G7PK59_MACFA Loading...

receptor protein-tyrosine kinase

AlphaFold DB , UniProt , Accession G7PK59, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene EPHA4, Length 986 aa.

						>G7PK59_MACFA|G7PK59|EPHA4
MAGIFYFALFSCLFGICDAVTGSRVYPANEVTLLDSRSVQGELGWIASPLEGGWEEVSIMDEKNTPIRTYQVCNVMEPSQNNWLRTDWITREGAQRVYIEIKFTLRDCNSLPGVMGTCKETFNLYYYESDNDKERFIRENQFVKIDTIAADESFTQVDIGDRIMKLNTEIRDVGPLSKKGFYLAFQDVGACIALVSVRVFYKKCPLTVRNLAQFPDTITGADTSSLVEVRGSCVNNSEEKDVPKMYCGADGEWLVPIGNCLCNAGHEERSGECQACKIGYYKALSTDATCAKCPPHSYSVWEGATSCTCDRGFFRADNDAASMPCTRPPSAPLNLISNVNETSVNLEWSSPQNTGGRQDISYNVVCKKCGAGDPSKCRPCGSGVHYTPQQNGLKTTKVSITDLLAHTNYTFEIWAVNGVSKYNPSPDQSVSVTVTTNQAAPSSIALVQAKEVTRYSVALAWLEPDRPNGVILEYEVKYYEKDQNERSYRIVRTAARNTDIKGLNPLTSYVFHVRARTAAGYGDFSEPLEVTTNTVPSRIIGDGANSTVLLVSVSGSVVLVVILIAAFVISRRRSKYSKAKQEADEEKHLNQGVRTYVDPFTYEDPNQAVREFAKEIDASCIKIEKVIGVGEFGEVCSGRLKVPGKREICVAIKTLKAGYTDKQRRDFLSEASIMGQFDHPNIIHLEGVVTKCKPVMIITEYMENGSLDAFLRKNDGRFTVIQLVGMLRGIGSGMKYLSDMSYVHRDLAARNILVNSNLVCKVSDFGMSRVLEDDPEAAYTTRGGKIPIRWTAPEAIAYRKFTSASDVWSYGIVMWEVMSYGERPYWDMSNQDVIKAIEEGYRLPPPMDCPIALHQLMLDCWQKERSDRPKFGQIVNMLDKLIRNPNSLKRTGTESSRPNTALLDPSSPEFSAVVSVGDWLQAIKMDRYKDNFTAAGYTTLEAVVHVNQEDLARIGITAITHQNKILSSVQAMRTQMQQMHGRMVPV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	33.2	Very low	242 Å²	242	158.6 Å²	158.6	100%	1.192	86%	0.857	S	S	*	*				0	154	0	-74.2	-174.2	-85	0	0	108.7
2	A	35.6	Very low	33	Very low	110 Å²	110	154.5 Å²	154.5	91%	0.909	85%	0.847	S	S	*	*			trans	33.8	112.6	167.2	0	0	0	0	0	118.8
3	G	36.4	Very low	32.9	Very low	77 Å²	77	154.1 Å²	154.1	79%	0.794	84%	0.842	S	S	*	*	S	Bend	trans	171.7	-27.8	166.3	0	0	0	0	0	118
4	I	35.6	Very low	33.1	Very low	164 Å²	164	157.2 Å²	157.2	84%	0.841	84%	0.844	S	S	*	*	S	Bend	trans	-114.9	1.7	-165.6	-53.6	-179.2	0	0	0	113.2	Y6	I4-Y6 PolarHBondContact O-N 3.06Å
5	F	31.9	Very low	33	Very low	191 Å²	191	152 Å²	152	84%	0.838	84%	0.842	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	8.2	-170.5	-101.7	-82.5	0	0	0	116.7
6	Y	33.1	Very low	33	Very low	221 Å²	221	150.4 Å²	150.4	87%	0.867	83%	0.83	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	7.2	-168.5	-109.1	-80.9	0	0	0	116.8	I4	I4-Y6 PolarHBondContact O-N 3.06Å
7	F	32.6	Very low	32.9	Very low	202 Å²	202	148.9 Å²	148.9	89%	0.886	83%	0.831	S	S	*	*	S	Bend	trans	-116.1	0.4	-179.8	-103.7	-84.6	0	0	0	115.5
8	A	31.4	Very low	32.7	Very low	86 Å²	86	148.1 Å²	148.1	71%	0.711	82%	0.824	S	S	*	*	S	Bend	trans	-107.2	13.4	-173.3	0	0	0	0	0	114.7
9	L	32.3	Very low	32.5	Very low	139 Å²	139	144.5 Å²	144.5	73%	0.728	82%	0.816	S	S	*	*	S	Bend	trans	-129.9	6.9	-166.4	-110.6	161.7	0	0	0	115.5
10	F	29.5	Very low	32.5	Very low	201 Å²	201	144.4 Å²	144.4	88%	0.882	82%	0.818	S	S	*	*	S	Bend	trans	-107.5	-10	178.9	-127.2	-93.5	0	0	0	114.6
11	S	30.2	Very low	32.6	Very low	112 Å²	112	142.6 Å²	142.6	78%	0.783	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	8.1	-175.7	-48.4	0	0	0	0	114.8
12	C	30.2	Very low	32.6	Very low	109 Å²	109	134.5 Å²	134.5	74%	0.736	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	14.4	-170.4	-60.2	0	0	0	0	114.6
13	L	32	Very low	33.2	Very low	149 Å²	149	134.1 Å²	134.1	78%	0.78	78%	0.78	S	S	*	*	S	Bend	trans	-119.3	-1.4	-174.5	-88.8	165.7	0	0	0	115.9
14	F	35.3	Very low	34.4	Very low	198 Å²	198	134.5 Å²	134.5	87%	0.868	76%	0.757	S	S	*	*			trans	-119.3	77.8	165.5	-80.7	-81	0	0	0	109.9	I16	F14-I16 VanDerWaalsContact C-N 3.35Å; F14-I16 PolarHBondContact O-N 3.03Å
15	G	32.8	Very low	36	Very low	79 Å²	79	133.6 Å²	133.6	81%	0.814	76%	0.759	S	S	*	*			trans	-74.2	85.3	171.3	0	0	0	0	0	111.1
16	I	33	Very low	38.3	Very low	127 Å²	127	128 Å²	128	65%	0.651	73%	0.733	S	S	*	*			trans	-85.8	117.8	156.6	-61.1	180	0	0	0	106.4	F14 D18	F14-I16 VanDerWaalsContact C-N 3.35Å; F14-I16 PolarHBondContact O-N 3.03Å; I16-D18 PolarHBondContact O-N 3.24Å
17	C	31.1	Very low	40.9	Very low	125 Å²	125	120.5 Å²	120.5	85%	0.845	71%	0.711	S	S	*	*			trans	-79.7	66.9	176.5	-70	0	0	0	0	110.8	A19	C17-A19 PolarHBondContact O-N 3.14Å
18	D	28.1	Very low	43.5	Very low	133 Å²	133	114.4 Å²	114.4	71%	0.711	70%	0.698	S	S	*	*			trans	-70.1	77.7	165.2	-73.1	-30	0	0	0	109	I16 V20	I16-D18 PolarHBondContact O-N 3.24Å; D18-V20 PolarHBondContact O-N 2.74Å
19	A	29	Very low	46.4	Very low	80 Å²	80	111.7 Å²	111.7	66%	0.661	67%	0.672	S	S	*	*			trans	-58.6	117	163.6	0	0	0	0	0	107.4	C17 T21	C17-A19 PolarHBondContact O-N 3.14Å; A19-T21 PolarHBondContact O-N 2.89Å
20	V	33.1	Very low	49.3	Very low	143 Å²	143	106.8 Å²	106.8	87%	0.867	65%	0.645	S	S	*	*			trans	-73.5	75.9	-171.2	-173.1	0	0	0	0	110.8	D18 G22	D18-V20 PolarHBondContact O-N 2.74Å; V20-G22 PolarHBondContact O-N 2.64Å
21	T	35.3	Very low	52.4	Low	106 Å²	106	99 Å²	99	65%	0.65	61%	0.614	S	S	*	*			trans	-63.6	122.5	152.8	51.2	0	0	0	0	107.3	A19 S23	A19-T21 PolarHBondContact O-N 2.89Å; T21-S23 PolarHBondContact O-N 3Å
22	G	36.5	Very low	55.4	Low	72 Å²	72	96.1 Å²	96.1	74%	0.742	59%	0.592	S	S	*	*			trans	-69.6	74.4	-177.6	0	0	0	0	0	112.7	V20 R24	V20-G22 PolarHBondContact O-N 2.64Å; G22-R24 PolarHBondContact O-N 2.92Å
23	S	47.5	Very low	58.5	Low	103 Å²	103	92.5 Å²	92.5	72%	0.72	57%	0.565	S	S	*	*			trans	-57.5	126.7	179	-172	0	0	0	0	110.4	T21 V25	T21-S23 PolarHBondContact O-N 3Å; S23-V25 PolarHBondContact O-N 3Å
24	R	62.2	Low	61.4	Low	84 Å²	84	87.1 Å²	87.1	32%	0.317	54%	0.537	S	S	.	.			trans	-75.2	118.2	179.8	-68.3	175.4	172.3	-168.2	-5.9	108.4	G22 Y26 D35 D61	G22-R24 PolarHBondContact O-N 2.92Å; R24-Y26 HydrophobicContact CB-CE2 3.8Å; R24-Y26 VanDerWaalsContact O-CD2 3.23Å; R24-Y26 WeakPolarHBondContact O-CD2 3.24Å; R24-Y26 WeakPolarHBondContact O-CE2 3.5Å; R24-Y26 PolarHBondContact O-N 3.38Å; R24-D35 IonicContact NH1-OD2 3.59Å; R24-D61 IonicContact NH2-OD2 2.76Å; R24-D61 PolarHBondContact NH2-OD2 2.95Å
25	V	68	Low	64	Low	145 Å²	145	77.9 Å²	77.9	88%	0.879	50%	0.497	S	S	*	.			trans	-77.2	108.8	-178.8	-177.3	0	0	0	0	109.3	S23	S23-V25 PolarHBondContact O-N 3Å
26	Y	81.9	Confident	66.7	Low	73 Å²	73	74.3 Å²	74.3	29%	0.286	46%	0.459	S	S	.	.			trans	-92.7	161.6	171.9	-64.9	-71.2	0	0	0	111.2	R24 D35 R198	R24-Y26 HydrophobicContact CB-CE2 3.8Å; R24-Y26 VanDerWaalsContact O-CD2 3.23Å; R24-Y26 WeakPolarHBondContact O-CD2 3.24Å; R24-Y26 WeakPolarHBondContact O-CE2 3.5Å; R24-Y26 PolarHBondContact O-N 3.38Å; Y26-D35 PolarHBondContact OH-OD2 2.85Å; Y26-D35 VanDerWaalsContact OH-OD2 3.06Å; Y26-R198 VanDerWaalsContact CD1-NH1 3.28Å; Y26-R198 VanDerWaalsContact CE1-CD 3.43Å
27	P	86.7	Confident	69	Low	64 Å²	64	71.1 Å²	71.1	42%	0.416	44%	0.439	S	S	.	.			trans	-56.3	143.6	174.9	-25.7	36	0	0	0	113	N29 E30	P27-N29 WeakPolarHBondContact CB-OD1 3.42Å; P27-N29 PolarHBondContact O-N 3.21Å; P27-N29 VanDerWaalsContact O-N 3.15Å; P27-E30 HydrophobicContact CB-CG 4.2Å; P27-E30 HydrophobicContact CG-CG 4.41Å; P27-E30 PolarHBondContact O-N 3.43Å
28	A	87.3	Confident	71.2	Confident	75 Å²	75	68.9 Å²	68.9	62%	0.62	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.5	-175.3	0	0	0	0	0	114.7	K203	A28-K203 VanDerWaalsContact O-CE 3.26Å; A28-K203 WeakPolarHBondContact O-CE 3.33Å
29	N	92.1	Very high	73.3	Confident	28 Å²	28	65.4 Å²	65.4	15%	0.15	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-1.8	172.8	62.6	-35.8	0	0	0	113.5	P27 K202 K203 D250	P27-N29 WeakPolarHBondContact CB-OD1 3.42Å; P27-N29 PolarHBondContact O-N 3.21Å; P27-N29 VanDerWaalsContact O-N 3.15Å; N29-K202 CarbonylContact O-C 3.6Å; N29-K202 VanDerWaalsContact O-CA 3.27Å; N29-K202 WeakPolarHBondContact O-CA 3.41Å; N29-K203 WeakPolarHBondContact CA-O 3.35Å; N29-K203 WeakPolarHBondContact CB-O 3.27Å; N29-K203 PolarHBondContact O-N 3.05Å; N29-D250 PolarHBondContact ND2-O 2.96Å
30	E	93.8	Very high	74.7	Confident	36 Å²	36	70.4 Å²	70.4	17%	0.168	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	141.8	177.4	-64.4	-173.4	171.4	0	0	111.6	P27 R198 F200	P27-E30 HydrophobicContact CB-CG 4.2Å; P27-E30 HydrophobicContact CG-CG 4.41Å; P27-E30 PolarHBondContact O-N 3.43Å; E30-R198 IonicContact OE1-NH2 2.81Å; E30-R198 IonicContact OE2-CZ 2.59Å; E30-R198 VanDerWaalsContact OE2-CZ 3.24Å; E30-R198 IonicContact OE2-NH1 2.62Å; E30-R198 PolarHBondContact OE2-NH1 2.91Å; E30-R198 IonicContact OE2-NH2 2.74Å; E30-R198 PolarHBondContact OE2-NH2 2.61Å; E30-F200 HydrophobicContact CB-CD2 3.93Å; E30-F200 HydrophobicContact CB-CE2 4.39Å; E30-F200 HydrophobicContact CG-CD2 3.75Å; E30-F200 HydrophobicContact CG-CE2 3.71Å; E30-F200 WeakPolarHBondContact OE1-CE2 3.44Å
31	V	93.9	Very high	76.2	Confident	39 Å²	39	65.5 Å²	65.5	24%	0.236	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	109.6	174	-177.4	0	0	0	0	109.1	F200 Y201 K203	V31-F200 CarbonylContact O-C 3.56Å; V31-F200 WeakPolarHBondContact O-CA 3.41Å; V31-F200 WeakPolarHBondContact O-CB 3.37Å; V31-Y201 HydrophobicContact CB-CD1 3.97Å; V31-Y201 HydrophobicContact CB-CD2 4.46Å; V31-Y201 HydrophobicContact CB-CE1 3.55Å; V31-Y201 HydrophobicContact CB-CE2 4.06Å; V31-Y201 HydrophobicContact CB-CG 4.42Å; V31-Y201 HydrophobicContact CG1-CD1 4.27Å; V31-Y201 HydrophobicContact CG1-CE1 3.5Å; V31-Y201 VanDerWaalsContact CG1-CE1 3.5Å; V31-Y201 HydrophobicContact CG2-CE1 4.38Å; V31-Y201 HydrophobicContact CG2-CE2 4.12Å; V31-Y201 PolarHBondContact N-O 3.4Å; V31-Y201 PolarHBondContact O-N 3.22Å; V31-K203 HydrophobicContact CG2-CD 3.83Å; V31-K203 HydrophobicContact CG2-CG 4.17Å
32	T	94.1	Very high	77.5	Confident	51 Å²	51	67.5 Å²	67.5	31%	0.313	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	126.7	-179.5	-56.6	0	0	0	0	111.3	L34 D35 R198	T32-L34 VanDerWaalsContact CG2-C 3.5Å; T32-L34 VanDerWaalsContact CG2-O 3.32Å; T32-L34 WeakPolarHBondContact CG2-O 3.49Å; T32-D35 HydrophobicContact CG2-CB 4.15Å; T32-R198 HydrophobicContact CG2-CG 4.08Å
33	L	93.9	Very high	79	Confident	33 Å²	33	64.6 Å²	64.6	17%	0.173	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	-29	171.3	-59.3	175	0	0	0	111.7	I89 E92 V97 F181 V199 Y201	L33-I89 HydrophobicContact CB-CG2 3.68Å; L33-I89 HydrophobicContact CD1-CG2 4.38Å; L33-E92 HydrophobicContact CD2-CG 4.09Å; L33-V97 HydrophobicContact CD1-CG1 4Å; L33-V97 HydrophobicContact CD1-CG2 4.05Å; L33-F181 HydrophobicContact CD1-CE1 4.49Å; L33-V199 PolarHBondContact N-O 3.26Å; L33-Y201 HydrophobicContact CD1-CD1 4.13Å; L33-Y201 HydrophobicContact CD2-CD1 3.75Å; L33-Y201 HydrophobicContact CD2-CE1 3.84Å; L33-Y201 HydrophobicContact CG-CD1 3.96Å
34	L	93	Very high	80.5	Confident	35 Å²	35	61.7 Å²	61.7	18%	0.183	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	138.2	175.4	177.7	63.5	0	0	0	109.9	T32 W45 T86 I89 R198 V199	T32-L34 VanDerWaalsContact CG2-C 3.5Å; T32-L34 VanDerWaalsContact CG2-O 3.32Å; T32-L34 WeakPolarHBondContact CG2-O 3.49Å; L34-W45 HydrophobicContact CD2-CZ2 4.12Å; L34-T86 HydrophobicContact CD2-CG2 4.4Å; L34-I89 HydrophobicContact CB-CD1 4.3Å; L34-I89 HydrophobicContact CD2-CD1 3.63Å; L34-I89 HydrophobicContact CD2-CG1 4.19Å; L34-R198 CarbonylContact O-C 3.59Å; L34-R198 VanDerWaalsContact O-CA 3.26Å; L34-R198 WeakPolarHBondContact O-CA 3.49Å; L34-R198 WeakPolarHBondContact O-CG 3.4Å; L34-V199 HydrophobicContact CB-CB 4.05Å; L34-V199 HydrophobicContact CB-CG2 4.13Å; L34-V199 HydrophobicContact CD2-CG2 4.22Å; L34-V199 PolarHBondContact N-O 2.81Å; L34-V199 VanDerWaalsContact N-O 3.08Å; L34-V199 PolarHBondContact O-N 3.45Å
35	D	91.5	Very high	81.9	Confident	5 Å²	5	58.7 Å²	58.7	3%	0.027	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	114.3	160.3	170.3	22.8	0	0	0	108	R24 Y26 T32 R37 S38 R198	R24-D35 IonicContact NH1-OD2 3.59Å; Y26-D35 PolarHBondContact OH-OD2 2.85Å; Y26-D35 VanDerWaalsContact OH-OD2 3.06Å; T32-D35 HydrophobicContact CG2-CB 4.15Å; D35-R37 PolarHBondContact O-N 2.92Å; D35-R37 VanDerWaalsContact O-N 3.15Å; D35-R37 PolarHBondContact OD1-N 2.83Å; D35-S38 WeakPolarHBondContact O-CB 3.47Å; D35-S38 PolarHBondContact O-N 3.47Å; D35-S38 PolarHBondContact O-OG 2.95Å; D35-S38 PolarHBondContact OD2-N 2.83Å; D35-R198 HydrophobicContact CB-CG 4.26Å
36	S	88.9	Confident	83	Confident	4 Å²	4	54.2 Å²	54.2	3%	0.028	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-57.6	-29.8	179.3	66.3	0	0	0	0	112.7	S38 L43 S196 V197	S36-S38 VanDerWaalsContact C-N 3.3Å; S36-S38 PolarHBondContact O-N 3.41Å; S36-L43 WeakPolarHBondContact O-CD1 3.44Å; S36-S196 VanDerWaalsContact OG-CA 3.27Å; S36-S196 WeakPolarHBondContact OG-CA 3.34Å; S36-V197 PolarHBondContact N-O 2.81Å; S36-V197 PolarHBondContact OG-N 2.94Å
37	R	82.2	Confident	83.6	Confident	60 Å²	60	51.3 Å²	51.3	23%	0.226	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-87.2	4.9	179.6	-65.7	-177.9	-67.3	-175.1	-16.5	113.9	D35 I67 S196	D35-R37 PolarHBondContact O-N 2.92Å; D35-R37 VanDerWaalsContact O-N 3.15Å; D35-R37 PolarHBondContact OD1-N 2.83Å; R37-I67 HydrophobicContact CB-CG2 4.27Å; R37-I67 HydrophobicContact CG-CB 4.25Å; R37-I67 HydrophobicContact CG-CD1 4.36Å; R37-I67 HydrophobicContact CG-CG2 3.97Å; R37-S196 PolarHBondContact NE-OG 3.35Å; R37-S196 PolarHBondContact NH2-OG 3.29Å
38	S	76.3	Confident	83.9	Confident	77 Å²	77	50.5 Å²	50.5	54%	0.538	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-95.1	-17.9	168.6	74.8	0	0	0	0	113.2	D35 S36 Q40	D35-S38 WeakPolarHBondContact O-CB 3.47Å; D35-S38 PolarHBondContact O-N 3.47Å; D35-S38 PolarHBondContact O-OG 2.95Å; D35-S38 PolarHBondContact OD2-N 2.83Å; S36-S38 VanDerWaalsContact C-N 3.3Å; S36-S38 PolarHBondContact O-N 3.41Å; S38-Q40 PolarHBondContact O-N 2.79Å
39	V	72.4	Confident	84.1	Confident	61 Å²	61	49.8 Å²	49.8	37%	0.37	29%	0.287	S	S	.	.			trans	-79.2	118.9	179.5	-178.2	0	0	0	0	109.2	L43	V39-L43 HydrophobicContact CB-CD1 3.88Å; V39-L43 HydrophobicContact CG1-CD1 4.16Å; V39-L43 HydrophobicContact CG2-CD1 4.32Å
40	Q	58.4	Low	83.9	Confident	184 Å²	184	55.2 Å²	55.2	86%	0.86	32%	0.316	S	S	*	.			trans	-90.6	1	-177.6	-63	-176.7	-7.3	0	0	114.1	S38	S38-Q40 PolarHBondContact O-N 2.79Å
41	G	63.3	Low	83.6	Confident	40 Å²	40	61.9 Å²	61.9	41%	0.412	35%	0.347	S	S	.	.	S	Bend	trans	-103.8	-155.2	179.5	0	0	0	0	0	113.4	R68	G41-R68 WeakPolarHBondContact O-CG 3.28Å
42	E	64.4	Low	83.2	Confident	149 Å²	149	62.2 Å²	62.2	70%	0.696	36%	0.357	S	S	*	.			trans	-67.5	149.3	158	-67.3	169.5	175.4	0	0	109	G44	E42-G44 VanDerWaalsContact C-N 3.32Å
43	L	68.1	Low	83.1	Confident	10 Å²	10	59.9 Å²	59.9	5%	0.052	34%	0.344	C	S	.	.			trans	-78.6	-19.8	-179.3	-134.2	77.5	0	0	0	113.1	S36 V39 W45 E56 R68 Y70	S36-L43 WeakPolarHBondContact O-CD1 3.44Å; V39-L43 HydrophobicContact CB-CD1 3.88Å; V39-L43 HydrophobicContact CG1-CD1 4.16Å; V39-L43 HydrophobicContact CG2-CD1 4.32Å; L43-W45 HydrophobicContact CD2-CD2 3.78Å; L43-W45 VanDerWaalsContact CD2-CE2 3.43Å; L43-W45 HydrophobicContact CD2-CE3 4.08Å; L43-W45 HydrophobicContact CD2-CG 4.4Å; L43-W45 HydrophobicContact CD2-CH2 3.71Å; L43-W45 HydrophobicContact CD2-CZ2 3.4Å; L43-W45 VanDerWaalsContact CD2-CZ2 3.4Å; L43-W45 HydrophobicContact CD2-CZ3 4.05Å; L43-W45 HydrophobicContact CG-CZ2 4.33Å; L43-W45 PolarHBondContact O-N 2.76Å; L43-E56 PolarHBondContact N-OE1 3.18Å; L43-E56 PolarHBondContact N-OE2 3.35Å; L43-R68 HydrophobicContact CD1-CB 4.13Å; L43-Y70 HydrophobicContact CB-CE2 3.84Å; L43-Y70 HydrophobicContact CD2-CD2 4.34Å; L43-Y70 HydrophobicContact CD2-CE2 3.75Å; L43-Y70 HydrophobicContact CG-CE2 4.43Å
44	G	77.3	Confident	83.2	Confident	42 Å²	42	58.7 Å²	58.7	43%	0.433	34%	0.337	S	S	.	.			trans	72.6	3.4	170.5	0	0	0	0	0	115.8	E42	E42-G44 VanDerWaalsContact C-N 3.32Å
45	W	91.6	Very high	83.2	Confident	21 Å²	21	62 Å²	62	8%	0.08	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-69.9	146.5	-174.2	-67.5	3.6	0	0	0	112	L34 L43 Y70 L84 R85 T86 F185 V197	L34-W45 HydrophobicContact CD2-CZ2 4.12Å; L43-W45 HydrophobicContact CD2-CD2 3.78Å; L43-W45 VanDerWaalsContact CD2-CE2 3.43Å; L43-W45 HydrophobicContact CD2-CE3 4.08Å; L43-W45 HydrophobicContact CD2-CG 4.4Å; L43-W45 HydrophobicContact CD2-CH2 3.71Å; L43-W45 HydrophobicContact CD2-CZ2 3.4Å; L43-W45 VanDerWaalsContact CD2-CZ2 3.4Å; L43-W45 HydrophobicContact CD2-CZ3 4.05Å; L43-W45 HydrophobicContact CG-CZ2 4.33Å; L43-W45 PolarHBondContact O-N 2.76Å; W45-Y70 HydrophobicContact CB-CE2 3.95Å; W45-Y70 AromaticContact CD2-CE2 3.96Å; W45-Y70 HydrophobicContact CD2-CE2 3.96Å; W45-Y70 AromaticContact CE3-CD2 3.83Å; W45-Y70 HydrophobicContact CE3-CD2 3.83Å; W45-Y70 AromaticContact CE3-CE2 3.66Å; W45-Y70 HydrophobicContact CE3-CE2 3.66Å; W45-Y70 HydrophobicContact CG-CE2 4.13Å; W45-Y70 HydrophobicContact CZ3-CD2 4.2Å; W45-Y70 HydrophobicContact CZ3-CE2 4.36Å; W45-Y70 PolarHBondContact N-OH 3.42Å; W45-L84 HydrophobicContact CB-CD1 3.78Å; W45-L84 HydrophobicContact CE3-CD1 4.28Å; W45-L84 HydrophobicContact CE3-CD2 3.99Å; W45-L84 HydrophobicContact CE3-CG 4.05Å; W45-L84 HydrophobicContact CZ3-CD2 4.39Å; W45-R85 WeakPolarHBondContact CA-O 3.49Å; W45-R85 VanDerWaalsContact CB-O 3.31Å; W45-R85 WeakPolarHBondContact CB-O 3.34Å; W45-T86 HydrophobicContact CD2-CG2 4.02Å; W45-T86 HydrophobicContact CE3-CG2 4.2Å; W45-T86 HydrophobicContact CH2-CG2 4.03Å; W45-T86 HydrophobicContact CZ2-CG2 3.8Å; W45-T86 HydrophobicContact CZ3-CG2 4.21Å; W45-F185 HydrophobicContact CH2-CE2 4.5Å; W45-F185 AromaticContact CZ3-CE2 3.91Å; W45-F185 HydrophobicContact CZ3-CE2 3.91Å; W45-V197 HydrophobicContact CH2-CB 3.89Å; W45-V197 HydrophobicContact CH2-CG2 3.69Å; W45-V197 HydrophobicContact CZ3-CG2 4.09Å
46	I	92.6	Very high	83.1	Confident	51 Å²	51	64.5 Å²	64.5	26%	0.262	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.1	-173.7	-53.3	-57.2	0	0	0	109.2	L84 R85 I137	I46-L84 CarbonylContact O-C 3.58Å; I46-L84 WeakPolarHBondContact O-CA 3.48Å; I46-R85 PolarHBondContact N-O 2.73Å; I46-R85 PolarHBondContact O-N 3.37Å; I46-I137 HydrophobicContact CG2-CD1 4.46Å; I46-I137 HydrophobicContact CG2-CG1 4.16Å
47	A	93	Very high	83	Confident	13 Å²	13	66.5 Å²	66.5	11%	0.107	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	149.2	169.6	0	0	0	0	0	111.7	P49 L50 W83	A47-P49 CarbonylContact C-O 3.56Å; A47-P49 WeakPolarHBondContact CB-O 3.31Å; A47-L50 WeakPolarHBondContact O-CD2 3.44Å; A47-W83 CarbonylContact C-O 3.53Å; A47-W83 WeakPolarHBondContact CA-O 3.46Å
48	S	93.1	Very high	83.1	Confident	47 Å²	47	67 Å²	67	33%	0.329	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	110.7	170	-175.7	0	0	0	0	109.5	W83	S48-W83 PolarHBondContact N-O 2.82Å; S48-W83 PolarHBondContact O-N 3.5Å
49	P	92.1	Very high	83.2	Confident	59 Å²	59	65.4 Å²	65.4	38%	0.383	37%	0.373	S	S	.	.	S	Bend	cis	-63.6	159	-0.1	30.2	-37	0	0	0	113	A47 E51	A47-P49 CarbonylContact C-O 3.56Å; A47-P49 WeakPolarHBondContact CB-O 3.31Å; P49-E51 VanDerWaalsContact C-N 3.33Å
50	L	87.8	Confident	83.3	Confident	143 Å²	143	68.3 Å²	68.3	75%	0.749	38%	0.384	S	S	*	.	S	Bend	trans	-72.8	-23.8	-179.2	-74.9	168	0	0	0	113.6	A47	A47-L50 WeakPolarHBondContact O-CD2 3.44Å
51	E	86.9	Confident	83.7	Confident	176 Å²	176	60.7 Å²	60.7	82%	0.822	35%	0.349	S	S	*	.	S	Bend	trans	-135	149.8	176.8	-67.9	-179.4	179.3	0	0	108.3	P49 G53	P49-E51 VanDerWaalsContact C-N 3.33Å; E51-G53 VanDerWaalsContact C-N 3.27Å; E51-G53 PolarHBondContact O-N 2.82Å
52	G	86.3	Confident	83.8	Confident	45 Å²	45	67.5 Å²	67.5	46%	0.464	37%	0.37	S	S	.	.	S	Bend	trans	69.5	20.8	-178.5	0	0	0	0	0	114.7	N74	G52-N74 PolarHBondContact O-ND2 3.08Å
