 HydrophobicContact CB-CB 4.14Å; L948-D1008 HydrophobicContact CD2-CB 4.32Å; L948-K1009 WeakPolarHBondContact CA-O 3.29Å; L948-V1010 HydrophobicContact CD2-CB 4.21Å; L948-V1010 HydrophobicContact CD2-CG1 4.36Å; L948-V1010 HydrophobicContact CD2-CG2 3.66Å; L948-V1050 HydrophobicContact CD2-CG1 3.82Å; L948-L1169 HydrophobicContact CD1-CD2 3.97Å
949	V	84.9	Confident	68.9	Low	52 Å²	52	76.4 Å²	76.4	32%	0.315	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.9	179	178.1	0	0	0	0	108.7	L951 D1008 K1009 F1011	V949-L951 PolarHBondContact O-N 3.16Å; V949-D1008 CarbonylContact O-C 3.59Å; V949-D1008 WeakPolarHBondContact O-CA 3.07Å; V949-K1009 PolarHBondContact N-O 2.88Å; V949-K1009 PolarHBondContact O-N 3.09Å; V949-F1011 HydrophobicContact CB-CD2 4.28Å; V949-F1011 HydrophobicContact CB-CE2 3.95Å; V949-F1011 HydrophobicContact CG2-CD2 3.65Å; V949-F1011 HydrophobicContact CG2-CE2 3.6Å
950	P	86.5	Confident	70.4	Confident	80 Å²	80	76 Å²	76	52%	0.519	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	130.1	176.3	-18.8	30.6	0	0	0	111	D1008	P950-D1008 WeakPolarHBondContact CA-OD1 3.24Å; P950-D1008 WeakPolarHBondContact CB-OD1 3.47Å; P950-D1008 WeakPolarHBondContact CG-OD1 3.39Å
951	L	85.2	Confident	72.1	Confident	21 Å²	21	71.2 Å²	71.2	11%	0.11	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-90	136.7	172.6	-61.4	176.5	0	0	0	109.8	V949 H955 E957 F958 V1007 K1009 Y1168	V949-L951 PolarHBondContact O-N 3.16Å; L951-H955 HydrophobicContact CB-CB 4.47Å; L951-E957 HydrophobicContact CD1-CB 3.73Å; L951-F958 HydrophobicContact CB-CB 4.14Å; L951-F958 HydrophobicContact CB-CD2 4.03Å; L951-F958 WeakPolarHBondContact O-CD2 3.42Å; L951-V1007 HydrophobicContact CD1-CG1 4.04Å; L951-V1007 PolarHBondContact N-O 3.45Å; L951-K1009 HydrophobicContact CD1-CB 4.48Å; L951-K1009 HydrophobicContact CD2-CB 4.37Å; L951-K1009 HydrophobicContact CG-CB 4.4Å; L951-Y1168 HydrophobicContact CD1-CD1 4.04Å; L951-Y1168 HydrophobicContact CD1-CE1 3.97Å
952	A	80.6	Confident	73.5	Confident	56 Å²	56	67.3 Å²	67.3	46%	0.463	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-69.8	150	172.4	0	0	0	0	0	110.3	D954 H955 F958	A952-D954 WeakPolarHBondContact CB-OD1 3.33Å; A952-D954 PolarHBondContact O-N 2.82Å; A952-H955 WeakPolarHBondContact O-CB 3.43Å; A952-H955 PolarHBondContact O-N 3.27Å; A952-F958 WeakPolarHBondContact O-CB 3.48Å; A952-F958 WeakPolarHBondContact O-CG 3.44Å
953	K	78.3	Confident	74.3	Confident	118 Å²	118	66.7 Å²	66.7	51%	0.513	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-29.5	-174.9	-69.2	-160.7	169	-151.1	0	113.8	H955 F958 M959	K953-H955 VanDerWaalsContact C-N 3.32Å; K953-F958 HydrophobicContact CB-CD1 4.27Å; K953-F958 HydrophobicContact CB-CE1 4.13Å; K953-F958 HydrophobicContact CB-CZ 4.49Å; K953-F958 HydrophobicContact CD-CE1 4.41Å; K953-F958 HydrophobicContact CD-CZ 4.41Å; K953-F958 HydrophobicContact CG-CD1 4.4Å; K953-F958 HydrophobicContact CG-CE1 3.81Å; K953-F958 HydrophobicContact CG-CE2 4.22Å; K953-F958 HydrophobicContact CG-CZ 3.75Å; K953-M959 WeakPolarHBondContact O-CG 3.46Å
954	D	77.1	Confident	74.3	Confident	129 Å²	129	69.8 Å²	69.8	69%	0.69	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-5.8	175.5	62	-35	0	0	0	113.3	A952	A952-D954 WeakPolarHBondContact CB-OD1 3.33Å; A952-D954 PolarHBondContact O-N 2.82Å
955	H	78.1	Confident	73.3	Confident	80 Å²	80	67.3 Å²	67.3	37%	0.37	37%	0.371	S	S	.	.	S	Bend	trans	-68.9	134.4	176.8	-166	-88.2	0	0	0	110	L951 A952 K953 E957 F958 M959	L951-H955 HydrophobicContact CB-CB 4.47Å; A952-H955 WeakPolarHBondContact O-CB 3.43Å; A952-H955 PolarHBondContact O-N 3.27Å; K953-H955 VanDerWaalsContact C-N 3.32Å; H955-E957 IonicContact CE1-OE2 3.92Å; H955-E957 WeakPolarHBondContact ND1-CB 3.31Å; H955-E957 PolarHBondContact ND1-N 3.29Å; H955-E957 PolarHBondContact O-N 2.83Å; H955-E957 VanDerWaalsContact O-N 3.12Å; H955-F958 HydrophobicContact CB-CB 4.24Å; H955-F958 WeakPolarHBondContact O-CA 3.38Å; H955-F958 WeakPolarHBondContact O-CB 3.41Å; H955-F958 PolarHBondContact O-N 3.06Å; H955-M959 PolarHBondContact O-N 2.78Å
956	I	74.9	Confident	71.5	Confident	143 Å²	143	72.9 Å²	72.9	73%	0.733	39%	0.392	S	S	*	.	H	α-helix	trans	-53.8	-40	-177.4	-63.1	170.4	0	0	0	111.6	M959 A960	I956-M959 PolarHBondContact O-N 3.25Å; I956-A960 VanDerWaalsContact O-CB 3.29Å; I956-A960 WeakPolarHBondContact O-CB 3.47Å; I956-A960 PolarHBondContact O-N 3.08Å
957	E	78.2	Confident	69.1	Low	55 Å²	55	77.3 Å²	77.3	26%	0.257	41%	0.413	S	S	.	.	H	α-helix	trans	-68	-32.9	176.3	-62.9	-178.5	174.8	0	0	113.1	L951 H955 V961 K1009 Y1168	L951-E957 HydrophobicContact CD1-CB 3.73Å; H955-E957 IonicContact CE1-OE2 3.92Å; H955-E957 WeakPolarHBondContact ND1-CB 3.31Å; H955-E957 PolarHBondContact ND1-N 3.29Å; H955-E957 PolarHBondContact O-N 2.83Å; H955-E957 VanDerWaalsContact O-N 3.12Å; E957-V961 VanDerWaalsContact O-CG2 3.3Å; E957-V961 WeakPolarHBondContact O-CG2 3.14Å; E957-V961 PolarHBondContact O-N 2.92Å; E957-K1009 IonicContact OE1-NZ 3.75Å; E957-K1009 PolarHBondContact OE1-NZ 2.82Å; E957-K1009 WeakPolarHBondContact OE2-CD 3.16Å; E957-K1009 IonicContact OE2-NZ 3.55Å; E957-K1009 PolarHBondContact OE2-NZ 2.96Å; E957-Y1168 HydrophobicContact CB-CE1 4.36Å
958	F	80.6	Confident	66.7	Low	3 Å²	3	81.5 Å²	81.5	1%	0.013	44%	0.437	C	S	.	.	H	α-helix	trans	-67.6	-49.4	174.6	-168.4	-75.8	0	0	0	109.8	L951 A952 K953 H955 A960 V961 E962 V1004 V1007	L951-F958 HydrophobicContact CB-CB 4.14Å; L951-F958 HydrophobicContact CB-CD2 4.03Å; L951-F958 WeakPolarHBondContact O-CD2 3.42Å; A952-F958 WeakPolarHBondContact O-CB 3.48Å; A952-F958 WeakPolarHBondContact O-CG 3.44Å; K953-F958 HydrophobicContact CB-CD1 4.27Å; K953-F958 HydrophobicContact CB-CE1 4.13Å; K953-F958 HydrophobicContact CB-CZ 4.49Å; K953-F958 HydrophobicContact CD-CE1 4.41Å; K953-F958 HydrophobicContact CD-CZ 4.41Å; K953-F958 HydrophobicContact CG-CD1 4.4Å; K953-F958 HydrophobicContact CG-CE1 3.81Å; K953-F958 HydrophobicContact CG-CE2 4.22Å; K953-F958 HydrophobicContact CG-CZ 3.75Å; H955-F958 HydrophobicContact CB-CB 4.24Å; H955-F958 WeakPolarHBondContact O-CA 3.38Å; H955-F958 WeakPolarHBondContact O-CB 3.41Å; H955-F958 PolarHBondContact O-N 3.06Å; F958-A960 VanDerWaalsContact C-N 3.29Å; F958-A960 PolarHBondContact O-N 3.19Å; F958-V961 WeakPolarHBondContact O-CB 3.11Å; F958-V961 PolarHBondContact O-N 3.24Å; F958-E962 HydrophobicContact CD1-CB 4.08Å; F958-E962 HydrophobicContact CE1-CB 4.05Å; F958-E962 VanDerWaalsContact CE1-CD 3.45Å; F958-E962 HydrophobicContact CE1-CG 4.29Å; F958-E962 WeakPolarHBondContact CE1-OE2 3.49Å; F958-E962 WeakPolarHBondContact O-CB 3.34Å; F958-E962 PolarHBondContact O-N 3.43Å; F958-V1004 HydrophobicContact CZ-CG1 4.21Å; F958-V1007 HydrophobicContact CD2-CB 3.64Å; F958-V1007 HydrophobicContact CD2-CG2 3.74Å; F958-V1007 HydrophobicContact CE2-CB 3.81Å; F958-V1007 HydrophobicContact CE2-CG2 3.65Å; F958-V1007 HydrophobicContact CG-CB 4.41Å; F958-V1007 HydrophobicContact CG-CG2 4.24Å; F958-V1007 HydrophobicContact CZ-CG2 4.07Å
959	M	75.2	Confident	64.3	Low	61 Å²	61	86.4 Å²	86.4	30%	0.3	46%	0.455	S	S	.	.	H	α-helix	trans	-60	-38.4	176.2	-61.7	179.6	71.7	0	0	111.5	K953 H955 I956 V961 E962 D963 V965	K953-M959 WeakPolarHBondContact O-CG 3.46Å; H955-M959 PolarHBondContact O-N 2.78Å; I956-M959 PolarHBondContact O-N 3.25Å; M959-V961 PolarHBondContact O-N 2.94Å; M959-E962 PolarHBondContact O-N 3.32Å; M959-D963 HydrophobicContact CB-CB 4.3Å; M959-D963 WeakPolarHBondContact O-CA 3.32Å; M959-D963 WeakPolarHBondContact O-CB 3.37Å; M959-D963 PolarHBondContact O-N 3.34Å; M959-V965 HydrophobicContact CE-CG2 4.18Å
960	A	70.4	Confident	61.6	Low	56 Å²	56	93.2 Å²	93.2	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-25.7	176.2	0	0	0	0	0	113.5	I956 F958	I956-A960 VanDerWaalsContact O-CB 3.29Å; I956-A960 WeakPolarHBondContact O-CB 3.47Å; I956-A960 PolarHBondContact O-N 3.08Å; F958-A960 VanDerWaalsContact C-N 3.29Å; F958-A960 PolarHBondContact O-N 3.19Å
961	V	72.7	Confident	58.8	Low	3 Å²	3	98.6 Å²	98.6	2%	0.018	50%	0.496	C	S	.	.	H	α-helix	trans	-85.2	-41.9	174.4	174.1	0	0	0	0	111.3	E957 F958 M959 V1007 L1108 Y1168 V1170	E957-V961 VanDerWaalsContact O-CG2 3.3Å; E957-V961 WeakPolarHBondContact O-CG2 3.14Å; E957-V961 PolarHBondContact O-N 2.92Å; F958-V961 WeakPolarHBondContact O-CB 3.11Å; F958-V961 PolarHBondContact O-N 3.24Å; M959-V961 PolarHBondContact O-N 2.94Å; V961-V1007 HydrophobicContact CB-CG1 4.41Å; V961-V1007 HydrophobicContact CB-CG2 4.24Å; V961-V1007 HydrophobicContact CG1-CG1 4.27Å; V961-V1007 HydrophobicContact CG1-CG2 3.83Å; V961-V1007 HydrophobicContact CG2-CG1 4.22Å; V961-L1108 HydrophobicContact CG2-CD2 3.87Å; V961-Y1168 HydrophobicContact CG2-CD2 4.49Å; V961-Y1168 HydrophobicContact CG2-CG 4.4Å; V961-V1170 HydrophobicContact CG1-CG1 4.4Å; V961-V1170 HydrophobicContact CG1-CG2 3.65Å
962	E	67.8	Low	56.1	Low	48 Å²	48	104.4 Å²	104.4	22%	0.224	53%	0.527	C	S	.	.	H	α-helix	trans	-82.1	-37.9	-173.1	-175.4	174.6	-127.9	0	0	114	F958 M959 V1004	F958-E962 HydrophobicContact CD1-CB 4.08Å; F958-E962 HydrophobicContact CE1-CB 4.05Å; F958-E962 VanDerWaalsContact CE1-CD 3.45Å; F958-E962 HydrophobicContact CE1-CG 4.29Å; F958-E962 WeakPolarHBondContact CE1-OE2 3.49Å; F958-E962 WeakPolarHBondContact O-CB 3.34Å; F958-E962 PolarHBondContact O-N 3.43Å; M959-E962 PolarHBondContact O-N 3.32Å; E962-V1004 HydrophobicContact CG-CB 4.06Å; E962-V1004 HydrophobicContact CG-CG2 4.31Å
963	D	62.4	Low	53.8	Low	57 Å²	57	111 Å²	111	31%	0.305	55%	0.545	S	S	.	.			trans	-113.4	158.6	-140.7	-136.6	-9.9	0	0	0	117.1	M959 V965	M959-D963 HydrophobicContact CB-CB 4.3Å; M959-D963 WeakPolarHBondContact O-CA 3.32Å; M959-D963 WeakPolarHBondContact O-CB 3.37Å; M959-D963 PolarHBondContact O-N 3.34Å; D963-V965 HydrophobicContact CB-CG2 4.07Å; D963-V965 WeakPolarHBondContact OD2-CG2 3.38Å
964	E	41.8	Very low	51.4	Low	180 Å²	180	112.6 Å²	112.6	84%	0.841	56%	0.56	S	S	*	*			trans	-94.6	18.7	179.5	-141.7	-175.9	-171.1	0	0	112.3	I966	E964-I966 PolarHBondContact O-N 3.41Å; E964-I966 VanDerWaalsContact O-N 3.13Å
965	V	32.9	Very low	49.3	Very low	75 Å²	75	112.4 Å²	112.4	46%	0.455	57%	0.565	S	S	.	*			trans	-81.5	102.5	-163.1	172.6	0	0	0	0	114	M959 D963 I967	M959-V965 HydrophobicContact CE-CG2 4.18Å; D963-V965 HydrophobicContact CB-CG2 4.07Å; D963-V965 WeakPolarHBondContact OD2-CG2 3.38Å; V965-I967 HydrophobicContact CG1-CB 4.39Å; V965-I967 HydrophobicContact CG1-CD1 3.43Å; V965-I967 VanDerWaalsContact CG1-CD1 3.43Å; V965-I967 HydrophobicContact CG1-CG1 3.44Å; V965-I967 VanDerWaalsContact CG1-CG1 3.44Å; V965-I967 PolarHBondContact O-N 2.87Å
966	I	29.6	Very low	47	Very low	148 Å²	148	115.8 Å²	115.8	76%	0.759	59%	0.585	S	S	*	*			trans	-63.5	105.1	153.4	-62	168.3	0	0	0	108.1	E964 D968	E964-I966 PolarHBondContact O-N 3.41Å; E964-I966 VanDerWaalsContact O-N 3.13Å; I966-D968 HydrophobicContact CG2-CB 4.33Å
967	I	29	Very low	44.9	Very low	129 Å²	129	115.6 Å²	115.6	66%	0.662	59%	0.585	S	S	*	*			trans	-115.2	92.6	158.8	-72.4	163.2	0	0	0	108	V965 F969	V965-I967 HydrophobicContact CG1-CB 4.39Å; V965-I967 HydrophobicContact CG1-CD1 3.43Å; V965-I967 VanDerWaalsContact CG1-CD1 3.43Å; V965-I967 HydrophobicContact CG1-CG1 3.44Å; V965-I967 VanDerWaalsContact CG1-CG1 3.44Å; V965-I967 PolarHBondContact O-N 2.87Å; I967-F969 HydrophobicContact CG2-CB 3.78Å; I967-F969 PolarHBondContact O-N 3.08Å
968	D	29.9	Very low	42.6	Very low	146 Å²	146	117.6 Å²	117.6	78%	0.781	61%	0.605	S	S	*	*			trans	-76.8	57	175.9	-147.8	13	0	0	0	110.5	I966	I966-D968 HydrophobicContact CG2-CB 4.33Å
969	F	33.6	Very low	40.5	Very low	175 Å²	175	124.1 Å²	124.1	77%	0.768	64%	0.64	S	S	*	*			trans	-99.4	-1.6	-178	-138.9	-93	0	0	0	115.3	I967	I967-F969 HydrophobicContact CG2-CB 3.78Å; I967-F969 PolarHBondContact O-N 3.08Å
970	F	29.1	Very low	39.1	Very low	194 Å²	194	131 Å²	131	85%	0.851	66%	0.662	S	S	*	*	S	Bend	trans	-118.8	92.4	168.3	-87.5	-84.3	0	0	0	111	N972	F970-N972 PolarHBondContact O-N 2.98Å
971	K	28.3	Very low	38.8	Very low	194 Å²	194	130.4 Å²	130.4	84%	0.843	65%	0.65	S	S	*	*			trans	-40.1	107.9	158.7	-72.2	175.8	175	175.6	0	110.3
972	N	28.4	Very low	38.7	Very low	143 Å²	143	130.5 Å²	130.5	77%	0.765	65%	0.65	S	S	*	*				155.4	123.7	126.8	-84.4	-39.4	0	0	0	112.5	F970	F970-N972 PolarHBondContact O-N 2.98Å
973	K	30.7	Very low	39.1	Very low	194 Å²	194	131.1 Å²	131.1	84%	0.843	65%	0.653	S	S	*	*	S	Bend	trans	73.2	108.4	153.2	-64	-176.5	177	-178.7	0	118.2
974	N	29.3	Very low	39.3	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	66%	0.662	S	S	*	*			trans	93.5	87.7	162.2	-66.4	-19.1	0	0	0	117.8	I976	N974-I976 VanDerWaalsContact C-N 3.32Å; N974-I976 PolarHBondContact O-N 3.22Å; N974-I976 VanDerWaalsContact O-N 3.14Å
975	P	32.8	Very low	40.5	Very low	124 Å²	124	124.2 Å²	124.2	81%	0.805	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	37.4	-175.6	36.4	-35.1	0	0	0	114.9
976	I	30.1	Very low	42.2	Very low	152 Å²	152	121.8 Å²	121.8	78%	0.779	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.6	-11.1	-178.8	-75.3	175.3	0	0	0	114.9	N974	N974-I976 VanDerWaalsContact C-N 3.32Å; N974-I976 PolarHBondContact O-N 3.22Å; N974-I976 VanDerWaalsContact O-N 3.14Å
977	N	29.4	Very low	43.8	Very low	138 Å²	138	118.7 Å²	118.7	74%	0.738	60%	0.6	S	S	*	*			trans	-123.8	28.4	-172.1	-74.7	-24.1	0	0	0	116.6	L979	N977-L979 PolarHBondContact O-N 3.31Å
978	S	30.6	Very low	45.2	Very low	97 Å²	97	116.4 Å²	116.4	68%	0.678	59%	0.587	S	S	*	*			trans	-71.7	77.3	171.7	-67.1	0	0	0	0	112.1	R980	S978-R980 PolarHBondContact O-N 3.43Å
979	L	37.1	Very low	46.3	Very low	141 Å²	141	111.3 Å²	111.3	74%	0.738	56%	0.558	S	S	*	*				29	86.8	125.7	-88.1	138.8	0	0	0	114.8	N977 H981	N977-L979 PolarHBondContact O-N 3.31Å; L979-H981 WeakPolarHBondContact CB-CE1 3.39Å; L979-H981 WeakPolarHBondContact CB-NE2 3.41Å; L979-H981 WeakPolarHBondContact CD2-CE1 3.45Å; L979-H981 PolarHBondContact O-CE1 3.45Å; L979-H981 PolarHBondContact O-NE2 3.19Å
980	R	45.7	Very low	46.8	Very low	205 Å²	205	110.8 Å²	110.8	77%	0.774	56%	0.558	S	S	*	*			trans	-105	128.3	169.2	-60.5	-177.6	174.3	179	-4.1	109.1	S978 S984	S978-R980 PolarHBondContact O-N 3.43Å; R980-S984 VanDerWaalsContact CB-OG 3.27Å; R980-S984 WeakPolarHBondContact CB-OG 3.36Å
981	H	63.9	Low	47.6	Very low	44 Å²	44	104.3 Å²	104.3	20%	0.204	54%	0.537	C	S	.	.			trans	-111.6	-37.7	-148.7	-72.7	-31	0	0	0	120.7	L979 F1040 K1124	L979-H981 WeakPolarHBondContact CB-CE1 3.39Å; L979-H981 WeakPolarHBondContact CB-NE2 3.41Å; L979-H981 WeakPolarHBondContact CD2-CE1 3.45Å; L979-H981 PolarHBondContact O-CE1 3.45Å; L979-H981 PolarHBondContact O-NE2 3.19Å; H981-F1040 WeakPolarHBondContact O-CE2 3.31Å; H981-K1124 WeakPolarHBondContact O-CE 3.5Å
982	M	71	Confident	48.6	Very low	4 Å²	4	100.1 Å²	100.1	2%	0.02	54%	0.538	C	S	.	.	S	Bend	trans	-140.2	-59.1	-179.6	-172.9	171	178.9	0	0	110.5	S984 T985 Y1002 V1004 F1040 L1106 A1126 V1170	M982-S984 VanDerWaalsContact C-N 3.33Å; M982-S984 PolarHBondContact O-N 3.14Å; M982-T985 PolarHBondContact O-N 2.85Å; M982-T985 VanDerWaalsContact O-N 3.09Å; M982-T985 PolarHBondContact O-OG1 3.35Å; M982-Y1002 HydrophobicContact CE-CD2 3.62Å; M982-Y1002 HydrophobicContact CE-CE2 4.37Å; M982-Y1002 HydrophobicContact CE-CG 4.49Å; M982-V1004 HydrophobicContact SD-CG2 4.2Å; M982-F1040 HydrophobicContact CB-CE2 4.29Å; M982-F1040 HydrophobicContact CB-CZ 3.88Å; M982-F1040 HydrophobicContact CE-CE1 4.47Å; M982-F1040 HydrophobicContact CG-CE1 4.36Å; M982-F1040 HydrophobicContact CG-CE2 4.25Å; M982-F1040 HydrophobicContact CG-CZ 3.77Å; M982-F1040 HydrophobicContact SD-CE1 4.04Å; M982-F1040 HydrophobicContact SD-CZ 3.96Å; M982-L1106 HydrophobicContact CE-CD2 3.77Å; M982-A1126 HydrophobicContact CG-CB 3.96Å; M982-V1170 HydrophobicContact CE-CG1 4.4Å
983	Q	75.1	Confident	49.2	Very low	62 Å²	62	98.9 Å²	98.9	29%	0.29	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-58	-41.4	-176.6	-54.6	-59.9	-19.4	0	0	112.9	T985 I986 Y1002	Q983-T985 PolarHBondContact O-N 3.2Å; Q983-T985 VanDerWaalsContact O-N 3.09Å; Q983-I986 PolarHBondContact O-N 3Å; Q983-I986 VanDerWaalsContact OE1-CD1 3.24Å; Q983-Y1002 PolarHBondContact NE2-O 3.41Å
984	S	67.2	Low	49.9	Very low	72 Å²	72	95.6 Å²	95.6	50%	0.503	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-67.8	-10.6	-179	65.9	0	0	0	0	115	R980 M982	R980-S984 VanDerWaalsContact CB-OG 3.27Å; R980-S984 WeakPolarHBondContact CB-OG 3.36Å; M982-S984 VanDerWaalsContact C-N 3.33Å; M982-S984 PolarHBondContact O-N 3.14Å