53	G	92.4	Very high	83.9	Confident	3 Å²	3	68.4 Å²	68.4	3%	0.031	37%	0.372	C	S	.	.	S	Bend	trans	-126.1	-118.4	176.3	0	0	0	0	0	111	E51 V72	E51-G53 VanDerWaalsContact C-N 3.27Å; E51-G53 PolarHBondContact O-N 2.82Å; G53-V72 WeakPolarHBondContact O-CB 3.26Å; G53-V72 VanDerWaalsContact O-CG2 3.31Å; G53-V72 WeakPolarHBondContact O-CG2 3.21Å
54	W	94.8	Very high	83.9	Confident	8 Å²	8	74.1 Å²	74.1	3%	0.03	40%	0.402	C	S	.	.	S	Bend	trans	-80.3	124.1	171.1	-71.1	95.5	0	0	0	111.3	Q71 V72 N82 L84 F185 D187 I192 L194	W54-Q71 WeakPolarHBondContact CA-O 3.37Å; W54-V72 HydrophobicContact CD2-CB 4.19Å; W54-V72 HydrophobicContact CD2-CG1 3.77Å; W54-V72 HydrophobicContact CE3-CB 4.19Å; W54-V72 HydrophobicContact CE3-CG1 3.76Å; W54-V72 HydrophobicContact CG-CG1 4.49Å; W54-V72 HydrophobicContact CH2-CG1 3.9Å; W54-V72 HydrophobicContact CZ2-CG1 3.89Å; W54-V72 HydrophobicContact CZ3-CG1 3.83Å; W54-N82 PolarHBondContact NE1-O 3.06Å; W54-L84 HydrophobicContact CB-CB 4.08Å; W54-L84 HydrophobicContact CB-CD1 4.36Å; W54-L84 HydrophobicContact CB-CD2 4.4Å; W54-L84 HydrophobicContact CD2-CB 4.05Å; W54-L84 HydrophobicContact CD2-CD2 4.02Å; W54-L84 HydrophobicContact CE3-CD2 4.12Å; W54-L84 HydrophobicContact CG-CB 3.65Å; W54-L84 HydrophobicContact CG-CD2 4.2Å; W54-L84 HydrophobicContact CG-CG 4.42Å; W54-F185 HydrophobicContact CZ2-CB 4.16Å; W54-D187 HydrophobicContact CZ2-CB 3.87Å; W54-I192 HydrophobicContact CH2-CD1 4.4Å; W54-I192 HydrophobicContact CH2-CG1 4.43Å; W54-I192 HydrophobicContact CH2-CG2 3.69Å; W54-I192 HydrophobicContact CZ2-CG2 4.47Å; W54-I192 HydrophobicContact CZ3-CG2 4.08Å; W54-L194 HydrophobicContact CE3-CD1 4.32Å; W54-L194 HydrophobicContact CH2-CD1 3.6Å; W54-L194 HydrophobicContact CH2-CG 3.78Å; W54-L194 HydrophobicContact CZ2-CD1 4.32Å; W54-L194 HydrophobicContact CZ3-CD1 3.61Å; W54-L194 HydrophobicContact CZ3-CG 3.69Å
55	E	92.9	Very high	83.7	Confident	105 Å²	105	75.2 Å²	75.2	49%	0.491	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.9	179.8	-62	-173.8	160	0	0	111.7	Y70 Q71	E55-Y70 WeakPolarHBondContact O-CA 3.42Å; E55-Q71 PolarHBondContact N-O 3.48Å; E55-Q71 PolarHBondContact O-N 3.48Å
56	E	90.3	Very high	82.9	Confident	57 Å²	57	78.5 Å²	78.5	27%	0.266	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119.2	176.2	-163.8	179.7	136.3	0	0	111.1	L43 R68 T69 Y70	L43-E56 PolarHBondContact N-OE1 3.18Å; L43-E56 PolarHBondContact N-OE2 3.35Å; E56-R68 WeakPolarHBondContact OE1-CD 3.36Å; E56-R68 WeakPolarHBondContact OE1-CG 3.47Å; E56-R68 IonicContact OE1-CZ 2.75Å; E56-R68 IonicContact OE1-NE 3.84Å; E56-R68 PolarHBondContact OE1-NE 2.9Å; E56-R68 IonicContact OE1-NH1 2.8Å; E56-R68 PolarHBondContact OE1-NH1 3.19Å; E56-R68 VanDerWaalsContact OE1-NH1 3.08Å; E56-T69 CarbonylContact C-O 3.54Å; E56-T69 WeakPolarHBondContact CA-O 3.19Å; E56-Y70 HydrophobicContact CB-CD1 3.99Å; E56-Y70 HydrophobicContact CB-CE1 3.49Å; E56-Y70 VanDerWaalsContact CB-CE1 3.49Å; E56-Y70 HydrophobicContact CG-CD1 4.41Å; E56-Y70 HydrophobicContact CG-CE1 3.87Å; E56-Y70 HydrophobicContact CG-CE2 4.48Å; E56-Y70 PolarHBondContact OE2-OH 2.86Å
57	V	86.8	Confident	82.4	Confident	45 Å²	45	76.5 Å²	76.5	27%	0.273	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.6	-177.2	178.5	0	0	0	0	110.9	I59 T69 Q71	V57-I59 HydrophobicContact CG1-CG1 4.41Å; V57-T69 PolarHBondContact N-O 2.81Å; V57-T69 PolarHBondContact O-N 3.14Å; V57-T69 PolarHBondContact O-OG1 2.7Å; V57-Q71 HydrophobicContact CB-CG 4.41Å; V57-Q71 HydrophobicContact CG2-CG 3.77Å
58	S	84.3	Confident	82	Confident	70 Å²	70	79.6 Å²	79.6	49%	0.49	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	121.4	173.9	-61.6	0	0	0	0	110.8	I67	S58-I67 WeakPolarHBondContact CA-O 3.21Å
59	I	79.1	Confident	81.8	Confident	44 Å²	44	77.4 Å²	77.4	23%	0.226	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	149.9	175.2	-63.7	-178.2	0	0	0	108.5	V57 I67 T69	V57-I59 HydrophobicContact CG1-CG1 4.41Å; I59-I67 HydrophobicContact CB-CG1 4.46Å; I59-I67 PolarHBondContact N-O 2.91Å; I59-I67 VanDerWaalsContact O-CG1 3.23Å; I59-I67 WeakPolarHBondContact O-CG1 3.39Å; I59-I67 PolarHBondContact O-N 2.95Å; I59-T69 HydrophobicContact CB-CG2 4.09Å; I59-T69 HydrophobicContact CD1-CG2 4.07Å; I59-T69 WeakPolarHBondContact CD1-OG1 3.16Å; I59-T69 HydrophobicContact CG1-CG2 4.21Å
60	M	72.8	Confident	81.8	Confident	122 Å²	122	75.1 Å²	75.1	60%	0.601	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	129.7	171.6	-70.2	-65.1	-170.5	0	0	110.2	P66	M60-P66 HydrophobicContact SD-CB 4.13Å
61	D	66.9	Low	82.1	Confident	25 Å²	25	71.8 Å²	71.8	13%	0.134	37%	0.372	C	S	.	.			trans	-76.3	172.8	170.7	85.5	-3.9	0	0	0	112.4	R24 K63 N64 T65 I67	R24-D61 IonicContact NH2-OD2 2.76Å; R24-D61 PolarHBondContact NH2-OD2 2.95Å; D61-K63 PolarHBondContact O-N 2.9Å; D61-K63 WeakPolarHBondContact OD1-CA 3.29Å; D61-K63 WeakPolarHBondContact OD1-CB 3.2Å; D61-K63 PolarHBondContact OD1-N 2.85Å; D61-N64 WeakPolarHBondContact O-CA 3.03Å; D61-N64 PolarHBondContact O-N 2.79Å; D61-N64 PolarHBondContact OD1-N 2.6Å; D61-T65 PolarHBondContact N-O 2.91Å; D61-T65 WeakPolarHBondContact OD1-CB 3.14Å; D61-T65 PolarHBondContact OD1-N 3.13Å; D61-T65 PolarHBondContact OD1-OG1 3.39Å; D61-T65 PolarHBondContact OD2-OG1 2.96Å; D61-I67 HydrophobicContact CB-CD1 4.07Å; D61-I67 HydrophobicContact CB-CG1 4.28Å; D61-I67 HydrophobicContact CB-CG2 4.13Å
62	E	67.1	Low	82.6	Confident	182 Å²	182	63.8 Å²	63.8	85%	0.85	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-16.5	179.9	-63.9	168.3	-169.6	0	0	114.4
63	K	65.4	Low	82.9	Confident	168 Å²	168	64.4 Å²	64.4	73%	0.73	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	9.7	179.5	-61.7	176.9	-177.6	177.9	0	112.3	D61 T65	D61-K63 PolarHBondContact O-N 2.9Å; D61-K63 WeakPolarHBondContact OD1-CA 3.29Å; D61-K63 WeakPolarHBondContact OD1-CB 3.2Å; D61-K63 PolarHBondContact OD1-N 2.85Å; K63-T65 PolarHBondContact O-N 2.83Å
64	N	68.3	Low	83	Confident	131 Å²	131	66.4 Å²	66.4	70%	0.701	34%	0.342	S	S	*	.	S	Bend	trans	59.7	29.4	-171.3	-54.9	-82.7	0	0	0	113.3	D61	D61-N64 WeakPolarHBondContact O-CA 3.03Å; D61-N64 PolarHBondContact O-N 2.79Å; D61-N64 PolarHBondContact OD1-N 2.6Å
65	T	72.9	Confident	82.9	Confident	64 Å²	64	66.3 Å²	66.3	39%	0.393	34%	0.342	S	S	.	.			trans	-83.6	127	170	-33.2	0	0	0	0	108.3	D61 K63 I67	D61-T65 PolarHBondContact N-O 2.91Å; D61-T65 WeakPolarHBondContact OD1-CB 3.14Å; D61-T65 PolarHBondContact OD1-N 3.13Å; D61-T65 PolarHBondContact OD1-OG1 3.39Å; D61-T65 PolarHBondContact OD2-OG1 2.96Å; K63-T65 PolarHBondContact O-N 2.83Å; T65-I67 PolarHBondContact O-N 3.05Å
66	P	75.9	Confident	82.7	Confident	90 Å²	90	67 Å²	67	58%	0.584	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.5	118.5	171.2	27.6	-32.8	0	0	0	109.3	M60	M60-P66 HydrophobicContact SD-CB 4.13Å
67	I	81.1	Confident	82.7	Confident	9 Å²	9	69.1 Å²	69.1	5%	0.046	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	141.5	174.1	55.3	166.4	0	0	0	110	R37 S58 I59 D61 T65 T69 V195	R37-I67 HydrophobicContact CB-CG2 4.27Å; R37-I67 HydrophobicContact CG-CB 4.25Å; R37-I67 HydrophobicContact CG-CD1 4.36Å; R37-I67 HydrophobicContact CG-CG2 3.97Å; S58-I67 WeakPolarHBondContact CA-O 3.21Å; I59-I67 HydrophobicContact CB-CG1 4.46Å; I59-I67 PolarHBondContact N-O 2.91Å; I59-I67 VanDerWaalsContact O-CG1 3.23Å; I59-I67 WeakPolarHBondContact O-CG1 3.39Å; I59-I67 PolarHBondContact O-N 2.95Å; D61-I67 HydrophobicContact CB-CD1 4.07Å; D61-I67 HydrophobicContact CB-CG1 4.28Å; D61-I67 HydrophobicContact CB-CG2 4.13Å; T65-I67 PolarHBondContact O-N 3.05Å; I67-T69 HydrophobicContact CD1-CG2 4.1Å; I67-T69 HydrophobicContact CG1-CG2 4.16Å; I67-V195 HydrophobicContact CD1-CG1 3.84Å
68	R	84.5	Confident	82.5	Confident	78 Å²	78	72.1 Å²	72.1	29%	0.294	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	136.6	170	-64.9	-56.8	-168.1	134.6	-1.9	110	G41 L43 E56	G41-R68 WeakPolarHBondContact O-CG 3.28Å; L43-R68 HydrophobicContact CD1-CB 4.13Å; E56-R68 WeakPolarHBondContact OE1-CD 3.36Å; E56-R68 WeakPolarHBondContact OE1-CG 3.47Å; E56-R68 IonicContact OE1-CZ 2.75Å; E56-R68 IonicContact OE1-NE 3.84Å; E56-R68 PolarHBondContact OE1-NE 2.9Å; E56-R68 IonicContact OE1-NH1 2.8Å; E56-R68 PolarHBondContact OE1-NH1 3.19Å; E56-R68 VanDerWaalsContact OE1-NH1 3.08Å
69	T	88.6	Confident	82.7	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.006	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	157.5	-176.4	64.9	0	0	0	0	109	E56 V57 I59 I67 L194	E56-T69 CarbonylContact C-O 3.54Å; E56-T69 WeakPolarHBondContact CA-O 3.19Å; V57-T69 PolarHBondContact N-O 2.81Å; V57-T69 PolarHBondContact O-N 3.14Å; V57-T69 PolarHBondContact O-OG1 2.7Å; I59-T69 HydrophobicContact CB-CG2 4.09Å; I59-T69 HydrophobicContact CD1-CG2 4.07Å; I59-T69 WeakPolarHBondContact CD1-OG1 3.16Å; I59-T69 HydrophobicContact CG1-CG2 4.21Å; I67-T69 HydrophobicContact CD1-CG2 4.1Å; I67-T69 HydrophobicContact CG1-CG2 4.16Å; T69-L194 WeakPolarHBondContact CA-O 3.26Å; T69-L194 VanDerWaalsContact CB-O 3.28Å; T69-L194 WeakPolarHBondContact CB-O 3.35Å
70	Y	93.7	Very high	83.3	Confident	11 Å²	11	73.2 Å²	73.2	4%	0.043	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	136.5	172.8	-75	-82.1	0	0	0	110.5	L43 W45 E55 E56 L84 A193 L194	L43-Y70 HydrophobicContact CB-CE2 3.84Å; L43-Y70 HydrophobicContact CD2-CD2 4.34Å; L43-Y70 HydrophobicContact CD2-CE2 3.75Å; L43-Y70 HydrophobicContact CG-CE2 4.43Å; W45-Y70 HydrophobicContact CB-CE2 3.95Å; W45-Y70 AromaticContact CD2-CE2 3.96Å; W45-Y70 HydrophobicContact CD2-CE2 3.96Å; W45-Y70 AromaticContact CE3-CD2 3.83Å; W45-Y70 HydrophobicContact CE3-CD2 3.83Å; W45-Y70 AromaticContact CE3-CE2 3.66Å; W45-Y70 HydrophobicContact CE3-CE2 3.66Å; W45-Y70 HydrophobicContact CG-CE2 4.13Å; W45-Y70 HydrophobicContact CZ3-CD2 4.2Å; W45-Y70 HydrophobicContact CZ3-CE2 4.36Å; W45-Y70 PolarHBondContact N-OH 3.42Å; E55-Y70 WeakPolarHBondContact O-CA 3.42Å; E56-Y70 HydrophobicContact CB-CD1 3.99Å; E56-Y70 HydrophobicContact CB-CE1 3.49Å; E56-Y70 VanDerWaalsContact CB-CE1 3.49Å; E56-Y70 HydrophobicContact CG-CD1 4.41Å; E56-Y70 HydrophobicContact CG-CE1 3.87Å; E56-Y70 HydrophobicContact CG-CE2 4.48Å; E56-Y70 PolarHBondContact OE2-OH 2.86Å; Y70-L84 HydrophobicContact CD1-CD1 3.84Å; Y70-L84 HydrophobicContact CD1-CD2 4.12Å; Y70-L84 HydrophobicContact CD2-CD1 4.2Å; Y70-L84 HydrophobicContact CD2-CD2 3.72Å; Y70-L84 HydrophobicContact CE1-CD1 3.89Å; Y70-L84 HydrophobicContact CE2-CD1 4.21Å; Y70-L84 HydrophobicContact CE2-CD2 4.47Å; Y70-L84 HydrophobicContact CG-CD1 4.03Å; Y70-L84 HydrophobicContact CG-CD2 3.52Å; Y70-L84 HydrophobicContact CG-CG 4.43Å; Y70-A193 CarbonylContact O-C 3.59Å; Y70-A193 WeakPolarHBondContact O-CA 3.33Å; Y70-L194 PolarHBondContact N-O 3.29Å; Y70-L194 PolarHBondContact O-N 2.81Å
71	Q	94	Very high	84.3	Confident	74 Å²	74	70.4 Å²	70.4	35%	0.346	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	154.8	179.2	62.6	169.7	37.8	0	0	112.8	W54 E55 V57 I192 A193	W54-Q71 WeakPolarHBondContact CA-O 3.37Å; E55-Q71 PolarHBondContact N-O 3.48Å; E55-Q71 PolarHBondContact O-N 3.48Å; V57-Q71 HydrophobicContact CB-CG 4.41Å; V57-Q71 HydrophobicContact CG2-CG 3.77Å; Q71-I192 VanDerWaalsContact CA-O 3.26Å; Q71-I192 WeakPolarHBondContact CA-O 3.47Å; Q71-A193 HydrophobicContact CB-CB 3.97Å
72	V	95.7	Very high	85.7	Confident	7 Å²	7	69.5 Å²	69.5	4%	0.042	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	143.7	170.4	59.6	0	0	0	0	109.1	G53 W54 N74 D187 C191 I192	G53-V72 WeakPolarHBondContact O-CB 3.26Å; G53-V72 VanDerWaalsContact O-CG2 3.31Å; G53-V72 WeakPolarHBondContact O-CG2 3.21Å; W54-V72 HydrophobicContact CD2-CB 4.19Å; W54-V72 HydrophobicContact CD2-CG1 3.77Å; W54-V72 HydrophobicContact CE3-CB 4.19Å; W54-V72 HydrophobicContact CE3-CG1 3.76Å; W54-V72 HydrophobicContact CG-CG1 4.49Å; W54-V72 HydrophobicContact CH2-CG1 3.9Å; W54-V72 HydrophobicContact CZ2-CG1 3.89Å; W54-V72 HydrophobicContact CZ3-CG1 3.83Å; V72-N74 HydrophobicContact CG2-CB 4.46Å; V72-D187 HydrophobicContact CG1-CB 3.67Å; V72-D187 WeakPolarHBondContact CG2-OD2 3.36Å; V72-C191 WeakPolarHBondContact O-CA 3.37Å; V72-I192 HydrophobicContact CG1-CG2 3.65Å; V72-I192 PolarHBondContact N-O 3.46Å; V72-I192 PolarHBondContact O-N 2.92Å
73	C	94.4	Very high	87.1	Confident	58 Å²	58	61.1 Å²	61.1	39%	0.392	33%	0.328	S	S	.	.			trans	-149.8	42.5	-177.6	-167.8	0	0	0	0	112.4	V75 A190 C191	C73-V75 PolarHBondContact O-N 3.24Å; C73-A190 WeakPolarHBondContact CA-O 3.45Å; C73-C191 HydrophobicContact CB-CB 3.93Å; C73-C191 WeakPolarHBondContact CB-SG 3.34Å; C73-C191 WeakPolarHBondContact SG-CB 3.46Å; C73-C191 CovalentContact SG-SG 2.05Å; C73-C191 PolarHBondContact SG-SG 2.86Å
74	N	93.3	Very high	88.5	Confident	45 Å²	45	53.1 Å²	53.1	24%	0.241	29%	0.293	C	S	.	.			trans	-81.3	40.5	-174.1	-66	1.1	0	0	0	113.1	G52 V72 M76 E77 Q80	G52-N74 PolarHBondContact O-ND2 3.08Å; V72-N74 HydrophobicContact CG2-CB 4.46Å; N74-M76 PolarHBondContact O-N 2.83Å; N74-E77 PolarHBondContact O-N 2.79Å; N74-Q80 HydrophobicContact CB-CG 4.09Å; N74-Q80 PolarHBondContact ND2-OE1 2.81Å
75	V	92.1	Very high	89.8	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.042	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-13.2	-170.6	-66.1	0	0	0	0	115.4	C73 L111 V114 T117 C118 C191	C73-V75 PolarHBondContact O-N 3.24Å; V75-L111 HydrophobicContact CG1-CD1 4.18Å; V75-L111 HydrophobicContact CG2-CD1 4.23Å; V75-V114 HydrophobicContact CB-CB 4.34Å; V75-V114 HydrophobicContact CB-CG1 4.1Å; V75-V114 HydrophobicContact CG2-CB 4.46Å; V75-V114 HydrophobicContact CG2-CG1 3.7Å; V75-T117 VanDerWaalsContact O-CB 3.32Å; V75-T117 WeakPolarHBondContact O-CB 3.13Å; V75-T117 PolarHBondContact O-OG1 2.05Å; V75-C118 HydrophobicContact CB-CB 4.2Å; V75-C118 HydrophobicContact CG1-CB 4.37Å; V75-C191 HydrophobicContact CG1-CB 3.79Å
76	M	89.4	Confident	90.8	Very high	118 Å²	118	44.1 Å²	44.1	58%	0.581	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-19.6	179.5	-67.8	-72.4	177.1	0	0	113.2	N74 P112 V114	N74-M76 PolarHBondContact O-N 2.83Å; M76-P112 WeakPolarHBondContact CE-O 3.5Å; M76-V114 HydrophobicContact CE-CG1 3.66Å; M76-V114 HydrophobicContact CG-CG1 4.47Å; M76-V114 HydrophobicContact SD-CG1 3.78Å
77	E	89.8	Confident	91.6	Very high	102 Å²	102	44 Å²	44	48%	0.477	24%	0.236	S	C	.	.	S	Bend	trans	-80.6	140.7	-172.2	-67.8	-58.5	140.5	0	0	112.1	N74 S79 Q80 T117	N74-E77 PolarHBondContact O-N 2.79Å; E77-S79 PolarHBondContact O-N 2.82Å; E77-Q80 HydrophobicContact CB-CG 3.99Å; E77-T117 WeakPolarHBondContact O-CB 3.42Å; E77-T117 WeakPolarHBondContact O-CG2 3.31Å
78	P	83.3	Confident	92.3	Very high	109 Å²	109	46.8 Å²	46.8	71%	0.708	25%	0.246	S	C	*	.	S	Bend	trans	-70.3	-17.5	-175.1	28.6	-35.3	0	0	0	113.9
79	S	88.3	Confident	92.8	Very high	95 Å²	95	43.4 Å²	43.4	66%	0.664	23%	0.234	S	C	*	.			trans	-155.9	140.4	173.3	57.2	0	0	0	0	110	E77	E77-S79 PolarHBondContact O-N 2.82Å
80	Q	92	Very high	93.1	Very high	41 Å²	41	45.4 Å²	45.4	19%	0.192	25%	0.246	C	C	.	.			trans	-135.6	152.6	177.2	-69.6	-66.8	-82.5	0	0	110.5	N74 E77 N82	N74-Q80 HydrophobicContact CB-CG 4.09Å; N74-Q80 PolarHBondContact ND2-OE1 2.81Å; E77-Q80 HydrophobicContact CB-CG 3.99Å; Q80-N82 PolarHBondContact OE1-ND2 2.83Å
81	N	94.4	Very high	93.1	Very high	64 Å²	64	47.2 Å²	47.2	34%	0.342	25%	0.253	S	S	.	.			trans	-151.6	59.4	178.6	-174.3	42.3	0	0	0	108.9	W83 E139 Q186	N81-W83 PolarHBondContact ND2-NE1 3.19Å; N81-W83 PolarHBondContact O-N 2.9Å; N81-W83 PolarHBondContact OD1-NE1 3.24Å; N81-E139 PolarHBondContact ND2-OE2 2.78Å; N81-Q186 PolarHBondContact OD1-NE2 2.87Å
82	N	95.6	Very high	93.1	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.032	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	106.7	-169.8	-61.8	-41	0	0	0	109.5	W54 Q80 Q186 D187	W54-N82 PolarHBondContact NE1-O 3.06Å; Q80-N82 PolarHBondContact OE1-ND2 2.83Å; N82-Q186 CarbonylContact O-C 3.5Å; N82-Q186 WeakPolarHBondContact O-CA 3.32Å; N82-D187 HydrophobicContact CB-CB 4.07Å; N82-D187 PolarHBondContact N-O 3.06Å; N82-D187 PolarHBondContact ND2-OD2 2.75Å; N82-D187 PolarHBondContact O-N 2.9Å
83	W	96.1	Very high	92.9	Very high	6 Å²	6	50.9 Å²	50.9	2%	0.023	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	141.8	179.4	-69	81.2	0	0	0	111.9	A47 S48 N81 Y125 I137 E139 F142 A184 F185 Q186	A47-W83 CarbonylContact C-O 3.53Å; A47-W83 WeakPolarHBondContact CA-O 3.46Å; S48-W83 PolarHBondContact N-O 2.82Å; S48-W83 PolarHBondContact O-N 3.5Å; N81-W83 PolarHBondContact ND2-NE1 3.19Å; N81-W83 PolarHBondContact O-N 2.9Å; N81-W83 PolarHBondContact OD1-NE1 3.24Å; W83-Y125 HydrophobicContact CH2-CD1 4.01Å; W83-Y125 AromaticContact CH2-CD2 3.84Å; W83-Y125 HydrophobicContact CH2-CD2 3.84Å; W83-Y125 AromaticContact CH2-CE1 3.91Å; W83-Y125 HydrophobicContact CH2-CE1 3.91Å; W83-Y125 AromaticContact CH2-CE2 3.71Å; W83-Y125 HydrophobicContact CH2-CE2 3.71Å; W83-Y125 HydrophobicContact CH2-CG 4Å; W83-Y125 AromaticContact CH2-CZ 3.76Å; W83-Y125 HydrophobicContact CZ2-CE2 4.43Å; W83-Y125 HydrophobicContact CZ3-CD1 4.28Å; W83-Y125 AromaticContact CZ3-CD2 3.69Å; W83-Y125 HydrophobicContact CZ3-CD2 3.69Å; W83-Y125 HydrophobicContact CZ3-CE2 4.01Å; W83-Y125 AromaticContact CZ3-CG 3.85Å; W83-Y125 HydrophobicContact CZ3-CG 3.85Å; W83-I137 HydrophobicContact CB-CD1 3.7Å; W83-I137 HydrophobicContact CB-CG2 4.49Å; W83-I137 HydrophobicContact CD2-CG2 4.46Å; W83-I137 HydrophobicContact CE3-CG2 4.34Å; W83-E139 HydrophobicContact CD2-CG 4.29Å; W83-E139 HydrophobicContact CZ2-CB 4.08Å; W83-E139 HydrophobicContact CZ2-CG 3.95Å; W83-E139 VanDerWaalsContact NE1-CD 3.34Å; W83-E139 PolarHBondContact NE1-OE2 3.03Å; W83-F142 HydrophobicContact CH2-CB 4.32Å; W83-F142 HydrophobicContact CZ3-CB 4.22Å; W83-F142 HydrophobicContact CZ3-CD2 4.32Å; W83-F142 HydrophobicContact CZ3-CG 4.17Å; W83-A184 HydrophobicContact CE3-CB 3.9Å; W83-A184 HydrophobicContact CZ3-CB 4.05Å; W83-F185 CarbonylContact C-O 3.51Å; W83-F185 WeakPolarHBondContact CA-O 3.45Å; W83-Q186 HydrophobicContact CD2-CB 4.08Å; W83-Q186 HydrophobicContact CD2-CG 4.22Å; W83-Q186 HydrophobicContact CE3-CB 4.22Å; W83-Q186 HydrophobicContact CZ2-CB 4.37Å; W83-Q186 HydrophobicContact CZ2-CG 4.17Å; W83-Q186 HydrophobicContact CZ3-CB 4.43Å
84	L	95.9	Very high	92.8	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123.2	169.5	172.6	69.3	0	0	0	108	W45 I46 W54 Y70 A184 F185 L194	W45-L84 HydrophobicContact CB-CD1 3.78Å; W45-L84 HydrophobicContact CE3-CD1 4.28Å; W45-L84 HydrophobicContact CE3-CD2 3.99Å; W45-L84 HydrophobicContact CE3-CG 4.05Å; W45-L84 HydrophobicContact CZ3-CD2 4.39Å; I46-L84 CarbonylContact O-C 3.58Å; I46-L84 WeakPolarHBondContact O-CA 3.48Å; W54-L84 HydrophobicContact CB-CB 4.08Å; W54-L84 HydrophobicContact CB-CD1 4.36Å; W54-L84 HydrophobicContact CB-CD2 4.4Å; W54-L84 HydrophobicContact CD2-CB 4.05Å; W54-L84 HydrophobicContact CD2-CD2 4.02Å; W54-L84 HydrophobicContact CE3-CD2 4.12Å; W54-L84 HydrophobicContact CG-CB 3.65Å; W54-L84 HydrophobicContact CG-CD2 4.2Å; W54-L84 HydrophobicContact CG-CG 4.42Å; Y70-L84 HydrophobicContact CD1-CD1 3.84Å; Y70-L84 HydrophobicContact CD1-CD2 4.12Å; Y70-L84 HydrophobicContact CD2-CD1 4.2Å; Y70-L84 HydrophobicContact CD2-CD2 3.72Å; Y70-L84 HydrophobicContact CE1-CD1 3.89Å; Y70-L84 HydrophobicContact CE2-CD1 4.21Å; Y70-L84 HydrophobicContact CE2-CD2 4.47Å; Y70-L84 HydrophobicContact CG-CD1 4.03Å; Y70-L84 HydrophobicContact CG-CD2 3.52Å; Y70-L84 HydrophobicContact CG-CG 4.43Å; L84-A184 CarbonylContact O-C 3.46Å; L84-A184 WeakPolarHBondContact O-CA 3.46Å; L84-F185 HydrophobicContact CB-CB 4.44Å; L84-F185 HydrophobicContact CD2-CD2 4.25Å; L84-F185 HydrophobicContact CG-CD2 4.38Å; L84-F185 PolarHBondContact N-O 2.91Å; L84-F185 PolarHBondContact O-N 3.2Å; L84-L194 HydrophobicContact CD2-CD1 3.9Å