985	T	67.6	Low	50.8	Low	20 Å²	20	90.1 Å²	90.1	12%	0.123	51%	0.512	C	S	.	.	G	3₁₀ helix	trans	-107.6	3.1	-177.9	65.7	0	0	0	0	112.4	M982 Q983 V987 K1124 L1125 A1126 H1127	M982-T985 PolarHBondContact O-N 2.85Å; M982-T985 VanDerWaalsContact O-N 3.09Å; M982-T985 PolarHBondContact O-OG1 3.35Å; Q983-T985 PolarHBondContact O-N 3.2Å; Q983-T985 VanDerWaalsContact O-N 3.09Å; T985-V987 PolarHBondContact O-N 3.25Å; T985-K1124 WeakPolarHBondContact CG2-O 3.38Å; T985-L1125 HydrophobicContact CG2-CD2 4.4Å; T985-A1126 VanDerWaalsContact OG1-CB 3.25Å; T985-A1126 WeakPolarHBondContact OG1-CB 3.35Å; T985-A1126 PolarHBondContact OG1-N 2.69Å; T985-H1127 PolarHBondContact O-ND1 3.48Å
986	I	68.8	Low	51.9	Low	23 Å²	23	85.8 Å²	85.8	12%	0.118	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-74.3	120.1	175.8	-62.2	173.4	0	0	0	108.2	Q983 F999 Y1002	Q983-I986 PolarHBondContact O-N 3Å; Q983-I986 VanDerWaalsContact OE1-CD1 3.24Å; I986-F999 HydrophobicContact CG2-CD2 3.88Å; I986-F999 HydrophobicContact CG2-CE2 3.89Å; I986-Y1002 HydrophobicContact CD1-CD1 4.03Å; I986-Y1002 HydrophobicContact CD1-CD2 3.56Å; I986-Y1002 HydrophobicContact CD1-CE1 4.3Å; I986-Y1002 HydrophobicContact CD1-CE2 3.89Å; I986-Y1002 HydrophobicContact CD1-CG 3.66Å; I986-Y1002 HydrophobicContact CG1-CD2 4.05Å; I986-Y1002 HydrophobicContact CG1-CE2 3.9Å
987	V	63.1	Low	53.2	Low	84 Å²	84	79.4 Å²	79.4	51%	0.509	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-101.5	129.3	177.5	-177.9	0	0	0	0	109.7	T985	T985-V987 PolarHBondContact O-N 3.25Å
988	Q	57.2	Low	54.8	Low	81 Å²	81	77.3 Å²	77.3	38%	0.379	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-71.1	133.1	177.6	-168.8	-179.4	37.6	0	0	110.8	Q990 L998	Q988-Q990 PolarHBondContact O-N 3.44Å; Q988-L998 HydrophobicContact CG-CD2 4.28Å
989	H	54.4	Low	56.7	Low	38 Å²	38	72.8 Å²	72.8	18%	0.176	42%	0.418	C	S	.	.			trans	-74.7	108.5	173.3	-88.6	-115.8	0	0	0	111.1	I1069 Y1070	H989-I1069 PolarHBondContact NE2-O 2.97Å; H989-Y1070 PolarHBondContact CE1-N 3.48Å; H989-Y1070 PolarHBondContact NE2-N 2.97Å
990	Q	44	Very low	58.3	Low	165 Å²	165	70.1 Å²	70.1	77%	0.771	40%	0.404	S	S	*	.			trans	-107.2	112.4	169	-68.7	-177.2	2.1	0	0	109.4	Q988	Q988-Q990 PolarHBondContact O-N 3.44Å
991	S	46	Very low	59.7	Low	58 Å²	58	64.3 Å²	64.3	41%	0.406	39%	0.385	S	S	.	.			trans	-148	134.4	170	178.6	0	0	0	0	110.9	V993	S991-V993 PolarHBondContact O-N 3.42Å; S991-V993 VanDerWaalsContact O-N 3.11Å; S991-V993 PolarHBondContact OG-N 3.41Å
992	A	47.7	Very low	60.5	Low	106 Å²	106	62.6 Å²	62.6	88%	0.876	38%	0.376	S	S	*	.	S	Bend	trans	-61.2	-13.6	173.7	0	0	0	0	0	113.4
993	V	42.3	Very low	61.1	Low	117 Å²	117	65.5 Å²	65.5	71%	0.709	39%	0.392	S	S	*	.	S	Bend	trans	-115.5	55.5	-175.5	-161.6	0	0	0	0	110.3	S991 A995	S991-V993 PolarHBondContact O-N 3.42Å; S991-V993 VanDerWaalsContact O-N 3.11Å; S991-V993 PolarHBondContact OG-N 3.41Å; V993-A995 VanDerWaalsContact C-N 3.25Å; V993-A995 WeakPolarHBondContact O-CB 3.42Å; V993-A995 PolarHBondContact O-N 3.11Å
994	C	44.1	Very low	61.6	Low	124 Å²	124	62.6 Å²	62.6	84%	0.838	38%	0.379	S	S	*	.			trans	33.5	37.2	159.7	-67.1	0	0	0	0	118.8
995	A	49.4	Very low	62.5	Low	38 Å²	38	62 Å²	62	31%	0.314	37%	0.371	S	S	.	.			trans	-96.3	0.2	-173.1	0	0	0	0	0	114.9	V993 K1097	V993-A995 VanDerWaalsContact C-N 3.25Å; V993-A995 WeakPolarHBondContact O-CB 3.42Å; V993-A995 PolarHBondContact O-N 3.11Å; A995-K1097 WeakPolarHBondContact O-CD 3.48Å
996	G	54.5	Low	63.5	Low	32 Å²	32	64.9 Å²	64.9	33%	0.33	38%	0.382	S	S	.	.	S	Bend	trans	-164.5	156.3	178.6	0	0	0	0	0	112.4
997	G	58.6	Low	64.4	Low	19 Å²	19	63.8 Å²	63.8	20%	0.196	38%	0.377	C	S	.	.			trans	-89.7	163.4	176.1	0	0	0	0	0	113	F999 S1098 Y1100	G997-F999 VanDerWaalsContact O-CD1 3.3Å; G997-F999 WeakPolarHBondContact O-CD1 3.34Å; G997-S1098 VanDerWaalsContact N-CB 3.27Å; G997-S1098 PolarHBondContact N-OG 3.28Å; G997-Y1100 VanDerWaalsContact C-OH 3.31Å; G997-Y1100 WeakPolarHBondContact CA-OH 3.35Å
998	L	63	Low	65.7	Low	94 Å²	94	60.1 Å²	60.1	49%	0.492	35%	0.354	S	S	.	.			trans	-78.4	123.5	-179.7	-65.5	158.2	0	0	0	110.5	Q988 Y1100 P1177	Q988-L998 HydrophobicContact CG-CD2 4.28Å; L998-Y1100 PolarHBondContact N-OH 3.18Å; L998-Y1100 VanDerWaalsContact O-CE1 3.3Å; L998-Y1100 WeakPolarHBondContact O-CE1 2.9Å; L998-Y1100 PolarHBondContact O-OH 2.86Å; L998-P1177 HydrophobicContact CB-CG 4.33Å; L998-P1177 WeakPolarHBondContact O-CD 3.41Å
999	F	70.2	Confident	67.2	Low	2 Å²	2	57.6 Å²	57.6	1%	0.009	34%	0.342	C	S	.	.			trans	-153.3	151.1	171.2	60.7	-86	0	0	0	110.5	I986 G997 Y1002 I1069 Y1100 I1174 I1175	I986-F999 HydrophobicContact CG2-CD2 3.88Å; I986-F999 HydrophobicContact CG2-CE2 3.89Å; G997-F999 VanDerWaalsContact O-CD1 3.3Å; G997-F999 WeakPolarHBondContact O-CD1 3.34Å; F999-Y1002 AromaticContact CD2-CE1 3.81Å; F999-Y1002 HydrophobicContact CD2-CE1 3.81Å; F999-Y1002 AromaticContact CE2-CE1 3.74Å; F999-Y1002 HydrophobicContact CE2-CE1 3.74Å; F999-I1069 HydrophobicContact CZ-CG2 4.15Å; F999-Y1100 HydrophobicContact CB-CE1 4.24Å; F999-I1174 HydrophobicContact CB-CG2 3.32Å; F999-I1174 HydrophobicContact CD1-CG2 3.83Å; F999-I1174 HydrophobicContact CD2-CG2 3.91Å; F999-I1174 HydrophobicContact CG-CG2 3.41Å; F999-I1174 VanDerWaalsContact CG-CG2 3.41Å; F999-I1175 VanDerWaalsContact CB-O 3.3Å; F999-I1175 WeakPolarHBondContact CB-O 3.08Å
1000	D	70.5	Confident	68.7	Low	84 Å²	84	55.9 Å²	55.9	45%	0.449	33%	0.334	S	S	.	.			trans	-134.6	-5.9	-179.5	58.3	-5	0	0	0	112.9
1001	K	74.4	Confident	70.5	Confident	84 Å²	84	48.4 Å²	48.4	37%	0.365	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	151.2	-176.6	66.4	-172.2	169.5	173.2	0	113.4	I1175	K1001-I1175 HydrophobicContact CD-CB 4.22Å; K1001-I1175 HydrophobicContact CD-CD1 3.89Å; K1001-I1175 HydrophobicContact CD-CG1 4.5Å; K1001-I1175 HydrophobicContact CD-CG2 4.49Å; K1001-I1175 VanDerWaalsContact CE-CG2 3.45Å; K1001-I1175 HydrophobicContact CG-CB 3.67Å; K1001-I1175 HydrophobicContact CG-CD1 3.78Å; K1001-I1175 HydrophobicContact CG-CG1 3.95Å; K1001-I1175 HydrophobicContact CG-CG2 4.44Å; K1001-I1175 PolarHBondContact O-N 3.13Å; K1001-I1175 VanDerWaalsContact O-N 3.17Å
1002	Y	81.8	Confident	72.2	Confident	7 Å²	7	46 Å²	46	3%	0.027	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.7	173.2	-63.9	-26.8	0	0	0	110.6	M982 Q983 I986 F999 A1126 Y1172 Q1173 I1174	M982-Y1002 HydrophobicContact CE-CD2 3.62Å; M982-Y1002 HydrophobicContact CE-CE2 4.37Å; M982-Y1002 HydrophobicContact CE-CG 4.49Å; Q983-Y1002 PolarHBondContact NE2-O 3.41Å; I986-Y1002 HydrophobicContact CD1-CD1 4.03Å; I986-Y1002 HydrophobicContact CD1-CD2 3.56Å; I986-Y1002 HydrophobicContact CD1-CE1 4.3Å; I986-Y1002 HydrophobicContact CD1-CE2 3.89Å; I986-Y1002 HydrophobicContact CD1-CG 3.66Å; I986-Y1002 HydrophobicContact CG1-CD2 4.05Å; I986-Y1002 HydrophobicContact CG1-CE2 3.9Å; F999-Y1002 AromaticContact CD2-CE1 3.81Å; F999-Y1002 HydrophobicContact CD2-CE1 3.81Å; F999-Y1002 AromaticContact CE2-CE1 3.74Å; F999-Y1002 HydrophobicContact CE2-CE1 3.74Å; Y1002-A1126 HydrophobicContact CE2-CB 4.39Å; Y1002-Y1172 AromaticContact CD1-CD2 3.73Å; Y1002-Y1172 HydrophobicContact CD1-CD2 3.73Å; Y1002-Y1172 AromaticContact CD1-CE2 3.63Å; Y1002-Y1172 HydrophobicContact CD1-CE2 3.63Å; Y1002-Y1172 AromaticContact CD2-CD2 3.97Å; Y1002-Y1172 HydrophobicContact CD2-CD2 3.97Å; Y1002-Y1172 AromaticContact CD2-CE2 3.93Å; Y1002-Y1172 HydrophobicContact CD2-CE2 3.93Å; Y1002-Y1172 HydrophobicContact CE1-CD2 4.3Å; Y1002-Y1172 AromaticContact CE1-CE2 3.71Å; Y1002-Y1172 HydrophobicContact CE1-CE2 3.71Å; Y1002-Y1172 HydrophobicContact CE2-CD2 4.49Å; Y1002-Y1172 AromaticContact CE2-CE2 3.99Å; Y1002-Y1172 HydrophobicContact CE2-CE2 3.99Å; Y1002-Y1172 AromaticContact CG-CD2 3.53Å; Y1002-Y1172 HydrophobicContact CG-CD2 3.53Å; Y1002-Y1172 AromaticContact CG-CE2 3.74Å; Y1002-Y1172 HydrophobicContact CG-CE2 3.74Å; Y1002-Y1172 HydrophobicContact CG-CG 4.49Å; Y1002-Y1172 AromaticContact CZ-CE2 3.89Å; Y1002-Q1173 CarbonylContact C-O 3.6Å; Y1002-Q1173 WeakPolarHBondContact CA-O 3.01Å; Y1002-I1174 HydrophobicContact CD1-CG1 4.22Å; Y1002-I1174 HydrophobicContact CE1-CG1 4.04Å
1003	N	83.3	Confident	73.5	Confident	65 Å²	65	47.5 Å²	47.5	35%	0.348	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	108.3	168.7	-176.8	25.1	0	0	0	109	V1005 Y1172 Q1173 I1175	N1003-V1005 PolarHBondContact O-N 3.48Å; N1003-Y1172 CarbonylContact O-C 3.44Å; N1003-Y1172 WeakPolarHBondContact O-CA 3.2Å; N1003-Y1172 WeakPolarHBondContact O-CB 3.1Å; N1003-Q1173 HydrophobicContact CB-CB 4.2Å; N1003-Q1173 PolarHBondContact N-O 3.46Å; N1003-Q1173 PolarHBondContact O-N 2.8Å; N1003-I1175 HydrophobicContact CB-CD1 3.74Å; N1003-I1175 HydrophobicContact CB-CG1 3.99Å
1004	V	85.5	Confident	75	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.012	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	116.8	176.7	-179.2	0	0	0	0	109.1	F958 E962 M982 V1007 V1170	F958-V1004 HydrophobicContact CZ-CG1 4.21Å; E962-V1004 HydrophobicContact CG-CB 4.06Å; E962-V1004 HydrophobicContact CG-CG2 4.31Å; M982-V1004 HydrophobicContact SD-CG2 4.2Å; V1004-V1007 HydrophobicContact CG1-CG2 3.84Å; V1004-V1170 HydrophobicContact CG1-CG1 3.99Å; V1004-V1170 HydrophobicContact CG2-CG1 4.46Å
1005	V	86.1	Confident	76.6	Confident	58 Å²	58	43.8 Å²	43.8	35%	0.352	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-41.2	-175.7	-179.9	0	0	0	0	110.9	N1003 L1103 T1171	N1003-V1005 PolarHBondContact O-N 3.48Å; V1005-L1103 HydrophobicContact CB-CD2 4.44Å; V1005-L1103 HydrophobicContact CG2-CD2 3.72Å; V1005-T1171 PolarHBondContact N-O 3.48Å
1006	K	88.3	Confident	78.1	Confident	82 Å²	82	43.2 Å²	43.2	36%	0.357	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	144.3	-175	-166.9	-172.3	-174.8	-147	0	111.1	D1008 T1171	K1006-D1008 WeakPolarHBondContact CE-OD1 3.05Å; K1006-D1008 WeakPolarHBondContact CE-OD2 3.44Å; K1006-D1008 IonicContact NZ-OD1 2.8Å; K1006-D1008 PolarHBondContact NZ-OD1 3.3Å; K1006-D1008 IonicContact NZ-OD2 2.69Å; K1006-D1008 PolarHBondContact NZ-OD2 2.68Å; K1006-T1171 PolarHBondContact N-O 2.98Å; K1006-T1171 PolarHBondContact O-N 2.85Å
1007	V	88.9	Confident	79	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	119.9	169.5	-175.4	0	0	0	0	108.4	L951 F958 V961 V1004 Y1168 L1169 V1170	L951-V1007 HydrophobicContact CD1-CG1 4.04Å; L951-V1007 PolarHBondContact N-O 3.45Å; F958-V1007 HydrophobicContact CD2-CB 3.64Å; F958-V1007 HydrophobicContact CD2-CG2 3.74Å; F958-V1007 HydrophobicContact CE2-CB 3.81Å; F958-V1007 HydrophobicContact CE2-CG2 3.65Å; F958-V1007 HydrophobicContact CG-CB 4.41Å; F958-V1007 HydrophobicContact CG-CG2 4.24Å; F958-V1007 HydrophobicContact CZ-CG2 4.07Å; V961-V1007 HydrophobicContact CB-CG1 4.41Å; V961-V1007 HydrophobicContact CB-CG2 4.24Å; V961-V1007 HydrophobicContact CG1-CG1 4.27Å; V961-V1007 HydrophobicContact CG1-CG2 3.83Å; V961-V1007 HydrophobicContact CG2-CG1 4.22Å; V1004-V1007 HydrophobicContact CG1-CG2 3.84Å; V1007-Y1168 HydrophobicContact CG1-CD1 4.07Å; V1007-Y1168 HydrophobicContact CG1-CG 4.35Å; V1007-L1169 WeakPolarHBondContact CA-O 3.47Å; V1007-V1170 HydrophobicContact CG2-CG1 4.5Å
1008	D	89.3	Confident	79.8	Confident	6 Å²	6	48.4 Å²	48.4	3%	0.032	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	127.7	174.6	-68.5	-51.1	0	0	0	109.9	L948 V949 P950 K1006 Y1168 L1169	L948-D1008 HydrophobicContact CB-CB 4.14Å; L948-D1008 HydrophobicContact CD2-CB 4.32Å; V949-D1008 CarbonylContact O-C 3.59Å; V949-D1008 WeakPolarHBondContact O-CA 3.07Å; P950-D1008 WeakPolarHBondContact CA-OD1 3.24Å; P950-D1008 WeakPolarHBondContact CB-OD1 3.47Å; P950-D1008 WeakPolarHBondContact CG-OD1 3.39Å; K1006-D1008 WeakPolarHBondContact CE-OD1 3.05Å; K1006-D1008 WeakPolarHBondContact CE-OD2 3.44Å; K1006-D1008 IonicContact NZ-OD1 2.8Å; K1006-D1008 PolarHBondContact NZ-OD1 3.3Å; K1006-D1008 IonicContact NZ-OD2 2.69Å; K1006-D1008 PolarHBondContact NZ-OD2 2.68Å; D1008-Y1168 CarbonylContact O-C 3.59Å; D1008-Y1168 VanDerWaalsContact O-CA 3.32Å; D1008-Y1168 WeakPolarHBondContact O-CA 3.4Å; D1008-L1169 HydrophobicContact CB-CB 4.27Å; D1008-L1169 PolarHBondContact N-O 2.91Å; D1008-L1169 PolarHBondContact O-N 3.22Å
1009	K	88.8	Confident	80.4	Confident	29 Å²	29	44 Å²	44	13%	0.126	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	128.9	170.4	-167.8	170.5	-163	164.3	0	110	L948 V949 L951 E957 F1011 Y1168	L948-K1009 WeakPolarHBondContact CA-O 3.29Å; V949-K1009 PolarHBondContact N-O 2.88Å; V949-K1009 PolarHBondContact O-N 3.09Å; L951-K1009 HydrophobicContact CD1-CB 4.48Å; L951-K1009 HydrophobicContact CD2-CB 4.37Å; L951-K1009 HydrophobicContact CG-CB 4.4Å; E957-K1009 IonicContact OE1-NZ 3.75Å; E957-K1009 PolarHBondContact OE1-NZ 2.82Å; E957-K1009 WeakPolarHBondContact OE2-CD 3.16Å; E957-K1009 IonicContact OE2-NZ 3.55Å; E957-K1009 PolarHBondContact OE2-NZ 2.96Å; K1009-F1011 HydrophobicContact CB-CE2 4.18Å; K1009-F1011 HydrophobicContact CD-CE2 3.99Å; K1009-F1011 HydrophobicContact CD-CZ 3.81Å; K1009-F1011 HydrophobicContact CG-CE2 3.95Å; K1009-F1011 HydrophobicContact CG-CZ 4.18Å; K1009-Y1168 HydrophobicContact CB-CD1 4.17Å; K1009-Y1168 HydrophobicContact CB-CE1 4.16Å; K1009-Y1168 HydrophobicContact CD-CE1 4.07Å; K1009-Y1168 HydrophobicContact CG-CD1 4.2Å; K1009-Y1168 HydrophobicContact CG-CE1 3.85Å
1010	V	85.7	Confident	80.8	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	127.9	-177.2	-177.3	0	0	0	0	109.6	T946 L948 V1050 Y1165 P1166 E1167 L1169	T946-V1010 HydrophobicContact CG2-CG1 3.76Å; L948-V1010 HydrophobicContact CD2-CB 4.21Å; L948-V1010 HydrophobicContact CD2-CG1 4.36Å; L948-V1010 HydrophobicContact CD2-CG2 3.66Å; V1010-V1050 HydrophobicContact CG1-CG1 3.97Å; V1010-V1050 HydrophobicContact CG2-CG1 4.29Å; V1010-V1050 HydrophobicContact CG2-CG2 4.33Å; V1010-Y1165 PolarHBondContact O-OH 2.82Å; V1010-P1166 WeakPolarHBondContact CB-O 3.42Å; V1010-P1166 WeakPolarHBondContact CG1-O 3.25Å; V1010-P1166 WeakPolarHBondContact CG2-O 3.32Å; V1010-E1167 PolarHBondContact N-O 3.27Å; V1010-L1169 HydrophobicContact CG2-CB 4.47Å
1011	F	83	Confident	81.1	Confident	9 Å²	9	47.5 Å²	47.5	4%	0.039	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	102.4	171.8	-70.2	-80.3	0	0	0	109.4	M933 G935 F936 T946 M947 V949 K1009	M933-F1011 HydrophobicContact CE-CD1 4.25Å; G935-F1011 WeakPolarHBondContact O-CZ 3.49Å; F936-F1011 HydrophobicContact CD2-CB 4.3Å; F936-F1011 AromaticContact CD2-CD1 3.44Å; F936-F1011 HydrophobicContact CD2-CD1 3.44Å; F936-F1011 VanDerWaalsContact CD2-CD1 3.44Å; F936-F1011 HydrophobicContact CD2-CE1 4.14Å; F936-F1011 HydrophobicContact CD2-CG 4.24Å; F936-F1011 HydrophobicContact CE2-CB 3.79Å; F936-F1011 AromaticContact CE2-CD1 3.83Å; F936-F1011 HydrophobicContact CE2-CD1 3.83Å; F936-F1011 HydrophobicContact CE2-CG 4.24Å; F936-F1011 HydrophobicContact CG-CD1 4.24Å; F936-F1011 HydrophobicContact CZ-CB 4.4Å; T946-F1011 WeakPolarHBondContact CA-O 3.1Å; M947-F1011 HydrophobicContact CB-CB 4.19Å; M947-F1011 PolarHBondContact N-O 2.92Å; M947-F1011 PolarHBondContact O-N 2.92Å; V949-F1011 HydrophobicContact CB-CD2 4.28Å; V949-F1011 HydrophobicContact CB-CE2 3.95Å; V949-F1011 HydrophobicContact CG2-CD2 3.65Å; V949-F1011 HydrophobicContact CG2-CE2 3.6Å; K1009-F1011 HydrophobicContact CB-CE2 4.18Å; K1009-F1011 HydrophobicContact CD-CE2 3.99Å; K1009-F1011 HydrophobicContact CD-CZ 3.81Å; K1009-F1011 HydrophobicContact CG-CE2 3.95Å; K1009-F1011 HydrophobicContact CG-CZ 4.18Å
1012	N	81.8	Confident	80.9	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.043	19%	0.194	C	C	.	.			trans	-132.5	105.2	172.5	-175.9	-37.4	0	0	0	109.5	T946 R1014 L1015 W1016 Q1051 Y1165	T946-N1012 HydrophobicContact CG2-CB 4.13Å; T946-N1012 PolarHBondContact OG1-ND2 3.48Å; N1012-R1014 PolarHBondContact O-N 3.47Å; N1012-R1014 PolarHBondContact OD1-N 2.78Å; N1012-L1015 HydrophobicContact CB-CB 4.1Å; N1012-L1015 HydrophobicContact CB-CD1 4.02Å; N1012-L1015 HydrophobicContact CB-CG 4.15Å; N1012-L1015 VanDerWaalsContact CG-CG 3.46Å; N1012-L1015 VanDerWaalsContact ND2-CD1 3.34Å; N1012-L1015 WeakPolarHBondContact ND2-CD1 3.37Å; N1012-L1015 WeakPolarHBondContact ND2-CG 3.25Å; N1012-L1015 PolarHBondContact O-N 3.01Å; N1012-L1015 PolarHBondContact OD1-N 3.17Å; N1012-L1015 VanDerWaalsContact OD1-N 3.08Å; N1012-W1016 WeakPolarHBondContact O-CB 3.16Å; N1012-W1016 PolarHBondContact O-N 3.11Å; N1012-Q1051 PolarHBondContact ND2-O 3.07Å; N1012-Y1165 PolarHBondContact N-OH 3.23Å; N1012-Y1165 VanDerWaalsContact N-OH 3.15Å
1013	R	73.8	Confident	80.7	Confident	137 Å²	137	47.8 Å²	47.8	52%	0.517	20%	0.202	S	C	.	.	H	α-helix	trans	-58.4	-46.4	-175.2	179.8	174.5	174.1	169.8	1.2	112.7	L1015 W1016 E1017	R1013-L1015 VanDerWaalsContact C-N 3.34Å; R1013-L1015 PolarHBondContact O-N 3.12Å; R1013-W1016 PolarHBondContact O-N 3.21Å; R1013-E1017 HydrophobicContact CG-CG 4.43Å; R1013-E1017 WeakPolarHBondContact CG-OE1 3.36Å; R1013-E1017 IonicContact CZ-OE1 3.93Å; R1013-E1017 IonicContact NE-OE1 3.64Å; R1013-E1017 PolarHBondContact NE-OE1 3.21Å; R1013-E1017 IonicContact NH2-OE1 3.7Å; R1013-E1017 WeakPolarHBondContact O-CG 3.4Å; R1013-E1017 PolarHBondContact O-N 3.49Å