85	R	95.4	Very high	92.8	Very high	6 Å²	6	50.1 Å²	50.1	2%	0.023	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.6	-177.8	-169.3	-147.2	73.5	-169.9	2.2	111.3	W45 I46 E134 I137 F142 Y182 L183 A184	W45-R85 WeakPolarHBondContact CA-O 3.49Å; W45-R85 VanDerWaalsContact CB-O 3.31Å; W45-R85 WeakPolarHBondContact CB-O 3.34Å; I46-R85 PolarHBondContact N-O 2.73Å; I46-R85 PolarHBondContact O-N 3.37Å; R85-E134 PolarHBondContact NH1-O 2.78Å; R85-E134 PolarHBondContact NH2-O 2.93Å; R85-E134 VanDerWaalsContact NH2-O 3.14Å; R85-I137 HydrophobicContact CB-CD1 3.74Å; R85-I137 HydrophobicContact CB-CG1 3.86Å; R85-F142 HydrophobicContact CG-CE1 4.29Å; R85-F142 HydrophobicContact CG-CZ 3.88Å; R85-Y182 HydrophobicContact CG-CD1 4.49Å; R85-L183 WeakPolarHBondContact CA-O 3.47Å; R85-L183 VanDerWaalsContact CG-O 3.26Å; R85-L183 WeakPolarHBondContact CG-O 3.4Å; R85-A184 HydrophobicContact CB-CB 4.23Å; R85-A184 HydrophobicContact CG-CB 4.2Å
86	T	94.3	Very high	92.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.272	C	S	.	.			trans	-61.3	170.2	173.4	67.9	0	0	0	0	112.2	L34 W45 Y182 L183 F185	L34-T86 HydrophobicContact CD2-CG2 4.4Å; W45-T86 HydrophobicContact CD2-CG2 4.02Å; W45-T86 HydrophobicContact CE3-CG2 4.2Å; W45-T86 HydrophobicContact CH2-CG2 4.03Å; W45-T86 HydrophobicContact CZ2-CG2 3.8Å; W45-T86 HydrophobicContact CZ3-CG2 4.21Å; T86-Y182 WeakPolarHBondContact O-CD1 3.21Å; T86-L183 HydrophobicContact CG2-CB 3.85Å; T86-L183 PolarHBondContact N-O 2.86Å; T86-L183 PolarHBondContact OG1-N 2.86Å; T86-L183 PolarHBondContact OG1-O 2.86Å; T86-F185 HydrophobicContact CG2-CE2 4.13Å
87	D	92.9	Very high	93.1	Very high	86 Å²	86	45.5 Å²	45.5	46%	0.46	25%	0.245	S	C	.	.			trans	-66.6	174.6	155.8	-82.3	-32.9	0	0	0	112.2
88	W	94.6	Very high	93.4	Very high	68 Å²	68	41.7 Å²	41.7	26%	0.258	23%	0.226	S	C	.	.			trans	-72.9	126.1	-179.9	-176.6	87.1	0	0	0	111	S129 N131 D132 K179 Y182	W88-S129 PolarHBondContact NE1-O 2.94Å; W88-N131 VanDerWaalsContact CD1-O 3.24Å; W88-D132 HydrophobicContact CB-CB 4.33Å; W88-D132 HydrophobicContact CD2-CB 3.9Å; W88-D132 HydrophobicContact CE3-CB 4.02Å; W88-D132 HydrophobicContact CG-CB 4.07Å; W88-K179 HydrophobicContact CH2-CB 4.24Å; W88-K179 HydrophobicContact CZ2-CB 3.77Å; W88-Y182 VanDerWaalsContact CA-CE1 3.5Å; W88-Y182 HydrophobicContact CB-CD1 4.25Å; W88-Y182 HydrophobicContact CB-CE1 3.56Å; W88-Y182 AromaticContact CD1-CE2 3.84Å; W88-Y182 AromaticContact CD1-CZ 3.84Å; W88-Y182 HydrophobicContact CG-CE1 4.41Å; W88-Y182 VanDerWaalsContact N-CE1 3.32Å
89	I	95.2	Very high	94	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.041	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.9	-179.1	-50.2	179.3	0	0	0	107.9	L33 L34 G180 F181 L183 V199	L33-I89 HydrophobicContact CB-CG2 3.68Å; L33-I89 HydrophobicContact CD1-CG2 4.38Å; L34-I89 HydrophobicContact CB-CD1 4.3Å; L34-I89 HydrophobicContact CD2-CD1 3.63Å; L34-I89 HydrophobicContact CD2-CG1 4.19Å; I89-G180 CarbonylContact O-C 3.55Å; I89-G180 WeakPolarHBondContact O-CA 3.43Å; I89-F181 HydrophobicContact CB-CD1 4.46Å; I89-F181 HydrophobicContact CB-CE1 4.06Å; I89-F181 HydrophobicContact CB-CE2 4.12Å; I89-F181 HydrophobicContact CB-CZ 3.86Å; I89-F181 HydrophobicContact CD1-CE2 3.9Å; I89-F181 HydrophobicContact CD1-CZ 4.23Å; I89-F181 HydrophobicContact CG2-CE1 3.94Å; I89-F181 HydrophobicContact CG2-CE2 4.35Å; I89-F181 HydrophobicContact CG2-CZ 3.68Å; I89-F181 PolarHBondContact N-O 2.96Å; I89-F181 PolarHBondContact O-N 2.79Å; I89-L183 HydrophobicContact CD1-CD1 4.23Å; I89-L183 HydrophobicContact CD1-CG 4.16Å; I89-V199 HydrophobicContact CD1-CB 4.37Å; I89-V199 HydrophobicContact CD1-CG1 4.37Å; I89-V199 HydrophobicContact CD1-CG2 3.94Å
90	T	95.8	Very high	94.4	Very high	43 Å²	43	33 Å²	33	26%	0.264	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	138.2	167.6	176.1	0	0	0	0	109.7	E92	T90-E92 WeakPolarHBondContact CB-OE1 3.47Å; T90-E92 HydrophobicContact CG2-CG 4.2Å; T90-E92 WeakPolarHBondContact CG2-OE1 3.31Å; T90-E92 PolarHBondContact OG1-N 2.85Å; T90-E92 VanDerWaalsContact OG1-N 3.13Å; T90-E92 PolarHBondContact OG1-OE1 2.95Å
91	R	93.5	Very high	94.5	Very high	48 Å²	48	31.1 Å²	31.1	18%	0.181	16%	0.157	C	C	.	.			trans	-87.8	-6.7	171.5	78.4	173.8	178.9	77.6	3.8	113.4	G93 A94 L176 S177 K178 K179 F181	R91-G93 PolarHBondContact O-N 3.49Å; R91-A94 VanDerWaalsContact CD-O 3.31Å; R91-A94 WeakPolarHBondContact CD-O 3.44Å; R91-A94 PolarHBondContact NH1-O 2.77Å; R91-A94 WeakPolarHBondContact O-CB 3.44Å; R91-A94 PolarHBondContact O-N 2.83Å; R91-L176 HydrophobicContact CB-CD1 4.25Å; R91-S177 PolarHBondContact NE-O 2.84Å; R91-S177 PolarHBondContact NH2-O 3.07Å; R91-K178 WeakPolarHBondContact CD-O 3.48Å; R91-K178 PolarHBondContact NE-O 3.26Å; R91-K179 PolarHBondContact N-O 2.72Å; R91-K179 VanDerWaalsContact N-O 3.14Å; R91-F181 HydrophobicContact CB-CD1 4.39Å; R91-F181 HydrophobicContact CB-CE1 4.24Å
92	E	93.4	Very high	94.4	Very high	119 Å²	119	29.7 Å²	29.7	56%	0.556	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	-124	-168.5	-62.9	-56	119.7	0	0	111.3	L33 T90 Y201	L33-E92 HydrophobicContact CD2-CG 4.09Å; T90-E92 WeakPolarHBondContact CB-OE1 3.47Å; T90-E92 HydrophobicContact CG2-CG 4.2Å; T90-E92 WeakPolarHBondContact CG2-OE1 3.31Å; T90-E92 PolarHBondContact OG1-N 2.85Å; T90-E92 VanDerWaalsContact OG1-N 3.13Å; T90-E92 PolarHBondContact OG1-OE1 2.95Å; E92-Y201 HydrophobicContact CB-CE1 4.4Å
93	G	90.5	Very high	94.2	Very high	39 Å²	39	29.4 Å²	29.4	40%	0.402	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-2.3	172.8	0	0	0	0	0	115.1	R91	R91-G93 PolarHBondContact O-N 3.49Å
94	A	93.4	Very high	93.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.147	C	C	.	.			trans	-66.3	141.1	-172.4	0	0	0	0	0	112.7	R91 V97 Y201	R91-A94 VanDerWaalsContact CD-O 3.31Å; R91-A94 WeakPolarHBondContact CD-O 3.44Å; R91-A94 PolarHBondContact NH1-O 2.77Å; R91-A94 WeakPolarHBondContact O-CB 3.44Å; R91-A94 PolarHBondContact O-N 2.83Å; A94-V97 HydrophobicContact CB-CG2 3.81Å; A94-Y201 VanDerWaalsContact CB-CB 3.48Å; A94-Y201 HydrophobicContact CB-CD1 3.88Å; A94-Y201 HydrophobicContact CB-CD2 4.03Å; A94-Y201 HydrophobicContact CB-CG 3.55Å
95	Q	92	Very high	93.7	Very high	88 Å²	88	29.5 Å²	29.5	41%	0.411	15%	0.147	S	C	.	.	S	Bend	trans	-105.6	-39.5	168.4	-64.8	177.7	46.6	0	0	111	G174 P175 L176	Q95-G174 WeakPolarHBondContact O-CA 3.35Å; Q95-P175 CarbonylContact O-C 3.44Å; Q95-P175 WeakPolarHBondContact O-CA 3.15Å; Q95-L176 PolarHBondContact O-N 2.94Å
96	R	93.2	Very high	93.4	Very high	28 Å²	28	31.9 Å²	31.9	11%	0.106	16%	0.156	C	C	.	.	S	Bend	trans	-106.6	129.6	172.9	-176.1	62.6	53.9	176.9	-6.6	109	Y98 D172 V173 G174 A221 D222	R96-Y98 HydrophobicContact CG-CE2 4.17Å; R96-D172 WeakPolarHBondContact CD-OD2 3.2Å; R96-D172 IonicContact CZ-OD2 3.5Å; R96-D172 IonicContact NE-OD2 2.65Å; R96-D172 IonicContact NH1-OD2 3.47Å; R96-D172 PolarHBondContact NH1-OD2 3.45Å; R96-V173 WeakPolarHBondContact CA-O 3.24Å; R96-G174 VanDerWaalsContact NH2-C 3.27Å; R96-G174 PolarHBondContact NH2-O 3.22Å; R96-A221 VanDerWaalsContact CZ-O 3.22Å; R96-A221 PolarHBondContact NE-O 3.42Å; R96-A221 PolarHBondContact NH2-O 2.91Å; R96-D222 IonicContact NH2-OD1 3.93Å
97	V	95.5	Very high	93	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139	179.9	176.7	0	0	0	0	109.8	L33 A94 D172 V173 L176 F181 V199	L33-V97 HydrophobicContact CD1-CG1 4Å; L33-V97 HydrophobicContact CD1-CG2 4.05Å; A94-V97 HydrophobicContact CB-CG2 3.81Å; V97-D172 CarbonylContact O-C 3.6Å; V97-D172 WeakPolarHBondContact O-CA 3.19Å; V97-D172 WeakPolarHBondContact O-CB 3.45Å; V97-V173 HydrophobicContact CB-CG2 4.3Å; V97-V173 PolarHBondContact N-O 3.13Å; V97-V173 PolarHBondContact O-N 2.69Å; V97-L176 HydrophobicContact CB-CD1 4.13Å; V97-L176 HydrophobicContact CG2-CD1 3.59Å; V97-F181 HydrophobicContact CG1-CZ 3.92Å; V97-F181 HydrophobicContact CG2-CE1 4.45Å; V97-V199 HydrophobicContact CG1-CG1 3.43Å; V97-V199 VanDerWaalsContact CG1-CG1 3.43Å
98	Y	95.6	Very high	92.7	Very high	22 Å²	22	29.9 Å²	29.9	9%	0.086	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	145	179.3	-60.4	-86.7	0	0	0	110.7	R96 R171 D172 V199 F200 K202 A249	R96-Y98 HydrophobicContact CG-CE2 4.17Å; Y98-R171 CarbonylContact C-O 3.6Å; Y98-R171 WeakPolarHBondContact CA-O 3.32Å; Y98-D172 HydrophobicContact CD1-CB 3.64Å; Y98-D172 HydrophobicContact CE1-CB 3.73Å; Y98-D172 HydrophobicContact CG-CB 4.37Å; Y98-V199 CarbonylContact O-C 3.59Å; Y98-V199 WeakPolarHBondContact O-CA 3.15Å; Y98-F200 HydrophobicContact CD2-CD2 4.5Å; Y98-F200 HydrophobicContact CD2-CE2 4.21Å; Y98-F200 HydrophobicContact CG-CE2 4.16Å; Y98-F200 HydrophobicContact CG-CZ 4.21Å; Y98-F200 PolarHBondContact N-O 2.89Å; Y98-F200 PolarHBondContact O-N 2.78Å; Y98-K202 HydrophobicContact CD2-CD 4.08Å; Y98-K202 HydrophobicContact CD2-CG 3.85Å; Y98-K202 HydrophobicContact CE2-CB 4.18Å; Y98-K202 HydrophobicContact CE2-CD 3.54Å; Y98-K202 HydrophobicContact CE2-CG 3.59Å; Y98-A249 PolarHBondContact OH-O 2.88Å
99	I	97	Very high	92.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	102.7	-174.6	-53.7	164.7	0	0	0	106.7	I101 L124 I145 I170 R171 V173 L183 V197 V199	I99-I101 HydrophobicContact CG2-CD1 4.31Å; I99-I101 HydrophobicContact CG2-CG1 4.03Å; I99-L124 HydrophobicContact CD1-CD2 4.48Å; I99-L124 HydrophobicContact CG2-CD2 4.42Å; I99-I145 HydrophobicContact CD1-CD1 3.57Å; I99-I170 WeakPolarHBondContact O-CA 3.46Å; I99-R171 PolarHBondContact N-O 2.85Å; I99-R171 PolarHBondContact O-N 3.43Å; I99-V173 HydrophobicContact CD1-CG1 4.34Å; I99-V173 HydrophobicContact CD1-CG2 4.2Å; I99-L183 HydrophobicContact CD1-CD1 3.98Å; I99-L183 HydrophobicContact CD1-CD2 3.6Å; I99-L183 HydrophobicContact CD1-CG 4.47Å; I99-L183 HydrophobicContact CG1-CD1 4.01Å; I99-L183 HydrophobicContact CG1-CD2 4.43Å; I99-L183 HydrophobicContact CG2-CD1 3.77Å; I99-V197 HydrophobicContact CG2-CG1 4.3Å; I99-V199 HydrophobicContact CG1-CG1 4.38Å
100	E	95.7	Very high	91.8	Very high	22 Å²	22	32.5 Å²	32.5	10%	0.103	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	117.9	174.1	176.1	-174.1	6.6	0	0	109.2	K102 T168 E169 I170 V197 R198 F200	E100-K102 WeakPolarHBondContact OE2-CE 3.5Å; E100-K102 IonicContact OE2-NZ 3.26Å; E100-K102 PolarHBondContact OE2-NZ 2.91Å; E100-T168 HydrophobicContact CG-CG2 4.25Å; E100-E169 CarbonylContact C-O 3.58Å; E100-E169 WeakPolarHBondContact CA-O 3.44Å; E100-I170 HydrophobicContact CB-CG1 4.15Å; E100-I170 HydrophobicContact CG-CG1 4.21Å; E100-V197 CarbonylContact O-C 3.55Å; E100-V197 WeakPolarHBondContact O-CA 3.48Å; E100-R198 HydrophobicContact CB-CB 4.33Å; E100-R198 PolarHBondContact N-O 3.26Å; E100-R198 PolarHBondContact O-N 3.26Å; E100-R198 IonicContact OE1-CZ 3.54Å; E100-R198 VanDerWaalsContact OE1-CZ 3.28Å; E100-R198 IonicContact OE1-NE 3.7Å; E100-R198 PolarHBondContact OE1-NE 3.41Å; E100-R198 IonicContact OE1-NH2 2.69Å; E100-R198 PolarHBondContact OE1-NH2 2.85Å; E100-F200 HydrophobicContact CB-CE1 4.15Å
101	I	94.8	Very high	91.2	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.8	178.9	-52.7	166.1	0	0	0	107.8	I99 F103 F122 L124 T168 E169 F185 L194 S196	I99-I101 HydrophobicContact CG2-CD1 4.31Å; I99-I101 HydrophobicContact CG2-CG1 4.03Å; I101-F103 HydrophobicContact CG2-CD1 4.06Å; I101-F122 HydrophobicContact CD1-CE2 4.45Å; I101-F122 HydrophobicContact CG2-CZ 4.28Å; I101-L124 HydrophobicContact CD1-CD1 3.88Å; I101-L124 HydrophobicContact CD1-CD2 3.79Å; I101-L124 HydrophobicContact CD1-CG 4.35Å; I101-T168 CarbonylContact O-C 3.56Å; I101-T168 WeakPolarHBondContact O-CA 3.4Å; I101-E169 PolarHBondContact N-O 2.89Å; I101-E169 PolarHBondContact O-N 3Å; I101-F185 HydrophobicContact CD1-CE1 3.87Å; I101-F185 HydrophobicContact CG1-CE1 4.27Å; I101-L194 HydrophobicContact CG2-CD2 3.74Å; I101-S196 CarbonylContact C-O 3.52Å; I101-S196 WeakPolarHBondContact CA-O 3.32Å
102	K	91.4	Very high	90.7	Very high	34 Å²	34	34.5 Å²	34.5	15%	0.148	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.8	168.7	-52.5	-166.3	-171	-72.7	0	109.7	E100 L166 N167 T168 V195 S196	E100-K102 WeakPolarHBondContact OE2-CE 3.5Å; E100-K102 IonicContact OE2-NZ 3.26Å; E100-K102 PolarHBondContact OE2-NZ 2.91Å; K102-L166 HydrophobicContact CB-CD1 3.98Å; K102-L166 HydrophobicContact CB-CD2 4.44Å; K102-L166 HydrophobicContact CB-CG 4.25Å; K102-L166 HydrophobicContact CD-CD2 4.21Å; K102-N167 VanDerWaalsContact CA-O 3.22Å; K102-N167 WeakPolarHBondContact CA-O 3.43Å; K102-T168 WeakPolarHBondContact CD-OG1 3.46Å; K102-T168 HydrophobicContact CG-CG2 4.25Å; K102-T168 WeakPolarHBondContact CG-OG1 3.42Å; K102-T168 PolarHBondContact NZ-OG1 2.88Å; K102-V195 WeakPolarHBondContact O-CA 3.31Å; K102-V195 PolarHBondContact O-N 3.36Å; K102-S196 PolarHBondContact N-O 3.41Å; K102-S196 PolarHBondContact O-N 3.45Å
103	F	92.5	Very high	90	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	157.6	-171.8	67.6	-80.1	0	0	0	111.8	I101 L105 F122 I148 A149 A150 N167 E169 I192 A193 L194	I101-F103 HydrophobicContact CG2-CD1 4.06Å; F103-L105 HydrophobicContact CD2-CB 4.16Å; F103-L105 HydrophobicContact CE2-CB 4.01Å; F103-L105 HydrophobicContact CE2-CD1 4.35Å; F103-F122 HydrophobicContact CD1-CE1 4.24Å; F103-F122 HydrophobicContact CD1-CZ 4.27Å; F103-F122 AromaticContact CD2-CE1 3.97Å; F103-F122 HydrophobicContact CD2-CE1 3.97Å; F103-F122 HydrophobicContact CE1-CE1 4.12Å; F103-F122 HydrophobicContact CE1-CZ 4.34Å; F103-F122 AromaticContact CE2-CE1 3.83Å; F103-F122 HydrophobicContact CE2-CE1 3.83Å; F103-F122 HydrophobicContact CG-CE1 4.18Å; F103-F122 HydrophobicContact CG-CZ 4.46Å; F103-F122 AromaticContact CZ-CE1 3.91Å; F103-F122 HydrophobicContact CZ-CE1 3.91Å; F103-I148 HydrophobicContact CE1-CG2 3.92Å; F103-I148 HydrophobicContact CZ-CG2 3.97Å; F103-A149 WeakPolarHBondContact CZ-O 3.07Å; F103-A150 HydrophobicContact CE2-CB 4.09Å; F103-A150 HydrophobicContact CZ-CB 4.37Å; F103-N167 HydrophobicContact CD1-CB 4.06Å; F103-N167 HydrophobicContact CD2-CB 4.4Å; F103-N167 HydrophobicContact CE1-CB 3.66Å; F103-N167 HydrophobicContact CE2-CB 4.04Å; F103-N167 HydrophobicContact CG-CB 4.4Å; F103-N167 HydrophobicContact CZ-CB 3.65Å; F103-N167 PolarHBondContact N-O 2.83Å; F103-N167 VanDerWaalsContact N-O 3.16Å; F103-N167 WeakPolarHBondContact O-CB 3.23Å; F103-N167 PolarHBondContact O-N 3.42Å; F103-E169 HydrophobicContact CE1-CB 4.18Å; F103-E169 HydrophobicContact CE1-CG 3.89Å; F103-E169 HydrophobicContact CZ-CG 4.38Å; F103-I192 HydrophobicContact CB-CD1 4.27Å; F103-I192 HydrophobicContact CB-CG1 4.38Å; F103-I192 HydrophobicContact CD2-CD1 3.73Å; F103-I192 HydrophobicContact CD2-CG1 4.16Å; F103-I192 HydrophobicContact CE2-CD1 4.42Å; F103-I192 HydrophobicContact CG-CD1 4.19Å; F103-A193 CarbonylContact C-O 3.55Å; F103-A193 WeakPolarHBondContact CA-O 3.48Å; F103-A193 VanDerWaalsContact CB-O 3.29Å; F103-A193 WeakPolarHBondContact CB-O 3.07Å; F103-L194 HydrophobicContact CB-CD2 4.1Å
104	T	89.7	Confident	89.8	Confident	7 Å²	7	30.6 Å²	30.6	4%	0.043	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	143.7	167.2	68.9	0	0	0	0	108.6	M164 K165 L166 I192 A193 V195	T104-M164 HydrophobicContact CG2-CE 4.37Å; T104-K165 WeakPolarHBondContact CG2-O 3.15Å; T104-L166 HydrophobicContact CG2-CD1 4.23Å; T104-I192 WeakPolarHBondContact O-CA 3.22Å; T104-A193 PolarHBondContact N-O 3.37Å; T104-A193 PolarHBondContact O-N 3.02Å; T104-V195 HydrophobicContact CG2-CG2 4.15Å
105	L	91.6	Very high	88.8	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	132.1	178	-173.7	143.3	0	0	0	109.7	F103 E120 A150 S153 F154	F103-L105 HydrophobicContact CD2-CB 4.16Å; F103-L105 HydrophobicContact CE2-CB 4.01Å; F103-L105 HydrophobicContact CE2-CD1 4.35Å; L105-E120 WeakPolarHBondContact CD1-O 3.28Å; L105-E120 HydrophobicContact CD2-CB 3.9Å; L105-E120 HydrophobicContact CD2-CG 4.28Å; L105-A150 HydrophobicContact CB-CB 4.04Å; L105-A150 HydrophobicContact CD2-CB 4.3Å; L105-S153 WeakPolarHBondContact O-CA 3.26Å; L105-F154 VanDerWaalsContact C-CE1 3.44Å; L105-F154 WeakPolarHBondContact O-CD1 3.32Å; L105-F154 WeakPolarHBondContact O-CE1 3.27Å; L105-F154 PolarHBondContact O-N 2.95Å
106	R	88.4	Confident	88.1	Confident	55 Å²	55	37.6 Å²	37.6	21%	0.208	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-91.6	134.8	-177.3	-174.9	172.1	174.5	172.3	-3.9	111	C108 S110 L111 F154 C191	R106-C108 PolarHBondContact O-N 2.76Å; R106-S110 VanDerWaalsContact CG-OG 3.25Å; R106-S110 WeakPolarHBondContact CG-OG 3.37Å; R106-S110 PolarHBondContact NE-OG 3.15Å; R106-S110 PolarHBondContact NH2-O 2.99Å; R106-L111 HydrophobicContact CG-CD1 4.31Å; R106-F154 HydrophobicContact CB-CD2 4.42Å; R106-F154 HydrophobicContact CB-CE1 3.99Å; R106-F154 HydrophobicContact CB-CE2 3.86Å; R106-F154 HydrophobicContact CB-CZ 3.62Å; R106-F154 HydrophobicContact CG-CD2 4.28Å; R106-F154 HydrophobicContact CG-CE2 3.88Å; R106-F154 HydrophobicContact CG-CZ 4.17Å; R106-C191 HydrophobicContact CB-CB 4.09Å; R106-C191 PolarHBondContact N-O 2.92Å
107	D	85.7	Confident	87.8	Confident	23 Å²	23	38 Å²	38	12%	0.123	24%	0.236	C	C	.	.			trans	-57.3	126.1	174.3	164.1	26.6	0	0	0	111	N109 S110 E120 F154 T155	D107-N109 PolarHBondContact O-N 2.76Å; D107-N109 VanDerWaalsContact OD1-CB 3.26Å; D107-N109 WeakPolarHBondContact OD1-CB 3.43Å; D107-N109 PolarHBondContact OD1-N 2.91Å; D107-N109 PolarHBondContact OD1-ND2 2.67Å; D107-S110 WeakPolarHBondContact O-CB 3.41Å; D107-S110 PolarHBondContact O-N 3.09Å; D107-S110 PolarHBondContact O-OG 2.94Å; D107-S110 PolarHBondContact OD2-N 2.91Å; D107-E120 WeakPolarHBondContact CA-OE1 3.19Å; D107-F154 PolarHBondContact N-O 3.08Å; D107-T155 HydrophobicContact CB-CG2 4.32Å
108	C	87.8	Confident	87.6	Confident	21 Å²	21	38.6 Å²	38.6	14%	0.142	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-62.6	-27.1	178.1	-76.3	0	0	0	0	112.7	R106 S110 L111 V114 C118 K119 E120	R106-C108 PolarHBondContact O-N 2.76Å; C108-S110 VanDerWaalsContact C-N 3.26Å; C108-S110 PolarHBondContact O-N 2.7Å; C108-L111 PolarHBondContact O-N 3.03Å; C108-V114 WeakPolarHBondContact O-CG2 3.06Å; C108-C118 VanDerWaalsContact CA-SG 3.56Å; C108-C118 HydrophobicContact CB-CB 3.81Å; C108-C118 WeakPolarHBondContact CB-SG 3.23Å; C108-C118 VanDerWaalsContact SG-C 3.57Å; C108-C118 WeakPolarHBondContact SG-CB 3.43Å; C108-C118 CovalentContact SG-SG 2.04Å; C108-C118 PolarHBondContact SG-SG 3.48Å; C108-K119 PolarHBondContact SG-N 2.94Å; C108-E120 HydrophobicContact CB-CG 4.15Å; C108-E120 PolarHBondContact N-OE1 2.81Å; C108-E120 WeakPolarHBondContact SG-CG 3.26Å