1014	R	74	Confident	80.5	Confident	150 Å²	150	48 Å²	48	57%	0.566	20%	0.203	S	C	*	.	H	α-helix	trans	-65.4	-38.4	-177.3	-175.7	179	176.7	168.6	1.3	112	N1012 R1018	N1012-R1014 PolarHBondContact O-N 3.47Å; N1012-R1014 PolarHBondContact OD1-N 2.78Å; R1014-R1018 VanDerWaalsContact NH2-NH2 3.18Å; R1014-R1018 WeakPolarHBondContact O-CD 3.44Å; R1014-R1018 VanDerWaalsContact O-CG 3.29Å; R1014-R1018 WeakPolarHBondContact O-CG 3.21Å; R1014-R1018 PolarHBondContact O-N 3.09Å
1015	L	78.6	Confident	80	Confident	13 Å²	13	50.3 Å²	50.3	7%	0.068	22%	0.215	C	C	.	.	H	α-helix	trans	-71.4	-37.5	176.1	-64.4	-177.4	0	0	0	111.7	N1012 R1013 R1018 Y1019 Y1165 P1166	N1012-L1015 HydrophobicContact CB-CB 4.1Å; N1012-L1015 HydrophobicContact CB-CD1 4.02Å; N1012-L1015 HydrophobicContact CB-CG 4.15Å; N1012-L1015 VanDerWaalsContact CG-CG 3.46Å; N1012-L1015 VanDerWaalsContact ND2-CD1 3.34Å; N1012-L1015 WeakPolarHBondContact ND2-CD1 3.37Å; N1012-L1015 WeakPolarHBondContact ND2-CG 3.25Å; N1012-L1015 PolarHBondContact O-N 3.01Å; N1012-L1015 PolarHBondContact OD1-N 3.17Å; N1012-L1015 VanDerWaalsContact OD1-N 3.08Å; R1013-L1015 VanDerWaalsContact C-N 3.34Å; R1013-L1015 PolarHBondContact O-N 3.12Å; L1015-R1018 PolarHBondContact O-N 2.74Å; L1015-Y1019 WeakPolarHBondContact O-CB 3.31Å; L1015-Y1019 PolarHBondContact O-N 2.92Å; L1015-Y1165 HydrophobicContact CB-CD2 3.94Å; L1015-Y1165 HydrophobicContact CB-CE2 3.95Å; L1015-P1166 HydrophobicContact CD1-CG 4.38Å
1016	W	79.7	Confident	79.1	Confident	26 Å²	26	47.8 Å²	47.8	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-64.5	-47.9	176.8	-174	-102.6	0	0	0	112.4	M933 N1012 R1013 R1018 Y1019 I1020 Y1165	M933-W1016 HydrophobicContact CE-CB 4.17Å; M933-W1016 HydrophobicContact CE-CD2 3.61Å; M933-W1016 HydrophobicContact CE-CE3 3.63Å; M933-W1016 HydrophobicContact CE-CG 3.85Å; M933-W1016 HydrophobicContact CE-CZ3 4.2Å; M933-W1016 HydrophobicContact CG-CB 4.34Å; M933-W1016 HydrophobicContact CG-CD2 3.91Å; M933-W1016 HydrophobicContact CG-CG 3.61Å; M933-W1016 HydrophobicContact SD-CB 4.44Å; M933-W1016 HydrophobicContact SD-CD2 3.17Å; M933-W1016 HydrophobicContact SD-CE3 3.62Å; M933-W1016 HydrophobicContact SD-CG 3.55Å; M933-W1016 VanDerWaalsContact SD-CG 3.55Å; M933-W1016 HydrophobicContact SD-CH2 3.93Å; M933-W1016 HydrophobicContact SD-CZ2 3.52Å; M933-W1016 VanDerWaalsContact SD-CZ2 3.52Å; M933-W1016 HydrophobicContact SD-CZ3 3.98Å; M933-W1016 PolarHBondContact SD-NE1 2.53Å; N1012-W1016 WeakPolarHBondContact O-CB 3.16Å; N1012-W1016 PolarHBondContact O-N 3.11Å; R1013-W1016 PolarHBondContact O-N 3.21Å; W1016-R1018 VanDerWaalsContact C-N 3.26Å; W1016-R1018 PolarHBondContact O-N 2.89Å; W1016-Y1019 HydrophobicContact CE3-CD1 4.21Å; W1016-Y1019 HydrophobicContact CH2-CD1 4.47Å; W1016-Y1019 HydrophobicContact CZ3-CD1 4.1Å; W1016-Y1019 HydrophobicContact CZ3-CE1 4.41Å; W1016-Y1019 WeakPolarHBondContact O-CB 3.43Å; W1016-Y1019 PolarHBondContact O-N 2.87Å; W1016-Y1019 VanDerWaalsContact O-N 3.08Å; W1016-I1020 HydrophobicContact CD2-CG1 4.31Å; W1016-I1020 HydrophobicContact CG-CG1 4.37Å; W1016-I1020 HydrophobicContact CZ2-CD1 3.77Å; W1016-I1020 HydrophobicContact CZ2-CG1 4.3Å; W1016-I1020 WeakPolarHBondContact O-CG1 3.46Å; W1016-I1020 PolarHBondContact O-N 2.9Å; W1016-Y1165 HydrophobicContact CB-CD2 4.42Å; W1016-Y1165 HydrophobicContact CB-CE2 4Å; W1016-Y1165 AromaticContact CE3-CD1 3.57Å; W1016-Y1165 HydrophobicContact CE3-CD1 3.57Å; W1016-Y1165 AromaticContact CE3-CD2 3.9Å; W1016-Y1165 HydrophobicContact CE3-CD2 3.9Å; W1016-Y1165 AromaticContact CE3-CE1 3.63Å; W1016-Y1165 HydrophobicContact CE3-CE1 3.63Å; W1016-Y1165 AromaticContact CE3-CE2 3.96Å; W1016-Y1165 HydrophobicContact CE3-CE2 3.96Å; W1016-Y1165 AromaticContact CE3-CG 3.71Å; W1016-Y1165 HydrophobicContact CE3-CG 3.71Å; W1016-Y1165 AromaticContact CE3-CZ 3.84Å; W1016-Y1165 AromaticContact CZ3-CD1 3.62Å; W1016-Y1165 HydrophobicContact CZ3-CD1 3.62Å; W1016-Y1165 AromaticContact CZ3-CE1 3.88Å; W1016-Y1165 HydrophobicContact CZ3-CE1 3.88Å; W1016-Y1165 HydrophobicContact CZ3-CG 4.07Å
1017	E	73.8	Confident	78.4	Confident	80 Å²	80	44.2 Å²	44.2	37%	0.374	19%	0.186	S	C	.	.	H	α-helix	trans	-58.1	-40.1	177.4	-73.3	169.6	-179.2	0	0	111.6	R1013 R1021	R1013-E1017 HydrophobicContact CG-CG 4.43Å; R1013-E1017 WeakPolarHBondContact CG-OE1 3.36Å; R1013-E1017 IonicContact CZ-OE1 3.93Å; R1013-E1017 IonicContact NE-OE1 3.64Å; R1013-E1017 PolarHBondContact NE-OE1 3.21Å; R1013-E1017 IonicContact NH2-OE1 3.7Å; R1013-E1017 WeakPolarHBondContact O-CG 3.4Å; R1013-E1017 PolarHBondContact O-N 3.49Å; E1017-R1021 PolarHBondContact O-N 2.71Å
1018	R	74.5	Confident	77.7	Confident	79 Å²	79	52.1 Å²	52.1	30%	0.298	22%	0.223	S	C	.	.	H	α-helix	trans	-64.6	-43.1	174.5	-74.2	172.1	172.8	-166.4	-7.5	112.3	R1014 L1015 W1016 R1022	R1014-R1018 VanDerWaalsContact NH2-NH2 3.18Å; R1014-R1018 WeakPolarHBondContact O-CD 3.44Å; R1014-R1018 VanDerWaalsContact O-CG 3.29Å; R1014-R1018 WeakPolarHBondContact O-CG 3.21Å; R1014-R1018 PolarHBondContact O-N 3.09Å; L1015-R1018 PolarHBondContact O-N 2.74Å; W1016-R1018 VanDerWaalsContact C-N 3.26Å; W1016-R1018 PolarHBondContact O-N 2.89Å; R1018-R1022 PolarHBondContact O-N 3.23Å
1019	Y	77	Confident	76.8	Confident	1 Å²	1	56.1 Å²	56.1	0%	0.004	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-44.9	178.6	171	-98.6	0	0	0	111.9	L1015 W1016 R1021 R1022 R1023 E1036 R1110 T1112	L1015-Y1019 WeakPolarHBondContact O-CB 3.31Å; L1015-Y1019 PolarHBondContact O-N 2.92Å; W1016-Y1019 HydrophobicContact CE3-CD1 4.21Å; W1016-Y1019 HydrophobicContact CH2-CD1 4.47Å; W1016-Y1019 HydrophobicContact CZ3-CD1 4.1Å; W1016-Y1019 HydrophobicContact CZ3-CE1 4.41Å; W1016-Y1019 WeakPolarHBondContact O-CB 3.43Å; W1016-Y1019 PolarHBondContact O-N 2.87Å; W1016-Y1019 VanDerWaalsContact O-N 3.08Å; Y1019-R1021 PolarHBondContact O-N 3.21Å; Y1019-R1022 PolarHBondContact O-N 3.36Å; Y1019-R1023 HydrophobicContact CE1-CB 4.45Å; Y1019-R1023 WeakPolarHBondContact O-CB 3.44Å; Y1019-R1023 PolarHBondContact O-N 2.96Å; Y1019-E1036 WeakPolarHBondContact CE1-OE1 3.02Å; Y1019-E1036 VanDerWaalsContact OH-CD 3.27Å; Y1019-E1036 VanDerWaalsContact OH-CG 3.27Å; Y1019-E1036 WeakPolarHBondContact OH-CG 2.89Å; Y1019-E1036 PolarHBondContact OH-OE1 2.91Å; Y1019-R1110 HydrophobicContact CE1-CG 3.99Å; Y1019-R1110 HydrophobicContact CE2-CB 4.5Å; Y1019-R1110 HydrophobicContact CE2-CG 4.21Å; Y1019-R1110 WeakPolarHBondContact CE2-O 3.35Å; Y1019-R1110 VanDerWaalsContact CZ-CD 3.45Å; Y1019-R1110 WeakPolarHBondContact OH-CD 3.4Å; Y1019-R1110 WeakPolarHBondContact OH-CG 2.97Å; Y1019-T1112 HydrophobicContact CE2-CG2 3.92Å; Y1019-T1112 WeakPolarHBondContact OH-CG2 3.34Å
1020	I	79	Confident	75.8	Confident	18 Å²	18	56 Å²	56	9%	0.092	24%	0.242	C	C	.	.	H	α-helix	trans	-59.9	-46.5	178.3	-69.2	-67.1	0	0	0	111.1	W1016 R1022 R1023 D1024	W1016-I1020 HydrophobicContact CD2-CG1 4.31Å; W1016-I1020 HydrophobicContact CG-CG1 4.37Å; W1016-I1020 HydrophobicContact CZ2-CD1 3.77Å; W1016-I1020 HydrophobicContact CZ2-CG1 4.3Å; W1016-I1020 WeakPolarHBondContact O-CG1 3.46Å; W1016-I1020 PolarHBondContact O-N 2.9Å; I1020-R1022 VanDerWaalsContact C-N 3.3Å; I1020-R1022 PolarHBondContact O-N 3.41Å; I1020-R1023 WeakPolarHBondContact O-CB 3.35Å; I1020-R1023 PolarHBondContact O-N 3.14Å; I1020-R1023 VanDerWaalsContact O-N 3.14Å; I1020-D1024 VanDerWaalsContact O-CG 3.22Å; I1020-D1024 PolarHBondContact O-N 3.36Å
1021	R	75.2	Confident	75.3	Confident	143 Å²	143	61.5 Å²	61.5	54%	0.54	28%	0.28	S	S	.	.	H	α-helix	trans	-56.3	-46.9	176	-175.1	-179.9	-83.4	-175.8	-7.5	111.3	E1017 Y1019 R1023 D1024 D1025	E1017-R1021 PolarHBondContact O-N 2.71Å; Y1019-R1021 PolarHBondContact O-N 3.21Å; R1021-R1023 VanDerWaalsContact C-N 3.34Å; R1021-R1023 PolarHBondContact O-N 3.24Å; R1021-D1024 PolarHBondContact O-N 3.15Å; R1021-D1025 PolarHBondContact O-N 3.37Å
1022	R	71.6	Confident	74.7	Confident	46 Å²	46	63.6 Å²	63.6	17%	0.174	30%	0.304	C	S	.	.	H	α-helix	trans	-65.8	-36.3	178.9	-175.9	54.3	177.6	159.3	2.2	112.9	R1018 Y1019 I1020 D1024 D1025 V1026	R1018-R1022 PolarHBondContact O-N 3.23Å; Y1019-R1022 PolarHBondContact O-N 3.36Å; I1020-R1022 VanDerWaalsContact C-N 3.3Å; I1020-R1022 PolarHBondContact O-N 3.41Å; R1022-D1024 VanDerWaalsContact C-N 3.3Å; R1022-D1025 PolarHBondContact O-N 2.78Å; R1022-V1026 VanDerWaalsContact O-CG2 3.32Å; R1022-V1026 WeakPolarHBondContact O-CG2 3.34Å; R1022-V1026 PolarHBondContact O-N 3.28Å
1023	R	77.5	Confident	74.2	Confident	51 Å²	51	69.3 Å²	69.3	19%	0.192	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-43	175.1	-179.2	-158.2	71.3	176.8	-1.3	111.2	Y1019 I1020 R1021 V1026 A1027 H1034 E1036 T1112	Y1019-R1023 HydrophobicContact CE1-CB 4.45Å; Y1019-R1023 WeakPolarHBondContact O-CB 3.44Å; Y1019-R1023 PolarHBondContact O-N 2.96Å; I1020-R1023 WeakPolarHBondContact O-CB 3.35Å; I1020-R1023 PolarHBondContact O-N 3.14Å; I1020-R1023 VanDerWaalsContact O-N 3.14Å; R1021-R1023 VanDerWaalsContact C-N 3.34Å; R1021-R1023 PolarHBondContact O-N 3.24Å; R1023-V1026 PolarHBondContact O-N 2.94Å; R1023-A1027 WeakPolarHBondContact O-CB 3.42Å; R1023-A1027 PolarHBondContact O-N 3.04Å; R1023-H1034 WeakPolarHBondContact CD-ND1 3.43Å; R1023-H1034 HydrophobicContact CG-CB 3.74Å; R1023-E1036 VanDerWaalsContact CD-CD 3.45Å; R1023-E1036 WeakPolarHBondContact CD-OE2 3.43Å; R1023-E1036 HydrophobicContact CG-CG 4.08Å; R1023-T1112 HydrophobicContact CB-CG2 3.82Å; R1023-T1112 HydrophobicContact CG-CG2 3.92Å
1024	D	78.5	Confident	74.1	Confident	69 Å²	69	66 Å²	66	37%	0.369	32%	0.321	S	S	.	.	H	α-helix	trans	-70	-40.1	179.5	-59.1	-15.6	0	0	0	110.6	I1020 R1021 R1022 V1026 A1027 E1028	I1020-D1024 VanDerWaalsContact O-CG 3.22Å; I1020-D1024 PolarHBondContact O-N 3.36Å; R1021-D1024 PolarHBondContact O-N 3.15Å; R1022-D1024 VanDerWaalsContact C-N 3.3Å; D1024-V1026 PolarHBondContact O-N 3.37Å; D1024-A1027 WeakPolarHBondContact O-CB 3.27Å; D1024-A1027 PolarHBondContact O-N 3.04Å; D1024-A1027 VanDerWaalsContact O-N 3.13Å; D1024-E1028 PolarHBondContact O-N 3.04Å
1025	D	74.5	Confident	74	Confident	50 Å²	50	59.7 Å²	59.7	27%	0.267	30%	0.299	S	S	.	.	H	α-helix	trans	-59	-44.8	172.9	-58.6	-22.3	0	0	0	111.8	R1021 R1022 A1027 E1028 E1029	R1021-D1025 PolarHBondContact O-N 3.37Å; R1022-D1025 PolarHBondContact O-N 2.78Å; D1025-A1027 VanDerWaalsContact C-N 3.29Å; D1025-A1027 PolarHBondContact O-N 3.5Å; D1025-E1028 PolarHBondContact O-N 2.99Å; D1025-E1029 PolarHBondContact O-N 3.26Å; D1025-E1029 VanDerWaalsContact O-N 3.11Å
1026	V	68.6	Low	73.8	Confident	5 Å²	5	61.4 Å²	61.4	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-65.8	-35.5	177.3	171.1	0	0	0	0	111	R1022 R1023 D1024 E1029 N1030	R1022-V1026 VanDerWaalsContact O-CG2 3.32Å; R1022-V1026 WeakPolarHBondContact O-CG2 3.34Å; R1022-V1026 PolarHBondContact O-N 3.28Å; R1023-V1026 PolarHBondContact O-N 2.94Å; D1024-V1026 PolarHBondContact O-N 3.37Å; V1026-E1029 PolarHBondContact O-N 3.26Å; V1026-N1030 WeakPolarHBondContact O-CB 3.37Å; V1026-N1030 PolarHBondContact O-N 3.47Å
1027	A	72.4	Confident	73.5	Confident	8 Å²	8	62.8 Å²	62.8	7%	0.066	31%	0.313	C	S	.	.	H	α-helix	trans	-64.1	-42.2	175.7	0	0	0	0	0	111.5	R1023 D1024 D1025 E1029 N1030 S1031 G1032 H1034	R1023-A1027 WeakPolarHBondContact O-CB 3.42Å; R1023-A1027 PolarHBondContact O-N 3.04Å; D1024-A1027 WeakPolarHBondContact O-CB 3.27Å; D1024-A1027 PolarHBondContact O-N 3.04Å; D1024-A1027 VanDerWaalsContact O-N 3.13Å; D1025-A1027 VanDerWaalsContact C-N 3.29Å; D1025-A1027 PolarHBondContact O-N 3.5Å; A1027-E1029 VanDerWaalsContact C-N 3.34Å; A1027-E1029 PolarHBondContact O-N 2.92Å; A1027-N1030 CarbonylContact O-C 3.57Å; A1027-N1030 VanDerWaalsContact O-C 3.32Å; A1027-N1030 PolarHBondContact O-N 2.98Å; A1027-N1030 VanDerWaalsContact O-N 3.11Å; A1027-S1031 PolarHBondContact O-N 2.93Å; A1027-G1032 VanDerWaalsContact O-CA 3.29Å; A1027-G1032 WeakPolarHBondContact O-CA 3.48Å; A1027-G1032 PolarHBondContact O-N 2.81Å; A1027-H1034 VanDerWaalsContact CB-CD2 3.47Å; A1027-H1034 WeakPolarHBondContact CB-CD2 3.09Å
1028	E	74.1	Confident	73.7	Confident	165 Å²	165	61.7 Å²	61.7	77%	0.771	31%	0.31	S	S	*	.	H	α-helix	trans	-60.2	-45	176.1	-166.6	174.9	-169.7	0	0	111.2	D1024 D1025 N1030	D1024-E1028 PolarHBondContact O-N 3.04Å; D1025-E1028 PolarHBondContact O-N 2.99Å; E1028-N1030 VanDerWaalsContact C-N 3.28Å; E1028-N1030 PolarHBondContact O-N 3.17Å
1029	E	70	Confident	73.8	Confident	90 Å²	90	58.1 Å²	58.1	42%	0.421	30%	0.296	S	S	.	.	H	α-helix	trans	-66.5	-30.2	175.1	-70.1	176.1	-165.9	0	0	112.5	D1025 V1026 A1027 K1115	D1025-E1029 PolarHBondContact O-N 3.26Å; D1025-E1029 VanDerWaalsContact O-N 3.11Å; V1026-E1029 PolarHBondContact O-N 3.26Å; A1027-E1029 VanDerWaalsContact C-N 3.34Å; A1027-E1029 PolarHBondContact O-N 2.92Å; E1029-K1115 WeakPolarHBondContact O-CE 3.32Å; E1029-K1115 PolarHBondContact O-NZ 2.82Å
1030	N	69	Low	73.9	Confident	26 Å²	26	58.1 Å²	58.1	14%	0.139	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	40.7	-170.6	-167.2	56.7	0	0	0	113.8	V1026 A1027 E1028 G1032 Q1033 N1035 K1115	V1026-N1030 WeakPolarHBondContact O-CB 3.37Å; V1026-N1030 PolarHBondContact O-N 3.47Å; A1027-N1030 CarbonylContact O-C 3.57Å; A1027-N1030 VanDerWaalsContact O-C 3.32Å; A1027-N1030 PolarHBondContact O-N 2.98Å; A1027-N1030 VanDerWaalsContact O-N 3.11Å; E1028-N1030 VanDerWaalsContact C-N 3.28Å; E1028-N1030 PolarHBondContact O-N 3.17Å; N1030-G1032 VanDerWaalsContact C-N 3.28Å; N1030-G1032 PolarHBondContact O-N 3Å; N1030-Q1033 WeakPolarHBondContact ND2-CB 3.46Å; N1030-Q1033 PolarHBondContact ND2-O 3.23Å; N1030-Q1033 VanDerWaalsContact ND2-O 3.1Å; N1030-Q1033 PolarHBondContact O-N 3.47Å; N1030-N1035 PolarHBondContact ND2-ND2 2.97Å; N1030-N1035 PolarHBondContact ND2-OD1 2.99Å; N1030-K1115 WeakPolarHBondContact OD1-CG 3.17Å
1031	S	74.1	Confident	73.6	Confident	117 Å²	117	57.2 Å²	57.2	82%	0.818	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	38.4	172.1	-52.5	0	0	0	0	113.8	A1027 Q1033	A1027-S1031 PolarHBondContact O-N 2.93Å; S1031-Q1033 VanDerWaalsContact C-N 3.34Å
1032	G	71.7	Confident	73.3	Confident	53 Å²	53	51 Å²	51	55%	0.546	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	-1	-179.3	0	0	0	0	0	115.2	A1027 N1030	A1027-G1032 VanDerWaalsContact O-CA 3.29Å; A1027-G1032 WeakPolarHBondContact O-CA 3.48Å; A1027-G1032 PolarHBondContact O-N 2.81Å; N1030-G1032 VanDerWaalsContact C-N 3.28Å; N1030-G1032 PolarHBondContact O-N 3Å
1033	Q	71.5	Confident	73	Confident	129 Å²	129	49.5 Å²	49.5	60%	0.603	27%	0.269	S	S	*	.			trans	-94.2	121.1	179.3	-67.2	-157.4	-3	0	0	112.6	N1030 S1031 N1035	N1030-Q1033 WeakPolarHBondContact ND2-CB 3.46Å; N1030-Q1033 PolarHBondContact ND2-O 3.23Å; N1030-Q1033 VanDerWaalsContact ND2-O 3.1Å; N1030-Q1033 PolarHBondContact O-N 3.47Å; S1031-Q1033 VanDerWaalsContact C-N 3.34Å; Q1033-N1035 VanDerWaalsContact C-N 3.27Å; Q1033-N1035 PolarHBondContact O-N 3.34Å
1034	H	70.7	Confident	72.2	Confident	67 Å²	67	50.6 Å²	50.6	31%	0.31	28%	0.282	S	S	.	.			trans	-67.2	-21.5	-177	-58.8	-179.1	0	0	0	114.4	R1023 A1027 E1036	R1023-H1034 WeakPolarHBondContact CD-ND1 3.43Å; R1023-H1034 HydrophobicContact CG-CB 3.74Å; A1027-H1034 VanDerWaalsContact CB-CD2 3.47Å; A1027-H1034 WeakPolarHBondContact CB-CD2 3.09Å; H1034-E1036 VanDerWaalsContact C-N 3.27Å; H1034-E1036 HydrophobicContact CB-CG 3.83Å; H1034-E1036 IonicContact ND1-OE2 2.93Å; H1034-E1036 PolarHBondContact O-N 3.47Å
1035	N	71.8	Confident	71.6	Confident	17 Å²	17	49.9 Å²	49.9	9%	0.091	28%	0.276	C	S	.	.			trans	48.3	39.9	-177.9	-74.5	-2.3	0	0	0	115.5	N1030 Q1033 L1113	N1030-N1035 PolarHBondContact ND2-ND2 2.97Å; N1030-N1035 PolarHBondContact ND2-OD1 2.99Å; Q1033-N1035 VanDerWaalsContact C-N 3.27Å; Q1033-N1035 PolarHBondContact O-N 3.34Å; N1035-L1113 WeakPolarHBondContact CB-O 3.44Å; N1035-L1113 PolarHBondContact ND2-O 2.9Å; N1035-L1113 PolarHBondContact O-N 2.8Å
1036	E	74.6	Confident	71.5	Confident	49 Å²	49	47.7 Å²	47.7	23%	0.229	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	140	-179.9	-55.7	-177.7	82.9	0	0	111.6	Y1019 R1023 H1034 R1110 V1111 T1112 H1119	Y1019-E1036 WeakPolarHBondContact CE1-OE1 3.02Å; Y1019-E1036 VanDerWaalsContact OH-CD 3.27Å; Y1019-E1036 VanDerWaalsContact OH-CG 3.27Å; Y1019-E1036 WeakPolarHBondContact OH-CG 2.89Å; Y1019-E1036 PolarHBondContact OH-OE1 2.91Å; R1023-E1036 VanDerWaalsContact CD-CD 3.45Å; R1023-E1036 WeakPolarHBondContact CD-OE2 3.43Å; R1023-E1036 HydrophobicContact CG-CG 4.08Å; H1034-E1036 VanDerWaalsContact C-N 3.27Å; H1034-E1036 HydrophobicContact CB-CG 3.83Å; H1034-E1036 IonicContact ND1-OE2 2.93Å; H1034-E1036 PolarHBondContact O-N 3.47Å; E1036-R1110 WeakPolarHBondContact OE1-CD 3.45Å; E1036-R1110 IonicContact OE1-NH1 3.26Å; E1036-R1110 PolarHBondContact OE1-NH1 2.86Å; E1036-V1111 CarbonylContact C-O 3.55Å; E1036-V1111 WeakPolarHBondContact CA-O 3.39Å; E1036-T1112 HydrophobicContact CG-CG2 4.11Å; E1036-H1119 PolarHBondContact O-NE2 3.22Å