109	N	85.3	Confident	87.4	Confident	121 Å²	121	41.2 Å²	41.2	65%	0.647	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-73.2	-20.1	175.5	-53	-83.8	0	0	0	112.1	D107 L111	D107-N109 PolarHBondContact O-N 2.76Å; D107-N109 VanDerWaalsContact OD1-CB 3.26Å; D107-N109 WeakPolarHBondContact OD1-CB 3.43Å; D107-N109 PolarHBondContact OD1-N 2.91Å; D107-N109 PolarHBondContact OD1-ND2 2.67Å; N109-L111 PolarHBondContact O-N 3.24Å
110	S	84.6	Confident	87.1	Confident	10 Å²	10	44.7 Å²	44.7	7%	0.07	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-80.2	4.4	174.2	82.5	0	0	0	0	114	R106 D107 C108	R106-S110 VanDerWaalsContact CG-OG 3.25Å; R106-S110 WeakPolarHBondContact CG-OG 3.37Å; R106-S110 PolarHBondContact NE-OG 3.15Å; R106-S110 PolarHBondContact NH2-O 2.99Å; D107-S110 WeakPolarHBondContact O-CB 3.41Å; D107-S110 PolarHBondContact O-N 3.09Å; D107-S110 PolarHBondContact O-OG 2.94Å; D107-S110 PolarHBondContact OD2-N 2.91Å; C108-S110 VanDerWaalsContact C-N 3.26Å; C108-S110 PolarHBondContact O-N 2.7Å
111	L	84.4	Confident	87	Confident	22 Å²	22	45.7 Å²	45.7	12%	0.115	28%	0.275	C	S	.	.	S	Bend	trans	-120.8	119	-175.9	-73.7	159.8	0	0	0	109.7	V75 R106 C108 N109 G113 V114 C191	V75-L111 HydrophobicContact CG1-CD1 4.18Å; V75-L111 HydrophobicContact CG2-CD1 4.23Å; R106-L111 HydrophobicContact CG-CD1 4.31Å; C108-L111 PolarHBondContact O-N 3.03Å; N109-L111 PolarHBondContact O-N 3.24Å; L111-G113 PolarHBondContact O-N 2.75Å; L111-V114 HydrophobicContact CB-CG1 4.11Å; L111-V114 HydrophobicContact CB-CG2 3.59Å; L111-C191 HydrophobicContact CD1-CB 4.24Å
112	P	81.4	Confident	87	Confident	111 Å²	111	45.6 Å²	45.6	72%	0.721	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	127	-175.4	28.5	-34	0	0	0	111.5	M76	M76-P112 WeakPolarHBondContact CE-O 3.5Å
113	G	79.7	Confident	87.3	Confident	75 Å²	75	44.9 Å²	44.9	77%	0.773	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	3.5	168.7	0	0	0	0	0	116.9	L111	L111-G113 PolarHBondContact O-N 2.75Å
114	V	86.4	Confident	87.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.006	27%	0.272	C	S	.	.			trans	-96.4	13.9	-170.8	-52.7	0	0	0	0	115.2	V75 M76 C108 L111 G116 T117 C118	V75-V114 HydrophobicContact CB-CB 4.34Å; V75-V114 HydrophobicContact CB-CG1 4.1Å; V75-V114 HydrophobicContact CG2-CB 4.46Å; V75-V114 HydrophobicContact CG2-CG1 3.7Å; M76-V114 HydrophobicContact CE-CG1 3.66Å; M76-V114 HydrophobicContact CG-CG1 4.47Å; M76-V114 HydrophobicContact SD-CG1 3.78Å; C108-V114 WeakPolarHBondContact O-CG2 3.06Å; L111-V114 HydrophobicContact CB-CG1 4.11Å; L111-V114 HydrophobicContact CB-CG2 3.59Å; V114-G116 PolarHBondContact O-N 2.97Å; V114-T117 PolarHBondContact O-N 3.01Å; V114-T117 PolarHBondContact O-OG1 3.49Å; V114-T117 VanDerWaalsContact O-OG1 3.09Å; V114-C118 HydrophobicContact CB-CB 3.81Å; V114-C118 HydrophobicContact CG2-CB 3.46Å; V114-C118 VanDerWaalsContact CG2-CB 3.46Å; V114-C118 WeakPolarHBondContact O-CB 3.36Å; V114-C118 PolarHBondContact O-N 3.47Å
115	M	72.4	Confident	87.9	Confident	168 Å²	168	46.1 Å²	46.1	83%	0.828	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	117.4	-174.4	-63.1	-167.7	94.3	0	0	111.4
116	G	76.9	Confident	88.1	Confident	67 Å²	67	48.1 Å²	48.1	69%	0.691	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.7	-41	-178.6	0	0	0	0	0	113	V114 K119	V114-G116 PolarHBondContact O-N 2.97Å; G116-K119 PolarHBondContact O-NZ 2.94Å
117	T	87.6	Confident	88.4	Confident	38 Å²	38	47.6 Å²	47.6	23%	0.233	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-50.9	176.1	52	0	0	0	0	111.4	V75 E77 V114 K119	V75-T117 VanDerWaalsContact O-CB 3.32Å; V75-T117 WeakPolarHBondContact O-CB 3.13Å; V75-T117 PolarHBondContact O-OG1 2.05Å; E77-T117 WeakPolarHBondContact O-CB 3.42Å; E77-T117 WeakPolarHBondContact O-CG2 3.31Å; V114-T117 PolarHBondContact O-N 3.01Å; V114-T117 PolarHBondContact O-OG1 3.49Å; V114-T117 VanDerWaalsContact O-OG1 3.09Å; T117-K119 PolarHBondContact O-NZ 2.92Å
118	C	91.3	Very high	88.9	Confident	12 Å²	12	48.1 Å²	48.1	8%	0.081	28%	0.284	C	S	.	.			trans	-57.8	148	-177	-169.7	0	0	0	0	113.6	V75 C108 V114 G189	V75-C118 HydrophobicContact CB-CB 4.2Å; V75-C118 HydrophobicContact CG1-CB 4.37Å; C108-C118 VanDerWaalsContact CA-SG 3.56Å; C108-C118 HydrophobicContact CB-CB 3.81Å; C108-C118 WeakPolarHBondContact CB-SG 3.23Å; C108-C118 VanDerWaalsContact SG-C 3.57Å; C108-C118 WeakPolarHBondContact SG-CB 3.43Å; C108-C118 CovalentContact SG-SG 2.04Å; C108-C118 PolarHBondContact SG-SG 3.48Å; V114-C118 HydrophobicContact CB-CB 3.81Å; V114-C118 HydrophobicContact CG2-CB 3.46Å; V114-C118 VanDerWaalsContact CG2-CB 3.46Å; V114-C118 WeakPolarHBondContact O-CB 3.36Å; V114-C118 PolarHBondContact O-N 3.47Å; C118-G189 CarbonylContact C-O 3.43Å; C118-G189 VanDerWaalsContact CA-O 3.31Å; C118-G189 WeakPolarHBondContact CA-O 3.36Å
119	K	91.3	Very high	89.2	Confident	76 Å²	76	47.5 Å²	47.5	33%	0.33	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-134.7	149.8	178.5	-56.3	-70.6	162.2	-88.3	0	110.3	C108 G116 T117 V188 G189 A190	C108-K119 PolarHBondContact SG-N 2.94Å; G116-K119 PolarHBondContact O-NZ 2.94Å; T117-K119 PolarHBondContact O-NZ 2.92Å; K119-V188 HydrophobicContact CG-CG2 4.34Å; K119-G189 PolarHBondContact N-O 2.64Å; K119-A190 HydrophobicContact CB-CB 4.47Å; K119-A190 WeakPolarHBondContact O-CA 3.01Å; K119-A190 VanDerWaalsContact O-CB 3.28Å; K119-A190 WeakPolarHBondContact O-CB 3.48Å
120	E	90.8	Very high	89.6	Confident	73 Å²	73	45.3 Å²	45.3	34%	0.341	27%	0.268	S	S	.	.	S	Bend	trans	-110.2	24.1	178.3	-57.6	-173.1	133.6	0	0	111.7	L105 D107 C108	L105-E120 WeakPolarHBondContact CD1-O 3.28Å; L105-E120 HydrophobicContact CD2-CB 3.9Å; L105-E120 HydrophobicContact CD2-CG 4.28Å; D107-E120 WeakPolarHBondContact CA-OE1 3.19Å; C108-E120 HydrophobicContact CB-CG 4.15Å; C108-E120 PolarHBondContact N-OE1 2.81Å; C108-E120 WeakPolarHBondContact SG-CG 3.26Å
121	T	92.9	Very high	90	Very high	43 Å²	43	48.3 Å²	48.3	26%	0.264	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	154.8	-176.4	56.9	0	0	0	0	112.1	T147 I148 A149	T121-T147 HydrophobicContact CG2-CG2 4.23Å; T121-I148 WeakPolarHBondContact CA-O 3.35Å; T121-I148 WeakPolarHBondContact CB-O 3.36Å; T121-A149 HydrophobicContact CG2-CB 3.83Å
122	F	96	Very high	90.3	Very high	0 Å²	0	51 Å²	51	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	160.7	170.2	66.8	-79.4	0	0	0	109.8	I101 F103 I148 F185 I192 L194	I101-F122 HydrophobicContact CD1-CE2 4.45Å; I101-F122 HydrophobicContact CG2-CZ 4.28Å; F103-F122 HydrophobicContact CD1-CE1 4.24Å; F103-F122 HydrophobicContact CD1-CZ 4.27Å; F103-F122 AromaticContact CD2-CE1 3.97Å; F103-F122 HydrophobicContact CD2-CE1 3.97Å; F103-F122 HydrophobicContact CE1-CE1 4.12Å; F103-F122 HydrophobicContact CE1-CZ 4.34Å; F103-F122 AromaticContact CE2-CE1 3.83Å; F103-F122 HydrophobicContact CE2-CE1 3.83Å; F103-F122 HydrophobicContact CG-CE1 4.18Å; F103-F122 HydrophobicContact CG-CZ 4.46Å; F103-F122 AromaticContact CZ-CE1 3.91Å; F103-F122 HydrophobicContact CZ-CE1 3.91Å; F122-I148 HydrophobicContact CD1-CB 3.98Å; F122-I148 HydrophobicContact CD1-CG2 4.36Å; F122-I148 HydrophobicContact CD2-CB 4.31Å; F122-I148 HydrophobicContact CD2-CG1 4.42Å; F122-I148 HydrophobicContact CE1-CB 3.54Å; F122-I148 HydrophobicContact CE1-CG1 4.42Å; F122-I148 HydrophobicContact CE1-CG2 3.49Å; F122-I148 VanDerWaalsContact CE1-CG2 3.49Å; F122-I148 HydrophobicContact CE2-CB 3.88Å; F122-I148 HydrophobicContact CE2-CG1 3.86Å; F122-I148 HydrophobicContact CE2-CG2 4.31Å; F122-I148 HydrophobicContact CG-CB 4.36Å; F122-I148 HydrophobicContact CZ-CB 3.5Å; F122-I148 VanDerWaalsContact CZ-CB 3.5Å; F122-I148 HydrophobicContact CZ-CG1 3.88Å; F122-I148 HydrophobicContact CZ-CG2 3.47Å; F122-I148 VanDerWaalsContact CZ-CG2 3.47Å; F122-I148 PolarHBondContact N-O 3.22Å; F122-I148 PolarHBondContact O-N 3.43Å; F122-F185 HydrophobicContact CD2-CD1 4.44Å; F122-F185 HydrophobicContact CE2-CD1 4Å; F122-I192 HydrophobicContact CB-CD1 4.45Å; F122-I192 HydrophobicContact CD1-CD1 3.18Å; F122-I192 HydrophobicContact CD2-CD1 4.43Å; F122-I192 HydrophobicContact CE1-CD1 3.29Å; F122-I192 HydrophobicContact CG-CD1 3.8Å; F122-I192 HydrophobicContact CZ-CD1 3.99Å; F122-L194 HydrophobicContact CE2-CD2 4.21Å; F122-L194 HydrophobicContact CZ-CD2 4.14Å
123	N	96.8	Very high	90.8	Very high	18 Å²	18	53 Å²	53	10%	0.096	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.7	-178.6	-61.1	-47.4	0	0	0	110.9	Y125 K144 F185 Q186	N123-Y125 HydrophobicContact CB-CD2 4.18Å; N123-Y125 HydrophobicContact CB-CE2 3.45Å; N123-Y125 VanDerWaalsContact CB-CE2 3.45Å; N123-K144 WeakPolarHBondContact OD1-CE 3.28Å; N123-K144 PolarHBondContact OD1-NZ 2.82Å; N123-F185 WeakPolarHBondContact O-CA 3.48Å; N123-Q186 HydrophobicContact CB-CB 4.21Å; N123-Q186 PolarHBondContact N-O 2.69Å; N123-Q186 PolarHBondContact ND2-OE1 2.86Å; N123-Q186 PolarHBondContact O-N 2.8Å
124	L	97.6	Very high	91.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	136	174.9	-179.5	66.3	0	0	0	110.1	I99 I101 I145 D146 I148 R171 F185	I99-L124 HydrophobicContact CD1-CD2 4.48Å; I99-L124 HydrophobicContact CG2-CD2 4.42Å; I101-L124 HydrophobicContact CD1-CD1 3.88Å; I101-L124 HydrophobicContact CD1-CD2 3.79Å; I101-L124 HydrophobicContact CD1-CG 4.35Å; L124-I145 HydrophobicContact CB-CB 4.36Å; L124-I145 HydrophobicContact CD1-CD1 4.49Å; L124-I145 HydrophobicContact CD2-CB 4.09Å; L124-I145 HydrophobicContact CD2-CD1 3.89Å; L124-I145 HydrophobicContact CD2-CG2 4.06Å; L124-I145 HydrophobicContact CG-CB 4.06Å; L124-I145 HydrophobicContact CG-CD1 3.72Å; L124-I145 HydrophobicContact CG-CG1 4.35Å; L124-I145 PolarHBondContact O-N 2.95Å; L124-D146 PolarHBondContact N-O 3.47Å; L124-D146 PolarHBondContact O-N 3.04Å; L124-I148 HydrophobicContact CB-CD1 4.21Å; L124-I148 HydrophobicContact CB-CG1 3.93Å; L124-I148 HydrophobicContact CD2-CD1 4.27Å; L124-R171 HydrophobicContact CD2-CB 4.17Å; L124-R171 HydrophobicContact CD2-CG 4.29Å; L124-F185 HydrophobicContact CD1-CD1 3.8Å; L124-F185 HydrophobicContact CD1-CE1 3.48Å; L124-F185 VanDerWaalsContact CD1-CE1 3.48Å; L124-F185 HydrophobicContact CD1-CZ 4.17Å
125	Y	96.3	Very high	90.9	Very high	33 Å²	33	60.2 Å²	60.2	13%	0.129	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	159.6	-177.3	-69.1	-98.2	0	0	0	112.5	W83 N123 F142 V143 K144 L183 A184 Q186	W83-Y125 HydrophobicContact CH2-CD1 4.01Å; W83-Y125 AromaticContact CH2-CD2 3.84Å; W83-Y125 HydrophobicContact CH2-CD2 3.84Å; W83-Y125 AromaticContact CH2-CE1 3.91Å; W83-Y125 HydrophobicContact CH2-CE1 3.91Å; W83-Y125 AromaticContact CH2-CE2 3.71Å; W83-Y125 HydrophobicContact CH2-CE2 3.71Å; W83-Y125 HydrophobicContact CH2-CG 4Å; W83-Y125 AromaticContact CH2-CZ 3.76Å; W83-Y125 HydrophobicContact CZ2-CE2 4.43Å; W83-Y125 HydrophobicContact CZ3-CD1 4.28Å; W83-Y125 AromaticContact CZ3-CD2 3.69Å; W83-Y125 HydrophobicContact CZ3-CD2 3.69Å; W83-Y125 HydrophobicContact CZ3-CE2 4.01Å; W83-Y125 AromaticContact CZ3-CG 3.85Å; W83-Y125 HydrophobicContact CZ3-CG 3.85Å; N123-Y125 HydrophobicContact CB-CD2 4.18Å; N123-Y125 HydrophobicContact CB-CE2 3.45Å; N123-Y125 VanDerWaalsContact CB-CE2 3.45Å; Y125-F142 HydrophobicContact CD1-CB 3.83Å; Y125-F142 HydrophobicContact CG-CB 4.24Å; Y125-V143 WeakPolarHBondContact CA-O 3.46Å; Y125-K144 VanDerWaalsContact CD1-CA 3.41Å; Y125-K144 HydrophobicContact CD1-CB 3.82Å; Y125-K144 HydrophobicContact CD1-CG 4.43Å; Y125-K144 HydrophobicContact CE1-CB 3.54Å; Y125-K144 HydrophobicContact CE1-CG 4.1Å; Y125-L183 WeakPolarHBondContact O-CA 3.34Å; Y125-A184 PolarHBondContact N-O 3.17Å; Y125-A184 PolarHBondContact O-N 2.72Å; Y125-Q186 HydrophobicContact CD2-CB 4.22Å; Y125-Q186 HydrophobicContact CE2-CB 3.74Å; Y125-Q186 HydrophobicContact CE2-CG 4.49Å; Y125-Q186 VanDerWaalsContact CE2-OE1 3.31Å; Y125-Q186 PolarHBondContact OH-OE1 2.85Å
126	Y	96.9	Very high	91.4	Very high	44 Å²	44	59.2 Å²	59.2	17%	0.173	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	160.3	166.3	78.2	-61.2	0	0	0	112.6	E128 V143 I145 V173 L176 Y182	Y126-E128 HydrophobicContact CD2-CG 4.49Å; Y126-E128 HydrophobicContact CE2-CG 4.23Å; Y126-V143 HydrophobicContact CD1-CB 4.14Å; Y126-V143 HydrophobicContact CE1-CB 3.81Å; Y126-V143 HydrophobicContact CE1-CG1 3.9Å; Y126-V143 PolarHBondContact N-O 2.74Å; Y126-V143 PolarHBondContact O-N 2.79Å; Y126-I145 HydrophobicContact CD1-CD1 3.98Å; Y126-I145 HydrophobicContact CD1-CG1 3.54Å; Y126-I145 HydrophobicContact CE1-CG1 4.22Å; Y126-I145 HydrophobicContact CG-CD1 4.26Å; Y126-I145 HydrophobicContact CG-CG1 4.32Å; Y126-V173 HydrophobicContact CD1-CG1 3.88Å; Y126-V173 HydrophobicContact CD2-CB 4.41Å; Y126-V173 HydrophobicContact CD2-CG1 4.4Å; Y126-V173 HydrophobicContact CD2-CG2 4.48Å; Y126-V173 HydrophobicContact CE1-CB 4.5Å; Y126-V173 HydrophobicContact CE1-CG1 3.91Å; Y126-V173 HydrophobicContact CE2-CB 4.26Å; Y126-V173 HydrophobicContact CE2-CG1 4.45Å; Y126-V173 HydrophobicContact CG-CG1 4.12Å; Y126-L176 HydrophobicContact CD2-CD2 4.16Å; Y126-L176 HydrophobicContact CE2-CD2 3.71Å; Y126-Y182 CarbonylContact C-O 3.55Å; Y126-Y182 VanDerWaalsContact CA-O 3.24Å; Y126-Y182 WeakPolarHBondContact CA-O 3.45Å
127	Y	94.6	Very high	91.7	Very high	44 Å²	44	57.2 Å²	57.2	17%	0.173	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	122.3	170.5	168.9	-124.2	0	0	0	109.9	Q141 F181 Y182	Y127-Q141 HydrophobicContact CD1-CB 4.5Å; Y127-Q141 HydrophobicContact CD2-CB 3.98Å; Y127-Q141 WeakPolarHBondContact CD2-O 3.42Å; Y127-Q141 HydrophobicContact CE2-CB 4.04Å; Y127-Q141 HydrophobicContact CG-CB 4.25Å; Y127-Q141 VanDerWaalsContact CZ-NE2 3.26Å; Y127-Q141 PolarHBondContact OH-NE2 2.79Å; Y127-F181 CarbonylContact O-C 3.43Å; Y127-F181 WeakPolarHBondContact O-CA 3.34Å; Y127-F181 WeakPolarHBondContact O-CB 3.26Å; Y127-Y182 HydrophobicContact CD1-CD2 4.24Å; Y127-Y182 PolarHBondContact N-O 3.43Å; Y127-Y182 PolarHBondContact O-N 2.82Å
128	E	95.6	Very high	91.4	Very high	34 Å²	34	61.7 Å²	61.7	16%	0.159	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	128.9	174.4	-69.7	-160.6	-102.9	0	0	112	Y126 L176 S177 K178	Y126-E128 HydrophobicContact CD2-CG 4.49Å; Y126-E128 HydrophobicContact CE2-CG 4.23Å; E128-L176 HydrophobicContact CG-CD2 3.92Å; E128-S177 PolarHBondContact OE1-OG 2.79Å; E128-S177 PolarHBondContact OE2-N 2.72Å; E128-S177 PolarHBondContact OE2-OG 2.96Å; E128-K178 HydrophobicContact CB-CB 4.1Å; E128-K178 HydrophobicContact CB-CD 3.73Å; E128-K178 HydrophobicContact CB-CG 4.12Å; E128-K178 VanDerWaalsContact O-CD 3.29Å; E128-K178 WeakPolarHBondContact O-CD 3.27Å; E128-K178 PolarHBondContact OE2-N 2.86Å
129	S	94.3	Very high	90.9	Very high	7 Å²	7	65.4 Å²	65.4	5%	0.049	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	143.6	176.1	-165.8	0	0	0	0	112.9	W88 N131 E134 G180	W88-S129 PolarHBondContact NE1-O 2.94Å; S129-N131 VanDerWaalsContact C-N 3.3Å; S129-N131 PolarHBondContact OG-N 2.88Å; S129-E134 WeakPolarHBondContact CB-OE1 3.35Å; S129-E134 PolarHBondContact OG-OE1 2.78Å; S129-G180 PolarHBondContact N-O 2.66Å; S129-G180 CarbonylContact O-C 3.47Å; S129-G180 PolarHBondContact O-N 2.87Å
130	D	94.1	Very high	90.6	Very high	75 Å²	75	68.9 Å²	68.9	40%	0.401	32%	0.316	S	S	.	.	S	Bend	trans	-88.6	-1.2	170.7	-58.4	-70	0	0	0	112.5	K178 K179	D130-K178 WeakPolarHBondContact OD1-CA 3.47Å; D130-K178 WeakPolarHBondContact OD1-CB 3.16Å; D130-K178 WeakPolarHBondContact OD2-CD 3.33Å; D130-K178 WeakPolarHBondContact OD2-CG 3.39Å; D130-K178 IonicContact OD2-NZ 2.64Å; D130-K178 PolarHBondContact OD2-NZ 3Å; D130-K179 PolarHBondContact OD1-N 2.92Å
131	N	93.5	Very high	90.5	Very high	73 Å²	73	68.2 Å²	68.2	39%	0.39	31%	0.313	S	S	.	.			trans	-102.1	125.8	175.4	179.3	17.9	0	0	0	109.5	W88 S129 K133 E134 Y182	W88-N131 VanDerWaalsContact CD1-O 3.24Å; S129-N131 VanDerWaalsContact C-N 3.3Å; S129-N131 PolarHBondContact OG-N 2.88Å; N131-K133 PolarHBondContact OD1-N 2.96Å; N131-E134 HydrophobicContact CB-CG 4.23Å; N131-E134 WeakPolarHBondContact ND2-CG 3.33Å; N131-Y182 PolarHBondContact O-OH 2.79Å
132	D	90.9	Very high	90.5	Very high	79 Å²	79	67.1 Å²	67.1	42%	0.422	30%	0.304	S	S	.	.	S	Bend	trans	-85	-16.1	-179.9	61.9	-29.7	0	0	0	113.3	W88 Y182	W88-D132 HydrophobicContact CB-CB 4.33Å; W88-D132 HydrophobicContact CD2-CB 3.9Å; W88-D132 HydrophobicContact CE3-CB 4.02Å; W88-D132 HydrophobicContact CG-CB 4.07Å; D132-Y182 PolarHBondContact O-OH 2.89Å
133	K	90.6	Very high	90.4	Very high	152 Å²	152	71.1 Å²	71.1	66%	0.661	33%	0.328	S	S	*	.			trans	-116.2	37.1	-166.2	-66.2	170.4	-170.1	85.5	0	114.1	N131 R135	N131-K133 PolarHBondContact OD1-N 2.96Å; K133-R135 PolarHBondContact O-N 2.7Å
134	E	87.6	Confident	90.4	Very high	24 Å²	24	74.3 Å²	74.3	11%	0.112	34%	0.341	C	S	.	.			trans	-70.8	114	174.4	-64.5	-166.7	-145.7	0	0	111.3	R85 S129 N131 Y182	R85-E134 PolarHBondContact NH1-O 2.78Å; R85-E134 PolarHBondContact NH2-O 2.93Å; R85-E134 VanDerWaalsContact NH2-O 3.14Å; S129-E134 WeakPolarHBondContact CB-OE1 3.35Å; S129-E134 PolarHBondContact OG-OE1 2.78Å; N131-E134 HydrophobicContact CB-CG 4.23Å; N131-E134 WeakPolarHBondContact ND2-CG 3.33Å; E134-Y182 HydrophobicContact CB-CE2 3.93Å; E134-Y182 WeakPolarHBondContact CB-OH 3.19Å; E134-Y182 HydrophobicContact CG-CE2 4.03Å; E134-Y182 PolarHBondContact N-OH 2.95Å
135	R	81.3	Confident	90.2	Very high	204 Å²	204	76 Å²	76	77%	0.77	35%	0.35	S	S	*	.			trans	-82.8	-14.1	-170.5	-167.3	172.5	-175.1	-178.2	2.3	115.2	K133	K133-R135 PolarHBondContact O-N 2.7Å
136	F	83.3	Confident	90.2	Very high	147 Å²	147	77.2 Å²	77.2	65%	0.645	36%	0.359	S	S	*	.	S	Bend	trans	-136.1	153.2	-174.4	-59.5	-73.8	0	0	0	110.9
137	I	83.3	Confident	90.1	Very high	26 Å²	26	77.9 Å²	77.9	13%	0.133	37%	0.368	C	S	.	.			trans	-75.3	137.7	169.9	-54.2	-175.7	0	0	0	108.6	I46 W83 R85 E139 F142	I46-I137 HydrophobicContact CG2-CD1 4.46Å; I46-I137 HydrophobicContact CG2-CG1 4.16Å; W83-I137 HydrophobicContact CB-CD1 3.7Å; W83-I137 HydrophobicContact CB-CG2 4.49Å; W83-I137 HydrophobicContact CD2-CG2 4.46Å; W83-I137 HydrophobicContact CE3-CG2 4.34Å; R85-I137 HydrophobicContact CB-CD1 3.74Å; R85-I137 HydrophobicContact CB-CG1 3.86Å; I137-E139 HydrophobicContact CG2-CG 4.42Å; I137-F142 HydrophobicContact CG2-CD2 4.38Å; I137-F142 HydrophobicContact CG2-CE2 3.78Å; I137-F142 HydrophobicContact CG2-CZ 4.5Å
138	R	80.8	Confident	90.1	Very high	131 Å²	131	75.8 Å²	75.8	49%	0.494	36%	0.36	S	S	.	.			trans	-124.2	88	175.1	-67.8	178.4	176.5	170.4	1.8	109.2	N140 Q141 F142	R138-N140 PolarHBondContact O-N 2.82Å; R138-Q141 HydrophobicContact CB-CB 4.44Å; R138-Q141 HydrophobicContact CB-CG 4.16Å; R138-Q141 PolarHBondContact O-N 3.4Å; R138-F142 VanDerWaalsContact O-CD2 3.28Å; R138-F142 WeakPolarHBondContact O-CD2 3.21Å
139	E	80.4	Confident	89.8	Confident	91 Å²	91	76.4 Å²	76.4	43%	0.425	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-51.2	-31.8	-171.1	-61.4	178.5	-120.4	0	0	113.4	N81 W83 I137 Q141	N81-E139 PolarHBondContact ND2-OE2 2.78Å; W83-E139 HydrophobicContact CD2-CG 4.29Å; W83-E139 HydrophobicContact CZ2-CB 4.08Å; W83-E139 HydrophobicContact CZ2-CG 3.95Å; W83-E139 VanDerWaalsContact NE1-CD 3.34Å; W83-E139 PolarHBondContact NE1-OE2 3.03Å; I137-E139 HydrophobicContact CG2-CG 4.42Å; E139-Q141 VanDerWaalsContact C-N 3.32Å; E139-Q141 PolarHBondContact O-N 3.23Å
140	N	84.6	Confident	89.4	Confident	148 Å²	148	77.3 Å²	77.3	79%	0.791	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-76.5	-6.3	179.2	73.4	-35.5	0	0	0	115.9	R138	R138-N140 PolarHBondContact O-N 2.82Å