1037	K	74.1	Confident	72	Confident	56 Å²	56	52 Å²	52	24%	0.243	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	148.1	172.4	-76.2	-68.7	-165.7	170.8	0	110.3	L1039 V1111 L1113 H1119 S1122	K1037-L1039 HydrophobicContact CB-CD2 4.31Å; K1037-L1039 HydrophobicContact CB-CG 4.42Å; K1037-V1111 PolarHBondContact N-O 2.74Å; K1037-V1111 PolarHBondContact O-N 2.79Å; K1037-L1113 HydrophobicContact CB-CD1 4.3Å; K1037-L1113 HydrophobicContact CG-CD1 3.84Å; K1037-L1113 HydrophobicContact CG-CG 4.46Å; K1037-H1119 WeakPolarHBondContact CE-CE1 3.39Å; K1037-H1119 WeakPolarHBondContact CE-NE2 3.38Å; K1037-H1119 WeakPolarHBondContact CE-O 3.47Å; K1037-H1119 PolarHBondContact NZ-O 2.54Å; K1037-H1119 VanDerWaalsContact NZ-O 3.07Å; K1037-S1122 WeakPolarHBondContact CE-OG 3.21Å; K1037-S1122 PolarHBondContact NZ-O 3.07Å
1038	L	78.5	Confident	71.9	Confident	57 Å²	57	52.8 Å²	52.8	30%	0.298	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	118.3	168.5	-71.1	172	0	0	0	109.7	L1108 C1109 R1110 K1124 E1167	L1038-L1108 HydrophobicContact CB-CD1 3.91Å; L1038-L1108 HydrophobicContact CB-CD2 4.44Å; L1038-L1108 HydrophobicContact CB-CG 4.1Å; L1038-L1108 HydrophobicContact CD1-CD2 4.27Å; L1038-L1108 HydrophobicContact CD2-CG 4.28Å; L1038-C1109 CarbonylContact C-O 3.58Å; L1038-C1109 VanDerWaalsContact CA-O 3.3Å; L1038-C1109 WeakPolarHBondContact CA-O 3.39Å; L1038-R1110 HydrophobicContact CD2-CB 3.98Å; L1038-R1110 HydrophobicContact CD2-CG 4.46Å; L1038-K1124 WeakPolarHBondContact O-CD 3.29Å; L1038-E1167 HydrophobicContact CD2-CB 4.47Å; L1038-E1167 WeakPolarHBondContact CD2-OE2 3.13Å
1039	L	75.6	Confident	71.9	Confident	4 Å²	4	45 Å²	45	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.3	-178.6	-59.2	-175.5	0	0	0	110.7	K1037 C1109 V1111 L1113 K1124 H1133 I1135 I1151	K1037-L1039 HydrophobicContact CB-CD2 4.31Å; K1037-L1039 HydrophobicContact CB-CG 4.42Å; L1039-C1109 PolarHBondContact N-O 3.32Å; L1039-C1109 PolarHBondContact O-N 2.79Å; L1039-V1111 HydrophobicContact CB-CG2 4.24Å; L1039-V1111 HydrophobicContact CD1-CB 4.17Å; L1039-V1111 HydrophobicContact CD1-CG1 4.38Å; L1039-V1111 HydrophobicContact CD1-CG2 4.18Å; L1039-V1111 HydrophobicContact CG-CB 4.46Å; L1039-V1111 HydrophobicContact CG-CG2 4.3Å; L1039-L1113 HydrophobicContact CD1-CD2 4.35Å; L1039-K1124 HydrophobicContact CD2-CB 3.87Å; L1039-H1133 HydrophobicContact CB-CB 4.28Å; L1039-H1133 HydrophobicContact CD1-CB 4Å; L1039-I1135 HydrophobicContact CD1-CG2 3.7Å; L1039-I1135 HydrophobicContact CD2-CG2 3.46Å; L1039-I1135 VanDerWaalsContact CD2-CG2 3.46Å; L1039-I1135 HydrophobicContact CG-CG2 4.23Å; L1039-I1151 HydrophobicContact CD1-CD1 3.81Å
1040	F	78.5	Confident	72.4	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	143.4	173.4	-65.4	-72.9	0	0	0	110.9	H981 M982 L1106 L1107 L1108 K1124 L1125 A1126 A1128	H981-F1040 WeakPolarHBondContact O-CE2 3.31Å; M982-F1040 HydrophobicContact CB-CE2 4.29Å; M982-F1040 HydrophobicContact CB-CZ 3.88Å; M982-F1040 HydrophobicContact CE-CE1 4.47Å; M982-F1040 HydrophobicContact CG-CE1 4.36Å; M982-F1040 HydrophobicContact CG-CE2 4.25Å; M982-F1040 HydrophobicContact CG-CZ 3.77Å; M982-F1040 HydrophobicContact SD-CE1 4.04Å; M982-F1040 HydrophobicContact SD-CZ 3.96Å; F1040-L1106 HydrophobicContact CB-CD1 4.33Å; F1040-L1106 HydrophobicContact CB-CD2 3.93Å; F1040-L1106 HydrophobicContact CB-CG 4.22Å; F1040-L1106 HydrophobicContact CD1-CD2 3.25Å; F1040-L1106 HydrophobicContact CD1-CG 3.95Å; F1040-L1106 HydrophobicContact CE1-CD2 3.89Å; F1040-L1106 HydrophobicContact CG-CD2 3.79Å; F1040-L1106 HydrophobicContact CG-CG 4.48Å; F1040-L1107 CarbonylContact C-O 3.56Å; F1040-L1107 VanDerWaalsContact CA-O 3.32Å; F1040-L1107 WeakPolarHBondContact CA-O 3.14Å; F1040-L1108 HydrophobicContact CD1-CB 4.45Å; F1040-L1108 HydrophobicContact CD1-CD1 3.8Å; F1040-L1108 HydrophobicContact CE1-CD1 3.81Å; F1040-L1108 HydrophobicContact CG-CD1 4.22Å; F1040-L1108 HydrophobicContact CZ-CD1 4.22Å; F1040-K1124 HydrophobicContact CD2-CB 4.49Å; F1040-K1124 HydrophobicContact CD2-CD 4.23Å; F1040-K1124 HydrophobicContact CD2-CG 4.4Å; F1040-K1124 HydrophobicContact CE2-CD 3.83Å; F1040-K1124 HydrophobicContact CE2-CG 4.22Å; F1040-L1125 WeakPolarHBondContact CB-O 3.42Å; F1040-A1126 HydrophobicContact CD2-CB 4.08Å; F1040-A1126 HydrophobicContact CE2-CB 4.2Å; F1040-A1128 WeakPolarHBondContact O-CB 3.29Å
1041	H	73.9	Confident	72.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	114.8	178.2	-174	86.4	0	0	0	110.2	F1054 L1106 L1107 H1132 H1133	H1041-F1054 AromaticContact CD2-CE1 3.77Å; H1041-F1054 AromaticContact CE1-CE1 3.68Å; H1041-F1054 AromaticContact CG-CE1 3.93Å; H1041-F1054 AromaticContact ND1-CE1 3.89Å; H1041-F1054 AromaticContact NE2-CE1 3.6Å; H1041-L1106 WeakPolarHBondContact O-CD1 2.98Å; H1041-L1107 HydrophobicContact CB-CB 4.24Å; H1041-L1107 PolarHBondContact N-O 3.21Å; H1041-L1107 PolarHBondContact O-N 3.4Å; H1041-H1132 PolarHBondContact CE1-N 2.99Å; H1041-H1132 PolarHBondContact ND1-O 2.87Å; H1041-H1133 AromaticContact CG-NE2 3.86Å; H1041-H1133 AromaticContact ND1-CD2 3.7Å; H1041-H1133 AromaticContact ND1-CE1 3.65Å; H1041-H1133 AromaticContact ND1-CG 3.99Å; H1041-H1133 AromaticContact ND1-ND1 3.96Å; H1041-H1133 AromaticContact ND1-NE2 3.47Å; H1041-H1133 PolarHBondContact ND1-NE2 3.32Å
1042	G	67.7	Low	72.8	Confident	11 Å²	11	46.5 Å²	46.5	11%	0.113	25%	0.246	C	C	.	.			trans	-89.3	133.8	170.6	0	0	0	0	0	110.3	P1130 G1131	G1042-P1130 VanDerWaalsContact O-CA 3.25Å; G1042-P1130 WeakPolarHBondContact O-CA 3.3Å; G1042-G1131 PolarHBondContact O-N 3.46Å
1043	S	66.5	Low	72.8	Confident	16 Å²	16	44.1 Å²	44.1	11%	0.112	22%	0.221	C	C	.	.			trans	-158.9	144.7	173.1	179.9	0	0	0	0	111.3	F1045 V1046	S1043-F1045 PolarHBondContact O-N 2.82Å; S1043-F1045 PolarHBondContact OG-N 3.43Å; S1043-V1046 WeakPolarHBondContact O-CG2 3.35Å
1044	P	61.1	Low	72.7	Confident	74 Å²	74	38.2 Å²	38.2	48%	0.481	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.3	165.8	26.4	-31.9	0	0	0	112.3
1045	F	65.7	Low	72.3	Confident	53 Å²	53	36.3 Å²	36.3	23%	0.232	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	22.5	-177.8	-56.4	-67.6	0	0	0	113.8	S1043 H1047 A1048 I1049 H1058 I1061	S1043-F1045 PolarHBondContact O-N 2.82Å; S1043-F1045 PolarHBondContact OG-N 3.43Å; F1045-H1047 VanDerWaalsContact C-N 3.27Å; F1045-H1047 PolarHBondContact O-N 2.95Å; F1045-A1048 HydrophobicContact CB-CB 4.32Å; F1045-A1048 WeakPolarHBondContact O-CB 3.25Å; F1045-A1048 PolarHBondContact O-N 3.15Å; F1045-I1049 WeakPolarHBondContact O-CG1 3.15Å; F1045-I1049 PolarHBondContact O-N 3.17Å; F1045-H1058 HydrophobicContact CB-CB 3.99Å; F1045-H1058 AromaticContact CD1-CD2 3.69Å; F1045-H1058 HydrophobicContact CD2-CB 3.81Å; F1045-H1058 VanDerWaalsContact CD2-O 3.31Å; F1045-H1058 WeakPolarHBondContact CD2-O 3.36Å; F1045-H1058 HydrophobicContact CG-CB 3.98Å; F1045-H1058 AromaticContact CG-CD2 3.51Å; F1045-I1061 HydrophobicContact CE1-CG2 4.37Å; F1045-I1061 HydrophobicContact CE2-CB 3.7Å; F1045-I1061 HydrophobicContact CE2-CG2 3.54Å; F1045-I1061 HydrophobicContact CZ-CB 3.86Å; F1045-I1061 HydrophobicContact CZ-CG2 3.23Å
1046	V	72	Confident	71.5	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.024	22%	0.215	C	C	.	.	H	α-helix	trans	-48.4	-46.6	-177.1	161.3	0	0	0	0	112.7	S1043 A1048 I1049 V1050 L1107 L1169	S1043-V1046 WeakPolarHBondContact O-CG2 3.35Å; V1046-A1048 PolarHBondContact O-N 2.67Å; V1046-I1049 PolarHBondContact O-N 2.97Å; V1046-V1050 WeakPolarHBondContact O-CG2 3.14Å; V1046-V1050 PolarHBondContact O-N 2.98Å; V1046-L1107 HydrophobicContact CB-CD1 4.44Å; V1046-L1107 HydrophobicContact CB-CG 4.44Å; V1046-L1107 HydrophobicContact CG1-CD1 4.18Å; V1046-L1107 HydrophobicContact CG1-CD2 3.86Å; V1046-L1107 HydrophobicContact CG1-CG 3.82Å; V1046-L1107 HydrophobicContact CG2-CD1 4.22Å; V1046-L1107 HydrophobicContact CG2-CG 4.11Å; V1046-L1169 HydrophobicContact CG1-CD1 3.27Å
1047	H	77.6	Confident	70.6	Confident	97 Å²	97	48 Å²	48	45%	0.449	23%	0.232	S	C	.	.	H	α-helix	trans	-66.2	-37.7	179.4	-64.9	-64	0	0	0	113.2	F1045 I1049 V1050 Q1051 Y1105	F1045-H1047 VanDerWaalsContact C-N 3.27Å; F1045-H1047 PolarHBondContact O-N 2.95Å; H1047-I1049 VanDerWaalsContact C-N 3.35Å; H1047-V1050 PolarHBondContact O-N 3.13Å; H1047-Q1051 WeakPolarHBondContact O-CG 3.3Å; H1047-Q1051 PolarHBondContact O-N 3.26Å; H1047-Y1105 AromaticContact NE2-CE2 4Å
1048	A	72.2	Confident	69.6	Low	24 Å²	24	46.6 Å²	46.6	20%	0.198	23%	0.227	C	C	.	.	H	α-helix	trans	-67.3	-38.2	175.4	0	0	0	0	0	111.4	F1045 V1046 Q1051 K1052	F1045-A1048 HydrophobicContact CB-CB 4.32Å; F1045-A1048 WeakPolarHBondContact O-CB 3.25Å; F1045-A1048 PolarHBondContact O-N 3.15Å; V1046-A1048 PolarHBondContact O-N 2.67Å; A1048-Q1051 PolarHBondContact O-N 2.53Å; A1048-K1052 WeakPolarHBondContact O-CB 3.44Å; A1048-K1052 PolarHBondContact O-N 3.25Å
1049	I	73.8	Confident	68.2	Low	1 Å²	1	44.8 Å²	44.8	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-64.3	-43.3	176.8	-66.5	166.3	0	0	0	111	F1045 V1046 H1047 Q1051 G1053 F1054 L1107 P1166	F1045-I1049 WeakPolarHBondContact O-CG1 3.15Å; F1045-I1049 PolarHBondContact O-N 3.17Å; V1046-I1049 PolarHBondContact O-N 2.97Å; H1047-I1049 VanDerWaalsContact C-N 3.35Å; I1049-Q1051 VanDerWaalsContact C-N 3.26Å; I1049-Q1051 PolarHBondContact O-N 3.04Å; I1049-G1053 WeakPolarHBondContact O-CA 3.46Å; I1049-G1053 PolarHBondContact O-N 2.91Å; I1049-F1054 HydrophobicContact CD1-CD1 4.26Å; I1049-F1054 HydrophobicContact CD1-CE1 4.05Å; I1049-F1054 HydrophobicContact CG1-CD1 4.42Å; I1049-F1054 HydrophobicContact CG2-CD1 3.89Å; I1049-F1054 HydrophobicContact CG2-CD2 4.04Å; I1049-F1054 HydrophobicContact CG2-CE1 3.67Å; I1049-F1054 HydrophobicContact CG2-CE2 3.81Å; I1049-F1054 HydrophobicContact CG2-CG 4.09Å; I1049-F1054 HydrophobicContact CG2-CZ 3.63Å; I1049-L1107 HydrophobicContact CB-CD1 3.92Å; I1049-L1107 HydrophobicContact CD1-CD1 4.37Å; I1049-L1107 HydrophobicContact CG2-CD1 3.59Å; I1049-P1166 HydrophobicContact CG2-CB 4.47Å; I1049-P1166 HydrophobicContact CG2-CG 4.44Å
1050	V	80.2	Confident	67	Low	5 Å²	5	51.9 Å²	51.9	3%	0.03	25%	0.248	C	C	.	.	H	α-helix	trans	-58.5	-39.8	176.1	166.5	0	0	0	0	111.5	T946 L948 V1010 V1046 H1047 L1107 P1166	T946-V1050 HydrophobicContact CG2-CG1 3.62Å; T946-V1050 PolarHBondContact OG1-O 3.1Å; L948-V1050 HydrophobicContact CD2-CG1 3.82Å; V1010-V1050 HydrophobicContact CG1-CG1 3.97Å; V1010-V1050 HydrophobicContact CG2-CG1 4.29Å; V1010-V1050 HydrophobicContact CG2-CG2 4.33Å; V1046-V1050 WeakPolarHBondContact O-CG2 3.14Å; V1046-V1050 PolarHBondContact O-N 2.98Å; H1047-V1050 PolarHBondContact O-N 3.13Å; V1050-L1107 HydrophobicContact CG2-CD1 4.48Å; V1050-L1107 HydrophobicContact CG2-CD2 3.52Å; V1050-P1166 HydrophobicContact CG2-CB 4.5Å
1051	Q	77.5	Confident	65.4	Low	121 Å²	121	54.8 Å²	54.8	57%	0.565	26%	0.262	S	S	*	.	H	α-helix	trans	-81.6	-46.4	-176.9	-69.6	179.6	-5.5	0	0	114	T946 N1012 H1047 A1048 I1049	T946-Q1051 WeakPolarHBondContact OG1-CA 3.37Å; N1012-Q1051 PolarHBondContact ND2-O 3.07Å; H1047-Q1051 WeakPolarHBondContact O-CG 3.3Å; H1047-Q1051 PolarHBondContact O-N 3.26Å; A1048-Q1051 PolarHBondContact O-N 2.53Å; I1049-Q1051 VanDerWaalsContact C-N 3.26Å; I1049-Q1051 PolarHBondContact O-N 3.04Å
1052	K	72.8	Confident	63.9	Low	139 Å²	139	54.8 Å²	54.8	60%	0.604	26%	0.262	S	S	*	.	H	α-helix	trans	-112	-8	-167.3	-61.8	-178.6	-179.1	175.8	0	113.4	A1048	A1048-K1052 WeakPolarHBondContact O-CB 3.44Å; A1048-K1052 PolarHBondContact O-N 3.25Å
1053	G	73.5	Confident	62.7	Low	2 Å²	2	54.6 Å²	54.6	2%	0.021	26%	0.26	C	S	.	.			trans	79.6	-173.8	-172.9	0	0	0	0	0	112.7	I1049 D1055	I1049-G1053 WeakPolarHBondContact O-CA 3.46Å; I1049-G1053 PolarHBondContact O-N 2.91Å; G1053-D1055 PolarHBondContact O-N 3.11Å; G1053-D1055 VanDerWaalsContact O-N 3.16Å
1054	F	68.7	Low	61.6	Low	6 Å²	6	59.6 Å²	59.6	3%	0.026	28%	0.283	C	S	.	.			trans	-77.3	96.6	-176.3	-75.7	-79.1	0	0	0	112	H1041 I1049 C1109 H1133 R1153 Y1162 A1164	H1041-F1054 AromaticContact CD2-CE1 3.77Å; H1041-F1054 AromaticContact CE1-CE1 3.68Å; H1041-F1054 AromaticContact CG-CE1 3.93Å; H1041-F1054 AromaticContact ND1-CE1 3.89Å; H1041-F1054 AromaticContact NE2-CE1 3.6Å; I1049-F1054 HydrophobicContact CD1-CD1 4.26Å; I1049-F1054 HydrophobicContact CD1-CE1 4.05Å; I1049-F1054 HydrophobicContact CG1-CD1 4.42Å; I1049-F1054 HydrophobicContact CG2-CD1 3.89Å; I1049-F1054 HydrophobicContact CG2-CD2 4.04Å; I1049-F1054 HydrophobicContact CG2-CE1 3.67Å; I1049-F1054 HydrophobicContact CG2-CE2 3.81Å; I1049-F1054 HydrophobicContact CG2-CG 4.09Å; I1049-F1054 HydrophobicContact CG2-CZ 3.63Å; F1054-C1109 HydrophobicContact CZ-CB 4.34Å; F1054-C1109 VanDerWaalsContact CZ-SG 3.51Å; F1054-H1133 AromaticContact CZ-NE2 3.97Å; F1054-R1153 VanDerWaalsContact CB-CZ 3.5Å; F1054-R1153 PolarHBondContact O-NH1 3.03Å; F1054-Y1162 HydrophobicContact CB-CD1 4.34Å; F1054-Y1162 WeakPolarHBondContact O-CD1 3.19Å; F1054-Y1162 WeakPolarHBondContact O-CE1 3.42Å; F1054-A1164 HydrophobicContact CD2-CB 3.78Å; F1054-A1164 WeakPolarHBondContact CD2-O 3.47Å; F1054-A1164 HydrophobicContact CE2-CB 3.57Å; F1054-A1164 HydrophobicContact CZ-CB 4.24Å
1055	D	61.4	Low	60.5	Low	26 Å²	26	63.2 Å²	63.2	14%	0.139	29%	0.292	C	S	.	.			trans	-96.6	143.7	175.2	170.6	-14.6	0	0	0	111.2	G1053 R1057 H1058 R1153	G1053-D1055 PolarHBondContact O-N 3.11Å; G1053-D1055 VanDerWaalsContact O-N 3.16Å; D1055-R1057 VanDerWaalsContact C-N 3.29Å; D1055-R1057 PolarHBondContact O-N 3.48Å; D1055-R1057 PolarHBondContact OD1-N 3.38Å; D1055-R1057 IonicContact OD1-NE 3.52Å; D1055-R1057 PolarHBondContact OD1-NE 2.83Å; D1055-R1057 IonicContact OD2-CZ 3.84Å; D1055-R1057 IonicContact OD2-NE 3.32Å; D1055-R1057 PolarHBondContact OD2-NE 3.18Å; D1055-R1057 VanDerWaalsContact OD2-NE 3.11Å; D1055-R1057 IonicContact OD2-NH2 3.84Å; D1055-R1057 PolarHBondContact OD2-NH2 3.31Å; D1055-H1058 WeakPolarHBondContact CB-ND1 3.2Å; D1055-H1058 PolarHBondContact O-N 3.24Å; D1055-R1153 PolarHBondContact O-NH1 2.84Å; D1055-R1153 PolarHBondContact O-NH2 3.2Å
1056	E	55.7	Low	59.1	Low	153 Å²	153	62.1 Å²	62.1	72%	0.715	30%	0.295	S	S	*	.	H	α-helix	trans	-58.8	-35.1	-177	64.1	-157.8	162.7	0	0	113.1	H1058 A1059 Y1060	E1056-H1058 PolarHBondContact O-N 3.23Å; E1056-A1059 WeakPolarHBondContact O-CB 3.04Å; E1056-A1059 PolarHBondContact O-N 3.27Å; E1056-A1059 VanDerWaalsContact O-N 3.13Å; E1056-Y1060 PolarHBondContact O-N 3.24Å
1057	R	56.7	Low	57.3	Low	158 Å²	158	63.9 Å²	63.9	60%	0.596	31%	0.31	S	S	*	.	H	α-helix	trans	-63.5	-42	179.1	-63.8	176.1	-66.7	175.3	-1	112	D1055 A1059 Y1060 I1061	D1055-R1057 VanDerWaalsContact C-N 3.29Å; D1055-R1057 PolarHBondContact O-N 3.48Å; D1055-R1057 PolarHBondContact OD1-N 3.38Å; D1055-R1057 IonicContact OD1-NE 3.52Å; D1055-R1057 PolarHBondContact OD1-NE 2.83Å; D1055-R1057 IonicContact OD2-CZ 3.84Å; D1055-R1057 IonicContact OD2-NE 3.32Å; D1055-R1057 PolarHBondContact OD2-NE 3.18Å; D1055-R1057 VanDerWaalsContact OD2-NE 3.11Å; D1055-R1057 IonicContact OD2-NH2 3.84Å; D1055-R1057 PolarHBondContact OD2-NH2 3.31Å; R1057-A1059 PolarHBondContact O-N 2.74Å; R1057-Y1060 PolarHBondContact O-N 2.91Å; R1057-I1061 WeakPolarHBondContact O-CB 3.25Å; R1057-I1061 WeakPolarHBondContact O-CD1 3.28Å; R1057-I1061 WeakPolarHBondContact O-CG1 3.4Å; R1057-I1061 PolarHBondContact O-N 3.26Å
1058	H	51.1	Low	55.4	Low	27 Å²	27	60.1 Å²	60.1	13%	0.125	30%	0.297	C	S	.	.	H	α-helix	trans	-65.9	-26.1	177.6	-59	115.2	0	0	0	112.6	F1045 D1055 E1056 G1062	F1045-H1058 HydrophobicContact CB-CB 3.99Å; F1045-H1058 AromaticContact CD1-CD2 3.69Å; F1045-H1058 HydrophobicContact CD2-CB 3.81Å; F1045-H1058 VanDerWaalsContact CD2-O 3.31Å; F1045-H1058 WeakPolarHBondContact CD2-O 3.36Å; F1045-H1058 HydrophobicContact CG-CB 3.98Å; F1045-H1058 AromaticContact CG-CD2 3.51Å; D1055-H1058 WeakPolarHBondContact CB-ND1 3.2Å; D1055-H1058 PolarHBondContact O-N 3.24Å; E1056-H1058 PolarHBondContact O-N 3.23Å; H1058-G1062 WeakPolarHBondContact O-CA 3.45Å; H1058-G1062 PolarHBondContact O-N 3.15Å