141	Q	88.6	Confident	88.4	Confident	59 Å²	59	80.8 Å²	80.8	28%	0.276	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-102	-11.8	177.7	-62.1	-157.4	-111.8	0	0	113.5	Y127 R138 E139	Y127-Q141 HydrophobicContact CD1-CB 4.5Å; Y127-Q141 HydrophobicContact CD2-CB 3.98Å; Y127-Q141 WeakPolarHBondContact CD2-O 3.42Å; Y127-Q141 HydrophobicContact CE2-CB 4.04Å; Y127-Q141 HydrophobicContact CG-CB 4.25Å; Y127-Q141 VanDerWaalsContact CZ-NE2 3.26Å; Y127-Q141 PolarHBondContact OH-NE2 2.79Å; R138-Q141 HydrophobicContact CB-CB 4.44Å; R138-Q141 HydrophobicContact CB-CG 4.16Å; R138-Q141 PolarHBondContact O-N 3.4Å; E139-Q141 VanDerWaalsContact C-N 3.32Å; E139-Q141 PolarHBondContact O-N 3.23Å
142	F	93.2	Very high	87.3	Confident	21 Å²	21	82.7 Å²	82.7	9%	0.092	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-82.7	132.9	-178.2	-76.9	-84.7	0	0	0	112.1	W83 R85 Y125 I137 R138 A184	W83-F142 HydrophobicContact CH2-CB 4.32Å; W83-F142 HydrophobicContact CZ3-CB 4.22Å; W83-F142 HydrophobicContact CZ3-CD2 4.32Å; W83-F142 HydrophobicContact CZ3-CG 4.17Å; R85-F142 HydrophobicContact CG-CE1 4.29Å; R85-F142 HydrophobicContact CG-CZ 3.88Å; Y125-F142 HydrophobicContact CD1-CB 3.83Å; Y125-F142 HydrophobicContact CG-CB 4.24Å; I137-F142 HydrophobicContact CG2-CD2 4.38Å; I137-F142 HydrophobicContact CG2-CE2 3.78Å; I137-F142 HydrophobicContact CG2-CZ 4.5Å; R138-F142 VanDerWaalsContact O-CD2 3.28Å; R138-F142 WeakPolarHBondContact O-CD2 3.21Å; F142-A184 HydrophobicContact CD1-CB 3.95Å; F142-A184 HydrophobicContact CE1-CB 3.7Å; F142-A184 HydrophobicContact CZ-CB 4.21Å
143	V	94.2	Very high	86.4	Confident	83 Å²	83	80.7 Å²	80.7	50%	0.503	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	128.1	171.8	-178.9	0	0	0	0	108.1	Y125 Y126 I145	Y125-V143 WeakPolarHBondContact CA-O 3.46Å; Y126-V143 HydrophobicContact CD1-CB 4.14Å; Y126-V143 HydrophobicContact CE1-CB 3.81Å; Y126-V143 HydrophobicContact CE1-CG1 3.9Å; Y126-V143 PolarHBondContact N-O 2.74Å; Y126-V143 PolarHBondContact O-N 2.79Å; V143-I145 PolarHBondContact O-N 2.8Å
144	K	96	Very high	85.3	Confident	85 Å²	85	75 Å²	75	37%	0.37	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	131.6	176.4	-172.3	169.3	169.4	174.9	0	109.7	N123 Y125 D146 T147	N123-K144 WeakPolarHBondContact OD1-CE 3.28Å; N123-K144 PolarHBondContact OD1-NZ 2.82Å; Y125-K144 VanDerWaalsContact CD1-CA 3.41Å; Y125-K144 HydrophobicContact CD1-CB 3.82Å; Y125-K144 HydrophobicContact CD1-CG 4.43Å; Y125-K144 HydrophobicContact CE1-CB 3.54Å; Y125-K144 HydrophobicContact CE1-CG 4.1Å; K144-D146 WeakPolarHBondContact CE-O 3.37Å; K144-T147 WeakPolarHBondContact CE-OG1 3.2Å; K144-T147 PolarHBondContact NZ-OG1 3.01Å
145	I	95.1	Very high	84.4	Confident	37 Å²	37	75.8 Å²	75.8	19%	0.19	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	-61.1	171.8	-58.9	170.4	0	0	0	108.3	I99 L124 Y126 V143 R171 V173 L183	I99-I145 HydrophobicContact CD1-CD1 3.57Å; L124-I145 HydrophobicContact CB-CB 4.36Å; L124-I145 HydrophobicContact CD1-CD1 4.49Å; L124-I145 HydrophobicContact CD2-CB 4.09Å; L124-I145 HydrophobicContact CD2-CD1 3.89Å; L124-I145 HydrophobicContact CD2-CG2 4.06Å; L124-I145 HydrophobicContact CG-CB 4.06Å; L124-I145 HydrophobicContact CG-CD1 3.72Å; L124-I145 HydrophobicContact CG-CG1 4.35Å; L124-I145 PolarHBondContact O-N 2.95Å; Y126-I145 HydrophobicContact CD1-CD1 3.98Å; Y126-I145 HydrophobicContact CD1-CG1 3.54Å; Y126-I145 HydrophobicContact CE1-CG1 4.22Å; Y126-I145 HydrophobicContact CG-CD1 4.26Å; Y126-I145 HydrophobicContact CG-CG1 4.32Å; V143-I145 PolarHBondContact O-N 2.8Å; I145-R171 HydrophobicContact CG2-CB 3.94Å; I145-R171 HydrophobicContact CG2-CG 4.4Å; I145-V173 HydrophobicContact CD1-CG1 3.56Å; I145-V173 HydrophobicContact CG1-CG1 3.61Å; I145-V173 HydrophobicContact CG2-CG1 4.15Å; I145-L183 HydrophobicContact CD1-CD2 4.2Å
146	D	95.2	Very high	83.3	Confident	58 Å²	58	72.9 Å²	72.9	31%	0.31	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	171.2	-178.6	-162	12.9	0	0	0	112.5	L124 K144 I148 R171	L124-D146 PolarHBondContact N-O 3.47Å; L124-D146 PolarHBondContact O-N 3.04Å; K144-D146 WeakPolarHBondContact CE-O 3.37Å; D146-I148 HydrophobicContact CB-CD1 4.1Å; D146-R171 HydrophobicContact CB-CG 4.42Å; D146-R171 IonicContact OD2-CZ 3.58Å; D146-R171 VanDerWaalsContact OD2-CZ 3.26Å; D146-R171 IonicContact OD2-NE 3.34Å; D146-R171 PolarHBondContact OD2-NE 2.04Å; D146-R171 IonicContact OD2-NH2 2.73Å; D146-R171 PolarHBondContact OD2-NH2 3.05Å
147	T	94.4	Very high	82.2	Confident	58 Å²	58	70.8 Å²	70.8	36%	0.356	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	114.5	162.1	-38.8	0	0	0	0	107.9	T121 K144	T121-T147 HydrophobicContact CG2-CG2 4.23Å; K144-T147 WeakPolarHBondContact CE-OG1 3.2Å; K144-T147 PolarHBondContact NZ-OG1 3.01Å
148	I	94.4	Very high	81	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	131	-179.9	-47.9	-58.4	0	0	0	109.2	F103 T121 F122 L124 D146 E169 R171	F103-I148 HydrophobicContact CE1-CG2 3.92Å; F103-I148 HydrophobicContact CZ-CG2 3.97Å; T121-I148 WeakPolarHBondContact CA-O 3.35Å; T121-I148 WeakPolarHBondContact CB-O 3.36Å; F122-I148 HydrophobicContact CD1-CB 3.98Å; F122-I148 HydrophobicContact CD1-CG2 4.36Å; F122-I148 HydrophobicContact CD2-CB 4.31Å; F122-I148 HydrophobicContact CD2-CG1 4.42Å; F122-I148 HydrophobicContact CE1-CB 3.54Å; F122-I148 HydrophobicContact CE1-CG1 4.42Å; F122-I148 HydrophobicContact CE1-CG2 3.49Å; F122-I148 VanDerWaalsContact CE1-CG2 3.49Å; F122-I148 HydrophobicContact CE2-CB 3.88Å; F122-I148 HydrophobicContact CE2-CG1 3.86Å; F122-I148 HydrophobicContact CE2-CG2 4.31Å; F122-I148 HydrophobicContact CG-CB 4.36Å; F122-I148 HydrophobicContact CZ-CB 3.5Å; F122-I148 VanDerWaalsContact CZ-CB 3.5Å; F122-I148 HydrophobicContact CZ-CG1 3.88Å; F122-I148 HydrophobicContact CZ-CG2 3.47Å; F122-I148 VanDerWaalsContact CZ-CG2 3.47Å; F122-I148 PolarHBondContact N-O 3.22Å; F122-I148 PolarHBondContact O-N 3.43Å; L124-I148 HydrophobicContact CB-CD1 4.21Å; L124-I148 HydrophobicContact CB-CG1 3.93Å; L124-I148 HydrophobicContact CD2-CD1 4.27Å; D146-I148 HydrophobicContact CB-CD1 4.1Å; I148-E169 HydrophobicContact CG2-CB 3.99Å; I148-E169 HydrophobicContact CG2-CG 3.81Å; I148-R171 HydrophobicContact CD1-CG 3.92Å
149	A	90.1	Very high	80	Confident	46 Å²	46	68.4 Å²	68.4	38%	0.38	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	163.3	174.7	0	0	0	0	0	109.9	F103 T121	F103-A149 WeakPolarHBondContact CZ-O 3.07Å; T121-A149 HydrophobicContact CG2-CB 3.83Å
150	A	84.8	Confident	78.8	Confident	27 Å²	27	67 Å²	67	22%	0.223	38%	0.378	C	S	.	.			trans	-88.9	137.9	171.7	0	0	0	0	0	111.3	F103 L105 N167	F103-A150 HydrophobicContact CE2-CB 4.09Å; F103-A150 HydrophobicContact CZ-CB 4.37Å; L105-A150 HydrophobicContact CB-CB 4.04Å; L105-A150 HydrophobicContact CD2-CB 4.3Å; A150-N167 WeakPolarHBondContact CA-OD1 3.05Å; A150-N167 WeakPolarHBondContact CB-OD1 3.33Å
151	D	74.6	Confident	77.4	Confident	147 Å²	147	65.4 Å²	65.4	79%	0.786	37%	0.37	S	S	*	.	S	Bend	trans	-70	-37.8	165.1	-86.3	-18.8	0	0	0	110.4	N167	D151-N167 PolarHBondContact N-OD1 2.82Å
152	E	70.6	Confident	76.2	Confident	113 Å²	113	73.4 Å²	73.4	53%	0.528	40%	0.397	S	S	.	.	S	Bend	trans	-132.7	119	172.4	-65	-165.7	-134.4	0	0	111.8	K165 N167	E152-K165 HydrophobicContact CB-CD 3.79Å; E152-K165 WeakPolarHBondContact OE2-CD 3.38Å; E152-K165 WeakPolarHBondContact OE2-CE 3.25Å; E152-K165 IonicContact OE2-NZ 3.78Å; E152-K165 PolarHBondContact OE2-NZ 3.46Å; E152-N167 PolarHBondContact N-OD1 2.96Å; E152-N167 PolarHBondContact O-ND2 2.85Å; E152-N167 PolarHBondContact O-OD1 2.91Å
153	S	71.2	Confident	74.6	Confident	38 Å²	38	76.7 Å²	76.7	27%	0.266	42%	0.415	S	S	.	.			trans	-85.2	153.3	165.2	57.3	0	0	0	0	111.1	L105	L105-S153 WeakPolarHBondContact O-CA 3.26Å
154	F	67.5	Low	73.2	Confident	31 Å²	31	78.8 Å²	78.8	14%	0.136	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-101.8	142.4	175.8	69.3	-93.3	0	0	0	112.1	L105 R106 D107 D158 I159 K165	L105-F154 VanDerWaalsContact C-CE1 3.44Å; L105-F154 WeakPolarHBondContact O-CD1 3.32Å; L105-F154 WeakPolarHBondContact O-CE1 3.27Å; L105-F154 PolarHBondContact O-N 2.95Å; R106-F154 HydrophobicContact CB-CD2 4.42Å; R106-F154 HydrophobicContact CB-CE1 3.99Å; R106-F154 HydrophobicContact CB-CE2 3.86Å; R106-F154 HydrophobicContact CB-CZ 3.62Å; R106-F154 HydrophobicContact CG-CD2 4.28Å; R106-F154 HydrophobicContact CG-CE2 3.88Å; R106-F154 HydrophobicContact CG-CZ 4.17Å; D107-F154 PolarHBondContact N-O 3.08Å; F154-D158 HydrophobicContact CB-CB 4.18Å; F154-I159 HydrophobicContact CD2-CD1 4.09Å; F154-I159 HydrophobicContact CD2-CG1 3.88Å; F154-I159 HydrophobicContact CE2-CD1 3.93Å; F154-I159 HydrophobicContact CE2-CG1 4.01Å; F154-K165 HydrophobicContact CB-CB 4.33Å; F154-K165 HydrophobicContact CB-CD 4.48Å; F154-K165 HydrophobicContact CB-CG 4.2Å
155	T	68.4	Low	72.3	Confident	42 Å²	42	77.1 Å²	77.1	26%	0.258	41%	0.414	S	S	.	.			trans	-107.8	-179.9	-174.5	76.7	0	0	0	0	111.9	D107 V157 D158 I159	D107-T155 HydrophobicContact CB-CG2 4.32Å; T155-V157 PolarHBondContact O-N 3.27Å; T155-V157 PolarHBondContact OG1-N 3.01Å; T155-D158 WeakPolarHBondContact CA-OD2 3.48Å; T155-D158 VanDerWaalsContact CB-OD2 3.31Å; T155-D158 WeakPolarHBondContact CB-OD2 3.29Å; T155-D158 PolarHBondContact N-OD2 2.85Å; T155-D158 PolarHBondContact O-N 3.16Å; T155-D158 PolarHBondContact OG1-OD2 3.39Å; T155-I159 WeakPolarHBondContact O-CG1 3.48Å; T155-I159 PolarHBondContact O-N 2.95Å
156	Q	58.4	Low	71.7	Confident	142 Å²	142	78.8 Å²	78.8	66%	0.664	42%	0.423	S	S	*	.	H	α-helix	trans	-66.3	-19.2	174.2	-167	170.1	6	0	0	113.5
157	V	59.6	Low	71.3	Confident	104 Å²	104	76.5 Å²	76.5	63%	0.63	41%	0.411	S	S	*	.	H	α-helix	trans	-75.7	-48.8	174.9	-175.5	0	0	0	0	110.3	T155 I159 G160 D161	T155-V157 PolarHBondContact O-N 3.27Å; T155-V157 PolarHBondContact OG1-N 3.01Å; V157-I159 PolarHBondContact O-N 3.25Å; V157-G160 WeakPolarHBondContact O-CA 3.46Å; V157-G160 PolarHBondContact O-N 3.06Å; V157-D161 PolarHBondContact O-N 3Å
158	D	58.9	Low	71.1	Confident	24 Å²	24	76.7 Å²	76.7	13%	0.128	41%	0.411	C	S	.	.	H	α-helix	trans	-58.9	-34.9	179.9	-51.4	-92.3	0	0	0	112.1	F154 T155 G160 D161 R162 I163 K165	F154-D158 HydrophobicContact CB-CB 4.18Å; T155-D158 WeakPolarHBondContact CA-OD2 3.48Å; T155-D158 VanDerWaalsContact CB-OD2 3.31Å; T155-D158 WeakPolarHBondContact CB-OD2 3.29Å; T155-D158 PolarHBondContact N-OD2 2.85Å; T155-D158 PolarHBondContact O-N 3.16Å; T155-D158 PolarHBondContact OG1-OD2 3.39Å; D158-G160 VanDerWaalsContact C-N 3.31Å; D158-G160 PolarHBondContact O-N 2.78Å; D158-D161 PolarHBondContact O-N 3.35Å; D158-R162 PolarHBondContact O-N 3.36Å; D158-I163 HydrophobicContact CB-CB 4.37Å; D158-I163 PolarHBondContact O-N 3.39Å; D158-K165 WeakPolarHBondContact OD1-CE 3.45Å; D158-K165 IonicContact OD1-NZ 2.66Å
159	I	60	Low	71	Confident	82 Å²	82	78.4 Å²	78.4	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-63	-36	173.8	-64.3	168.8	0	0	0	111.6	F154 T155 V157 R162	F154-I159 HydrophobicContact CD2-CD1 4.09Å; F154-I159 HydrophobicContact CD2-CG1 3.88Å; F154-I159 HydrophobicContact CE2-CD1 3.93Å; F154-I159 HydrophobicContact CE2-CG1 4.01Å; T155-I159 WeakPolarHBondContact O-CG1 3.48Å; T155-I159 PolarHBondContact O-N 2.95Å; V157-I159 PolarHBondContact O-N 3.25Å; I159-R162 PolarHBondContact O-N 2.76Å
160	G	54.6	Low	71.2	Confident	62 Å²	62	80.1 Å²	80.1	64%	0.639	42%	0.422	S	S	*	.	H	α-helix	trans	-66.1	-43.5	177	0	0	0	0	0	112.6	V157 D158 R162	V157-G160 WeakPolarHBondContact O-CA 3.46Å; V157-G160 PolarHBondContact O-N 3.06Å; D158-G160 VanDerWaalsContact C-N 3.31Å; D158-G160 PolarHBondContact O-N 2.78Å; G160-R162 VanDerWaalsContact C-N 3.26Å; G160-R162 PolarHBondContact O-N 3.32Å
161	D	55.7	Low	71.7	Confident	115 Å²	115	81.5 Å²	81.5	62%	0.615	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-0.2	178.1	-67.1	-34.6	0	0	0	113.6	V157 D158 I163	V157-D161 PolarHBondContact O-N 3Å; D158-D161 PolarHBondContact O-N 3.35Å; D161-I163 VanDerWaalsContact C-N 3.27Å; D161-I163 HydrophobicContact CB-CD1 3.87Å; D161-I163 HydrophobicContact CB-CG1 3.92Å; D161-I163 PolarHBondContact O-N 3.4Å
162	R	63.3	Low	72.6	Confident	226 Å²	226	77.2 Å²	77.2	85%	0.853	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	25.7	-175.2	-52.6	-179	175.3	-168.1	-2.5	114.7	D158 I159 G160 M164	D158-R162 PolarHBondContact O-N 3.36Å; I159-R162 PolarHBondContact O-N 2.76Å; G160-R162 VanDerWaalsContact C-N 3.26Å; G160-R162 PolarHBondContact O-N 3.32Å; R162-M164 PolarHBondContact O-N 2.88Å
163	I	59.3	Low	73.7	Confident	91 Å²	91	72.1 Å²	72.1	47%	0.467	37%	0.374	S	S	.	.			trans	-85.1	97	-179.8	-58.6	175.9	0	0	0	108.9	D158 D161 K165	D158-I163 HydrophobicContact CB-CB 4.37Å; D158-I163 PolarHBondContact O-N 3.39Å; D161-I163 VanDerWaalsContact C-N 3.27Å; D161-I163 HydrophobicContact CB-CD1 3.87Å; D161-I163 HydrophobicContact CB-CG1 3.92Å; D161-I163 PolarHBondContact O-N 3.4Å; I163-K165 HydrophobicContact CG2-CG 4.45Å; I163-K165 PolarHBondContact O-N 2.85Å
164	M	64.8	Low	74.6	Confident	126 Å²	126	71.2 Å²	71.2	62%	0.621	37%	0.371	S	S	*	.			trans	-83.9	109.7	172.8	-63.8	-169.4	78.2	0	0	110.2	T104 R162 L166	T104-M164 HydrophobicContact CG2-CE 4.37Å; R162-M164 PolarHBondContact O-N 2.88Å; M164-L166 PolarHBondContact O-N 2.9Å
165	K	76.6	Confident	75.8	Confident	51 Å²	51	73.3 Å²	73.3	22%	0.222	39%	0.388	C	S	.	.			trans	-78	110.5	178	-59.8	-164.1	-179.1	-170.8	0	111.2	T104 E152 F154 D158 I163	T104-K165 WeakPolarHBondContact CG2-O 3.15Å; E152-K165 HydrophobicContact CB-CD 3.79Å; E152-K165 WeakPolarHBondContact OE2-CD 3.38Å; E152-K165 WeakPolarHBondContact OE2-CE 3.25Å; E152-K165 IonicContact OE2-NZ 3.78Å; E152-K165 PolarHBondContact OE2-NZ 3.46Å; F154-K165 HydrophobicContact CB-CB 4.33Å; F154-K165 HydrophobicContact CB-CD 4.48Å; F154-K165 HydrophobicContact CB-CG 4.2Å; D158-K165 WeakPolarHBondContact OD1-CE 3.45Å; D158-K165 IonicContact OD1-NZ 2.66Å; I163-K165 HydrophobicContact CG2-CG 4.45Å; I163-K165 PolarHBondContact O-N 2.85Å
166	L	83.8	Confident	77	Confident	71 Å²	71	71.6 Å²	71.6	37%	0.372	38%	0.377	S	S	.	.			trans	-99.1	102.6	-177.6	-174.8	68	0	0	0	111	K102 T104 M164 V195	K102-L166 HydrophobicContact CB-CD1 3.98Å; K102-L166 HydrophobicContact CB-CD2 4.44Å; K102-L166 HydrophobicContact CB-CG 4.25Å; K102-L166 HydrophobicContact CD-CD2 4.21Å; T104-L166 HydrophobicContact CG2-CD1 4.23Å; M164-L166 PolarHBondContact O-N 2.9Å; L166-V195 HydrophobicContact CD1-CB 3.78Å; L166-V195 HydrophobicContact CD1-CG1 4Å; L166-V195 HydrophobicContact CD1-CG2 3.76Å
167	N	86.6	Confident	78.7	Confident	11 Å²	11	68.6 Å²	68.6	6%	0.059	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	151.4	172.7	-65.6	-89.4	0	0	0	110.1	K102 F103 A150 D151 E152	K102-N167 VanDerWaalsContact CA-O 3.22Å; K102-N167 WeakPolarHBondContact CA-O 3.43Å; F103-N167 HydrophobicContact CD1-CB 4.06Å; F103-N167 HydrophobicContact CD2-CB 4.4Å; F103-N167 HydrophobicContact CE1-CB 3.66Å; F103-N167 HydrophobicContact CE2-CB 4.04Å; F103-N167 HydrophobicContact CG-CB 4.4Å; F103-N167 HydrophobicContact CZ-CB 3.65Å; F103-N167 PolarHBondContact N-O 2.83Å; F103-N167 VanDerWaalsContact N-O 3.16Å; F103-N167 WeakPolarHBondContact O-CB 3.23Å; F103-N167 PolarHBondContact O-N 3.42Å; A150-N167 WeakPolarHBondContact CA-OD1 3.05Å; A150-N167 WeakPolarHBondContact CB-OD1 3.33Å; D151-N167 PolarHBondContact N-OD1 2.82Å; E152-N167 PolarHBondContact N-OD1 2.96Å; E152-N167 PolarHBondContact O-ND2 2.85Å; E152-N167 PolarHBondContact O-OD1 2.91Å
168	T	90.1	Very high	80.4	Confident	61 Å²	61	67.3 Å²	67.3	37%	0.374	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	109.4	172.5	-68	0	0	0	0	109.1	E100 I101 K102	E100-T168 HydrophobicContact CG-CG2 4.25Å; I101-T168 CarbonylContact O-C 3.56Å; I101-T168 WeakPolarHBondContact O-CA 3.4Å; K102-T168 WeakPolarHBondContact CD-OG1 3.46Å; K102-T168 HydrophobicContact CG-CG2 4.25Å; K102-T168 WeakPolarHBondContact CG-OG1 3.42Å; K102-T168 PolarHBondContact NZ-OG1 2.88Å
169	E	92.7	Very high	82.1	Confident	36 Å²	36	73 Å²	73	17%	0.168	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	138.9	179.3	-80.6	-74.3	84.8	0	0	110.7	E100 I101 F103 I148 R171	E100-E169 CarbonylContact C-O 3.58Å; E100-E169 WeakPolarHBondContact CA-O 3.44Å; I101-E169 PolarHBondContact N-O 2.89Å; I101-E169 PolarHBondContact O-N 3Å; F103-E169 HydrophobicContact CE1-CB 4.18Å; F103-E169 HydrophobicContact CE1-CG 3.89Å; F103-E169 HydrophobicContact CZ-CG 4.38Å; I148-E169 HydrophobicContact CG2-CB 3.99Å; I148-E169 HydrophobicContact CG2-CG 3.81Å; E169-R171 IonicContact OE1-NH1 3.71Å; E169-R171 IonicContact OE2-CZ 3.08Å; E169-R171 IonicContact OE2-NH1 3.39Å; E169-R171 PolarHBondContact OE2-NH1 2.83Å; E169-R171 IonicContact OE2-NH2 3.51Å; E169-R171 PolarHBondContact OE2-NH2 2.77Å
170	I	93.8	Very high	83.7	Confident	83 Å²	83	69.1 Å²	69.1	43%	0.426	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	132	175.5	-55.8	-179.6	0	0	0	109.2	I99 E100	I99-I170 WeakPolarHBondContact O-CA 3.46Å; E100-I170 HydrophobicContact CB-CG1 4.15Å; E100-I170 HydrophobicContact CG-CG1 4.21Å
171	R	95.3	Very high	85.7	Confident	56 Å²	56	66.1 Å²	66.1	21%	0.211	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	166.1	169	-65.6	-60.6	-179.5	-73.3	-10.6	110.4	Y98 I99 L124 I145 D146 I148 E169	Y98-R171 CarbonylContact C-O 3.6Å; Y98-R171 WeakPolarHBondContact CA-O 3.32Å; I99-R171 PolarHBondContact N-O 2.85Å; I99-R171 PolarHBondContact O-N 3.43Å; L124-R171 HydrophobicContact CD2-CB 4.17Å; L124-R171 HydrophobicContact CD2-CG 4.29Å; I145-R171 HydrophobicContact CG2-CB 3.94Å; I145-R171 HydrophobicContact CG2-CG 4.4Å; D146-R171 HydrophobicContact CB-CG 4.42Å; D146-R171 IonicContact OD2-CZ 3.58Å; D146-R171 VanDerWaalsContact OD2-CZ 3.26Å; D146-R171 IonicContact OD2-NE 3.34Å; D146-R171 PolarHBondContact OD2-NE 2.04Å; D146-R171 IonicContact OD2-NH2 2.73Å; D146-R171 PolarHBondContact OD2-NH2 3.05Å; I148-R171 HydrophobicContact CD1-CG 3.92Å; E169-R171 IonicContact OE1-NH1 3.71Å; E169-R171 IonicContact OE2-CZ 3.08Å; E169-R171 IonicContact OE2-NH1 3.39Å; E169-R171 PolarHBondContact OE2-NH1 2.83Å; E169-R171 IonicContact OE2-NH2 3.51Å; E169-R171 PolarHBondContact OE2-NH2 2.77Å
172	D	93.9	Very high	87.6	Confident	56 Å²	56	60.7 Å²	60.7	30%	0.299	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	155.5	177.4	70.6	-105.1	0	0	0	112.7	R96 V97 Y98	R96-D172 WeakPolarHBondContact CD-OD2 3.2Å; R96-D172 IonicContact CZ-OD2 3.5Å; R96-D172 IonicContact NE-OD2 2.65Å; R96-D172 IonicContact NH1-OD2 3.47Å; R96-D172 PolarHBondContact NH1-OD2 3.45Å; V97-D172 CarbonylContact O-C 3.6Å; V97-D172 WeakPolarHBondContact O-CA 3.19Å; V97-D172 WeakPolarHBondContact O-CB 3.45Å; Y98-D172 HydrophobicContact CD1-CB 3.64Å; Y98-D172 HydrophobicContact CE1-CB 3.73Å; Y98-D172 HydrophobicContact CG-CB 4.37Å