1059	A	50.4	Low	53.8	Low	19 Å²	19	61.2 Å²	61.2	16%	0.157	30%	0.299	C	S	.	.	H	α-helix	trans	-75.3	-45.1	176.2	0	0	0	0	0	111.3	E1056 R1057 G1062 G1063	E1056-A1059 WeakPolarHBondContact O-CB 3.04Å; E1056-A1059 PolarHBondContact O-N 3.27Å; E1056-A1059 VanDerWaalsContact O-N 3.13Å; R1057-A1059 PolarHBondContact O-N 2.74Å; A1059-G1062 PolarHBondContact O-N 2.87Å; A1059-G1063 PolarHBondContact O-N 3.45Å; A1059-G1063 VanDerWaalsContact O-N 3.12Å
1060	Y	49.5	Very low	52.7	Low	154 Å²	154	62 Å²	62	60%	0.604	30%	0.302	S	S	*	.	H	α-helix	trans	-62	-48.6	176.9	-170.2	-92.1	0	0	0	111.6	E1056 R1057 G1062 G1063 M1064	E1056-Y1060 PolarHBondContact O-N 3.24Å; R1057-Y1060 PolarHBondContact O-N 2.91Å; Y1060-G1062 VanDerWaalsContact C-N 3.33Å; Y1060-G1062 PolarHBondContact O-N 2.63Å; Y1060-G1063 PolarHBondContact O-N 2.72Å; Y1060-M1064 HydrophobicContact CD1-SD 4.48Å; Y1060-M1064 HydrophobicContact CE1-CE 4.41Å; Y1060-M1064 HydrophobicContact CE1-SD 3.9Å; Y1060-M1064 PolarHBondContact O-N 2.9Å
1061	I	44.8	Very low	50.7	Low	61 Å²	61	65.4 Å²	65.4	31%	0.313	32%	0.317	S	S	.	.	H	α-helix	trans	-66.8	-37.9	177.8	-59.3	165.3	0	0	0	110	F1045 R1057 G1063 M1064 F1065	F1045-I1061 HydrophobicContact CE1-CG2 4.37Å; F1045-I1061 HydrophobicContact CE2-CB 3.7Å; F1045-I1061 HydrophobicContact CE2-CG2 3.54Å; F1045-I1061 HydrophobicContact CZ-CB 3.86Å; F1045-I1061 HydrophobicContact CZ-CG2 3.23Å; R1057-I1061 WeakPolarHBondContact O-CB 3.25Å; R1057-I1061 WeakPolarHBondContact O-CD1 3.28Å; R1057-I1061 WeakPolarHBondContact O-CG1 3.4Å; R1057-I1061 PolarHBondContact O-N 3.26Å; I1061-G1063 VanDerWaalsContact C-N 3.29Å; I1061-G1063 PolarHBondContact O-N 2.97Å; I1061-M1064 PolarHBondContact O-N 3.24Å; I1061-M1064 VanDerWaalsContact O-N 3.09Å; I1061-F1065 HydrophobicContact CB-CD2 4.46Å; I1061-F1065 HydrophobicContact CG2-CD2 3.36Å; I1061-F1065 HydrophobicContact CG2-CE2 3.61Å; I1061-F1065 HydrophobicContact CG2-CG 4.49Å; I1061-F1065 VanDerWaalsContact O-CD2 3.29Å; I1061-F1065 WeakPolarHBondContact O-CD2 3.23Å; I1061-F1065 PolarHBondContact O-N 2.82Å
1062	G	42.4	Very low	49	Very low	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-56.3	-43.3	177	0	0	0	0	0	112.6	H1058 A1059 Y1060 G1066 P1130	H1058-G1062 WeakPolarHBondContact O-CA 3.45Å; H1058-G1062 PolarHBondContact O-N 3.15Å; A1059-G1062 PolarHBondContact O-N 2.87Å; Y1060-G1062 VanDerWaalsContact C-N 3.33Å; Y1060-G1062 PolarHBondContact O-N 2.63Å; G1062-G1066 WeakPolarHBondContact O-CA 3.42Å; G1062-G1066 PolarHBondContact O-N 2.65Å; G1062-P1130 VanDerWaalsContact O-CB 3.25Å; G1062-P1130 WeakPolarHBondContact O-CB 3.33Å
1063	G	43.1	Very low	47.6	Very low	7 Å²	7	60.6 Å²	60.6	7%	0.072	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-39.5	174.7	0	0	0	0	0	113.6	A1059 Y1060 I1061 Y1081	A1059-G1063 PolarHBondContact O-N 3.45Å; A1059-G1063 VanDerWaalsContact O-N 3.12Å; Y1060-G1063 PolarHBondContact O-N 2.72Å; I1061-G1063 VanDerWaalsContact C-N 3.29Å; I1061-G1063 PolarHBondContact O-N 2.97Å; G1063-Y1081 VanDerWaalsContact C-CD1 3.42Å; G1063-Y1081 WeakPolarHBondContact O-CB 3.45Å; G1063-Y1081 WeakPolarHBondContact O-CD1 3.32Å; G1063-Y1081 VanDerWaalsContact O-CG 3.31Å
1064	M	43.1	Very low	46.3	Very low	120 Å²	120	64.5 Å²	64.5	59%	0.591	32%	0.316	S	S	*	.	H	α-helix	trans	-71.7	-36.8	-179.4	-89.9	-176.6	149.2	0	0	114.4	Y1060 I1061	Y1060-M1064 HydrophobicContact CD1-SD 4.48Å; Y1060-M1064 HydrophobicContact CE1-CE 4.41Å; Y1060-M1064 HydrophobicContact CE1-SD 3.9Å; Y1060-M1064 PolarHBondContact O-N 2.9Å; I1061-M1064 PolarHBondContact O-N 3.24Å; I1061-M1064 VanDerWaalsContact O-N 3.09Å
1065	F	39.4	Very low	45.2	Very low	151 Å²	151	65.1 Å²	65.1	66%	0.662	32%	0.32	S	S	*	.	H	α-helix	trans	-108	-9.7	-170	-65.3	-83	0	0	0	114.3	I1061 A1067	I1061-F1065 HydrophobicContact CB-CD2 4.46Å; I1061-F1065 HydrophobicContact CG2-CD2 3.36Å; I1061-F1065 HydrophobicContact CG2-CE2 3.61Å; I1061-F1065 HydrophobicContact CG2-CG 4.49Å; I1061-F1065 VanDerWaalsContact O-CD2 3.29Å; I1061-F1065 WeakPolarHBondContact O-CD2 3.23Å; I1061-F1065 PolarHBondContact O-N 2.82Å; F1065-A1067 VanDerWaalsContact C-N 3.26Å; F1065-A1067 PolarHBondContact O-N 3.11Å
1066	G	35.6	Very low	44.6	Very low	29 Å²	29	68.7 Å²	68.7	30%	0.299	35%	0.348	S	S	.	.			trans	-77.3	54.6	-172.3	0	0	0	0	0	115.8	G1062	G1062-G1066 WeakPolarHBondContact O-CA 3.42Å; G1062-G1066 PolarHBondContact O-N 2.65Å
1067	A	34	Very low	44	Very low	42 Å²	42	66.1 Å²	66.1	35%	0.347	33%	0.334	S	S	.	.			trans	-83.9	119.6	176.8	0	0	0	0	0	112.2	F1065	F1065-A1067 VanDerWaalsContact C-N 3.26Å; F1065-A1067 PolarHBondContact O-N 3.11Å
1068	G	37.3	Very low	43.5	Very low	17 Å²	17	58.8 Å²	58.8	18%	0.175	31%	0.307	C	S	.	.	S	Bend	trans	149.1	-2.9	158.7	0	0	0	0	0	118.4
1069	I	39.3	Very low	42.8	Very low	47 Å²	47	59.5 Å²	59.5	24%	0.241	31%	0.312	C	S	.	.	S	Bend	trans	-142.9	26.6	-178.6	-40.3	167.5	0	0	0	114.4	H989 F999	H989-I1069 PolarHBondContact NE2-O 2.97Å; F999-I1069 HydrophobicContact CZ-CG2 4.15Å
1070	Y	50	Low	42.4	Very low	17 Å²	17	65.2 Å²	65.2	7%	0.067	34%	0.335	C	S	.	.			trans	-139.9	135.7	-178.8	-154.3	-112	0	0	0	118.4	H989 A1072 S1078 V1082 P1129 E1148 V1150	H989-Y1070 PolarHBondContact CE1-N 3.48Å; H989-Y1070 PolarHBondContact NE2-N 2.97Å; Y1070-A1072 HydrophobicContact CD1-CB 4.46Å; Y1070-A1072 HydrophobicContact CE1-CB 3.39Å; Y1070-A1072 VanDerWaalsContact CE1-N 3.25Å; Y1070-A1072 HydrophobicContact CE2-CB 4.27Å; Y1070-A1072 WeakPolarHBondContact OH-CB 3.3Å; Y1070-S1078 VanDerWaalsContact CE1-CB 3.44Å; Y1070-V1082 WeakPolarHBondContact O-CG2 3.37Å; Y1070-P1129 HydrophobicContact CD1-CB 3.98Å; Y1070-P1129 HydrophobicContact CD1-CG 4.35Å; Y1070-P1129 HydrophobicContact CD2-CB 4.05Å; Y1070-P1129 HydrophobicContact CD2-CG 4.29Å; Y1070-P1129 HydrophobicContact CE1-CB 4.03Å; Y1070-P1129 HydrophobicContact CE1-CG 3.89Å; Y1070-P1129 HydrophobicContact CE2-CB 4.15Å; Y1070-P1129 HydrophobicContact CE2-CG 3.87Å; Y1070-P1129 HydrophobicContact CG-CB 3.94Å; Y1070-P1129 HydrophobicContact CG-CG 4.5Å; Y1070-E1148 WeakPolarHBondContact CE2-OE1 3.49Å; Y1070-E1148 PolarHBondContact OH-OE1 3.38Å; Y1070-V1150 VanDerWaalsContact OH-CG2 3.31Å; Y1070-V1150 WeakPolarHBondContact OH-CG2 3.19Å
1071	F	37.6	Very low	42.1	Very low	77 Å²	77	62.1 Å²	62.1	34%	0.338	32%	0.323	S	S	.	.			trans	-138.9	112.9	153.1	-111.7	-88.9	0	0	0	105.3	V1082	F1071-V1082 HydrophobicContact CE2-CG1 4.43Å
1072	A	42.8	Very low	41.8	Very low	6 Å²	6	61.2 Å²	61.2	5%	0.05	32%	0.32	C	S	.	.			trans	-107.2	108.9	150.6	0	0	0	0	0	106.8	Y1070 H1074 S1075 N1079	Y1070-A1072 HydrophobicContact CD1-CB 4.46Å; Y1070-A1072 HydrophobicContact CE1-CB 3.39Å; Y1070-A1072 VanDerWaalsContact CE1-N 3.25Å; Y1070-A1072 HydrophobicContact CE2-CB 4.27Å; Y1070-A1072 WeakPolarHBondContact OH-CB 3.3Å; A1072-H1074 PolarHBondContact O-N 2.93Å; A1072-S1075 PolarHBondContact O-N 3Å; A1072-S1075 VanDerWaalsContact O-N 3.15Å; A1072-N1079 PolarHBondContact O-OD1 3Å
1073	E	42.5	Very low	41.4	Very low	153 Å²	153	67.9 Å²	67.9	72%	0.715	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-22.7	-178.3	-69.7	-173.8	145.5	0	0	113.1
1074	H	46.2	Very low	41.1	Very low	85 Å²	85	69.2 Å²	69.2	39%	0.394	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	1.5	-173.2	-51.8	-52.8	0	0	0	115.9	A1072 Y1146 P1147	A1072-H1074 PolarHBondContact O-N 2.93Å; H1074-Y1146 HydrophobicContact CB-CD1 3.43Å; H1074-Y1146 VanDerWaalsContact CB-CD1 3.43Å; H1074-Y1146 HydrophobicContact CB-CE1 3.64Å; H1074-Y1146 HydrophobicContact CB-CG 4.04Å; H1074-Y1146 AromaticContact CD2-CD1 3.78Å; H1074-Y1146 AromaticContact CG-CD1 3.46Å; H1074-Y1146 VanDerWaalsContact CG-CD1 3.46Å; H1074-Y1146 AromaticContact CG-CE1 3.8Å; H1074-P1147 VanDerWaalsContact CD2-CD 3.44Å; H1074-P1147 WeakPolarHBondContact CD2-CD 3.41Å
1075	S	47.3	Very low	40.7	Very low	18 Å²	18	72.4 Å²	72.4	13%	0.126	38%	0.383	C	S	.	.			trans	-100.2	101.4	178.6	-175.3	0	0	0	0	111.3	A1072 K1077 S1078 N1079	A1072-S1075 PolarHBondContact O-N 3Å; A1072-S1075 VanDerWaalsContact O-N 3.15Å; S1075-K1077 VanDerWaalsContact C-N 3.27Å; S1075-K1077 PolarHBondContact O-N 2.82Å; S1075-S1078 WeakPolarHBondContact CB-OG 3.2Å; S1075-S1078 PolarHBondContact O-N 2.87Å; S1075-S1078 VanDerWaalsContact O-N 3.14Å; S1075-S1078 WeakPolarHBondContact OG-CB 3.45Å; S1075-S1078 PolarHBondContact OG-N 2.84Å; S1075-S1078 PolarHBondContact OG-OG 2.83Å; S1075-N1079 PolarHBondContact O-N 3.1Å
1076	S	47.8	Very low	40.8	Very low	102 Å²	102	68.4 Å²	68.4	71%	0.713	38%	0.384	S	S	*	.	H	α-helix	trans	-55.1	-38.9	-178.7	58.2	0	0	0	0	113.6	Q1080	S1076-Q1080 PolarHBondContact O-N 3.16Å
1077	K	43.9	Very low	41.1	Very low	98 Å²	98	68.9 Å²	68.9	43%	0.426	39%	0.389	S	S	.	.	H	α-helix	trans	-77.4	-33.8	179.3	-156.7	170.7	-172	175	0	112.5	S1075 N1079 Q1080 Y1081 Y1152	S1075-K1077 VanDerWaalsContact C-N 3.27Å; S1075-K1077 PolarHBondContact O-N 2.82Å; K1077-N1079 VanDerWaalsContact C-N 3.35Å; K1077-Q1080 PolarHBondContact O-N 3.3Å; K1077-Y1081 HydrophobicContact CG-CE2 4.13Å; K1077-Y1081 WeakPolarHBondContact O-CD2 3.5Å; K1077-Y1152 WeakPolarHBondContact CB-OH 3.47Å; K1077-Y1152 HydrophobicContact CD-CE1 4.06Å; K1077-Y1152 WeakPolarHBondContact CD-OH 3.15Å
1078	S	45	Very low	41.7	Very low	5 Å²	5	68 Å²	68	4%	0.035	38%	0.384	C	S	.	.	H	α-helix	trans	-68.8	-36.2	174	-51.3	0	0	0	0	111.7	Y1070 S1075 Q1080 Y1081 V1082	Y1070-S1078 VanDerWaalsContact CE1-CB 3.44Å; S1075-S1078 WeakPolarHBondContact CB-OG 3.2Å; S1075-S1078 PolarHBondContact O-N 2.87Å; S1075-S1078 VanDerWaalsContact O-N 3.14Å; S1075-S1078 WeakPolarHBondContact OG-CB 3.45Å; S1075-S1078 PolarHBondContact OG-N 2.84Å; S1075-S1078 PolarHBondContact OG-OG 2.83Å; S1078-Q1080 VanDerWaalsContact C-N 3.28Å; S1078-Q1080 PolarHBondContact O-N 2.88Å; S1078-Y1081 PolarHBondContact O-N 3.34Å; S1078-Y1081 VanDerWaalsContact O-N 3.15Å; S1078-V1082 WeakPolarHBondContact O-CG2 3.4Å; S1078-V1082 PolarHBondContact O-N 2.88Å
1079	N	37.5	Very low	42.5	Very low	41 Å²	41	72.1 Å²	72.1	22%	0.219	41%	0.406	C	S	.	.	H	α-helix	trans	-64.2	-30.8	175.8	-70.6	-16.3	0	0	0	112.5	A1072 S1075 K1077 V1082 H1083	A1072-N1079 PolarHBondContact O-OD1 3Å; S1075-N1079 PolarHBondContact O-N 3.1Å; K1077-N1079 VanDerWaalsContact C-N 3.35Å; N1079-V1082 PolarHBondContact O-N 2.87Å; N1079-H1083 WeakPolarHBondContact O-CB 3.32Å; N1079-H1083 PolarHBondContact O-CD2 3.09Å; N1079-H1083 VanDerWaalsContact O-CD2 3.31Å; N1079-H1083 PolarHBondContact O-N 2.82Å
1080	Q	40.9	Very low	43.3	Very low	140 Å²	140	70.8 Å²	70.8	65%	0.654	40%	0.403	S	S	*	.	H	α-helix	trans	-66	-36.4	172.6	-81.3	-178	-8.2	0	0	112.8	S1076 K1077 S1078 V1082 G1084	S1076-Q1080 PolarHBondContact O-N 3.16Å; K1077-Q1080 PolarHBondContact O-N 3.3Å; S1078-Q1080 VanDerWaalsContact C-N 3.28Å; S1078-Q1080 PolarHBondContact O-N 2.88Å; Q1080-V1082 VanDerWaalsContact C-N 3.31Å; Q1080-G1084 VanDerWaalsContact O-CA 3.24Å; Q1080-G1084 WeakPolarHBondContact O-CA 3.48Å; Q1080-G1084 PolarHBondContact O-N 2.82Å
1081	Y	43.2	Very low	43.6	Very low	88 Å²	88	71.1 Å²	71.1	35%	0.345	41%	0.408	S	S	.	.	H	α-helix	trans	-73.6	-24.5	176.6	-60.7	-55.1	0	0	0	112.8	G1063 K1077 S1078	G1063-Y1081 VanDerWaalsContact C-CD1 3.42Å; G1063-Y1081 WeakPolarHBondContact O-CB 3.45Å; G1063-Y1081 WeakPolarHBondContact O-CD1 3.32Å; G1063-Y1081 VanDerWaalsContact O-CG 3.31Å; K1077-Y1081 HydrophobicContact CG-CE2 4.13Å; K1077-Y1081 WeakPolarHBondContact O-CD2 3.5Å; S1078-Y1081 PolarHBondContact O-N 3.34Å; S1078-Y1081 VanDerWaalsContact O-N 3.15Å
1082	V	38.9	Very low	44.8	Very low	43 Å²	43	74.5 Å²	74.5	26%	0.261	43%	0.429	S	S	.	.	H	α-helix	trans	-84.9	-41.6	177.7	176.6	0	0	0	0	112.3	Y1070 F1071 S1078 N1079 Q1080	Y1070-V1082 WeakPolarHBondContact O-CG2 3.37Å; F1071-V1082 HydrophobicContact CE2-CG1 4.43Å; S1078-V1082 WeakPolarHBondContact O-CG2 3.4Å; S1078-V1082 PolarHBondContact O-N 2.88Å; N1079-V1082 PolarHBondContact O-N 2.87Å; Q1080-V1082 VanDerWaalsContact C-N 3.31Å
1083	H	34.7	Very low	45.9	Very low	139 Å²	139	78.1 Å²	78.1	64%	0.644	46%	0.459	S	S	*	.	H	α-helix	trans	-95.3	-6	-179.5	-64.1	-64	0	0	0	114.1	N1079	N1079-H1083 WeakPolarHBondContact O-CB 3.32Å; N1079-H1083 PolarHBondContact O-CD2 3.09Å; N1079-H1083 VanDerWaalsContact O-CD2 3.31Å; N1079-H1083 PolarHBondContact O-N 2.82Å
1084	G	35.6	Very low	47.3	Very low	35 Å²	35	75.3 Å²	75.3	36%	0.361	45%	0.445	S	S	.	.	S	Bend	trans	-63.3	148.9	174.1	0	0	0	0	0	112.5	Q1080 G1086	Q1080-G1084 VanDerWaalsContact O-CA 3.24Å; Q1080-G1084 WeakPolarHBondContact O-CA 3.48Å; Q1080-G1084 PolarHBondContact O-N 2.82Å; G1084-G1086 PolarHBondContact O-N 2.71Å
1085	I	35.6	Very low	48.3	Very low	188 Å²	188	79.8 Å²	79.8	96%	0.964	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	99.4	-168.2	-55.6	167.4	0	0	0	111.1
1086	G	42	Very low	48.9	Very low	67 Å²	67	81.9 Å²	81.9	69%	0.691	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	135.4	-10.8	166.2	0	0	0	0	0	117.3	G1084 G1088	G1084-G1086 PolarHBondContact O-N 2.71Å; G1086-G1088 PolarHBondContact O-N 2.78Å
1087	G	40.7	Very low	49.6	Very low	39 Å²	39	80 Å²	80	40%	0.402	45%	0.452	S	S	.	.			trans	34.8	69.5	169.9	0	0	0	0	0	113.9	K1097	G1087-K1097 PolarHBondContact O-NZ 3.2Å
1088	G	46.9	Very low	50.7	Low	23 Å²	23	75.4 Å²	75.4	24%	0.237	43%	0.433	C	S	.	.			trans	-55.9	168.2	-152.6	0	0	0	0	0	118.9	G1086 G1090 K1097	G1086-G1088 PolarHBondContact O-N 2.78Å; G1088-G1090 VanDerWaalsContact C-N 3.34Å; G1088-G1090 PolarHBondContact O-N 2.81Å; G1088-K1097 WeakPolarHBondContact O-CE 3.46Å
1089	T	54	Low	51.7	Low	104 Å²	104	75.2 Å²	75.2	64%	0.638	43%	0.431	S	S	*	.			trans	-80	-3.6	-147.1	54.5	0	0	0	0	116.3
1090	G	55.7	Low	53.7	Low	18 Å²	18	75.4 Å²	75.4	19%	0.186	43%	0.429	C	S	.	.			trans	71.8	-164.1	-171.1	0	0	0	0	0	113.7	G1088 L1092	G1088-G1090 VanDerWaalsContact C-N 3.34Å; G1088-G1090 PolarHBondContact O-N 2.81Å; G1090-L1092 PolarHBondContact O-N 2.95Å
1091	C	57.9	Low	55.5	Low	25 Å²	25	73.2 Å²	73.2	17%	0.169	43%	0.425	C	S	.	.	B	Isolated β-bridge	trans	-56.6	121.5	176.7	165.7	0	0	0	0	110.5	A1093 H1094 K1095 D1096 C1099 C1102	C1091-A1093 VanDerWaalsContact C-N 3.27Å; C1091-A1093 PolarHBondContact O-N 3.34Å; C1091-H1094 PolarHBondContact O-N 2.85Å; C1091-K1095 WeakPolarHBondContact O-CA 3.16Å; C1091-K1095 PolarHBondContact O-N 3.27Å; C1091-D1096 PolarHBondContact N-O 2.81Å; C1091-C1099 HydrophobicContact CB-CB 3.51Å; C1091-C1102 PolarHBondContact SG-SG 3.44Å
1092	L	61.6	Low	57.1	Low	148 Å²	148	70.7 Å²	70.7	78%	0.775	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-38.1	-178.3	-74.4	167.6	0	0	0	113.5	G1090	G1090-L1092 PolarHBondContact O-N 2.95Å
1093	A	66.6	Low	59.1	Low	82 Å²	82	72.6 Å²	72.6	68%	0.678	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-37.4	-177.4	0	0	0	0	0	112.9	C1091	C1091-A1093 VanDerWaalsContact C-N 3.27Å; C1091-A1093 PolarHBondContact O-N 3.34Å
1094	H	71.2	Confident	61.2	Low	93 Å²	93	68.1 Å²	68.1	43%	0.431	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-7.1	-174.6	-59.7	105.8	0	0	0	113.6	C1091 D1096 C1099 C1102	C1091-H1094 PolarHBondContact O-N 2.85Å; H1094-D1096 HydrophobicContact CB-CB 4.4Å; H1094-D1096 PolarHBondContact O-N 3.23Å; H1094-D1096 VanDerWaalsContact O-N 3.12Å; H1094-C1099 HydrophobicContact CB-CB 4.48Å; H1094-C1099 PolarHBondContact ND1-SG 3.32Å; H1094-C1102 PolarHBondContact CE1-SG 3.11Å; H1094-C1102 PolarHBondContact ND1-SG 2.74Å
1095	K	66.9	Low	63.3	Low	179 Å²	179	71.2 Å²	71.2	78%	0.778	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.5	33.6	-173.4	-59.3	-177.5	-179.7	-179.6	0	113.3	C1091	C1091-K1095 WeakPolarHBondContact O-CA 3.16Å; C1091-K1095 PolarHBondContact O-N 3.27Å
1096	D	60.7	Low	65.5	Low	62 Å²	62	62.5 Å²	62.5	33%	0.332	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-115.2	122.2	-179.3	-178.2	-2.3	0	0	0	109.2	C1091 H1094 S1098 C1099	C1091-D1096 PolarHBondContact N-O 2.81Å; H1094-D1096 HydrophobicContact CB-CB 4.4Å; H1094-D1096 PolarHBondContact O-N 3.23Å; H1094-D1096 VanDerWaalsContact O-N 3.12Å; D1096-S1098 PolarHBondContact O-N 2.69Å; D1096-S1098 PolarHBondContact OD1-N 3.17Å; D1096-C1099 HydrophobicContact CB-CB 4.01Å; D1096-C1099 WeakPolarHBondContact O-CB 3.42Å; D1096-C1099 PolarHBondContact O-N 3.12Å; D1096-C1099 PolarHBondContact OD1-N 3.42Å; D1096-C1099 WeakPolarHBondContact OD2-CA 3.33Å; D1096-C1099 PolarHBondContact OD2-N 3.26Å
1097	K	62.6	Low	67.4	Low	64 Å²	64	59.3 Å²	59.3	28%	0.278	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-34.1	178.1	-62.5	-174.3	-178.4	-164	0	111.3	A995 G1087 G1088 R1104	A995-K1097 WeakPolarHBondContact O-CD 3.48Å; G1087-K1097 PolarHBondContact O-NZ 3.2Å; G1088-K1097 WeakPolarHBondContact O-CE 3.46Å; K1097-R1104 PolarHBondContact O-NH2 3.38Å