173	V	93.6	Very high	89.2	Confident	6 Å²	6	50 Å²	50	4%	0.036	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.4	178.3	-70.1	0	0	0	0	111.4	R96 V97 I99 Y126 I145 L176	R96-V173 WeakPolarHBondContact CA-O 3.24Å; V97-V173 HydrophobicContact CB-CG2 4.3Å; V97-V173 PolarHBondContact N-O 3.13Å; V97-V173 PolarHBondContact O-N 2.69Å; I99-V173 HydrophobicContact CD1-CG1 4.34Å; I99-V173 HydrophobicContact CD1-CG2 4.2Å; Y126-V173 HydrophobicContact CD1-CG1 3.88Å; Y126-V173 HydrophobicContact CD2-CB 4.41Å; Y126-V173 HydrophobicContact CD2-CG1 4.4Å; Y126-V173 HydrophobicContact CD2-CG2 4.48Å; Y126-V173 HydrophobicContact CE1-CB 4.5Å; Y126-V173 HydrophobicContact CE1-CG1 3.91Å; Y126-V173 HydrophobicContact CE2-CB 4.26Å; Y126-V173 HydrophobicContact CE2-CG1 4.45Å; Y126-V173 HydrophobicContact CG-CG1 4.12Å; I145-V173 HydrophobicContact CD1-CG1 3.56Å; I145-V173 HydrophobicContact CG1-CG1 3.61Å; I145-V173 HydrophobicContact CG2-CG1 4.15Å; V173-L176 HydrophobicContact CG2-CD1 4.48Å; V173-L176 HydrophobicContact CG2-CD2 4.26Å
174	G	88.8	Confident	91	Very high	19 Å²	19	45.6 Å²	45.6	20%	0.196	24%	0.239	C	C	.	.			trans	158.3	173.1	175.2	0	0	0	0	0	113.1	Q95 R96	Q95-G174 WeakPolarHBondContact O-CA 3.35Å; R96-G174 VanDerWaalsContact NH2-C 3.27Å; R96-G174 PolarHBondContact NH2-O 3.22Å
175	P	93.3	Very high	92.6	Very high	75 Å²	75	39.6 Å²	39.6	49%	0.487	21%	0.209	S	C	.	.			cis	-74.3	121.4	-0.5	27.6	-33.2	0	0	0	113.2	Q95 A221	Q95-P175 CarbonylContact O-C 3.44Å; Q95-P175 WeakPolarHBondContact O-CA 3.15Å; P175-A221 HydrophobicContact CB-CB 3.93Å; P175-A221 HydrophobicContact CG-CB 4.46Å
176	L	93.9	Very high	93.5	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.031	20%	0.203	C	C	.	.			trans	-74.5	143.3	172.9	-57	-176.9	0	0	0	110.6	R91 Q95 V97 Y126 E128 V173 F181	R91-L176 HydrophobicContact CB-CD1 4.25Å; Q95-L176 PolarHBondContact O-N 2.94Å; V97-L176 HydrophobicContact CB-CD1 4.13Å; V97-L176 HydrophobicContact CG2-CD1 3.59Å; Y126-L176 HydrophobicContact CD2-CD2 4.16Å; Y126-L176 HydrophobicContact CE2-CD2 3.71Å; E128-L176 HydrophobicContact CG-CD2 3.92Å; V173-L176 HydrophobicContact CG2-CD1 4.48Å; V173-L176 HydrophobicContact CG2-CD2 4.26Å; L176-F181 HydrophobicContact CD1-CD1 3.72Å; L176-F181 HydrophobicContact CD1-CE1 3.8Å; L176-F181 HydrophobicContact CD1-CG 4.4Å
177	S	93.8	Very high	94.1	Very high	79 Å²	79	34.7 Å²	34.7	55%	0.552	19%	0.185	S	C	*	.			trans	-124.8	-45.5	-167.6	63.2	0	0	0	0	113.1	R91 E128	R91-S177 PolarHBondContact NE-O 2.84Å; R91-S177 PolarHBondContact NH2-O 3.07Å; E128-S177 PolarHBondContact OE1-OG 2.79Å; E128-S177 PolarHBondContact OE2-N 2.72Å; E128-S177 PolarHBondContact OE2-OG 2.96Å
178	K	95.3	Very high	94.5	Very high	78 Å²	78	36.3 Å²	36.3	34%	0.339	20%	0.195	S	C	.	.	S	Bend	trans	-74.2	171.9	-178	-66.3	-174.3	161.9	-62.8	0	112	R91 E128 D130 G180	R91-K178 WeakPolarHBondContact CD-O 3.48Å; R91-K178 PolarHBondContact NE-O 3.26Å; E128-K178 HydrophobicContact CB-CB 4.1Å; E128-K178 HydrophobicContact CB-CD 3.73Å; E128-K178 HydrophobicContact CB-CG 4.12Å; E128-K178 VanDerWaalsContact O-CD 3.29Å; E128-K178 WeakPolarHBondContact O-CD 3.27Å; E128-K178 PolarHBondContact OE2-N 2.86Å; D130-K178 WeakPolarHBondContact OD1-CA 3.47Å; D130-K178 WeakPolarHBondContact OD1-CB 3.16Å; D130-K178 WeakPolarHBondContact OD2-CD 3.33Å; D130-K178 WeakPolarHBondContact OD2-CG 3.39Å; D130-K178 IonicContact OD2-NZ 2.64Å; D130-K178 PolarHBondContact OD2-NZ 3Å; K178-G180 PolarHBondContact O-N 2.72Å
179	K	94.6	Very high	94.6	Very high	143 Å²	143	33.5 Å²	33.5	62%	0.622	18%	0.179	S	C	*	.	S	Bend	trans	-59.5	-28.7	-178.6	-68.9	177.5	-179.4	179.5	0	114.2	W88 R91 D130	W88-K179 HydrophobicContact CH2-CB 4.24Å; W88-K179 HydrophobicContact CZ2-CB 3.77Å; R91-K179 PolarHBondContact N-O 2.72Å; R91-K179 VanDerWaalsContact N-O 3.14Å; D130-K179 PolarHBondContact OD1-N 2.92Å
180	G	95.1	Very high	94.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171	-170.6	-179	0	0	0	0	0	112.2	I89 S129 K178	I89-G180 CarbonylContact O-C 3.55Å; I89-G180 WeakPolarHBondContact O-CA 3.43Å; S129-G180 PolarHBondContact N-O 2.66Å; S129-G180 CarbonylContact O-C 3.47Å; S129-G180 PolarHBondContact O-N 2.87Å; K178-G180 PolarHBondContact O-N 2.72Å
181	F	96.4	Very high	94.6	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	159.9	-173	60.4	-78.1	0	0	0	111.6	L33 I89 R91 V97 Y127 L176 L183 V199	L33-F181 HydrophobicContact CD1-CE1 4.49Å; I89-F181 HydrophobicContact CB-CD1 4.46Å; I89-F181 HydrophobicContact CB-CE1 4.06Å; I89-F181 HydrophobicContact CB-CE2 4.12Å; I89-F181 HydrophobicContact CB-CZ 3.86Å; I89-F181 HydrophobicContact CD1-CE2 3.9Å; I89-F181 HydrophobicContact CD1-CZ 4.23Å; I89-F181 HydrophobicContact CG2-CE1 3.94Å; I89-F181 HydrophobicContact CG2-CE2 4.35Å; I89-F181 HydrophobicContact CG2-CZ 3.68Å; I89-F181 PolarHBondContact N-O 2.96Å; I89-F181 PolarHBondContact O-N 2.79Å; R91-F181 HydrophobicContact CB-CD1 4.39Å; R91-F181 HydrophobicContact CB-CE1 4.24Å; V97-F181 HydrophobicContact CG1-CZ 3.92Å; V97-F181 HydrophobicContact CG2-CE1 4.45Å; Y127-F181 CarbonylContact O-C 3.43Å; Y127-F181 WeakPolarHBondContact O-CA 3.34Å; Y127-F181 WeakPolarHBondContact O-CB 3.26Å; L176-F181 HydrophobicContact CD1-CD1 3.72Å; L176-F181 HydrophobicContact CD1-CE1 3.8Å; L176-F181 HydrophobicContact CD1-CG 4.4Å; F181-L183 HydrophobicContact CD2-CD2 3.91Å; F181-L183 HydrophobicContact CD2-CG 4.21Å; F181-L183 HydrophobicContact CE2-CD2 3.85Å; F181-L183 HydrophobicContact CE2-CG 3.96Å; F181-V199 HydrophobicContact CE2-CG1 4.17Å; F181-V199 HydrophobicContact CZ-CG1 3.83Å
182	Y	95.8	Very high	94.6	Very high	1 Å²	1	26.2 Å²	26.2	0%	0.004	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	143.9	167	-64.5	-80.7	0	0	0	109.2	R85 T86 W88 Y126 Y127 N131 D132 E134	R85-Y182 HydrophobicContact CG-CD1 4.49Å; T86-Y182 WeakPolarHBondContact O-CD1 3.21Å; W88-Y182 VanDerWaalsContact CA-CE1 3.5Å; W88-Y182 HydrophobicContact CB-CD1 4.25Å; W88-Y182 HydrophobicContact CB-CE1 3.56Å; W88-Y182 AromaticContact CD1-CE2 3.84Å; W88-Y182 AromaticContact CD1-CZ 3.84Å; W88-Y182 HydrophobicContact CG-CE1 4.41Å; W88-Y182 VanDerWaalsContact N-CE1 3.32Å; Y126-Y182 CarbonylContact C-O 3.55Å; Y126-Y182 VanDerWaalsContact CA-O 3.24Å; Y126-Y182 WeakPolarHBondContact CA-O 3.45Å; Y127-Y182 HydrophobicContact CD1-CD2 4.24Å; Y127-Y182 PolarHBondContact N-O 3.43Å; Y127-Y182 PolarHBondContact O-N 2.82Å; N131-Y182 PolarHBondContact O-OH 2.79Å; D132-Y182 PolarHBondContact O-OH 2.89Å; E134-Y182 HydrophobicContact CB-CE2 3.93Å; E134-Y182 WeakPolarHBondContact CB-OH 3.19Å; E134-Y182 HydrophobicContact CG-CE2 4.03Å; E134-Y182 PolarHBondContact N-OH 2.95Å
183	L	96.8	Very high	94.5	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	151.1	163	-63.3	-177.7	0	0	0	110	R85 T86 I89 I99 Y125 I145 F181 V199	R85-L183 WeakPolarHBondContact CA-O 3.47Å; R85-L183 VanDerWaalsContact CG-O 3.26Å; R85-L183 WeakPolarHBondContact CG-O 3.4Å; T86-L183 HydrophobicContact CG2-CB 3.85Å; T86-L183 PolarHBondContact N-O 2.86Å; T86-L183 PolarHBondContact OG1-N 2.86Å; T86-L183 PolarHBondContact OG1-O 2.86Å; I89-L183 HydrophobicContact CD1-CD1 4.23Å; I89-L183 HydrophobicContact CD1-CG 4.16Å; I99-L183 HydrophobicContact CD1-CD1 3.98Å; I99-L183 HydrophobicContact CD1-CD2 3.6Å; I99-L183 HydrophobicContact CD1-CG 4.47Å; I99-L183 HydrophobicContact CG1-CD1 4.01Å; I99-L183 HydrophobicContact CG1-CD2 4.43Å; I99-L183 HydrophobicContact CG2-CD1 3.77Å; Y125-L183 WeakPolarHBondContact O-CA 3.34Å; I145-L183 HydrophobicContact CD1-CD2 4.2Å; F181-L183 HydrophobicContact CD2-CD2 3.91Å; F181-L183 HydrophobicContact CD2-CG 4.21Å; F181-L183 HydrophobicContact CE2-CD2 3.85Å; F181-L183 HydrophobicContact CE2-CG 3.96Å; L183-V199 HydrophobicContact CD1-CG2 3.56Å
184	A	96.4	Very high	94.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.1	171	0	0	0	0	0	112.7	W83 L84 R85 Y125 F142	W83-A184 HydrophobicContact CE3-CB 3.9Å; W83-A184 HydrophobicContact CZ3-CB 4.05Å; L84-A184 CarbonylContact O-C 3.46Å; L84-A184 WeakPolarHBondContact O-CA 3.46Å; R85-A184 HydrophobicContact CB-CB 4.23Å; R85-A184 HydrophobicContact CG-CB 4.2Å; Y125-A184 PolarHBondContact N-O 3.17Å; Y125-A184 PolarHBondContact O-N 2.72Å; F142-A184 HydrophobicContact CD1-CB 3.95Å; F142-A184 HydrophobicContact CE1-CB 3.7Å; F142-A184 HydrophobicContact CZ-CB 4.21Å
185	F	97.2	Very high	94.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.6	178.3	-51.1	-88.3	0	0	0	107.4	W45 W54 W83 L84 T86 I101 F122 N123 L124 L194 V197	W45-F185 HydrophobicContact CH2-CE2 4.5Å; W45-F185 AromaticContact CZ3-CE2 3.91Å; W45-F185 HydrophobicContact CZ3-CE2 3.91Å; W54-F185 HydrophobicContact CZ2-CB 4.16Å; W83-F185 CarbonylContact C-O 3.51Å; W83-F185 WeakPolarHBondContact CA-O 3.45Å; L84-F185 HydrophobicContact CB-CB 4.44Å; L84-F185 HydrophobicContact CD2-CD2 4.25Å; L84-F185 HydrophobicContact CG-CD2 4.38Å; L84-F185 PolarHBondContact N-O 2.91Å; L84-F185 PolarHBondContact O-N 3.2Å; T86-F185 HydrophobicContact CG2-CE2 4.13Å; I101-F185 HydrophobicContact CD1-CE1 3.87Å; I101-F185 HydrophobicContact CG1-CE1 4.27Å; F122-F185 HydrophobicContact CD2-CD1 4.44Å; F122-F185 HydrophobicContact CE2-CD1 4Å; N123-F185 WeakPolarHBondContact O-CA 3.48Å; L124-F185 HydrophobicContact CD1-CD1 3.8Å; L124-F185 HydrophobicContact CD1-CE1 3.48Å; L124-F185 VanDerWaalsContact CD1-CE1 3.48Å; L124-F185 HydrophobicContact CD1-CZ 4.17Å; F185-L194 HydrophobicContact CB-CD1 4.17Å; F185-L194 HydrophobicContact CD1-CD1 3.99Å; F185-L194 HydrophobicContact CD1-CD2 4.45Å; F185-L194 HydrophobicContact CD2-CD1 4.11Å; F185-L194 HydrophobicContact CE1-CD1 4.48Å; F185-L194 HydrophobicContact CG-CD1 3.81Å; F185-V197 HydrophobicContact CE1-CG2 4.15Å; F185-V197 HydrophobicContact CE2-CG2 4.17Å; F185-V197 HydrophobicContact CZ-CB 4.43Å; F185-V197 HydrophobicContact CZ-CG1 4.08Å; F185-V197 HydrophobicContact CZ-CG2 3.52Å
186	Q	96.8	Very high	94.4	Very high	19 Å²	19	20.3 Å²	20.3	9%	0.089	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	117.4	177.9	178.8	-158.9	38.8	0	0	108.9	N81 N82 W83 N123 Y125 V188	N81-Q186 PolarHBondContact OD1-NE2 2.87Å; N82-Q186 CarbonylContact O-C 3.5Å; N82-Q186 WeakPolarHBondContact O-CA 3.32Å; W83-Q186 HydrophobicContact CD2-CB 4.08Å; W83-Q186 HydrophobicContact CD2-CG 4.22Å; W83-Q186 HydrophobicContact CE3-CB 4.22Å; W83-Q186 HydrophobicContact CZ2-CB 4.37Å; W83-Q186 HydrophobicContact CZ2-CG 4.17Å; W83-Q186 HydrophobicContact CZ3-CB 4.43Å; N123-Q186 HydrophobicContact CB-CB 4.21Å; N123-Q186 PolarHBondContact N-O 2.69Å; N123-Q186 PolarHBondContact ND2-OE1 2.86Å; N123-Q186 PolarHBondContact O-N 2.8Å; Y125-Q186 HydrophobicContact CD2-CB 4.22Å; Y125-Q186 HydrophobicContact CE2-CB 3.74Å; Y125-Q186 HydrophobicContact CE2-CG 4.49Å; Y125-Q186 VanDerWaalsContact CE2-OE1 3.31Å; Y125-Q186 PolarHBondContact OH-OE1 2.85Å; Q186-V188 HydrophobicContact CG-CG1 4.23Å
187	D	96.6	Very high	94.4	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	145.4	167.4	158.7	59.4	0	0	0	110.6	W54 V72 N82 G189 A190	W54-D187 HydrophobicContact CZ2-CB 3.87Å; V72-D187 HydrophobicContact CG1-CB 3.67Å; V72-D187 WeakPolarHBondContact CG2-OD2 3.36Å; N82-D187 HydrophobicContact CB-CB 4.07Å; N82-D187 PolarHBondContact N-O 3.06Å; N82-D187 PolarHBondContact ND2-OD2 2.75Å; N82-D187 PolarHBondContact O-N 2.9Å; D187-G189 PolarHBondContact OD1-N 3.4Å; D187-A190 PolarHBondContact OD1-N 3.01Å
188	V	94.4	Very high	94.4	Very high	44 Å²	44	17 Å²	17	27%	0.267	8%	0.083	S	C	.	.	S	Bend	trans	-133.9	20.3	-176.2	-65.9	0	0	0	0	112.5	K119 Q186	K119-V188 HydrophobicContact CG-CG2 4.34Å; Q186-V188 HydrophobicContact CG-CG1 4.23Å
189	G	92.6	Very high	94.4	Very high	2 Å²	2	13.3 Å²	13.3	2%	0.021	7%	0.067	C	C	.	.	S	Bend	trans	125.3	25.8	176.3	0	0	0	0	0	114.7	C118 K119 D187	C118-G189 CarbonylContact C-O 3.43Å; C118-G189 VanDerWaalsContact CA-O 3.31Å; C118-G189 WeakPolarHBondContact CA-O 3.36Å; K119-G189 PolarHBondContact N-O 2.64Å; D187-G189 PolarHBondContact OD1-N 3.4Å
190	A	93.8	Very high	94.5	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.039	C	C	.	.	B	Isolated β-bridge	trans	-92.1	170	179	0	0	0	0	0	112.9	C73 K119 D187 I192	C73-A190 WeakPolarHBondContact CA-O 3.45Å; K119-A190 HydrophobicContact CB-CB 4.47Å; K119-A190 WeakPolarHBondContact O-CA 3.01Å; K119-A190 VanDerWaalsContact O-CB 3.28Å; K119-A190 WeakPolarHBondContact O-CB 3.48Å; D187-A190 PolarHBondContact OD1-N 3.01Å; A190-I192 HydrophobicContact CB-CG2 4.29Å
191	C	93.4	Very high	94.5	Very high	17 Å²	17	8 Å²	8	12%	0.115	4%	0.044	C	C	.	.			trans	-119.8	96.7	169	-167.4	0	0	0	0	109.3	V72 C73 V75 R106 L111	V72-C191 WeakPolarHBondContact O-CA 3.37Å; C73-C191 HydrophobicContact CB-CB 3.93Å; C73-C191 WeakPolarHBondContact CB-SG 3.34Å; C73-C191 WeakPolarHBondContact SG-CB 3.46Å; C73-C191 CovalentContact SG-SG 2.05Å; C73-C191 PolarHBondContact SG-SG 2.86Å; V75-C191 HydrophobicContact CG1-CB 3.79Å; R106-C191 HydrophobicContact CB-CB 4.09Å; R106-C191 PolarHBondContact N-O 2.92Å; L111-C191 HydrophobicContact CD1-CB 4.24Å
192	I	94.3	Very high	94.4	Very high	6 Å²	6	9.8 Å²	9.8	3%	0.031	5%	0.051	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	144.3	-164.8	176.4	165.3	0	0	0	111.7	W54 Q71 V72 F103 T104 F122 A190 L194	W54-I192 HydrophobicContact CH2-CD1 4.4Å; W54-I192 HydrophobicContact CH2-CG1 4.43Å; W54-I192 HydrophobicContact CH2-CG2 3.69Å; W54-I192 HydrophobicContact CZ2-CG2 4.47Å; W54-I192 HydrophobicContact CZ3-CG2 4.08Å; Q71-I192 VanDerWaalsContact CA-O 3.26Å; Q71-I192 WeakPolarHBondContact CA-O 3.47Å; V72-I192 HydrophobicContact CG1-CG2 3.65Å; V72-I192 PolarHBondContact N-O 3.46Å; V72-I192 PolarHBondContact O-N 2.92Å; F103-I192 HydrophobicContact CB-CD1 4.27Å; F103-I192 HydrophobicContact CB-CG1 4.38Å; F103-I192 HydrophobicContact CD2-CD1 3.73Å; F103-I192 HydrophobicContact CD2-CG1 4.16Å; F103-I192 HydrophobicContact CE2-CD1 4.42Å; F103-I192 HydrophobicContact CG-CD1 4.19Å; T104-I192 WeakPolarHBondContact O-CA 3.22Å; F122-I192 HydrophobicContact CB-CD1 4.45Å; F122-I192 HydrophobicContact CD1-CD1 3.18Å; F122-I192 HydrophobicContact CD2-CD1 4.43Å; F122-I192 HydrophobicContact CE1-CD1 3.29Å; F122-I192 HydrophobicContact CG-CD1 3.8Å; F122-I192 HydrophobicContact CZ-CD1 3.99Å; A190-I192 HydrophobicContact CB-CG2 4.29Å; I192-L194 HydrophobicContact CD1-CD2 4.18Å
193	A	92	Very high	94.4	Very high	8 Å²	8	11.7 Å²	11.7	7%	0.066	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.1	163.3	0	0	0	0	0	111	Y70 Q71 F103 T104 V195	Y70-A193 CarbonylContact O-C 3.59Å; Y70-A193 WeakPolarHBondContact O-CA 3.33Å; Q71-A193 HydrophobicContact CB-CB 3.97Å; F103-A193 CarbonylContact C-O 3.55Å; F103-A193 WeakPolarHBondContact CA-O 3.48Å; F103-A193 VanDerWaalsContact CB-O 3.29Å; F103-A193 WeakPolarHBondContact CB-O 3.07Å; T104-A193 PolarHBondContact N-O 3.37Å; T104-A193 PolarHBondContact O-N 3.02Å; A193-V195 PolarHBondContact O-N 3.33Å
194	L	92.9	Very high	94.3	Very high	5 Å²	5	11.7 Å²	11.7	3%	0.026	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	100.1	171.2	-66.6	174.3	0	0	0	109.3	W54 T69 Y70 L84 I101 F103 F122 F185 I192	W54-L194 HydrophobicContact CE3-CD1 4.32Å; W54-L194 HydrophobicContact CH2-CD1 3.6Å; W54-L194 HydrophobicContact CH2-CG 3.78Å; W54-L194 HydrophobicContact CZ2-CD1 4.32Å; W54-L194 HydrophobicContact CZ3-CD1 3.61Å; W54-L194 HydrophobicContact CZ3-CG 3.69Å; T69-L194 WeakPolarHBondContact CA-O 3.26Å; T69-L194 VanDerWaalsContact CB-O 3.28Å; T69-L194 WeakPolarHBondContact CB-O 3.35Å; Y70-L194 PolarHBondContact N-O 3.29Å; Y70-L194 PolarHBondContact O-N 2.81Å; L84-L194 HydrophobicContact CD2-CD1 3.9Å; I101-L194 HydrophobicContact CG2-CD2 3.74Å; F103-L194 HydrophobicContact CB-CD2 4.1Å; F122-L194 HydrophobicContact CE2-CD2 4.21Å; F122-L194 HydrophobicContact CZ-CD2 4.14Å; F185-L194 HydrophobicContact CB-CD1 4.17Å; F185-L194 HydrophobicContact CD1-CD1 3.99Å; F185-L194 HydrophobicContact CD1-CD2 4.45Å; F185-L194 HydrophobicContact CD2-CD1 4.11Å; F185-L194 HydrophobicContact CE1-CD1 4.48Å; F185-L194 HydrophobicContact CG-CD1 3.81Å; I192-L194 HydrophobicContact CD1-CD2 4.18Å
195	V	89.5	Confident	94.3	Very high	16 Å²	16	13.6 Å²	13.6	10%	0.097	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-32	-177.4	178.7	0	0	0	0	111.9	I67 K102 T104 L166 A193	I67-V195 HydrophobicContact CD1-CG1 3.84Å; K102-V195 WeakPolarHBondContact O-CA 3.31Å; K102-V195 PolarHBondContact O-N 3.36Å; T104-V195 HydrophobicContact CG2-CG2 4.15Å; L166-V195 HydrophobicContact CD1-CB 3.78Å; L166-V195 HydrophobicContact CD1-CG1 4Å; L166-V195 HydrophobicContact CD1-CG2 3.76Å; A193-V195 PolarHBondContact O-N 3.33Å
196	S	90.1	Very high	94.2	Very high	2 Å²	2	18.5 Å²	18.5	1%	0.014	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.1	153	166.4	72.1	0	0	0	0	114.8	S36 R37 I101 K102	S36-S196 VanDerWaalsContact OG-CA 3.27Å; S36-S196 WeakPolarHBondContact OG-CA 3.34Å; R37-S196 PolarHBondContact NE-OG 3.35Å; R37-S196 PolarHBondContact NH2-OG 3.29Å; I101-S196 CarbonylContact C-O 3.52Å; I101-S196 WeakPolarHBondContact CA-O 3.32Å; K102-S196 PolarHBondContact N-O 3.41Å; K102-S196 PolarHBondContact O-N 3.45Å
197	V	94	Very high	94.1	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.006	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123.8	163.5	-173.9	0	0	0	0	108.3	S36 W45 I99 E100 F185 V199	S36-V197 PolarHBondContact N-O 2.81Å; S36-V197 PolarHBondContact OG-N 2.94Å; W45-V197 HydrophobicContact CH2-CB 3.89Å; W45-V197 HydrophobicContact CH2-CG2 3.69Å; W45-V197 HydrophobicContact CZ3-CG2 4.09Å; I99-V197 HydrophobicContact CG2-CG1 4.3Å; E100-V197 CarbonylContact O-C 3.55Å; E100-V197 WeakPolarHBondContact O-CA 3.48Å; F185-V197 HydrophobicContact CE1-CG2 4.15Å; F185-V197 HydrophobicContact CE2-CG2 4.17Å; F185-V197 HydrophobicContact CZ-CB 4.43Å; F185-V197 HydrophobicContact CZ-CG1 4.08Å; F185-V197 HydrophobicContact CZ-CG2 3.52Å; V197-V199 HydrophobicContact CG1-CG2 3.98Å
198	R	94.4	Very high	94.1	Very high	15 Å²	15	21.9 Å²	21.9	6%	0.057	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.8	167.8	-174.3	177.2	71.5	114	-1.3	109.2	Y26 E30 T32 L34 D35 E100 F200	Y26-R198 VanDerWaalsContact CD1-NH1 3.28Å; Y26-R198 VanDerWaalsContact CE1-CD 3.43Å; E30-R198 IonicContact OE1-NH2 2.81Å; E30-R198 IonicContact OE2-CZ 2.59Å; E30-R198 VanDerWaalsContact OE2-CZ 3.24Å; E30-R198 IonicContact OE2-NH1 2.62Å; E30-R198 PolarHBondContact OE2-NH1 2.91Å; E30-R198 IonicContact OE2-NH2 2.74Å; E30-R198 PolarHBondContact OE2-NH2 2.61Å; T32-R198 HydrophobicContact CG2-CG 4.08Å; L34-R198 CarbonylContact O-C 3.59Å; L34-R198 VanDerWaalsContact O-CA 3.26Å; L34-R198 WeakPolarHBondContact O-CA 3.49Å; L34-R198 WeakPolarHBondContact O-CG 3.4Å; D35-R198 HydrophobicContact CB-CG 4.26Å; E100-R198 HydrophobicContact CB-CB 4.33Å; E100-R198 PolarHBondContact N-O 3.26Å; E100-R198 PolarHBondContact O-N 3.26Å; E100-R198 IonicContact OE1-CZ 3.54Å; E100-R198 VanDerWaalsContact OE1-CZ 3.28Å; E100-R198 IonicContact OE1-NE 3.7Å; E100-R198 PolarHBondContact OE1-NE 3.41Å; E100-R198 IonicContact OE1-NH2 2.69Å; E100-R198 PolarHBondContact OE1-NH2 2.85Å; R198-F200 HydrophobicContact CG-CD1 4.38Å
199	V	96.1	Very high	94	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.3	178.1	-170.5	0	0	0	0	107.4	L33 L34 I89 V97 Y98 I99 F181 L183 V197	L33-V199 PolarHBondContact N-O 3.26Å; L34-V199 HydrophobicContact CB-CB 4.05Å; L34-V199 HydrophobicContact CB-CG2 4.13Å; L34-V199 HydrophobicContact CD2-CG2 4.22Å; L34-V199 PolarHBondContact N-O 2.81Å; L34-V199 VanDerWaalsContact N-O 3.08Å; L34-V199 PolarHBondContact O-N 3.45Å; I89-V199 HydrophobicContact CD1-CB 4.37Å; I89-V199 HydrophobicContact CD1-CG1 4.37Å; I89-V199 HydrophobicContact CD1-CG2 3.94Å; V97-V199 HydrophobicContact CG1-CG1 3.43Å; V97-V199 VanDerWaalsContact CG1-CG1 3.43Å; Y98-V199 CarbonylContact O-C 3.59Å; Y98-V199 WeakPolarHBondContact O-CA 3.15Å; I99-V199 HydrophobicContact CG1-CG1 4.38Å; F181-V199 HydrophobicContact CE2-CG1 4.17Å; F181-V199 HydrophobicContact CZ-CG1 3.83Å; L183-V199 HydrophobicContact CD1-CG2 3.56Å; V197-V199 HydrophobicContact CG1-CG2 3.98Å
200	F	95.6	Very high	94	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.018	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	155.4	-173.6	66.2	-81.6	0	0	0	111.3	E30 V31 Y98 E100 R198 K202	E30-F200 HydrophobicContact CB-CD2 3.93Å; E30-F200 HydrophobicContact CB-CE2 4.39Å; E30-F200 HydrophobicContact CG-CD2 3.75Å; E30-F200 HydrophobicContact CG-CE2 3.71Å; E30-F200 WeakPolarHBondContact OE1-CE2 3.44Å; V31-F200 CarbonylContact O-C 3.56Å; V31-F200 WeakPolarHBondContact O-CA 3.41Å; V31-F200 WeakPolarHBondContact O-CB 3.37Å; Y98-F200 HydrophobicContact CD2-CD2 4.5Å; Y98-F200 HydrophobicContact CD2-CE2 4.21Å; Y98-F200 HydrophobicContact CG-CE2 4.16Å; Y98-F200 HydrophobicContact CG-CZ 4.21Å; Y98-F200 PolarHBondContact N-O 2.89Å; Y98-F200 PolarHBondContact O-N 2.78Å; E100-F200 HydrophobicContact CB-CE1 4.15Å; R198-F200 HydrophobicContact CG-CD1 4.38Å; F200-K202 HydrophobicContact CE2-CG 4.37Å
201	Y	95.3	Very high	94.1	Very high	27 Å²	27	29.7 Å²	29.7	11%	0.106	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	169.6	168.3	72.8	-90.3	0	0	0	110.8	V31 L33 E92 A94 I218	V31-Y201 HydrophobicContact CB-CD1 3.97Å; V31-Y201 HydrophobicContact CB-CD2 4.46Å; V31-Y201 HydrophobicContact CB-CE1 3.55Å; V31-Y201 HydrophobicContact CB-CE2 4.06Å; V31-Y201 HydrophobicContact CB-CG 4.42Å; V31-Y201 HydrophobicContact CG1-CD1 4.27Å; V31-Y201 HydrophobicContact CG1-CE1 3.5Å; V31-Y201 VanDerWaalsContact CG1-CE1 3.5Å; V31-Y201 HydrophobicContact CG2-CE1 4.38Å; V31-Y201 HydrophobicContact CG2-CE2 4.12Å; V31-Y201 PolarHBondContact N-O 3.4Å; V31-Y201 PolarHBondContact O-N 3.22Å; L33-Y201 HydrophobicContact CD1-CD1 4.13Å; L33-Y201 HydrophobicContact CD2-CD1 3.75Å; L33-Y201 HydrophobicContact CD2-CE1 3.84Å; L33-Y201 HydrophobicContact CG-CD1 3.96Å; E92-Y201 HydrophobicContact CB-CE1 4.4Å; A94-Y201 VanDerWaalsContact CB-CB 3.48Å; A94-Y201 HydrophobicContact CB-CD1 3.88Å; A94-Y201 HydrophobicContact CB-CD2 4.03Å; A94-Y201 HydrophobicContact CB-CG 3.55Å; Y201-I218 HydrophobicContact CD2-CG2 4Å; Y201-I218 HydrophobicContact CE2-CD1 4.04Å; Y201-I218 HydrophobicContact CE2-CG1 3.99Å; Y201-I218 HydrophobicContact CE2-CG2 4.11Å
202	K	94.8	Very high	94.2	Very high	38 Å²	38	28.9 Å²	28.9	17%	0.165	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	148.6	-178.9	-67.2	-174.9	171.5	-160.3	0	112.2	N29 Y98 F200 T219 D250	N29-K202 CarbonylContact O-C 3.6Å; N29-K202 VanDerWaalsContact O-CA 3.27Å; N29-K202 WeakPolarHBondContact O-CA 3.41Å; Y98-K202 HydrophobicContact CD2-CD 4.08Å; Y98-K202 HydrophobicContact CD2-CG 3.85Å; Y98-K202 HydrophobicContact CE2-CB 4.18Å; Y98-K202 HydrophobicContact CE2-CD 3.54Å; Y98-K202 HydrophobicContact CE2-CG 3.59Å; F200-K202 HydrophobicContact CE2-CG 4.37Å; K202-T219 HydrophobicContact CB-CG2 3.77Å; K202-T219 PolarHBondContact O-N 2.99Å; K202-T219 VanDerWaalsContact O-N 3.13Å; K202-T219 PolarHBondContact O-OG1 3.36Å; K202-D250 WeakPolarHBondContact CD-O 3.45Å; K202-D250 PolarHBondContact NZ-O 3.07Å
203	K	95.2	Very high	94.3	Very high	41 Å²	41	32.9 Å²	32.9	18%	0.178	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.1	172.3	65.2	172.9	-174.6	173.3	0	110	A28 N29 V31 D216 T217	A28-K203 VanDerWaalsContact O-CE 3.26Å; A28-K203 WeakPolarHBondContact O-CE 3.33Å; N29-K203 WeakPolarHBondContact CA-O 3.35Å; N29-K203 WeakPolarHBondContact CB-O 3.27Å; N29-K203 PolarHBondContact O-N 3.05Å; V31-K203 HydrophobicContact CG2-CD 3.83Å; V31-K203 HydrophobicContact CG2-CG 4.17Å; K203-D216 HydrophobicContact CD-CB 4.46Å; K203-D216 IonicContact NZ-OD1 3.51Å; K203-D216 IonicContact NZ-OD2 3.6Å; K203-D216 PolarHBondContact NZ-OD2 2.96Å; K203-T217 CarbonylContact C-O 3.59Å; K203-T217 WeakPolarHBondContact CA-O 3.33Å; K203-T217 WeakPolarHBondContact CB-O 3.18Å
204	C	95.8	Very high	94.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	120.7	162.6	-54.4	0	0	0	0	108.5	D216 T217 C247 G251 E252 W253	C204-D216 WeakPolarHBondContact O-CA 2.97Å; C204-T217 PolarHBondContact N-O 2.7Å; C204-T217 PolarHBondContact O-N 2.97Å; C204-C247 HydrophobicContact CB-CB 3.75Å; C204-C247 WeakPolarHBondContact CB-SG 3.34Å; C204-C247 WeakPolarHBondContact SG-CA 3.44Å; C204-C247 WeakPolarHBondContact SG-CB 3.49Å; C204-C247 CovalentContact SG-SG 2.03Å; C204-C247 PolarHBondContact SG-SG 3.27Å; C204-G251 WeakPolarHBondContact CA-O 3.49Å; C204-E252 PolarHBondContact SG-O 3.42Å; C204-E252 VanDerWaalsContact SG-O 3.35Å; C204-W253 HydrophobicContact CB-CD2 3.69Å; C204-W253 VanDerWaalsContact CB-CE2 3.41Å; C204-W253 HydrophobicContact CB-CE3 4.23Å; C204-W253 HydrophobicContact CB-CG 4.06Å; C204-W253 HydrophobicContact CB-CH2 4.3Å; C204-W253 HydrophobicContact CB-CZ2 3.76Å
205	P	95.9	Very high	94.7	Very high	40 Å²	40	35.5 Å²	35.5	26%	0.26	18%	0.179	S	C	.	.			trans	-76	153.6	-170.5	29.7	-35.5	0	0	0	112.6	T207 D216 W253	P205-T207 PolarHBondContact O-N 3.4Å; P205-D216 WeakPolarHBondContact CA-OD1 3.27Å; P205-W253 PolarHBondContact O-NE1 3.32Å
206	L	95.5	Very high	95	Very high	103 Å²	103	38.7 Å²	38.7	54%	0.539	20%	0.196	S	C	.	.			trans	-42.6	121	174.1	-174.9	77.9	0	0	0	111.6	Q213 F214 D216	L206-Q213 HydrophobicContact CD1-CG 4.24Å; L206-F214 WeakPolarHBondContact CA-O 3.31Å; L206-D216 PolarHBondContact N-OD1 2.94Å
207	T	94.9	Very high	95.2	Very high	33 Å²	33	39.4 Å²	39.4	20%	0.202	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	162.4	-178.1	-158.1	0	0	0	0	112.2	P205 R209 Q213 F214 M245 W253	P205-T207 PolarHBondContact O-N 3.4Å; T207-R209 HydrophobicContact CG2-CG 4.19Å; T207-Q213 WeakPolarHBondContact O-CA 3.22Å; T207-F214 HydrophobicContact CG2-CB 4.2Å; T207-F214 PolarHBondContact N-O 3.37Å; T207-F214 VanDerWaalsContact N-O 3.08Å; T207-F214 PolarHBondContact O-N 3.4Å; T207-M245 HydrophobicContact CG2-CE 4.35Å; T207-W253 HydrophobicContact CG2-CD2 4.45Å; T207-W253 HydrophobicContact CG2-CG 4.23Å
208	V	95.1	Very high	95.3	Very high	57 Å²	57	42.1 Å²	42.1	35%	0.345	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126	171.8	-177.8	0	0	0	0	108.6	A212 Q213 V234 G271	V208-A212 CarbonylContact C-O 3.56Å; V208-A212 VanDerWaalsContact CA-O 3.31Å; V208-A212 WeakPolarHBondContact CA-O 3.23Å; V208-Q213 HydrophobicContact CG2-CB 4.2Å; V208-Q213 HydrophobicContact CG2-CG 4.21Å; V208-V234 HydrophobicContact CG1-CG1 3.83Å; V208-G271 WeakPolarHBondContact CG1-O 3.27Å
209	R	93	Very high	95.2	Very high	135 Å²	135	41.6 Å²	41.6	51%	0.509	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	137	178.8	-64.4	-63.5	-175.4	157.3	4.5	109.4	T207 L211 A212 F214 M245 P256	T207-R209 HydrophobicContact CG2-CG 4.19Å; R209-L211 PolarHBondContact O-N 3.45Å; R209-A212 PolarHBondContact N-O 2.72Å; R209-A212 PolarHBondContact O-N 3.32Å; R209-A212 VanDerWaalsContact O-O 3.11Å; R209-F214 HydrophobicContact CB-CE2 4.18Å; R209-M245 HydrophobicContact CB-SD 3.74Å; R209-M245 HydrophobicContact CG-CE 3.94Å; R209-M245 HydrophobicContact CG-SD 3.68Å; R209-P256 HydrophobicContact CB-CB 4.4Å; R209-P256 HydrophobicContact CB-CG 4.5Å
210	N	93.7	Very high	94.8	Very high	68 Å²	68	41.9 Å²	41.9	36%	0.364	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	41.1	178.4	-55.2	-1.9	0	0	0	113	A212 G258 N259 C260	N210-A212 PolarHBondContact O-N 3.33Å; N210-G258 PolarHBondContact ND2-O 3.14Å; N210-N259 HydrophobicContact CB-CB 3.79Å; N210-C260 PolarHBondContact O-N 2.75Å
211	L	95.3	Very high	94.2	Very high	7 Å²	7	42.6 Å²	42.6	4%	0.037	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	21.3	-173.9	-63.4	169.9	0	0	0	115.7	R209 V234 C260 C262 E268	R209-L211 PolarHBondContact O-N 3.45Å; L211-V234 HydrophobicContact CB-CG2 4.2Å; L211-V234 HydrophobicContact CD2-CG2 4.01Å; L211-V234 PolarHBondContact O-N 3.08Å; L211-C260 HydrophobicContact CB-CB 3.89Å; L211-C262 HydrophobicContact CD1-CB 4.41Å; L211-C262 WeakPolarHBondContact CD1-SG 3.38Å; L211-E268 HydrophobicContact CD1-CB 4.34Å; L211-E268 HydrophobicContact CD2-CB 4.04Å; L211-E268 HydrophobicContact CD2-CG 3.72Å; L211-E268 HydrophobicContact CG-CG 4.31Å
212	A	96.1	Very high	93.7	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.4	170.6	0	0	0	0	0	111.2	V208 R209 N210 F214 S232 P243	V208-A212 CarbonylContact C-O 3.56Å; V208-A212 VanDerWaalsContact CA-O 3.31Å; V208-A212 WeakPolarHBondContact CA-O 3.23Å; R209-A212 PolarHBondContact N-O 2.72Å; R209-A212 PolarHBondContact O-N 3.32Å; R209-A212 VanDerWaalsContact O-O 3.11Å; N210-A212 PolarHBondContact O-N 3.33Å; A212-F214 HydrophobicContact CB-CE2 3.73Å; A212-F214 HydrophobicContact CB-CZ 4.06Å; A212-F214 VanDerWaalsContact O-CD2 3.29Å; A212-F214 WeakPolarHBondContact O-CD2 3.32Å; A212-F214 VanDerWaalsContact O-CE2 3.31Å; A212-F214 WeakPolarHBondContact O-CE2 3.44Å; A212-S232 CarbonylContact C-O 3.5Å; A212-S232 WeakPolarHBondContact CA-O 3.22Å; A212-P243 HydrophobicContact CB-CB 3.39Å; A212-P243 HydrophobicContact CB-CG 3.65Å
213	Q	96.4	Very high	92.8	Very high	90 Å²	90	47.7 Å²	47.7	42%	0.421	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	133.5	174.1	-172.8	176.2	17.5	0	0	110.3	L206 T207 V208 G231 S232 V234	L206-Q213 HydrophobicContact CD1-CG 4.24Å; T207-Q213 WeakPolarHBondContact O-CA 3.22Å; V208-Q213 HydrophobicContact CG2-CB 4.2Å; V208-Q213 HydrophobicContact CG2-CG 4.21Å; Q213-G231 CarbonylContact O-C 3.56Å; Q213-G231 VanDerWaalsContact O-CA 3.31Å; Q213-G231 WeakPolarHBondContact O-CA 3.21Å; Q213-S232 PolarHBondContact N-O 2.77Å; Q213-S232 PolarHBondContact O-N 3.46Å; Q213-V234 HydrophobicContact CB-CG1 4.5Å
214	F	96.3	Very high	92.1	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.009	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.2	178.3	-63.5	-95.7	0	0	0	108.9	L206 T207 R209 A212 V229 P243 M245 W253	L206-F214 WeakPolarHBondContact CA-O 3.31Å; T207-F214 HydrophobicContact CG2-CB 4.2Å; T207-F214 PolarHBondContact N-O 3.37Å; T207-F214 VanDerWaalsContact N-O 3.08Å; T207-F214 PolarHBondContact O-N 3.4Å; R209-F214 HydrophobicContact CB-CE2 4.18Å; A212-F214 HydrophobicContact CB-CE2 3.73Å; A212-F214 HydrophobicContact CB-CZ 4.06Å; A212-F214 VanDerWaalsContact O-CD2 3.29Å; A212-F214 WeakPolarHBondContact O-CD2 3.32Å; A212-F214 VanDerWaalsContact O-CE2 3.31Å; A212-F214 WeakPolarHBondContact O-CE2 3.44Å; F214-V229 HydrophobicContact CD1-CB 4.47Å; F214-V229 HydrophobicContact CD1-CG1 4.16Å; F214-P243 HydrophobicContact CZ-CB 4.05Å; F214-M245 HydrophobicContact CD1-CB 3.82Å; F214-M245 HydrophobicContact CD1-CG 4.02Å; F214-M245 HydrophobicContact CD1-SD 4.02Å; F214-M245 HydrophobicContact CD2-CG 4.4Å; F214-M245 HydrophobicContact CD2-SD 3.46Å; F214-M245 WeakPolarHBondContact CD2-SD 3.49Å; F214-M245 HydrophobicContact CE1-CB 3.66Å; F214-M245 HydrophobicContact CE1-CG 3.57Å; F214-M245 HydrophobicContact CE1-SD 3.92Å; F214-M245 HydrophobicContact CE2-CG 4Å; F214-M245 HydrophobicContact CE2-SD 3.35Å; F214-M245 WeakPolarHBondContact CE2-SD 3.37Å; F214-M245 HydrophobicContact CG-CB 4.48Å; F214-M245 HydrophobicContact CG-CG 4.42Å; F214-M245 HydrophobicContact CG-SD 3.8Å; F214-M245 HydrophobicContact CZ-CB 4.2Å; F214-M245 HydrophobicContact CZ-CG 3.56Å; F214-M245 HydrophobicContact CZ-SD 3.6Å; F214-M245 VanDerWaalsContact CZ-SD 3.6Å; F214-W253 HydrophobicContact CB-CH2 3.95Å; F214-W253 HydrophobicContact CB-CZ2 3.8Å
215	P	95.9	Very high	91.5	Very high	66 Å²	66	51.7 Å²	51.7	43%	0.429	29%	0.29	S	S	.	.			trans	-71.1	160.8	-174.7	30.1	-36.9	0	0	0	113.2	T217 V229	P215-T217 PolarHBondContact O-N 3.05Å; P215-T217 VanDerWaalsContact O-N 3.07Å; P215-T217 PolarHBondContact O-OG1 3.45Å; P215-V229 HydrophobicContact CG-CG1 4.17Å
216	D	95.9	Very high	91.2	Very high	84 Å²	84	54.6 Å²	54.6	45%	0.449	30%	0.302	S	S	.	.			trans	-47	115.2	162.2	-96.7	6.7	0	0	0	109.7	K203 C204 P205 L206	K203-D216 HydrophobicContact CD-CB 4.46Å; K203-D216 IonicContact NZ-OD1 3.51Å; K203-D216 IonicContact NZ-OD2 3.6Å; K203-D216 PolarHBondContact NZ-OD2 2.96Å; C204-D216 WeakPolarHBondContact O-CA 2.97Å; P205-D216 WeakPolarHBondContact CA-OD1 3.27Å; L206-D216 PolarHBondContact N-OD1 2.94Å
217	T	95.2	Very high	91.1	Very high	17 Å²	17	52 Å²	52	10%	0.104	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	119.4	-173.1	-60.3	0	0	0	0	110.3	K203 C204 P215 V227 V229 C247	K203-T217 CarbonylContact C-O 3.59Å; K203-T217 WeakPolarHBondContact CA-O 3.33Å; K203-T217 WeakPolarHBondContact CB-O 3.18Å; C204-T217 PolarHBondContact N-O 2.7Å; C204-T217 PolarHBondContact O-N 2.97Å; P215-T217 PolarHBondContact O-N 3.05Å; P215-T217 VanDerWaalsContact O-N 3.07Å; P215-T217 PolarHBondContact O-OG1 3.45Å; T217-V227 HydrophobicContact CG2-CB 4.4Å; T217-V227 HydrophobicContact CG2-CG1 4.03Å; T217-V229 HydrophobicContact CG2-CG2 3.66Å; T217-C247 HydrophobicContact CG2-CB 3.91Å
218	I	95.2	Very high	91	Very high	58 Å²	58	54.9 Å²	54.9	30%	0.297	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	140.9	176.5	-55.1	-174.7	0	0	0	109.8	Y201	Y201-I218 HydrophobicContact CD2-CG2 4Å; Y201-I218 HydrophobicContact CE2-CD1 4.04Å; Y201-I218 HydrophobicContact CE2-CG1 3.99Å; Y201-I218 HydrophobicContact CE2-CG2 4.11Å
219	T	93.4	Very high	91.1	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.018	29%	0.289	C	S	.	.			trans	-67.3	157.3	179.2	58	0	0	0	0	113	K202 G248	K202-T219 HydrophobicContact CB-CG2 3.77Å; K202-T219 PolarHBondContact O-N 2.99Å; K202-T219 VanDerWaalsContact O-N 3.13Å; K202-T219 PolarHBondContact O-OG1 3.36Å; T219-G248 WeakPolarHBondContact CG2-O 3.45Å
220	G	87.4	Confident	91.2	Very high	7 Å²	7	53.2 Å²	53.2	7%	0.072	29%	0.291	C	S	.	.			trans	-72.3	-177.6	-176.6	0	0	0	0	0	115	D222	G220-D222 PolarHBondContact O-N 3.02Å
221	A	83.3	Confident	91.3	Very high	19 Å²	19	50.1 Å²	50.1	16%	0.157	28%	0.275	C	S	.	.	S	Bend	trans	-61.1	-39.4	-176.9	0	0	0	0	0	113.9	R96 P175	R96-A221 VanDerWaalsContact CZ-O 3.22Å; R96-A221 PolarHBondContact NE-O 3.42Å; R96-A221 PolarHBondContact NH2-O 2.91Å; P175-A221 HydrophobicContact CB-CB 3.93Å; P175-A221 HydrophobicContact CG-CB 4.46Å
222	D	83.1	Confident	91.3	Very high	78 Å²	78	53.7 Å²	53.7	42%	0.417	30%	0.3	S	S	.	.	S	Bend	trans	-116.2	156.9	-168.3	-56.5	-46.3	0	0	0	112.5	R96 G220 S224 S225 A249	R96-D222 IonicContact NH2-OD1 3.93Å; G220-D222 PolarHBondContact O-N 3.02Å; D222-S224 PolarHBondContact O-N 3.36Å; D222-S225 PolarHBondContact N-OG 3.31Å; D222-S225 VanDerWaalsContact O-CB 3.23Å; D222-S225 WeakPolarHBondContact O-CB 3.45Å; D222-S225 PolarHBondContact O-N 3.24Å; D222-S225 PolarHBondContact O-OG 2.86Å; D222-A249 VanDerWaalsContact O-CB 3.32Å; D222-A249 WeakPolarHBondContact O-CB 3.03Å
223	T	75.5	Confident	91.3	Very high	93 Å²	93	55.6 Å²	55.6	57%	0.571	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-7.7	178.2	52	0	0	0	0	114.5	A249	T223-A249 WeakPolarHBondContact O-CB 3.5Å
224	S	81.9	Confident	91.3	Very high	102 Å²	102	52.3 Å²	52.3	71%	0.713	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	6.8	172	58.6	0	0	0	0	113.7	D222	D222-S224 PolarHBondContact O-N 3.36Å
225	S	83.6	Confident	91.2	Very high	24 Å²	24	58.6 Å²	58.6	17%	0.168	33%	0.333	C	S	.	.			trans	-65.7	138.9	179.8	-78.5	0	0	0	0	112.5	D222 A249	D222-S225 PolarHBondContact N-OG 3.31Å; D222-S225 VanDerWaalsContact O-CB 3.23Å; D222-S225 WeakPolarHBondContact O-CB 3.45Å; D222-S225 PolarHBondContact O-N 3.24Å; D222-S225 PolarHBondContact O-OG 2.86Å; S225-A249 PolarHBondContact O-N 2.82Å
226	L	89.3	Confident	91.1	Very high	101 Å²	101	58.5 Å²	58.5	53%	0.529	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	117.4	170.6	-60.3	-174.9	0	0	0	109.4	Y246 C247 L254	L226-Y246 HydrophobicContact CB-CD1 4.22Å; L226-C247 WeakPolarHBondContact CA-O 3.37Å; L226-L254 HydrophobicContact CD1-CD1 4.12Å; L226-L254 HydrophobicContact CD2-CD1 3.5Å; L226-L254 VanDerWaalsContact CD2-CD1 3.5Å; L226-L254 HydrophobicContact CG-CD1 4.45Å
227	V	92.2	Very high	91.1	Very high	47 Å²	47	55.3 Å²	55.3	29%	0.285	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.8	177.1	-176.8	0	0	0	0	108.7	T217 V229 Y246 C247	T217-V227 HydrophobicContact CG2-CB 4.4Å; T217-V227 HydrophobicContact CG2-CG1 4.03Å; V227-V229 HydrophobicContact CG1-CG2 4.33Å; V227-Y246 CarbonylContact O-C 3.57Å; V227-Y246 WeakPolarHBondContact O-CA 3.46Å; V227-C247 HydrophobicContact CB-CB 4.28Å; V227-C247 PolarHBondContact N-O 2.96Å; V227-C247 PolarHBondContact O-N 2.83Å
228	E	94.2	Very high	91	Very high	94 Å²	94	59.6 Å²	59.6	44%	0.439	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129.4	173.4	-166.3	-169	94.5	0	0	110.3	K244 Y246	E228-K244 HydrophobicContact CG-CD 4.26Å; E228-K244 WeakPolarHBondContact OE1-CE 3.44Å; E228-K244 IonicContact OE1-NZ 3.24Å; E228-K244 PolarHBondContact OE1-NZ 3.17Å; E228-K244 IonicContact OE2-NZ 3.61Å; E228-K244 PolarHBondContact OE2-NZ 3.26Å; E228-Y246 HydrophobicContact CB-CD1 3.96Å; E228-Y246 HydrophobicContact CB-CE1 3.64Å; E228-Y246 HydrophobicContact CG-CD1 4.26Å; E228-Y246 HydrophobicContact CG-CE1 3.7Å; E228-Y246 PolarHBondContact OE2-OH 2.85Å
229	V	96	Very high	91	Very high	14 Å²	14	61 Å²	61	9%	0.085	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	123.1	176.8	-176.2	0	0	0	0	109.5	F214 P215 T217 V227 K244 M245 W253	F214-V229 HydrophobicContact CD1-CB 4.47Å; F214-V229 HydrophobicContact CD1-CG1 4.16Å; P215-V229 HydrophobicContact CG-CG1 4.17Å; T217-V229 HydrophobicContact CG2-CG2 3.66Å; V227-V229 HydrophobicContact CG1-CG2 4.33Å; V229-K244 WeakPolarHBondContact O-CA 3.39Å; V229-M245 PolarHBondContact N-O 2.91Å; V229-M245 PolarHBondContact O-N 2.96Å; V229-W253 HydrophobicContact CB-CH2 3.95Å; V229-W253 HydrophobicContact CB-CZ3 4.09Å; V229-W253 HydrophobicContact CG1-CH2 4.15Å; V229-W253 HydrophobicContact CG2-CH2 3.86Å; V229-W253 HydrophobicContact CG2-CZ3 4.04Å
230	R	95.7	Very high	90.9	Very high	143 Å²	143	66.5 Å²	66.5	54%	0.54	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	127.2	168.4	-172.3	-175.1	179.1	165.7	4.8	109.2	E239 V242 P243	R230-E239 IonicContact CZ-OE2 2.72Å; R230-E239 IonicContact NE-OE2 2.72Å; R230-E239 IonicContact NH2-OE1 3.13Å; R230-E239 PolarHBondContact NH2-OE1 3.15Å; R230-E239 IonicContact NH2-OE2 2.72Å; R230-E239 PolarHBondContact NH2-OE2 2.9Å; R230-V242 HydrophobicContact CG-CG1 4.15Å; R230-P243 WeakPolarHBondContact CA-O 3.42Å
231	G	95.2	Very high	91	Very high	3 Å²	3	70.1 Å²	70.1	3%	0.031	38%	0.379	C	S	.	.			trans	-75.8	157.5	172.8	0	0	0	0	0	111.8	Q213 P243	Q213-G231 CarbonylContact O-C 3.56Å; Q213-G231 VanDerWaalsContact O-CA 3.31Å; Q213-G231 WeakPolarHBondContact O-CA 3.21Å; G231-P243 PolarHBondContact N-O 2.03Å
232	S	96.1	Very high	91.5	Very high	82 Å²	82	72.2 Å²	72.2	57%	0.573	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.8	169.2	-62.8	0	0	0	0	109.3	A212 Q213 V234	A212-S232 CarbonylContact C-O 3.5Å; A212-S232 WeakPolarHBondContact CA-O 3.22Å; Q213-S232 PolarHBondContact N-O 2.77Å; Q213-S232 PolarHBondContact O-N 3.46Å; S232-V234 PolarHBondContact O-N 2.89Å