1098	S	65.8	Low	69.5	Low	1 Å²	1	57.6 Å²	57.6	1%	0.007	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	35.4	179	-63.8	0	0	0	0	112.5	G997 D1096 Y1100	G997-S1098 VanDerWaalsContact N-CB 3.27Å; G997-S1098 PolarHBondContact N-OG 3.28Å; D1096-S1098 PolarHBondContact O-N 2.69Å; D1096-S1098 PolarHBondContact OD1-N 3.17Å; S1098-Y1100 VanDerWaalsContact O-CD2 3.29Å; S1098-Y1100 WeakPolarHBondContact O-CD2 3.44Å; S1098-Y1100 WeakPolarHBondContact O-CE2 3.46Å; S1098-Y1100 PolarHBondContact O-N 3.45Å
1099	C	67.2	Low	71.2	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.007	30%	0.3	C	S	.	.			trans	-43.1	113.6	176.9	-178.7	0	0	0	0	111.8	C1091 H1094 D1096 V1101 C1102	C1091-C1099 HydrophobicContact CB-CB 3.51Å; H1094-C1099 HydrophobicContact CB-CB 4.48Å; H1094-C1099 PolarHBondContact ND1-SG 3.32Å; D1096-C1099 HydrophobicContact CB-CB 4.01Å; D1096-C1099 WeakPolarHBondContact O-CB 3.42Å; D1096-C1099 PolarHBondContact O-N 3.12Å; D1096-C1099 PolarHBondContact OD1-N 3.42Å; D1096-C1099 WeakPolarHBondContact OD2-CA 3.33Å; D1096-C1099 PolarHBondContact OD2-N 3.26Å; C1099-V1101 VanDerWaalsContact C-N 3.32Å; C1099-C1102 PolarHBondContact SG-N 3.07Å; C1099-C1102 VanDerWaalsContact SG-N 3.42Å
1100	Y	79.5	Confident	72.6	Confident	44 Å²	44	54.2 Å²	54.2	17%	0.173	28%	0.28	C	S	.	.	S	Bend	trans	-85.3	-6.7	178.8	-54.2	-81	0	0	0	112.6	G997 L998 F999 S1098 Q1173 I1174 K1176	G997-Y1100 VanDerWaalsContact C-OH 3.31Å; G997-Y1100 WeakPolarHBondContact CA-OH 3.35Å; L998-Y1100 PolarHBondContact N-OH 3.18Å; L998-Y1100 VanDerWaalsContact O-CE1 3.3Å; L998-Y1100 WeakPolarHBondContact O-CE1 2.9Å; L998-Y1100 PolarHBondContact O-OH 2.86Å; F999-Y1100 HydrophobicContact CB-CE1 4.24Å; S1098-Y1100 VanDerWaalsContact O-CD2 3.29Å; S1098-Y1100 WeakPolarHBondContact O-CD2 3.44Å; S1098-Y1100 WeakPolarHBondContact O-CE2 3.46Å; S1098-Y1100 PolarHBondContact O-N 3.45Å; Y1100-Q1173 WeakPolarHBondContact O-CG 3Å; Y1100-Q1173 PolarHBondContact O-NE2 3.3Å; Y1100-I1174 HydrophobicContact CD1-CB 4.26Å; Y1100-I1174 HydrophobicContact CD1-CG2 3.8Å; Y1100-I1174 HydrophobicContact CE1-CG2 3.91Å; Y1100-K1176 HydrophobicContact CD1-CB 3.8Å; Y1100-K1176 HydrophobicContact CD2-CB 4.49Å; Y1100-K1176 HydrophobicContact CD2-CD 4.45Å; Y1100-K1176 HydrophobicContact CE1-CB 3.72Å; Y1100-K1176 HydrophobicContact CE1-CG 4.12Å; Y1100-K1176 HydrophobicContact CE2-CB 4.44Å; Y1100-K1176 HydrophobicContact CE2-CD 4.09Å; Y1100-K1176 HydrophobicContact CE2-CG 4.36Å; Y1100-K1176 HydrophobicContact CG-CB 4.19Å
1101	V	78.1	Confident	73.7	Confident	95 Å²	95	53.8 Å²	53.8	58%	0.576	27%	0.273	S	S	*	.	S	Bend	trans	-91.4	-43.2	-177	-176.8	0	0	0	0	111.2	C1099 Q1173	C1099-V1101 VanDerWaalsContact C-N 3.32Å; V1101-Q1173 PolarHBondContact O-NE2 2.75Å
1102	C	77.5	Confident	74.3	Confident	35 Å²	35	53.3 Å²	53.3	24%	0.236	27%	0.27	C	S	.	.	S	Bend	trans	-76.7	137.8	-175.2	-73.5	0	0	0	0	112.7	C1091 H1094 C1099	C1091-C1102 PolarHBondContact SG-SG 3.44Å; H1094-C1102 PolarHBondContact CE1-SG 3.11Å; H1094-C1102 PolarHBondContact ND1-SG 2.74Å; C1099-C1102 PolarHBondContact SG-N 3.07Å; C1099-C1102 VanDerWaalsContact SG-N 3.42Å
1103	L	81	Confident	74.7	Confident	83 Å²	83	46.6 Å²	46.6	44%	0.435	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	144.2	164.8	-59	-178.2	0	0	0	110	V1005 T1171 Y1172 Q1173	V1005-L1103 HydrophobicContact CB-CD2 4.44Å; V1005-L1103 HydrophobicContact CG2-CD2 3.72Å; L1103-T1171 HydrophobicContact CB-CG2 4.04Å; L1103-T1171 HydrophobicContact CD1-CG2 4.09Å; L1103-Y1172 CarbonylContact C-O 3.56Å; L1103-Y1172 WeakPolarHBondContact CA-O 3.41Å; L1103-Q1173 HydrophobicContact CD2-CB 4.02Å
1104	R	77.9	Confident	74.5	Confident	44 Å²	44	44.4 Å²	44.4	17%	0.166	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	161.7	179.2	-62.6	-171.5	-176.9	-134.2	5.8	109.4	K1097 T1171 Y1172	K1097-R1104 PolarHBondContact O-NH2 3.38Å; R1104-T1171 CarbonylContact O-C 3.39Å; R1104-T1171 WeakPolarHBondContact O-CA 3.5Å; R1104-Y1172 HydrophobicContact CB-CD1 4.11Å; R1104-Y1172 HydrophobicContact CB-CE1 3.59Å; R1104-Y1172 HydrophobicContact CB-CE2 4.14Å; R1104-Y1172 PolarHBondContact N-O 3.39Å; R1104-Y1172 WeakPolarHBondContact O-CD1 3.34Å; R1104-Y1172 PolarHBondContact O-N 2.82Å
1105	Y	81	Confident	74.1	Confident	100 Å²	100	46.1 Å²	46.1	39%	0.392	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.8	-176.7	-56.8	-83.4	0	0	0	110.5	H1047 L1169 V1170 T1171	H1047-Y1105 AromaticContact NE2-CE2 4Å; Y1105-L1169 HydrophobicContact CD1-CD1 4.17Å; Y1105-V1170 CarbonylContact C-O 3.43Å; Y1105-V1170 WeakPolarHBondContact CA-O 3.07Å; Y1105-T1171 HydrophobicContact CD1-CG2 4.13Å; Y1105-T1171 WeakPolarHBondContact CD1-OG1 3.4Å; Y1105-T1171 HydrophobicContact CE1-CG2 3.75Å; Y1105-T1171 WeakPolarHBondContact CE1-OG1 3.5Å
1106	L	80.8	Confident	73.9	Confident	5 Å²	5	41.5 Å²	41.5	3%	0.026	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	143.7	175.9	-169.4	71.4	0	0	0	108.1	M982 F1040 H1041 V1170 Y1172	M982-L1106 HydrophobicContact CE-CD2 3.77Å; F1040-L1106 HydrophobicContact CB-CD1 4.33Å; F1040-L1106 HydrophobicContact CB-CD2 3.93Å; F1040-L1106 HydrophobicContact CB-CG 4.22Å; F1040-L1106 HydrophobicContact CD1-CD2 3.25Å; F1040-L1106 HydrophobicContact CD1-CG 3.95Å; F1040-L1106 HydrophobicContact CE1-CD2 3.89Å; F1040-L1106 HydrophobicContact CG-CD2 3.79Å; F1040-L1106 HydrophobicContact CG-CG 4.48Å; H1041-L1106 WeakPolarHBondContact O-CD1 2.98Å; L1106-V1170 HydrophobicContact CB-CB 4.36Å; L1106-V1170 PolarHBondContact N-O 3.36Å; L1106-V1170 PolarHBondContact O-N 3.18Å; L1106-Y1172 HydrophobicContact CB-CD1 4.19Å; L1106-Y1172 HydrophobicContact CB-CE1 3.84Å
1107	L	82.1	Confident	73.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	138.5	171.1	-65.9	169.5	0	0	0	109.8	F1040 H1041 V1046 I1049 V1050 C1109 P1166 Y1168 L1169	F1040-L1107 CarbonylContact C-O 3.56Å; F1040-L1107 VanDerWaalsContact CA-O 3.32Å; F1040-L1107 WeakPolarHBondContact CA-O 3.14Å; H1041-L1107 HydrophobicContact CB-CB 4.24Å; H1041-L1107 PolarHBondContact N-O 3.21Å; H1041-L1107 PolarHBondContact O-N 3.4Å; V1046-L1107 HydrophobicContact CB-CD1 4.44Å; V1046-L1107 HydrophobicContact CB-CG 4.44Å; V1046-L1107 HydrophobicContact CG1-CD1 4.18Å; V1046-L1107 HydrophobicContact CG1-CD2 3.86Å; V1046-L1107 HydrophobicContact CG1-CG 3.82Å; V1046-L1107 HydrophobicContact CG2-CD1 4.22Å; V1046-L1107 HydrophobicContact CG2-CG 4.11Å; I1049-L1107 HydrophobicContact CB-CD1 3.92Å; I1049-L1107 HydrophobicContact CD1-CD1 4.37Å; I1049-L1107 HydrophobicContact CG2-CD1 3.59Å; V1050-L1107 HydrophobicContact CG2-CD1 4.48Å; V1050-L1107 HydrophobicContact CG2-CD2 3.52Å; L1107-C1109 WeakPolarHBondContact CB-SG 3.32Å; L1107-P1166 HydrophobicContact CD1-CB 4.22Å; L1107-P1166 HydrophobicContact CD2-CB 4.17Å; L1107-Y1168 WeakPolarHBondContact CA-O 3.32Å; L1107-L1169 HydrophobicContact CD2-CB 4.2Å; L1107-L1169 HydrophobicContact CD2-CD1 3.87Å
1108	L	84.8	Confident	73.7	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	106.9	162.3	-173.1	62.3	0	0	0	107.3	V961 L1038 F1040 E1167 Y1168	V961-L1108 HydrophobicContact CG2-CD2 3.87Å; L1038-L1108 HydrophobicContact CB-CD1 3.91Å; L1038-L1108 HydrophobicContact CB-CD2 4.44Å; L1038-L1108 HydrophobicContact CB-CG 4.1Å; L1038-L1108 HydrophobicContact CD1-CD2 4.27Å; L1038-L1108 HydrophobicContact CD2-CG 4.28Å; F1040-L1108 HydrophobicContact CD1-CB 4.45Å; F1040-L1108 HydrophobicContact CD1-CD1 3.8Å; F1040-L1108 HydrophobicContact CE1-CD1 3.81Å; F1040-L1108 HydrophobicContact CG-CD1 4.22Å; F1040-L1108 HydrophobicContact CZ-CD1 4.22Å; L1108-E1167 PolarHBondContact O-N 2.8Å; L1108-Y1168 HydrophobicContact CB-CD2 4.19Å; L1108-Y1168 HydrophobicContact CD2-CD2 3.88Å; L1108-Y1168 HydrophobicContact CD2-CE2 4.5Å; L1108-Y1168 HydrophobicContact CG-CD2 4.28Å; L1108-Y1168 PolarHBondContact N-O 3.46Å; L1108-Y1168 PolarHBondContact O-N 2.86Å; L1108-Y1168 VanDerWaalsContact O-N 3.1Å
1109	C	83.2	Confident	73.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	136.8	-171.3	-61.5	0	0	0	0	110.6	L1038 L1039 F1054 L1107 V1111 Y1165	L1038-C1109 CarbonylContact C-O 3.58Å; L1038-C1109 VanDerWaalsContact CA-O 3.3Å; L1038-C1109 WeakPolarHBondContact CA-O 3.39Å; L1039-C1109 PolarHBondContact N-O 3.32Å; L1039-C1109 PolarHBondContact O-N 2.79Å; F1054-C1109 HydrophobicContact CZ-CB 4.34Å; F1054-C1109 VanDerWaalsContact CZ-SG 3.51Å; L1107-C1109 WeakPolarHBondContact CB-SG 3.32Å; C1109-V1111 HydrophobicContact CB-CG2 4.11Å; C1109-Y1165 CarbonylContact C-O 3.58Å; C1109-Y1165 WeakPolarHBondContact CA-O 3.29Å
1110	R	83	Confident	73.4	Confident	57 Å²	57	48.5 Å²	48.5	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	122.2	167.8	-168.6	-174.7	-78.3	-87.3	-10.7	108.9	Y1019 E1036 L1038 A1164 Y1165 E1167	Y1019-R1110 HydrophobicContact CE1-CG 3.99Å; Y1019-R1110 HydrophobicContact CE2-CB 4.5Å; Y1019-R1110 HydrophobicContact CE2-CG 4.21Å; Y1019-R1110 WeakPolarHBondContact CE2-O 3.35Å; Y1019-R1110 VanDerWaalsContact CZ-CD 3.45Å; Y1019-R1110 WeakPolarHBondContact OH-CD 3.4Å; Y1019-R1110 WeakPolarHBondContact OH-CG 2.97Å; E1036-R1110 WeakPolarHBondContact OE1-CD 3.45Å; E1036-R1110 IonicContact OE1-NH1 3.26Å; E1036-R1110 PolarHBondContact OE1-NH1 2.86Å; L1038-R1110 HydrophobicContact CD2-CB 3.98Å; L1038-R1110 HydrophobicContact CD2-CG 4.46Å; R1110-A1164 CarbonylContact O-C 3.55Å; R1110-A1164 WeakPolarHBondContact O-CA 3.42Å; R1110-Y1165 PolarHBondContact N-O 2.77Å; R1110-Y1165 PolarHBondContact O-N 3.09Å; R1110-E1167 IonicContact CZ-OE2 2.74Å; R1110-E1167 IonicContact NE-OE2 2.8Å; R1110-E1167 PolarHBondContact NE-OE2 3.38Å; R1110-E1167 VanDerWaalsContact NH2-CD 3.34Å; R1110-E1167 IonicContact NH2-OE1 3.07Å; R1110-E1167 PolarHBondContact NH2-OE1 2.85Å; R1110-E1167 VanDerWaalsContact NH2-OE1 3.07Å; R1110-E1167 IonicContact NH2-OE2 3.92Å; R1110-E1167 PolarHBondContact NH2-OE2 3.28Å
1111	V	78	Confident	72.6	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.055	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.4	-172.1	-173.5	0	0	0	0	109.4	E1036 K1037 L1039 C1109 L1113 A1164	E1036-V1111 CarbonylContact C-O 3.55Å; E1036-V1111 WeakPolarHBondContact CA-O 3.39Å; K1037-V1111 PolarHBondContact N-O 2.74Å; K1037-V1111 PolarHBondContact O-N 2.79Å; L1039-V1111 HydrophobicContact CB-CG2 4.24Å; L1039-V1111 HydrophobicContact CD1-CB 4.17Å; L1039-V1111 HydrophobicContact CD1-CG1 4.38Å; L1039-V1111 HydrophobicContact CD1-CG2 4.18Å; L1039-V1111 HydrophobicContact CG-CB 4.46Å; L1039-V1111 HydrophobicContact CG-CG2 4.3Å; C1109-V1111 HydrophobicContact CB-CG2 4.11Å; V1111-L1113 HydrophobicContact CG1-CD2 4.27Å; V1111-A1164 HydrophobicContact CG2-CB 3.88Å
1112	T	71.8	Confident	71.9	Confident	15 Å²	15	44.5 Å²	44.5	9%	0.092	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	118.2	173.2	52.9	0	0	0	0	109.6	Y1019 R1023 E1036 G1163	Y1019-T1112 HydrophobicContact CE2-CG2 3.92Å; Y1019-T1112 WeakPolarHBondContact OH-CG2 3.34Å; R1023-T1112 HydrophobicContact CB-CG2 3.82Å; R1023-T1112 HydrophobicContact CG-CG2 3.92Å; E1036-T1112 HydrophobicContact CG-CG2 4.11Å; T1112-G1163 PolarHBondContact N-O 3.17Å
1113	L	68.6	Low	71.4	Confident	6 Å²	6	48 Å²	48	3%	0.031	26%	0.263	C	S	.	.			trans	-90.1	126	179.2	-60	-178.6	0	0	0	110.8	N1035 K1037 L1039 V1111 I1151	N1035-L1113 WeakPolarHBondContact CB-O 3.44Å; N1035-L1113 PolarHBondContact ND2-O 2.9Å; N1035-L1113 PolarHBondContact O-N 2.8Å; K1037-L1113 HydrophobicContact CB-CD1 4.3Å; K1037-L1113 HydrophobicContact CG-CD1 3.84Å; K1037-L1113 HydrophobicContact CG-CG 4.46Å; L1039-L1113 HydrophobicContact CD1-CD2 4.35Å; V1111-L1113 HydrophobicContact CG1-CD2 4.27Å; L1113-I1151 HydrophobicContact CD2-CD1 3.42Å; L1113-I1151 VanDerWaalsContact CD2-CD1 3.42Å
1114	G	64.2	Low	70.9	Confident	37 Å²	37	45.8 Å²	45.8	38%	0.381	25%	0.25	S	C	.	.			trans	-67.3	-179.1	173.8	0	0	0	0	0	113.3	S1116	G1114-S1116 PolarHBondContact O-N 3.26Å
1115	K	62.5	Low	70.4	Confident	129 Å²	129	44.1 Å²	44.1	56%	0.561	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-19.4	-176.5	-78.4	178.1	179.2	165.2	0	115.4	E1029 N1030 F1117 S1140	E1029-K1115 WeakPolarHBondContact O-CE 3.32Å; E1029-K1115 PolarHBondContact O-NZ 2.82Å; N1030-K1115 WeakPolarHBondContact OD1-CG 3.17Å; K1115-F1117 VanDerWaalsContact C-N 3.26Å; K1115-F1117 PolarHBondContact O-N 2.83Å; K1115-S1140 WeakPolarHBondContact O-CB 3.46Å; K1115-S1140 PolarHBondContact O-OG 3.45Å
1116	S	61.1	Low	69.7	Low	81 Å²	81	39.5 Å²	39.5	57%	0.566	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-10.8	-170.2	-50.6	0	0	0	0	115.3	G1114 P1139 S1140	G1114-S1116 PolarHBondContact O-N 3.26Å; S1116-P1139 CarbonylContact O-C 3.57Å; S1116-P1139 VanDerWaalsContact O-CA 3.23Å; S1116-P1139 WeakPolarHBondContact O-CA 3.47Å; S1116-S1140 VanDerWaalsContact C-OG 3.23Å; S1116-S1140 VanDerWaalsContact CA-OG 3.31Å; S1116-S1140 WeakPolarHBondContact CA-OG 3.46Å; S1116-S1140 PolarHBondContact O-N 2.81Å; S1116-S1140 PolarHBondContact O-OG 2.84Å
1117	F	59.7	Low	68.7	Low	41 Å²	41	40.3 Å²	40.3	18%	0.18	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-123.7	140.6	179.5	-76.6	-83.1	0	0	0	112.4	K1115 H1119 I1135 Y1149	K1115-F1117 VanDerWaalsContact C-N 3.26Å; K1115-F1117 PolarHBondContact O-N 2.83Å; F1117-H1119 PolarHBondContact O-N 3.39Å; F1117-H1119 VanDerWaalsContact O-N 3.16Å; F1117-I1135 HydrophobicContact CD1-CD1 3.56Å; F1117-I1135 HydrophobicContact CD2-CD1 4.23Å; F1117-I1135 HydrophobicContact CE1-CD1 3.55Å; F1117-I1135 HydrophobicContact CE1-CG1 4.38Å; F1117-I1135 HydrophobicContact CE2-CD1 4.23Å; F1117-I1135 HydrophobicContact CG-CD1 3.91Å; F1117-I1135 HydrophobicContact CZ-CD1 3.9Å; F1117-Y1149 HydrophobicContact CE1-CD1 4.06Å; F1117-Y1149 HydrophobicContact CE1-CD2 4.06Å; F1117-Y1149 AromaticContact CE1-CG 3.78Å; F1117-Y1149 HydrophobicContact CE1-CG 3.78Å; F1117-Y1149 AromaticContact CZ-CD1 3.94Å; F1117-Y1149 HydrophobicContact CZ-CD1 3.94Å; F1117-Y1149 AromaticContact CZ-CG 3.89Å; F1117-Y1149 HydrophobicContact CZ-CG 3.89Å
1118	V	61	Low	67.5	Low	58 Å²	58	40.9 Å²	40.9	35%	0.352	24%	0.235	S	C	.	.			trans	-73.1	105.4	170.2	-176.6	0	0	0	0	108.8	S1120 A1121 S1122 R1138	V1118-S1120 VanDerWaalsContact C-N 3.29Å; V1118-S1120 PolarHBondContact O-N 3.36Å; V1118-A1121 HydrophobicContact CB-CB 4.22Å; V1118-A1121 HydrophobicContact CG1-CB 4.19Å; V1118-A1121 PolarHBondContact O-N 2.82Å; V1118-S1122 PolarHBondContact O-N 3.4Å; V1118-R1138 PolarHBondContact N-O 3.01Å
1119	H	61.2	Low	66	Low	67 Å²	67	41.1 Å²	41.1	31%	0.31	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-54.7	-40.3	-173	-176.4	-84.9	0	0	0	113.6	E1036 K1037 F1117 A1121 S1122	E1036-H1119 PolarHBondContact O-NE2 3.22Å; K1037-H1119 WeakPolarHBondContact CE-CE1 3.39Å; K1037-H1119 WeakPolarHBondContact CE-NE2 3.38Å; K1037-H1119 WeakPolarHBondContact CE-O 3.47Å; K1037-H1119 PolarHBondContact NZ-O 2.54Å; K1037-H1119 VanDerWaalsContact NZ-O 3.07Å; F1117-H1119 PolarHBondContact O-N 3.39Å; F1117-H1119 VanDerWaalsContact O-N 3.16Å; H1119-A1121 VanDerWaalsContact C-N 3.29Å; H1119-A1121 PolarHBondContact O-N 2.94Å; H1119-S1122 PolarHBondContact O-N 3.01Å; H1119-S1122 PolarHBondContact O-OG 2.93Å
1120	S	63.9	Low	64.6	Low	110 Å²	110	42.5 Å²	42.5	77%	0.769	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-68.3	-23.4	179.3	55.7	0	0	0	0	114.2	V1118	V1118-S1120 VanDerWaalsContact C-N 3.29Å; V1118-S1120 PolarHBondContact O-N 3.36Å
1121	A	64	Low	63.3	Low	44 Å²	44	39.9 Å²	39.9	36%	0.364	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-98.4	-7.2	-179.8	0	0	0	0	0	113.6	V1118 H1119	V1118-A1121 HydrophobicContact CB-CB 4.22Å; V1118-A1121 HydrophobicContact CG1-CB 4.19Å; V1118-A1121 PolarHBondContact O-N 2.82Å; H1119-A1121 VanDerWaalsContact C-N 3.29Å; H1119-A1121 PolarHBondContact O-N 2.94Å
1122	S	63.3	Low	62.5	Low	10 Å²	10	40.4 Å²	40.4	7%	0.07	24%	0.238	C	C	.	.			trans	-83.8	114.9	-177.8	61.9	0	0	0	0	112.1	K1037 V1118 H1119 L1136	K1037-S1122 WeakPolarHBondContact CE-OG 3.21Å; K1037-S1122 PolarHBondContact NZ-O 3.07Å; V1118-S1122 PolarHBondContact O-N 3.4Å; H1119-S1122 PolarHBondContact O-N 3.01Å; H1119-S1122 PolarHBondContact O-OG 2.93Å; S1122-L1136 CarbonylContact C-O 3.46Å; S1122-L1136 WeakPolarHBondContact CA-O 3.34Å
1123	M	67.1	Low	62.4	Low	110 Å²	110	40 Å²	40	54%	0.542	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.1	177.5	-60.4	-173.3	-69.9	0	0	110.4	I1135 L1136	M1123-I1135 CarbonylContact O-C 3.56Å; M1123-I1135 VanDerWaalsContact O-CA 3.29Å; M1123-I1135 WeakPolarHBondContact O-CA 3.25Å; M1123-L1136 HydrophobicContact CB-CB 4.16Å; M1123-L1136 HydrophobicContact CE-CB 4.08Å; M1123-L1136 HydrophobicContact CE-CD2 3.32Å; M1123-L1136 HydrophobicContact CE-CG 4.26Å; M1123-L1136 PolarHBondContact N-O 3.41Å; M1123-L1136 PolarHBondContact O-N 2.81Å
1124	K	70.9	Confident	62.4	Low	36 Å²	36	39.8 Å²	39.8	16%	0.157	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	143	175.3	61.5	-177.8	176	167.3	0	110.5	H981 T985 L1038 L1039 F1040	H981-K1124 WeakPolarHBondContact O-CE 3.5Å; T985-K1124 WeakPolarHBondContact CG2-O 3.38Å; L1038-K1124 WeakPolarHBondContact O-CD 3.29Å; L1039-K1124 HydrophobicContact CD2-CB 3.87Å; F1040-K1124 HydrophobicContact CD2-CB 4.49Å; F1040-K1124 HydrophobicContact CD2-CD 4.23Å; F1040-K1124 HydrophobicContact CD2-CG 4.4Å; F1040-K1124 HydrophobicContact CE2-CD 3.83Å; F1040-K1124 HydrophobicContact CE2-CG 4.22Å
1125	L	67.4	Low	62.6	Low	9 Å²	9	38 Å²	38	5%	0.047	22%	0.216	C	C	.	.			trans	-113.2	129.6	174	-74.3	169.8	0	0	0	109.9	T985 F1040 H1127 S1134 L1136 E1148	T985-L1125 HydrophobicContact CG2-CD2 4.4Å; F1040-L1125 WeakPolarHBondContact CB-O 3.42Å; L1125-H1127 PolarHBondContact O-N 3.07Å; L1125-S1134 PolarHBondContact N-O 2.75Å; L1125-L1136 HydrophobicContact CD1-CB 4.36Å; L1125-L1136 HydrophobicContact CD1-CD1 4.22Å; L1125-L1136 HydrophobicContact CD2-CD1 3.97Å; L1125-L1136 HydrophobicContact CG-CB 4.4Å; L1125-L1136 HydrophobicContact CG-CD1 4.49Å; L1125-E1148 HydrophobicContact CD1-CB 4.17Å; L1125-E1148 HydrophobicContact CD1-CG 3.63Å
1126	A	64.8	Low	62.8	Low	3 Å²	3	34.9 Å²	34.9	3%	0.025	21%	0.205	C	C	.	.	S	Bend	trans	-69	-21.6	178.6	0	0	0	0	0	112.9	M982 T985 Y1002 F1040	M982-A1126 HydrophobicContact CG-CB 3.96Å; T985-A1126 VanDerWaalsContact OG1-CB 3.25Å; T985-A1126 WeakPolarHBondContact OG1-CB 3.35Å; T985-A1126 PolarHBondContact OG1-N 2.69Å; Y1002-A1126 HydrophobicContact CE2-CB 4.39Å; F1040-A1126 HydrophobicContact CD2-CB 4.08Å; F1040-A1126 HydrophobicContact CE2-CB 4.2Å
1127	H	60.7	Low	63	Low	21 Å²	21	31.7 Å²	31.7	10%	0.097	19%	0.185	C	C	.	.			trans	-94	102.4	172.7	67.4	-71.9	0	0	0	109.9	T985 L1125 S1134 E1148	T985-H1127 PolarHBondContact O-ND1 3.48Å; L1125-H1127 PolarHBondContact O-N 3.07Å; H1127-S1134 WeakPolarHBondContact O-CB 3.47Å; H1127-S1134 PolarHBondContact O-OG 3.28Å; H1127-E1148 IonicContact CD2-OE1 3.83Å; H1127-E1148 IonicContact CD2-OE2 3.06Å; H1127-E1148 IonicContact CE1-OE2 3.18Å; H1127-E1148 IonicContact NE2-OE1 2.86Å; H1127-E1148 IonicContact NE2-OE2 3.43Å; H1127-E1148 PolarHBondContact NE2-OE2 3.09Å
1128	A	56.2	Low	63.1	Low	13 Å²	13	38.3 Å²	38.3	11%	0.107	21%	0.209	C	C	.	.			trans	-118.8	135	172.5	0	0	0	0	0	109.6	F1040 H1132	F1040-A1128 WeakPolarHBondContact O-CB 3.29Å; A1128-H1132 WeakPolarHBondContact CB-O 3.43Å
1129	P	53.8	Low	63.1	Low	8 Å²	8	37.2 Å²	37.2	5%	0.052	20%	0.202	C	C	.	.			trans	-65.6	148.3	-179	19.2	-21.2	0	0	0	110.5	Y1070 G1131 H1132 S1134 V1150	Y1070-P1129 HydrophobicContact CD1-CB 3.98Å; Y1070-P1129 HydrophobicContact CD1-CG 4.35Å; Y1070-P1129 HydrophobicContact CD2-CB 4.05Å; Y1070-P1129 HydrophobicContact CD2-CG 4.29Å; Y1070-P1129 HydrophobicContact CE1-CB 4.03Å; Y1070-P1129 HydrophobicContact CE1-CG 3.89Å; Y1070-P1129 HydrophobicContact CE2-CB 4.15Å; Y1070-P1129 HydrophobicContact CE2-CG 3.87Å; Y1070-P1129 HydrophobicContact CG-CB 3.94Å; Y1070-P1129 HydrophobicContact CG-CG 4.5Å; P1129-G1131 PolarHBondContact O-N 2.88Å; P1129-H1132 HydrophobicContact CG-CB 4.06Å; P1129-H1132 PolarHBondContact O-N 3.49Å; P1129-S1134 VanDerWaalsContact CD-OG 3.25Å; P1129-S1134 WeakPolarHBondContact CD-OG 3.15Å; P1129-V1150 HydrophobicContact CG-CG1 4.25Å; P1129-V1150 HydrophobicContact CG-CG2 4.23Å
1130	P	53.2	Low	63.3	Low	29 Å²	29	36.7 Å²	36.7	19%	0.188	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45	112.9	176	-37.4	44.3	0	0	0	113.4	G1042 G1062	G1042-P1130 VanDerWaalsContact O-CA 3.25Å; G1042-P1130 WeakPolarHBondContact O-CA 3.3Å; G1062-P1130 VanDerWaalsContact O-CB 3.25Å; G1062-P1130 WeakPolarHBondContact O-CB 3.33Å
1131	G	56.2	Low	62.9	Low	2 Å²	2	35.8 Å²	35.8	2%	0.021	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.5	0.8	178.7	0	0	0	0	0	115.9	G1042 P1129	G1042-G1131 PolarHBondContact O-N 3.46Å; P1129-G1131 PolarHBondContact O-N 2.88Å
1132	H	61.4	Low	62.4	Low	19 Å²	19	39.2 Å²	39.2	9%	0.088	23%	0.228	C	C	.	.			trans	-132.7	168.3	-179	-58.4	-76.8	0	0	0	113.6	H1041 A1128 P1129 V1150 Y1152	H1041-H1132 PolarHBondContact CE1-N 2.99Å; H1041-H1132 PolarHBondContact ND1-O 2.87Å; A1128-H1132 WeakPolarHBondContact CB-O 3.43Å; P1129-H1132 HydrophobicContact CG-CB 4.06Å; P1129-H1132 PolarHBondContact O-N 3.49Å; H1132-V1150 HydrophobicContact CB-CG1 3.4Å; H1132-V1150 VanDerWaalsContact CB-CG1 3.4Å; H1132-Y1152 AromaticContact CE1-CD1 3.6Å; H1132-Y1152 AromaticContact CE1-CE1 3.38Å; H1132-Y1152 WeakPolarHBondContact CE1-CE1 3.27Å; H1132-Y1152 AromaticContact ND1-CD1 3.9Å; H1132-Y1152 AromaticContact ND1-CE1 3.95Å
1133	H	68.4	Low	62.1	Low	8 Å²	8	41.1 Å²	41.1	4%	0.037	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	138.9	170.2	-53.5	89.5	0	0	0	108.9	L1039 H1041 F1054 I1151	L1039-H1133 HydrophobicContact CB-CB 4.28Å; L1039-H1133 HydrophobicContact CD1-CB 4Å; H1041-H1133 AromaticContact CG-NE2 3.86Å; H1041-H1133 AromaticContact ND1-CD2 3.7Å; H1041-H1133 AromaticContact ND1-CE1 3.65Å; H1041-H1133 AromaticContact ND1-CG 3.99Å; H1041-H1133 AromaticContact ND1-ND1 3.96Å; H1041-H1133 AromaticContact ND1-NE2 3.47Å; H1041-H1133 PolarHBondContact ND1-NE2 3.32Å; F1054-H1133 AromaticContact CZ-NE2 3.97Å; H1133-I1151 HydrophobicContact CB-CB 4.46Å; H1133-I1151 PolarHBondContact O-N 3.25Å
1134	S	68.6	Low	61.4	Low	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	138.1	176.5	-74	0	0	0	0	111.5	L1125 H1127 P1129 E1148 Y1149	L1125-S1134 PolarHBondContact N-O 2.75Å; H1127-S1134 WeakPolarHBondContact O-CB 3.47Å; H1127-S1134 PolarHBondContact O-OG 3.28Å; P1129-S1134 VanDerWaalsContact CD-OG 3.25Å; P1129-S1134 WeakPolarHBondContact CD-OG 3.15Å; S1134-E1148 VanDerWaalsContact CB-OE1 3.3Å; S1134-E1148 WeakPolarHBondContact CB-OE1 3.44Å; S1134-E1148 PolarHBondContact OG-OE1 3.26Å; S1134-Y1149 WeakPolarHBondContact CA-O 3.29Å
1135	I	68.2	Low	60.8	Low	1 Å²	1	43.6 Å²	43.6	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150.4	173.2	63.4	162.7	0	0	0	111.7	L1039 F1117 M1123 Y1149 I1151	L1039-I1135 HydrophobicContact CD1-CG2 3.7Å; L1039-I1135 HydrophobicContact CD2-CG2 3.46Å; L1039-I1135 VanDerWaalsContact CD2-CG2 3.46Å; L1039-I1135 HydrophobicContact CG-CG2 4.23Å; F1117-I1135 HydrophobicContact CD1-CD1 3.56Å; F1117-I1135 HydrophobicContact CD2-CD1 4.23Å; F1117-I1135 HydrophobicContact CE1-CD1 3.55Å; F1117-I1135 HydrophobicContact CE1-CG1 4.38Å; F1117-I1135 HydrophobicContact CE2-CD1 4.23Å; F1117-I1135 HydrophobicContact CG-CD1 3.91Å; F1117-I1135 HydrophobicContact CZ-CD1 3.9Å; M1123-I1135 CarbonylContact O-C 3.56Å; M1123-I1135 VanDerWaalsContact O-CA 3.29Å; M1123-I1135 WeakPolarHBondContact O-CA 3.25Å; I1135-Y1149 PolarHBondContact N-O 3.09Å; I1135-Y1149 PolarHBondContact O-N 3.38Å; I1135-I1151 HydrophobicContact CB-CD1 4.42Å; I1135-I1151 HydrophobicContact CD1-CD1 3.67Å; I1135-I1151 HydrophobicContact CD1-CG1 4.1Å; I1135-I1151 HydrophobicContact CG1-CD1 3.81Å; I1135-I1151 HydrophobicContact CG1-CG1 3.9Å; I1135-I1151 HydrophobicContact CG2-CD1 3.73Å; I1135-I1151 HydrophobicContact CG2-CG1 4.39Å
1136	L	67.9	Low	60.4	Low	62 Å²	62	47.3 Å²	47.3	33%	0.325	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.8	165.8	-143.8	119	0	0	0	107.7	S1122 M1123 L1125 P1147	S1122-L1136 CarbonylContact C-O 3.46Å; S1122-L1136 WeakPolarHBondContact CA-O 3.34Å; M1123-L1136 HydrophobicContact CB-CB 4.16Å; M1123-L1136 HydrophobicContact CE-CB 4.08Å; M1123-L1136 HydrophobicContact CE-CD2 3.32Å; M1123-L1136 HydrophobicContact CE-CG 4.26Å; M1123-L1136 PolarHBondContact N-O 3.41Å; M1123-L1136 PolarHBondContact O-N 2.81Å; L1125-L1136 HydrophobicContact CD1-CB 4.36Å; L1125-L1136 HydrophobicContact CD1-CD1 4.22Å; L1125-L1136 HydrophobicContact CD2-CD1 3.97Å; L1125-L1136 HydrophobicContact CG-CB 4.4Å; L1125-L1136 HydrophobicContact CG-CD1 4.49Å; L1136-P1147 WeakPolarHBondContact CD1-O 3.3Å; L1136-P1147 WeakPolarHBondContact CG-O 3.38Å
1137	G	64.1	Low	60.2	Low	14 Å²	14	50.8 Å²	50.8	14%	0.144	31%	0.313	C	S	.	.			trans	-179.9	-180	-178.4	0	0	0	0	0	115	Y1149	G1137-Y1149 WeakPolarHBondContact O-CE2 3.1Å
1138	R	62.3	Low	60.3	Low	181 Å²	181	51.1 Å²	51.1	68%	0.683	32%	0.315	S	S	*	.			trans	-112.2	141.2	171	-80.5	-174.9	179.9	176.7	0.5	110.9	V1118	V1118-R1138 PolarHBondContact N-O 3.01Å
1139	P	62.3	Low	60.6	Low	34 Å²	34	52 Å²	52	22%	0.221	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-63.6	149.3	171.8	-12.4	28.1	0	0	0	109.8	S1116 Y1149	S1116-P1139 CarbonylContact O-C 3.57Å; S1116-P1139 VanDerWaalsContact O-CA 3.23Å; S1116-P1139 WeakPolarHBondContact O-CA 3.47Å; P1139-Y1149 VanDerWaalsContact CD-OH 3.25Å; P1139-Y1149 WeakPolarHBondContact CD-OH 3.13Å; P1139-Y1149 HydrophobicContact CG-CE1 4.12Å; P1139-Y1149 WeakPolarHBondContact CG-OH 3.3Å
1140	S	63.9	Low	61	Low	57 Å²	57	52.7 Å²	52.7	40%	0.399	32%	0.32	S	S	.	.	S	Bend	trans	-73.8	-25.8	179.8	58.8	0	0	0	0	113.6	K1115 S1116	K1115-S1140 WeakPolarHBondContact O-CB 3.46Å; K1115-S1140 PolarHBondContact O-OG 3.45Å; S1116-S1140 VanDerWaalsContact C-OG 3.23Å; S1116-S1140 VanDerWaalsContact CA-OG 3.31Å; S1116-S1140 WeakPolarHBondContact CA-OG 3.46Å; S1116-S1140 PolarHBondContact O-N 2.81Å; S1116-S1140 PolarHBondContact O-OG 2.84Å
1141	S	56.6	Low	61.2	Low	91 Å²	91	52.7 Å²	52.7	64%	0.636	32%	0.318	S	S	*	.	S	Bend	trans	-148.2	139.6	176.7	56.4	0	0	0	0	109.3
1142	A	52.9	Low	61.1	Low	115 Å²	115	56.9 Å²	56.9	95%	0.95	33%	0.334	S	S	*	.	S	Bend	trans	25.8	97.7	172.1	0	0	0	0	0	115.9
1143	G	56.3	Low	60.5	Low	51 Å²	51	59.8 Å²	59.8	53%	0.526	34%	0.344	S	S	.	.			trans	-168.1	158.4	174.8	0	0	0	0	0	111.9	A1145	G1143-A1145 PolarHBondContact O-N 2.81Å
1144	L	53	Low	59.2	Low	120 Å²	120	62.6 Å²	62.6	63%	0.628	38%	0.375	S	S	*	.			trans	-71.8	119.5	-179.8	-69.4	170	0	0	0	109.8	Y1146 Y1149	L1144-Y1146 HydrophobicContact CB-CD2 3.95Å; L1144-Y1146 HydrophobicContact CB-CE2 3.4Å; L1144-Y1146 HydrophobicContact CD1-CE2 3.95Å; L1144-Y1146 WeakPolarHBondContact CD1-OH 3.13Å; L1144-Y1146 HydrophobicContact CG-CE2 4.3Å; L1144-Y1146 VanDerWaalsContact O-CD2 3.28Å; L1144-Y1146 WeakPolarHBondContact O-CD2 3.48Å; L1144-Y1146 PolarHBondContact O-N 3.23Å; L1144-Y1149 PolarHBondContact O-OH 3.3Å
1145	A	58.3	Low	57.5	Low	77 Å²	77	71.9 Å²	71.9	64%	0.636	42%	0.418	S	S	*	.			trans	-68.9	89.7	179.4	0	0	0	0	0	111.7	G1143 Y1149	G1143-A1145 PolarHBondContact O-N 2.81Å; A1145-Y1149 WeakPolarHBondContact CA-OH 3.3Å
1146	Y	59.5	Low	55.8	Low	88 Å²	88	78.2 Å²	78.2	35%	0.345	45%	0.448	S	S	.	.			trans	-90.7	149.9	174	-67.1	-63.4	0	0	0	112.8	H1074 L1144 E1148 Y1149	H1074-Y1146 HydrophobicContact CB-CD1 3.43Å; H1074-Y1146 VanDerWaalsContact CB-CD1 3.43Å; H1074-Y1146 HydrophobicContact CB-CE1 3.64Å; H1074-Y1146 HydrophobicContact CB-CG 4.04Å; H1074-Y1146 AromaticContact CD2-CD1 3.78Å; H1074-Y1146 AromaticContact CG-CD1 3.46Å; H1074-Y1146 VanDerWaalsContact CG-CD1 3.46Å; H1074-Y1146 AromaticContact CG-CE1 3.8Å; L1144-Y1146 HydrophobicContact CB-CD2 3.95Å; L1144-Y1146 HydrophobicContact CB-CE2 3.4Å; L1144-Y1146 HydrophobicContact CD1-CE2 3.95Å; L1144-Y1146 WeakPolarHBondContact CD1-OH 3.13Å; L1144-Y1146 HydrophobicContact CG-CE2 4.3Å; L1144-Y1146 VanDerWaalsContact O-CD2 3.28Å; L1144-Y1146 WeakPolarHBondContact O-CD2 3.48Å; L1144-Y1146 PolarHBondContact O-N 3.23Å; Y1146-E1148 PolarHBondContact O-N 3.2Å; Y1146-Y1149 HydrophobicContact CD2-CE1 4.23Å; Y1146-Y1149 PolarHBondContact N-OH 2.83Å; Y1146-Y1149 VanDerWaalsContact N-OH 3.11Å; Y1146-Y1149 WeakPolarHBondContact O-CE2 3.43Å
1147	P	59.9	Low	54.3	Low	75 Å²	75	79.2 Å²	79.2	49%	0.487	47%	0.465	S	S	.	.	S	Bend	trans	-67.3	-18.5	171.2	26	-33.2	0	0	0	113	H1074 L1136	H1074-P1147 VanDerWaalsContact CD2-CD 3.44Å; H1074-P1147 WeakPolarHBondContact CD2-CD 3.41Å; L1136-P1147 WeakPolarHBondContact CD1-O 3.3Å; L1136-P1147 WeakPolarHBondContact CG-O 3.38Å
1148	E	63.4	Low	53.1	Low	28 Å²	28	87 Å²	87	13%	0.131	50%	0.503	C	S	.	.			trans	-143.9	133.5	175.4	177.1	175.4	168.4	0	0	110	Y1070 L1125 H1127 S1134 Y1146	Y1070-E1148 WeakPolarHBondContact CE2-OE1 3.49Å; Y1070-E1148 PolarHBondContact OH-OE1 3.38Å; L1125-E1148 HydrophobicContact CD1-CB 4.17Å; L1125-E1148 HydrophobicContact CD1-CG 3.63Å; H1127-E1148 IonicContact CD2-OE1 3.83Å; H1127-E1148 IonicContact CD2-OE2 3.06Å; H1127-E1148 IonicContact CE1-OE2 3.18Å; H1127-E1148 IonicContact NE2-OE1 2.86Å; H1127-E1148 IonicContact NE2-OE2 3.43Å; H1127-E1148 PolarHBondContact NE2-OE2 3.09Å; S1134-E1148 VanDerWaalsContact CB-OE1 3.3Å; S1134-E1148 WeakPolarHBondContact CB-OE1 3.44Å; S1134-E1148 PolarHBondContact OG-OE1 3.26Å; Y1146-E1148 PolarHBondContact O-N 3.2Å
1149	Y	62	Low	52	Low	33 Å²	33	86.5 Å²	86.5	13%	0.129	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.1	170.6	-65.3	-98.8	0	0	0	110	F1117 S1134 I1135 G1137 P1139 L1144 A1145 Y1146	F1117-Y1149 HydrophobicContact CE1-CD1 4.06Å; F1117-Y1149 HydrophobicContact CE1-CD2 4.06Å; F1117-Y1149 AromaticContact CE1-CG 3.78Å; F1117-Y1149 HydrophobicContact CE1-CG 3.78Å; F1117-Y1149 AromaticContact CZ-CD1 3.94Å; F1117-Y1149 HydrophobicContact CZ-CD1 3.94Å; F1117-Y1149 AromaticContact CZ-CG 3.89Å; F1117-Y1149 HydrophobicContact CZ-CG 3.89Å; S1134-Y1149 WeakPolarHBondContact CA-O 3.29Å; I1135-Y1149 PolarHBondContact N-O 3.09Å; I1135-Y1149 PolarHBondContact O-N 3.38Å; G1137-Y1149 WeakPolarHBondContact O-CE2 3.1Å; P1139-Y1149 VanDerWaalsContact CD-OH 3.25Å; P1139-Y1149 WeakPolarHBondContact CD-OH 3.13Å; P1139-Y1149 HydrophobicContact CG-CE1 4.12Å; P1139-Y1149 WeakPolarHBondContact CG-OH 3.3Å; L1144-Y1149 PolarHBondContact O-OH 3.3Å; A1145-Y1149 WeakPolarHBondContact CA-OH 3.3Å; Y1146-Y1149 HydrophobicContact CD2-CE1 4.23Å; Y1146-Y1149 PolarHBondContact N-OH 2.83Å; Y1146-Y1149 VanDerWaalsContact N-OH 3.11Å; Y1146-Y1149 WeakPolarHBondContact O-CE2 3.43Å
1150	V	62.1	Low	50.9	Low	22 Å²	22	89.8 Å²	89.8	13%	0.133	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114.9	170.4	-177.2	0	0	0	0	107.8	Y1070 P1129 H1132 Y1152	Y1070-V1150 VanDerWaalsContact OH-CG2 3.31Å; Y1070-V1150 WeakPolarHBondContact OH-CG2 3.19Å; P1129-V1150 HydrophobicContact CG-CG1 4.25Å; P1129-V1150 HydrophobicContact CG-CG2 4.23Å; H1132-V1150 HydrophobicContact CB-CG1 3.4Å; H1132-V1150 VanDerWaalsContact CB-CG1 3.4Å; V1150-Y1152 HydrophobicContact CB-CE2 4.42Å; V1150-Y1152 HydrophobicContact CG1-CE2 4.28Å; V1150-Y1152 PolarHBondContact O-N 3.01Å
1151	I	57.1	Low	50	Low	29 Å²	29	91.4 Å²	91.4	15%	0.149	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	106	175.8	-51.2	-175.3	0	0	0	107.9	L1039 L1113 H1133 I1135	L1039-I1151 HydrophobicContact CD1-CD1 3.81Å; L1113-I1151 HydrophobicContact CD2-CD1 3.42Å; L1113-I1151 VanDerWaalsContact CD2-CD1 3.42Å; H1133-I1151 HydrophobicContact CB-CB 4.46Å; H1133-I1151 PolarHBondContact O-N 3.25Å; I1135-I1151 HydrophobicContact CB-CD1 4.42Å; I1135-I1151 HydrophobicContact CD1-CD1 3.67Å; I1135-I1151 HydrophobicContact CD1-CG1 4.1Å; I1135-I1151 HydrophobicContact CG1-CD1 3.81Å; I1135-I1151 HydrophobicContact CG1-CG1 3.9Å; I1135-I1151 HydrophobicContact CG2-CD1 3.73Å; I1135-I1151 HydrophobicContact CG2-CG1 4.39Å
1152	Y	55.2	Low	49.7	Very low	90 Å²	90	89.7 Å²	89.7	35%	0.353	51%	0.506	S	S	.	.			trans	-67	144.2	166.4	-74	-92.7	0	0	0	109.2	K1077 H1132 V1150 G1154	K1077-Y1152 WeakPolarHBondContact CB-OH 3.47Å; K1077-Y1152 HydrophobicContact CD-CE1 4.06Å; K1077-Y1152 WeakPolarHBondContact CD-OH 3.15Å; H1132-Y1152 AromaticContact CE1-CD1 3.6Å; H1132-Y1152 AromaticContact CE1-CE1 3.38Å; H1132-Y1152 WeakPolarHBondContact CE1-CE1 3.27Å; H1132-Y1152 AromaticContact ND1-CD1 3.9Å; H1132-Y1152 AromaticContact ND1-CE1 3.95Å; V1150-Y1152 HydrophobicContact CB-CE2 4.42Å; V1150-Y1152 HydrophobicContact CG1-CE2 4.28Å; V1150-Y1152 PolarHBondContact O-N 3.01Å; Y1152-G1154 PolarHBondContact O-N 3.26Å
1153	R	48.8	Very low	50.2	Low	80 Å²	80	85.5 Å²	85.5	30%	0.302	48%	0.475	S	S	.	.	S	Bend	trans	-53.5	114.3	166.5	-62.4	-167.2	-166.8	164.6	8.8	106.4	F1054 D1055 E1155	F1054-R1153 VanDerWaalsContact CB-CZ 3.5Å; F1054-R1153 PolarHBondContact O-NH1 3.03Å; D1055-R1153 PolarHBondContact O-NH1 2.84Å; D1055-R1153 PolarHBondContact O-NH2 3.2Å; R1153-E1155 PolarHBondContact O-N 3.12Å
1154	G	40.2	Very low	51.1	Low	67 Å²	67	83.8 Å²	83.8	69%	0.691	46%	0.455	S	S	*	.			trans	-52.1	126.9	-162.1	0	0	0	0	0	111.9	Y1152 Q1156	Y1152-G1154 PolarHBondContact O-N 3.26Å; G1154-Q1156 PolarHBondContact O-N 3.4Å
1155	E	33.1	Very low	52.5	Low	195 Å²	195	78.1 Å²	78.1	91%	0.911	43%	0.426	S	S	*	.			trans	-51.2	96.2	144.9	-68.6	176	154.1	0	0	106.5	R1153	R1153-E1155 PolarHBondContact O-N 3.12Å
1156	Q	33.2	Very low	53.8	Low	134 Å²	134	74.5 Å²	74.5	63%	0.626	40%	0.396	S	S	*	.			trans	-170.1	127.6	149.9	-75	-139.9	-6.7	0	0	110	G1154	G1154-Q1156 PolarHBondContact O-N 3.4Å
1157	A	35.4	Very low	55	Low	83 Å²	83	71 Å²	71	69%	0.686	38%	0.382	S	S	*	.			trans	67.9	106.7	167.8	0	0	0	0	0	117.8	F1159	A1157-F1159 PolarHBondContact O-N 2.69Å
1158	N	39.1	Very low	56.4	Low	177 Å²	177	68.2 Å²	68.2	95%	0.947	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	18.4	180	-102.5	-10.9	0	0	0	118.2
1159	F	40	Very low	57.6	Low	171 Å²	171	67 Å²	67	75%	0.75	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.2	-12.4	-172.6	-136.8	-101.8	0	0	0	118.6	A1157	A1157-F1159 PolarHBondContact O-N 2.69Å
1160	F	38.7	Very low	58.8	Low	103 Å²	103	65.4 Å²	65.4	45%	0.452	35%	0.351	S	S	.	.			trans	-144.4	94	177.5	-74.8	-79	0	0	0	113.4	Y1162	F1160-Y1162 PolarHBondContact O-N 2.98Å; F1160-Y1162 VanDerWaalsContact O-N 3.09Å
1161	P	44.4	Very low	60	Low	90 Å²	90	64.8 Å²	64.8	58%	0.584	35%	0.347	S	S	*	.			trans	-83.4	23.6	-162.5	30.6	-33.8	0	0	0	117.4
1162	Y	52.1	Low	61.2	Low	55 Å²	55	63.9 Å²	63.9	22%	0.216	34%	0.341	C	S	.	.			trans	-132.2	95.2	-173.2	-46.7	-76.5	0	0	0	114.2	F1054 F1160	F1054-Y1162 HydrophobicContact CB-CD1 4.34Å; F1054-Y1162 WeakPolarHBondContact O-CD1 3.19Å; F1054-Y1162 WeakPolarHBondContact O-CE1 3.42Å; F1160-Y1162 PolarHBondContact O-N 2.98Å; F1160-Y1162 VanDerWaalsContact O-N 3.09Å
1163	G	62.3	Low	62.5	Low	28 Å²	28	62.2 Å²	62.2	29%	0.289	34%	0.337	S	S	.	.			trans	-95.1	12.4	173.9	0	0	0	0	0	115.7	T1112	T1112-G1163 PolarHBondContact N-O 3.17Å
1164	A	74.8	Confident	63.9	Low	14 Å²	14	58.5 Å²	58.5	12%	0.116	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	136.4	-175.7	0	0	0	0	0	112.4	F1054 R1110 V1111	F1054-A1164 HydrophobicContact CD2-CB 3.78Å; F1054-A1164 WeakPolarHBondContact CD2-O 3.47Å; F1054-A1164 HydrophobicContact CE2-CB 3.57Å; F1054-A1164 HydrophobicContact CZ-CB 4.24Å; R1110-A1164 CarbonylContact O-C 3.55Å; R1110-A1164 WeakPolarHBondContact O-CA 3.42Å; V1111-A1164 HydrophobicContact CG2-CB 3.88Å
1165	Y	83	Confident	65.7	Low	1 Å²	1	58 Å²	58	0%	0.004	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124	173.7	178	-103.1	0	0	0	110.2	M933 V1010 N1012 L1015 W1016 C1109 R1110 E1167	M933-Y1165 HydrophobicContact CE-CE1 4.12Å; M933-Y1165 WeakPolarHBondContact CE-OH 3.49Å; V1010-Y1165 PolarHBondContact O-OH 2.82Å; N1012-Y1165 PolarHBondContact N-OH 3.23Å; N1012-Y1165 VanDerWaalsContact N-OH 3.15Å; L1015-Y1165 HydrophobicContact CB-CD2 3.94Å; L1015-Y1165 HydrophobicContact CB-CE2 3.95Å; W1016-Y1165 HydrophobicContact CB-CD2 4.42Å; W1016-Y1165 HydrophobicContact CB-CE2 4Å; W1016-Y1165 AromaticContact CE3-CD1 3.57Å; W1016-Y1165 HydrophobicContact CE3-CD1 3.57Å; W1016-Y1165 AromaticContact CE3-CD2 3.9Å; W1016-Y1165 HydrophobicContact CE3-CD2 3.9Å; W1016-Y1165 AromaticContact CE3-CE1 3.63Å; W1016-Y1165 HydrophobicContact CE3-CE1 3.63Å; W1016-Y1165 AromaticContact CE3-CE2 3.96Å; W1016-Y1165 HydrophobicContact CE3-CE2 3.96Å; W1016-Y1165 AromaticContact CE3-CG 3.71Å; W1016-Y1165 HydrophobicContact CE3-CG 3.71Å; W1016-Y1165 AromaticContact CE3-CZ 3.84Å; W1016-Y1165 AromaticContact CZ3-CD1 3.62Å; W1016-Y1165 HydrophobicContact CZ3-CD1 3.62Å; W1016-Y1165 AromaticContact CZ3-CE1 3.88Å; W1016-Y1165 HydrophobicContact CZ3-CE1 3.88Å; W1016-Y1165 HydrophobicContact CZ3-CG 4.07Å; C1109-Y1165 CarbonylContact C-O 3.58Å; C1109-Y1165 WeakPolarHBondContact CA-O 3.29Å; R1110-Y1165 PolarHBondContact N-O 2.77Å; R1110-Y1165 PolarHBondContact O-N 3.09Å; Y1165-E1167 HydrophobicContact CD1-CB 3.99Å; Y1165-E1167 HydrophobicContact CD1-CG 4.38Å; Y1165-E1167 HydrophobicContact CE1-CB 4.18Å; Y1165-E1167 HydrophobicContact CE1-CG 4.27Å; Y1165-E1167 PolarHBondContact O-N 3.32Å; Y1165-E1167 VanDerWaalsContact O-N 3.09Å
1166	P	84.6	Confident	67.7	Low	1 Å²	1	54.4 Å²	54.4	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	104.4	173.1	29.8	-31.4	0	0	0	108.9	V1010 L1015 I1049 V1050 L1107	V1010-P1166 WeakPolarHBondContact CB-O 3.42Å; V1010-P1166 WeakPolarHBondContact CG1-O 3.25Å; V1010-P1166 WeakPolarHBondContact CG2-O 3.32Å; L1015-P1166 HydrophobicContact CD1-CG 4.38Å; I1049-P1166 HydrophobicContact CG2-CB 4.47Å; I1049-P1166 HydrophobicContact CG2-CG 4.44Å; V1050-P1166 HydrophobicContact CG2-CB 4.5Å; L1107-P1166 HydrophobicContact CD1-CB 4.22Å; L1107-P1166 HydrophobicContact CD2-CB 4.17Å
1167	E	85.5	Confident	69.5	Low	15 Å²	15	50 Å²	50	7%	0.07	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-39.6	-174.4	-165	172.9	152.1	0	0	112	V1010 L1038 L1108 R1110 Y1165	V1010-E1167 PolarHBondContact N-O 3.27Å; L1038-E1167 HydrophobicContact CD2-CB 4.47Å; L1038-E1167 WeakPolarHBondContact CD2-OE2 3.13Å; L1108-E1167 PolarHBondContact O-N 2.8Å; R1110-E1167 IonicContact CZ-OE2 2.74Å; R1110-E1167 IonicContact NE-OE2 2.8Å; R1110-E1167 PolarHBondContact NE-OE2 3.38Å; R1110-E1167 VanDerWaalsContact NH2-CD 3.34Å; R1110-E1167 IonicContact NH2-OE1 3.07Å; R1110-E1167 PolarHBondContact NH2-OE1 2.85Å; R1110-E1167 VanDerWaalsContact NH2-OE1 3.07Å; R1110-E1167 IonicContact NH2-OE2 3.92Å; R1110-E1167 PolarHBondContact NH2-OE2 3.28Å; Y1165-E1167 HydrophobicContact CD1-CB 3.99Å; Y1165-E1167 HydrophobicContact CD1-CG 4.38Å; Y1165-E1167 HydrophobicContact CE1-CB 4.18Å; Y1165-E1167 HydrophobicContact CE1-CG 4.27Å; Y1165-E1167 PolarHBondContact O-N 3.32Å; Y1165-E1167 VanDerWaalsContact O-N 3.09Å
1168	Y	89	Confident	71	Confident	16 Å²	16	54.6 Å²	54.6	6%	0.063	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.8	176.7	-49.7	-87.6	0	0	0	111.6	L951 E957 V961 V1007 D1008 K1009 L1107 L1108	L951-Y1168 HydrophobicContact CD1-CD1 4.04Å; L951-Y1168 HydrophobicContact CD1-CE1 3.97Å; E957-Y1168 HydrophobicContact CB-CE1 4.36Å; V961-Y1168 HydrophobicContact CG2-CD2 4.49Å; V961-Y1168 HydrophobicContact CG2-CG 4.4Å; V1007-Y1168 HydrophobicContact CG1-CD1 4.07Å; V1007-Y1168 HydrophobicContact CG1-CG 4.35Å; D1008-Y1168 CarbonylContact O-C 3.59Å; D1008-Y1168 VanDerWaalsContact O-CA 3.32Å; D1008-Y1168 WeakPolarHBondContact O-CA 3.4Å; K1009-Y1168 HydrophobicContact CB-CD1 4.17Å; K1009-Y1168 HydrophobicContact CB-CE1 4.16Å; K1009-Y1168 HydrophobicContact CD-CE1 4.07Å; K1009-Y1168 HydrophobicContact CG-CD1 4.2Å; K1009-Y1168 HydrophobicContact CG-CE1 3.85Å; L1107-Y1168 WeakPolarHBondContact CA-O 3.32Å; L1108-Y1168 HydrophobicContact CB-CD2 4.19Å; L1108-Y1168 HydrophobicContact CD2-CD2 3.88Å; L1108-Y1168 HydrophobicContact CD2-CE2 4.5Å; L1108-Y1168 HydrophobicContact CG-CD2 4.28Å; L1108-Y1168 PolarHBondContact N-O 3.46Å; L1108-Y1168 PolarHBondContact O-N 2.86Å; L1108-Y1168 VanDerWaalsContact O-N 3.1Å
1169	L	89.2	Confident	71.8	Confident	3 Å²	3	55 Å²	55	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	113.1	167.8	172.5	63.5	0	0	0	108.8	L948 V1007 D1008 V1010 V1046 Y1105 L1107	L948-L1169 HydrophobicContact CD1-CD2 3.97Å; V1007-L1169 WeakPolarHBondContact CA-O 3.47Å; D1008-L1169 HydrophobicContact CB-CB 4.27Å; D1008-L1169 PolarHBondContact N-O 2.91Å; D1008-L1169 PolarHBondContact O-N 3.22Å; V1010-L1169 HydrophobicContact CG2-CB 4.47Å; V1046-L1169 HydrophobicContact CG1-CD1 3.27Å; Y1105-L1169 HydrophobicContact CD1-CD1 4.17Å; L1107-L1169 HydrophobicContact CD2-CB 4.2Å; L1107-L1169 HydrophobicContact CD2-CD1 3.87Å
1170	V	86.1	Confident	72	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.9	-178	-173.5	0	0	0	0	109	V961 M982 V1004 V1007 Y1105 L1106	V961-V1170 HydrophobicContact CG1-CG1 4.4Å; V961-V1170 HydrophobicContact CG1-CG2 3.65Å; M982-V1170 HydrophobicContact CE-CG1 4.4Å; V1004-V1170 HydrophobicContact CG1-CG1 3.99Å; V1004-V1170 HydrophobicContact CG2-CG1 4.46Å; V1007-V1170 HydrophobicContact CG2-CG1 4.5Å; Y1105-V1170 CarbonylContact C-O 3.43Å; Y1105-V1170 WeakPolarHBondContact CA-O 3.07Å; L1106-V1170 HydrophobicContact CB-CB 4.36Å; L1106-V1170 PolarHBondContact N-O 3.36Å; L1106-V1170 PolarHBondContact O-N 3.18Å
1171	T	87.8	Confident	72.1	Confident	9 Å²	9	59.2 Å²	59.2	6%	0.055	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	124.4	172.1	-51.2	0	0	0	0	108.7	V1005 K1006 L1103 R1104 Y1105	V1005-T1171 PolarHBondContact N-O 3.48Å; K1006-T1171 PolarHBondContact N-O 2.98Å; K1006-T1171 PolarHBondContact O-N 2.85Å; L1103-T1171 HydrophobicContact CB-CG2 4.04Å; L1103-T1171 HydrophobicContact CD1-CG2 4.09Å; R1104-T1171 CarbonylContact O-C 3.39Å; R1104-T1171 WeakPolarHBondContact O-CA 3.5Å; Y1105-T1171 HydrophobicContact CD1-CG2 4.13Å; Y1105-T1171 WeakPolarHBondContact CD1-OG1 3.4Å; Y1105-T1171 HydrophobicContact CE1-CG2 3.75Å; Y1105-T1171 WeakPolarHBondContact CE1-OG1 3.5Å
1172	Y	83.5	Confident	71.9	Confident	9 Å²	9	60.9 Å²	60.9	4%	0.035	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	163.6	-174.1	73.9	-79.2	0	0	0	112.9	Y1002 N1003 L1103 R1104 L1106 I1174	Y1002-Y1172 AromaticContact CD1-CD2 3.73Å; Y1002-Y1172 HydrophobicContact CD1-CD2 3.73Å; Y1002-Y1172 AromaticContact CD1-CE2 3.63Å; Y1002-Y1172 HydrophobicContact CD1-CE2 3.63Å; Y1002-Y1172 AromaticContact CD2-CD2 3.97Å; Y1002-Y1172 HydrophobicContact CD2-CD2 3.97Å; Y1002-Y1172 AromaticContact CD2-CE2 3.93Å; Y1002-Y1172 HydrophobicContact CD2-CE2 3.93Å; Y1002-Y1172 HydrophobicContact CE1-CD2 4.3Å; Y1002-Y1172 AromaticContact CE1-CE2 3.71Å; Y1002-Y1172 HydrophobicContact CE1-CE2 3.71Å; Y1002-Y1172 HydrophobicContact CE2-CD2 4.49Å; Y1002-Y1172 AromaticContact CE2-CE2 3.99Å; Y1002-Y1172 HydrophobicContact CE2-CE2 3.99Å; Y1002-Y1172 AromaticContact CG-CD2 3.53Å; Y1002-Y1172 HydrophobicContact CG-CD2 3.53Å; Y1002-Y1172 AromaticContact CG-CE2 3.74Å; Y1002-Y1172 HydrophobicContact CG-CE2 3.74Å; Y1002-Y1172 HydrophobicContact CG-CG 4.49Å; Y1002-Y1172 AromaticContact CZ-CE2 3.89Å; N1003-Y1172 CarbonylContact O-C 3.44Å; N1003-Y1172 WeakPolarHBondContact O-CA 3.2Å; N1003-Y1172 WeakPolarHBondContact O-CB 3.1Å; L1103-Y1172 CarbonylContact C-O 3.56Å; L1103-Y1172 WeakPolarHBondContact CA-O 3.41Å; R1104-Y1172 HydrophobicContact CB-CD1 4.11Å; R1104-Y1172 HydrophobicContact CB-CE1 3.59Å; R1104-Y1172 HydrophobicContact CB-CE2 4.14Å; R1104-Y1172 PolarHBondContact N-O 3.39Å; R1104-Y1172 WeakPolarHBondContact O-CD1 3.34Å; R1104-Y1172 PolarHBondContact O-N 2.82Å; L1106-Y1172 HydrophobicContact CB-CD1 4.19Å; L1106-Y1172 HydrophobicContact CB-CE1 3.84Å; Y1172-I1174 HydrophobicContact CE2-CG1 4.08Å
1173	Q	82	Confident	71.1	Confident	56 Å²	56	62.4 Å²	62.4	26%	0.262	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	138.9	174.5	-170.2	179.5	17.7	0	0	109.9	Y1002 N1003 Y1100 V1101 L1103	Y1002-Q1173 CarbonylContact C-O 3.6Å; Y1002-Q1173 WeakPolarHBondContact CA-O 3.01Å; N1003-Q1173 HydrophobicContact CB-CB 4.2Å; N1003-Q1173 PolarHBondContact N-O 3.46Å; N1003-Q1173 PolarHBondContact O-N 2.8Å; Y1100-Q1173 WeakPolarHBondContact O-CG 3Å; Y1100-Q1173 PolarHBondContact O-NE2 3.3Å; V1101-Q1173 PolarHBondContact O-NE2 2.75Å; L1103-Q1173 HydrophobicContact CD2-CB 4.02Å
1174	I	78.3	Confident	69.6	Low	2 Å²	2	69.6 Å²	69.6	1%	0.01	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	130.5	176.1	-57.5	-177.5	0	0	0	108.9	F999 Y1002 Y1100 Y1172	F999-I1174 HydrophobicContact CB-CG2 3.32Å; F999-I1174 HydrophobicContact CD1-CG2 3.83Å; F999-I1174 HydrophobicContact CD2-CG2 3.91Å; F999-I1174 HydrophobicContact CG-CG2 3.41Å; F999-I1174 VanDerWaalsContact CG-CG2 3.41Å; Y1002-I1174 HydrophobicContact CD1-CG1 4.22Å; Y1002-I1174 HydrophobicContact CE1-CG1 4.04Å; Y1100-I1174 HydrophobicContact CD1-CB 4.26Å; Y1100-I1174 HydrophobicContact CD1-CG2 3.8Å; Y1100-I1174 HydrophobicContact CE1-CG2 3.91Å; Y1172-I1174 HydrophobicContact CE2-CG1 4.08Å
1175	I	77.3	Confident	67.6	Low	56 Å²	56	73.1 Å²	73.1	29%	0.287	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135.3	177.7	-40.1	-176.5	0	0	0	110.4	F999 K1001 N1003	F999-I1175 VanDerWaalsContact CB-O 3.3Å; F999-I1175 WeakPolarHBondContact CB-O 3.08Å; K1001-I1175 HydrophobicContact CD-CB 4.22Å; K1001-I1175 HydrophobicContact CD-CD1 3.89Å; K1001-I1175 HydrophobicContact CD-CG1 4.5Å; K1001-I1175 HydrophobicContact CD-CG2 4.49Å; K1001-I1175 VanDerWaalsContact CE-CG2 3.45Å; K1001-I1175 HydrophobicContact CG-CB 3.67Å; K1001-I1175 HydrophobicContact CG-CD1 3.78Å; K1001-I1175 HydrophobicContact CG-CG1 3.95Å; K1001-I1175 HydrophobicContact CG-CG2 4.44Å; K1001-I1175 PolarHBondContact O-N 3.13Å; K1001-I1175 VanDerWaalsContact O-N 3.17Å; N1003-I1175 HydrophobicContact CB-CD1 3.74Å; N1003-I1175 HydrophobicContact CB-CG1 3.99Å
1176	K	75.6	Confident	65.2	Low	120 Å²	120	78.7 Å²	78.7	52%	0.522	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-80.1	139.2	174.2	-167.2	174.2	-177.8	174.2	0	110.2	Y1100	Y1100-K1176 HydrophobicContact CD1-CB 3.8Å; Y1100-K1176 HydrophobicContact CD2-CB 4.49Å; Y1100-K1176 HydrophobicContact CD2-CD 4.45Å; Y1100-K1176 HydrophobicContact CE1-CB 3.72Å; Y1100-K1176 HydrophobicContact CE1-CG 4.12Å; Y1100-K1176 HydrophobicContact CE2-CB 4.44Å; Y1100-K1176 HydrophobicContact CE2-CD 4.09Å; Y1100-K1176 HydrophobicContact CE2-CG 4.36Å; Y1100-K1176 HydrophobicContact CG-CB 4.19Å
1177	P	71.6	Confident	62.6	Low	42 Å²	42	83.9 Å²	83.9	27%	0.273	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-62.1	136.9	173.8	-19	30.8	0	0	0	110.4	L998 K1179	L998-P1177 HydrophobicContact CB-CG 4.33Å; L998-P1177 WeakPolarHBondContact O-CD 3.41Å; P1177-K1179 PolarHBondContact O-N 3.31Å
1178	E	66.6	Low	60	Low	178 Å²	178	88.7 Å²	88.7	83%	0.832	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-67.6	128.9	173.2	-69.8	-175.1	175.8	0	0	109	D1180	E1178-D1180 PolarHBondContact O-N 3.14Å
1179	K	55.9	Low	57.3	Low	187 Å²	187	94.3 Å²	94.3	81%	0.813	53%	0.534	S	S	*	.			trans	-68.3	115.1	173.3	-75.7	-173.3	173.8	-171.1	0	108.1	P1177 K1181	P1177-K1179 PolarHBondContact O-N 3.31Å; K1179-K1181 PolarHBondContact O-N 2.97Å
1180	D	42.9	Very low	54.5	Low	150 Å²	150	100.7 Å²	100.7	80%	0.802	57%	0.568	S	S	*	*			trans	-50.1	115.1	169.1	-82.2	-36.5	0	0	0	109.5	E1178 T1182	E1178-D1180 PolarHBondContact O-N 3.14Å; D1180-T1182 PolarHBondContact O-N 3.37Å
1181	K	42	Very low	51.9	Low	212 Å²	212	107.6 Å²	107.6	92%	0.922	61%	0.605	S	S	*	*	S	Bend	trans	-72.4	30.9	-178.1	-75.8	-175.1	174.4	176.8	0	113.4	K1179	K1179-K1181 PolarHBondContact O-N 2.97Å
1182	T	39.1	Very low	49.3	Very low	124 Å²	124	115.6 Å²	115.6	76%	0.761	65%	0.647	S	S	*	*			trans	-135	59.9	-175.2	56.7	0	0	0	0	112	D1180	D1180-T1182 PolarHBondContact O-N 3.37Å
1183	A	35.1	Very low	46.8	Very low	87 Å²	87	120.6 Å²	120.6	72%	0.719	68%	0.678	S	S	*	*			trans	-164.6	40.4	161.5	0	0	0	0	0	113.6
1184	D	32.4	Very low	44.4	Very low	179 Å²	179	124.8 Å²	124.8	96%	0.957	71%	0.707	S	S	*	*			trans	-118.3	71.3	168.8	-78.5	-27.9	0	0	0	109.7
1185	A	33	Very low	41.9	Very low	88 Å²	88	130.2 Å²	130.2	73%	0.727	74%	0.744	S	S	*	*	S	Bend	trans	-141.8	117.4	156.4	0	0	0	0	0	108.5
1186	S	32.4	Very low	40.3	Very low	118 Å²	118	136.7 Å²	136.7	83%	0.825	79%	0.79	S	S	*	*	S	Bend	trans	72.9	95.8	172.3	71.7	0	0	0	0	117.7
1187	S	29.6	Very low	38.6	Very low	110 Å²	110	137.6 Å²	137.6	77%	0.769	80%	0.803	S	S	*	*				174.7	104.9	104.7	42.8	0	0	0	0	109.6	V1189	S1187-V1189 PolarHBondContact O-N 3.22Å
1188	S	31	Very low	36.8	Very low	116 Å²	116	142.6 Å²	142.6	81%	0.811	83%	0.831	S	S	*	*			trans	-62.9	114.8	157	49.4	0	0	0	0	108.6
1189	V	32	Very low	35.2	Very low	135 Å²	135	140.6 Å²	140.6	82%	0.818	83%	0.831	S	S	*	*			trans	-134.3	108.8	157.8	-178.4	0	0	0	0	107.1	S1187	S1187-V1189 PolarHBondContact O-N 3.22Å
1190	D	30.5	Very low	34	Very low	137 Å²	137	137.9 Å²	137.9	73%	0.733	83%	0.832	S	S	*	*			trans	-59.1	155.5	171.7	-68.1	-52.1	0	0	0	112.4
1191	D	32.4	Very low	33.4	Very low	144 Å²	144	137.1 Å²	137.1	77%	0.77	83%	0.834	S	S	*	*			trans	55.8	79.9	149.1	-66.4	-20.7	0	0	0	118.1	T1193	D1191-T1193 PolarHBondContact O-N 3.01Å
1192	L	32.2	Very low	32.8	Very low	178 Å²	178	132.1 Å²	132.1	93%	0.932	83%	0.828	S	S	*	*			trans	-90	87.8	149.8	-88	159	0	0	0	109.5	V1194	L1192-V1194 PolarHBondContact O-N 2.88Å
1193	T	31.5	Very low	32.4	Very low	113 Å²	113	132.7 Å²	132.7	69%	0.693	83%	0.833	S	S	*	*			trans	-37.6	128.8	156.8	42	0	0	0	0	112.2	D1191 C1195	D1191-T1193 PolarHBondContact O-N 3.01Å; T1193-C1195 PolarHBondContact O-N 3.05Å; T1193-C1195 VanDerWaalsContact O-N 3.09Å
1194	V	30.6	Very low	32.2	Very low	145 Å²	145	136.2 Å²	136.2	88%	0.879	84%	0.842	S	S	*	*			trans	-52.6	107.8	164.5	179	0	0	0	0	108.8	L1192	L1192-V1194 PolarHBondContact O-N 2.88Å
1195	C	27.1	Very low	32.1	Very low	115 Å²	115	132.7 Å²	132.7	78%	0.777	83%	0.832	S	S	*	*			trans	-88.2	140.3	163.4	-111	0	0	0	0	108.4	T1193	T1193-C1195 PolarHBondContact O-N 3.05Å; T1193-C1195 VanDerWaalsContact O-N 3.09Å
1196	P	43.7	Very low	32.1	Very low	193 Å²	193	136.7 Å²	136.7	100%	1.253	84%	0.842	S	S	*	*			trans	-70.7	0	-166.5	31.3	-35.8	0	0	0	114.2

Retrieved 1,196 of 1,196 residues in 384.2 ms (Link to these results)

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