233	C	96.3	Very high	92.1	Very high	41 Å²	41	68.6 Å²	68.6	28%	0.277	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	137.3	177.7	-67.3	0	0	0	0	111.5	S237 E239 C260	C233-S237 WeakPolarHBondContact CB-OG 3.31Å; C233-E239 VanDerWaalsContact SG-CA 3.59Å; C233-C260 WeakPolarHBondContact CA-SG 3.44Å; C233-C260 HydrophobicContact CB-CB 3.74Å; C233-C260 WeakPolarHBondContact CB-SG 3.46Å; C233-C260 WeakPolarHBondContact SG-CB 3.11Å; C233-C260 CovalentContact SG-SG 2.04Å; C233-C260 PolarHBondContact SG-SG 2.84Å
234	V	95.8	Very high	93	Very high	20 Å²	20	67.1 Å²	67.1	12%	0.121	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-66.4	159.2	177.8	-59.7	0	0	0	0	110.9	V208 L211 Q213 S232 S237	V208-V234 HydrophobicContact CG1-CG1 3.83Å; L211-V234 HydrophobicContact CB-CG2 4.2Å; L211-V234 HydrophobicContact CD2-CG2 4.01Å; L211-V234 PolarHBondContact O-N 3.08Å; Q213-V234 HydrophobicContact CB-CG1 4.5Å; S232-V234 PolarHBondContact O-N 2.89Å; V234-S237 PolarHBondContact N-OG 3.42Å; V234-S237 WeakPolarHBondContact O-CB 3.12Å; V234-S237 PolarHBondContact O-N 3.35Å; V234-S237 VanDerWaalsContact O-N 3.12Å; V234-S237 PolarHBondContact O-OG 3.33Å
235	N	94.1	Very high	93.5	Very high	134 Å²	134	62.4 Å²	62.4	72%	0.717	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	143.3	-178.1	-164	14.6	0	0	0	111.7	S237	N235-S237 VanDerWaalsContact C-N 3.31Å
236	N	94.1	Very high	93.9	Very high	64 Å²	64	64.5 Å²	64.5	34%	0.342	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	30.6	-170.3	-44.4	-56.5	0	0	0	114.9	N263 C273	N236-N263 WeakPolarHBondContact O-CB 3.39Å; N236-N263 PolarHBondContact O-N 2.78Å; N236-N263 PolarHBondContact O-OD1 3.36Å; N236-C273 HydrophobicContact CB-CB 4.16Å; N236-C273 WeakPolarHBondContact O-CB 3.32Å
237	S	95.3	Very high	94.2	Very high	18 Å²	18	59.7 Å²	59.7	13%	0.126	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	154.8	169.9	75.1	0	0	0	0	113.3	C233 V234 N235 L261 N263 C273	C233-S237 WeakPolarHBondContact CB-OG 3.31Å; V234-S237 PolarHBondContact N-OG 3.42Å; V234-S237 WeakPolarHBondContact O-CB 3.12Å; V234-S237 PolarHBondContact O-N 3.35Å; V234-S237 VanDerWaalsContact O-N 3.12Å; V234-S237 PolarHBondContact O-OG 3.33Å; N235-S237 VanDerWaalsContact C-N 3.31Å; S237-L261 CarbonylContact C-O 3.54Å; S237-L261 WeakPolarHBondContact CA-O 3.34Å; S237-L261 VanDerWaalsContact CB-O 3.27Å; S237-L261 WeakPolarHBondContact CB-O 3.35Å; S237-N263 VanDerWaalsContact C-OD1 3.23Å; S237-N263 WeakPolarHBondContact CA-OD1 3.08Å; S237-C273 VanDerWaalsContact CB-SG 3.59Å
238	E	93.5	Very high	94.1	Very high	106 Å²	106	57.7 Å²	57.7	50%	0.495	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	144.4	-179.4	-79.9	164.1	-177.1	0	0	111.3	K240 C260 L261 N263	E238-K240 PolarHBondContact O-N 2.93Å; E238-C260 CarbonylContact O-C 3.49Å; E238-C260 WeakPolarHBondContact O-CA 3.42Å; E238-C260 WeakPolarHBondContact O-CB 3.35Å; E238-L261 PolarHBondContact N-O 3.2Å; E238-L261 PolarHBondContact O-N 3.15Å; E238-N263 WeakPolarHBondContact CG-OD1 3.47Å; E238-N263 PolarHBondContact N-OD1 3.13Å
239	E	94.6	Very high	93.8	Very high	87 Å²	87	53.6 Å²	53.6	41%	0.407	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	117.8	176.2	-175.7	171.8	89.7	0	0	110.2	R230 C233 P243	R230-E239 IonicContact CZ-OE2 2.72Å; R230-E239 IonicContact NE-OE2 2.72Å; R230-E239 IonicContact NH2-OE1 3.13Å; R230-E239 PolarHBondContact NH2-OE1 3.15Å; R230-E239 IonicContact NH2-OE2 2.72Å; R230-E239 PolarHBondContact NH2-OE2 2.9Å; C233-E239 VanDerWaalsContact SG-CA 3.59Å; E239-P243 WeakPolarHBondContact OE2-CD 3.43Å
240	K	91	Very high	93.5	Very high	119 Å²	119	56.8 Å²	56.8	52%	0.517	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	-48.8	172.6	173.1	-179.3	159.3	-73.5	0	111	E238 N259 L261	E238-K240 PolarHBondContact O-N 2.93Å; K240-N259 PolarHBondContact N-O 2.77Å; K240-N259 VanDerWaalsContact N-O 3.07Å; K240-N259 PolarHBondContact NZ-OD1 2.77Å; K240-L261 HydrophobicContact CB-CD1 4.21Å; K240-L261 HydrophobicContact CB-CG 4.16Å; K240-L261 HydrophobicContact CD-CD1 3.75Å; K240-L261 HydrophobicContact CD-CG 4.13Å; K240-L261 HydrophobicContact CG-CD1 4.43Å
241	D	91.5	Very high	93.2	Very high	83 Å²	83	50 Å²	50	44%	0.444	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	130.6	175.7	-73.8	-71.8	0	0	0	107	P243 G258 N259	D241-P243 WeakPolarHBondContact O-CD 3.3Å; D241-G258 CarbonylContact O-C 3.58Å; D241-G258 WeakPolarHBondContact O-CA 3.43Å; D241-N259 PolarHBondContact N-O 3.18Å; D241-N259 PolarHBondContact O-N 3.4Å
242	V	93.7	Very high	93.1	Very high	64 Å²	64	54.9 Å²	54.9	39%	0.388	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51	113.5	-170.2	-176	0	0	0	0	111.5	R230 K244	R230-V242 HydrophobicContact CG-CG1 4.15Å; V242-K244 HydrophobicContact CG1-CG 4.45Å; V242-K244 PolarHBondContact O-N 3.04Å
243	P	95.3	Very high	92.9	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.006	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.2	-175.9	29.2	-33.9	0	0	0	110.4	A212 F214 R230 G231 E239 D241 I257	A212-P243 HydrophobicContact CB-CB 3.39Å; A212-P243 HydrophobicContact CB-CG 3.65Å; F214-P243 HydrophobicContact CZ-CB 4.05Å; R230-P243 WeakPolarHBondContact CA-O 3.42Å; G231-P243 PolarHBondContact N-O 2.03Å; E239-P243 WeakPolarHBondContact OE2-CD 3.43Å; D241-P243 WeakPolarHBondContact O-CD 3.3Å; P243-I257 CarbonylContact C-O 3.32Å; P243-I257 WeakPolarHBondContact CA-O 3.49Å
244	K	93.4	Very high	92.4	Very high	62 Å²	62	54.2 Å²	54.2	27%	0.27	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	143.1	178.8	-67.7	-170.5	174.2	-155.3	0	110.9	E228 V229 V242 P256 I257	E228-K244 HydrophobicContact CG-CD 4.26Å; E228-K244 WeakPolarHBondContact OE1-CE 3.44Å; E228-K244 IonicContact OE1-NZ 3.24Å; E228-K244 PolarHBondContact OE1-NZ 3.17Å; E228-K244 IonicContact OE2-NZ 3.61Å; E228-K244 PolarHBondContact OE2-NZ 3.26Å; V229-K244 WeakPolarHBondContact O-CA 3.39Å; V242-K244 HydrophobicContact CG1-CG 4.45Å; V242-K244 PolarHBondContact O-N 3.04Å; K244-P256 WeakPolarHBondContact O-CA 3.3Å; K244-I257 PolarHBondContact N-O 2.7Å; K244-I257 PolarHBondContact O-N 2.61Å
245	M	93	Very high	91.9	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	160.1	170.3	-74.2	177	63.5	0	0	109.4	T207 R209 F214 V229 W253 P256	T207-M245 HydrophobicContact CG2-CE 4.35Å; R209-M245 HydrophobicContact CB-SD 3.74Å; R209-M245 HydrophobicContact CG-CE 3.94Å; R209-M245 HydrophobicContact CG-SD 3.68Å; F214-M245 HydrophobicContact CD1-CB 3.82Å; F214-M245 HydrophobicContact CD1-CG 4.02Å; F214-M245 HydrophobicContact CD1-SD 4.02Å; F214-M245 HydrophobicContact CD2-CG 4.4Å; F214-M245 HydrophobicContact CD2-SD 3.46Å; F214-M245 WeakPolarHBondContact CD2-SD 3.49Å; F214-M245 HydrophobicContact CE1-CB 3.66Å; F214-M245 HydrophobicContact CE1-CG 3.57Å; F214-M245 HydrophobicContact CE1-SD 3.92Å; F214-M245 HydrophobicContact CE2-CG 4Å; F214-M245 HydrophobicContact CE2-SD 3.35Å; F214-M245 WeakPolarHBondContact CE2-SD 3.37Å; F214-M245 HydrophobicContact CG-CB 4.48Å; F214-M245 HydrophobicContact CG-CG 4.42Å; F214-M245 HydrophobicContact CG-SD 3.8Å; F214-M245 HydrophobicContact CZ-CB 4.2Å; F214-M245 HydrophobicContact CZ-CG 3.56Å; F214-M245 HydrophobicContact CZ-SD 3.6Å; F214-M245 VanDerWaalsContact CZ-SD 3.6Å; V229-M245 PolarHBondContact N-O 2.91Å; V229-M245 PolarHBondContact O-N 2.96Å; M245-W253 HydrophobicContact CB-CE3 3.7Å; M245-W253 HydrophobicContact CB-CZ3 3.75Å; M245-W253 HydrophobicContact CE-CB 3.47Å; M245-W253 VanDerWaalsContact CE-CB 3.47Å; M245-W253 HydrophobicContact CE-CD2 3.72Å; M245-W253 HydrophobicContact CE-CE3 3.79Å; M245-W253 HydrophobicContact CE-CG 3.63Å; M245-P256 HydrophobicContact CG-CB 3.65Å; M245-P256 HydrophobicContact SD-CB 3.94Å
246	Y	92.8	Very high	91.6	Very high	69 Å²	69	53.9 Å²	53.9	27%	0.271	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.6	173.1	-62.2	-88.6	0	0	0	109.4	L226 V227 E228 L254 I257	L226-Y246 HydrophobicContact CB-CD1 4.22Å; V227-Y246 CarbonylContact O-C 3.57Å; V227-Y246 WeakPolarHBondContact O-CA 3.46Å; E228-Y246 HydrophobicContact CB-CD1 3.96Å; E228-Y246 HydrophobicContact CB-CE1 3.64Å; E228-Y246 HydrophobicContact CG-CD1 4.26Å; E228-Y246 HydrophobicContact CG-CE1 3.7Å; E228-Y246 PolarHBondContact OE2-OH 2.85Å; Y246-L254 PolarHBondContact O-N 2.97Å; Y246-I257 HydrophobicContact CE2-CD1 4.18Å
247	C	93.8	Very high	91.3	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	121	170	176.4	0	0	0	0	109.3	C204 T217 L226 V227 W253	C204-C247 HydrophobicContact CB-CB 3.75Å; C204-C247 WeakPolarHBondContact CB-SG 3.34Å; C204-C247 WeakPolarHBondContact SG-CA 3.44Å; C204-C247 WeakPolarHBondContact SG-CB 3.49Å; C204-C247 CovalentContact SG-SG 2.03Å; C204-C247 PolarHBondContact SG-SG 3.27Å; T217-C247 HydrophobicContact CG2-CB 3.91Å; L226-C247 WeakPolarHBondContact CA-O 3.37Å; V227-C247 HydrophobicContact CB-CB 4.28Å; V227-C247 PolarHBondContact N-O 2.96Å; V227-C247 PolarHBondContact O-N 2.83Å; C247-W253 HydrophobicContact CB-CE3 4.21Å; C247-W253 HydrophobicContact CB-CH2 4.33Å; C247-W253 HydrophobicContact CB-CZ3 3.9Å
248	G	90.3	Very high	91.1	Very high	4 Å²	4	55.4 Å²	55.4	4%	0.041	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	155.9	177.6	0	0	0	0	0	112.9	T219 D250 G251 E252	T219-G248 WeakPolarHBondContact CG2-O 3.45Å; G248-D250 PolarHBondContact O-N 3.17Å; G248-D250 VanDerWaalsContact O-N 3.15Å; G248-G251 PolarHBondContact O-N 3.34Å; G248-E252 PolarHBondContact N-O 2.8Å
249	A	89.1	Confident	91.1	Very high	8 Å²	8	52 Å²	52	7%	0.066	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.4	-179.5	0	0	0	0	0	114.8	Y98 D222 T223 S225 G251	Y98-A249 PolarHBondContact OH-O 2.88Å; D222-A249 VanDerWaalsContact O-CB 3.32Å; D222-A249 WeakPolarHBondContact O-CB 3.03Å; T223-A249 WeakPolarHBondContact O-CB 3.5Å; S225-A249 PolarHBondContact O-N 2.82Å; A249-G251 VanDerWaalsContact C-N 3.29Å
250	D	88.4	Confident	91.1	Very high	81 Å²	81	48 Å²	48	43%	0.433	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.5	172.6	58.2	-6.2	0	0	0	114.2	N29 K202 G248 E252	N29-D250 PolarHBondContact ND2-O 2.96Å; K202-D250 WeakPolarHBondContact CD-O 3.45Å; K202-D250 PolarHBondContact NZ-O 3.07Å; G248-D250 PolarHBondContact O-N 3.17Å; G248-D250 VanDerWaalsContact O-N 3.15Å; D250-E252 PolarHBondContact OD1-N 3.12Å; D250-E252 VanDerWaalsContact OD1-N 3.08Å
251	G	90.1	Very high	91.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.237	C	C	.	.	S	Bend	trans	83.8	10.2	-175.3	0	0	0	0	0	113.6	C204 G248 A249	C204-G251 WeakPolarHBondContact CA-O 3.49Å; G248-G251 PolarHBondContact O-N 3.34Å; A249-G251 VanDerWaalsContact C-N 3.29Å
252	E	92	Very high	91.6	Very high	107 Å²	107	40.7 Å²	40.7	50%	0.5	22%	0.217	S	C	.	.			trans	-95.3	149.1	177.3	-73.3	-61.3	151.9	0	0	113.1	C204 G248 D250	C204-E252 PolarHBondContact SG-O 3.42Å; C204-E252 VanDerWaalsContact SG-O 3.35Å; G248-E252 PolarHBondContact N-O 2.8Å; D250-E252 PolarHBondContact OD1-N 3.12Å; D250-E252 VanDerWaalsContact OD1-N 3.08Å
253	W	92.1	Very high	91.7	Very high	36 Å²	36	39.6 Å²	39.6	14%	0.136	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-89.2	118.5	178.5	-85.3	120.6	0	0	0	111.2	C204 P205 T207 F214 V229 M245 C247	C204-W253 HydrophobicContact CB-CD2 3.69Å; C204-W253 VanDerWaalsContact CB-CE2 3.41Å; C204-W253 HydrophobicContact CB-CE3 4.23Å; C204-W253 HydrophobicContact CB-CG 4.06Å; C204-W253 HydrophobicContact CB-CH2 4.3Å; C204-W253 HydrophobicContact CB-CZ2 3.76Å; P205-W253 PolarHBondContact O-NE1 3.32Å; T207-W253 HydrophobicContact CG2-CD2 4.45Å; T207-W253 HydrophobicContact CG2-CG 4.23Å; F214-W253 HydrophobicContact CB-CH2 3.95Å; F214-W253 HydrophobicContact CB-CZ2 3.8Å; V229-W253 HydrophobicContact CB-CH2 3.95Å; V229-W253 HydrophobicContact CB-CZ3 4.09Å; V229-W253 HydrophobicContact CG1-CH2 4.15Å; V229-W253 HydrophobicContact CG2-CH2 3.86Å; V229-W253 HydrophobicContact CG2-CZ3 4.04Å; M245-W253 HydrophobicContact CB-CE3 3.7Å; M245-W253 HydrophobicContact CB-CZ3 3.75Å; M245-W253 HydrophobicContact CE-CB 3.47Å; M245-W253 VanDerWaalsContact CE-CB 3.47Å; M245-W253 HydrophobicContact CE-CD2 3.72Å; M245-W253 HydrophobicContact CE-CE3 3.79Å; M245-W253 HydrophobicContact CE-CG 3.63Å; C247-W253 HydrophobicContact CB-CE3 4.21Å; C247-W253 HydrophobicContact CB-CH2 4.33Å; C247-W253 HydrophobicContact CB-CZ3 3.9Å
254	L	87.5	Confident	91.6	Very high	73 Å²	73	41.3 Å²	41.3	38%	0.382	22%	0.223	S	C	.	.			trans	-80.1	176.6	175.8	-56.5	-171.4	0	0	0	112.8	L226 Y246	L226-L254 HydrophobicContact CD1-CD1 4.12Å; L226-L254 HydrophobicContact CD2-CD1 3.5Å; L226-L254 VanDerWaalsContact CD2-CD1 3.5Å; L226-L254 HydrophobicContact CG-CD1 4.45Å; Y246-L254 PolarHBondContact O-N 2.97Å
255	V	83.9	Confident	91.7	Very high	104 Å²	104	38.3 Å²	38.3	63%	0.63	21%	0.21	S	C	*	.			trans	-50.7	124.8	-171	-176.1	0	0	0	0	112.5
256	P	88.3	Confident	91.9	Very high	43 Å²	43	39.8 Å²	39.8	28%	0.279	22%	0.217	S	C	.	.			trans	-72.1	137.5	174.5	28.9	-33.9	0	0	0	112.1	R209 K244 M245	R209-P256 HydrophobicContact CB-CB 4.4Å; R209-P256 HydrophobicContact CB-CG 4.5Å; K244-P256 WeakPolarHBondContact O-CA 3.3Å; M245-P256 HydrophobicContact CG-CB 3.65Å; M245-P256 HydrophobicContact SD-CB 3.94Å
257	I	87.7	Confident	92	Very high	94 Å²	94	37.7 Å²	37.7	48%	0.482	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	139.9	172.1	-55.7	175.3	0	0	0	107.3	P243 K244 Y246	P243-I257 CarbonylContact C-O 3.32Å; P243-I257 WeakPolarHBondContact CA-O 3.49Å; K244-I257 PolarHBondContact N-O 2.7Å; K244-I257 PolarHBondContact O-N 2.61Å; Y246-I257 HydrophobicContact CE2-CD1 4.18Å
258	G	90.2	Very high	92	Very high	19 Å²	19	42.9 Å²	42.9	20%	0.196	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	77.2	173.6	-177.7	0	0	0	0	0	114.1	N210 D241	N210-G258 PolarHBondContact ND2-O 3.14Å; D241-G258 CarbonylContact O-C 3.58Å; D241-G258 WeakPolarHBondContact O-CA 3.43Å
259	N	94	Very high	92.1	Very high	36 Å²	36	48.3 Å²	48.3	19%	0.193	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	153	-178.6	79.3	-91.9	0	0	0	111.9	N210 K240 D241 L261	N210-N259 HydrophobicContact CB-CB 3.79Å; K240-N259 PolarHBondContact N-O 2.77Å; K240-N259 VanDerWaalsContact N-O 3.07Å; K240-N259 PolarHBondContact NZ-OD1 2.77Å; D241-N259 PolarHBondContact N-O 3.18Å; D241-N259 PolarHBondContact O-N 3.4Å; N259-L261 WeakPolarHBondContact ND2-CD2 3.45Å
260	C	95.1	Very high	92	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.014	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	165.6	161.1	-47.5	0	0	0	0	109.8	N210 L211 C233 E238	N210-C260 PolarHBondContact O-N 2.75Å; L211-C260 HydrophobicContact CB-CB 3.89Å; C233-C260 WeakPolarHBondContact CA-SG 3.44Å; C233-C260 HydrophobicContact CB-CB 3.74Å; C233-C260 WeakPolarHBondContact CB-SG 3.46Å; C233-C260 WeakPolarHBondContact SG-CB 3.11Å; C233-C260 CovalentContact SG-SG 2.04Å; C233-C260 PolarHBondContact SG-SG 2.84Å; E238-C260 CarbonylContact O-C 3.49Å; E238-C260 WeakPolarHBondContact O-CA 3.42Å; E238-C260 WeakPolarHBondContact O-CB 3.35Å
261	L	95.6	Very high	91.9	Very high	45 Å²	45	50.7 Å²	50.7	24%	0.236	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.5	174.9	-70.8	179.8	0	0	0	109.8	S237 E238 K240 N259 N263 T286	S237-L261 CarbonylContact C-O 3.54Å; S237-L261 WeakPolarHBondContact CA-O 3.34Å; S237-L261 VanDerWaalsContact CB-O 3.27Å; S237-L261 WeakPolarHBondContact CB-O 3.35Å; E238-L261 PolarHBondContact N-O 3.2Å; E238-L261 PolarHBondContact O-N 3.15Å; K240-L261 HydrophobicContact CB-CD1 4.21Å; K240-L261 HydrophobicContact CB-CG 4.16Å; K240-L261 HydrophobicContact CD-CD1 3.75Å; K240-L261 HydrophobicContact CD-CG 4.13Å; K240-L261 HydrophobicContact CG-CD1 4.43Å; N259-L261 WeakPolarHBondContact ND2-CD2 3.45Å; L261-N263 PolarHBondContact O-N 3.05Å; L261-T286 HydrophobicContact CD1-CG2 4.38Å
262	C	96.2	Very high	92.1	Very high	4 Å²	4	56 Å²	56	3%	0.027	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	136.7	172.9	-62	0	0	0	0	111.1	L211 H266 E267 E268 C273 K282 S285	L211-C262 HydrophobicContact CD1-CB 4.41Å; L211-C262 WeakPolarHBondContact CD1-SG 3.38Å; C262-H266 HydrophobicContact CB-CB 3.99Å; C262-H266 WeakPolarHBondContact CB-O 3.19Å; C262-E267 VanDerWaalsContact SG-C 3.54Å; C262-E268 PolarHBondContact SG-N 3.4Å; C262-E268 VanDerWaalsContact SG-N 3.43Å; C262-C273 WeakPolarHBondContact CA-SG 3.35Å; C262-C273 HydrophobicContact CB-CB 3.66Å; C262-C273 WeakPolarHBondContact CB-SG 3.31Å; C262-C273 WeakPolarHBondContact SG-CA 3.21Å; C262-C273 WeakPolarHBondContact SG-CB 3.31Å; C262-C273 CovalentContact SG-SG 2.03Å; C262-C273 PolarHBondContact SG-SG 3.43Å; C262-K282 PolarHBondContact O-NZ 2.9Å; C262-S285 WeakPolarHBondContact O-CA 3.35Å; C262-S285 WeakPolarHBondContact O-CB 3.3Å
263	N	96.1	Very high	92.3	Very high	41 Å²	41	51.2 Å²	51.2	22%	0.219	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-62.4	170.8	-175.5	-68.8	9.7	0	0	0	112	N236 S237 E238 L261 G265 H266	N236-N263 WeakPolarHBondContact O-CB 3.39Å; N236-N263 PolarHBondContact O-N 2.78Å; N236-N263 PolarHBondContact O-OD1 3.36Å; S237-N263 VanDerWaalsContact C-OD1 3.23Å; S237-N263 WeakPolarHBondContact CA-OD1 3.08Å; E238-N263 WeakPolarHBondContact CG-OD1 3.47Å; E238-N263 PolarHBondContact N-OD1 3.13Å; L261-N263 PolarHBondContact O-N 3.05Å; N263-G265 PolarHBondContact O-N 3.44Å; N263-H266 PolarHBondContact O-N 3.27Å
264	A	94.8	Very high	92.4	Very high	36 Å²	36	52.4 Å²	52.4	30%	0.298	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	142.3	169.5	0	0	0	0	0	110.2	H266 T305	A264-H266 VanDerWaalsContact C-N 3.27Å; A264-H266 PolarHBondContact O-N 2.9Å; A264-H266 PolarHBondContact O-ND1 3.4Å; A264-T305 HydrophobicContact CB-CG2 3.71Å
265	G	95.1	Very high	92.9	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	4.1	-171.6	0	0	0	0	0	116.6	N263 C276 K282 G303	N263-G265 PolarHBondContact O-N 3.44Å; G265-C276 PolarHBondContact O-N 3.31Å; G265-C276 PolarHBondContact O-SG 3.34Å; G265-K282 PolarHBondContact N-O 2.95Å; G265-G303 WeakPolarHBondContact CA-O 3.33Å; G265-G303 WeakPolarHBondContact O-CA 3.29Å
266	H	96.3	Very high	93.4	Very high	34 Å²	34	45.3 Å²	45.3	16%	0.157	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	137.7	-176.3	-62.9	75.9	0	0	0	113.7	C262 N263 A264 C273 Q274 K282	C262-H266 HydrophobicContact CB-CB 3.99Å; C262-H266 WeakPolarHBondContact CB-O 3.19Å; N263-H266 PolarHBondContact O-N 3.27Å; A264-H266 VanDerWaalsContact C-N 3.27Å; A264-H266 PolarHBondContact O-N 2.9Å; A264-H266 PolarHBondContact O-ND1 3.4Å; H266-C273 HydrophobicContact CB-CB 4.27Å; H266-Q274 CarbonylContact C-O 3.54Å; H266-Q274 WeakPolarHBondContact CA-O 3.46Å; H266-K282 WeakPolarHBondContact O-CD 3.43Å; H266-K282 WeakPolarHBondContact O-CE 3.43Å; H266-K282 PolarHBondContact O-NZ 3.13Å
267	E	95.2	Very high	93.8	Very high	24 Å²	24	47.2 Å²	47.2	11%	0.112	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	154.2	175.2	63.7	177.2	-162.2	0	0	112.9	C262 R269 C273 Q274 C290	C262-E267 VanDerWaalsContact SG-C 3.54Å; E267-R269 PolarHBondContact O-N 3.24Å; E267-R269 IonicContact OE1-CZ 3.28Å; E267-R269 IonicContact OE1-NE 2.72Å; E267-R269 IonicContact OE1-NH2 2.91Å; E267-R269 PolarHBondContact OE1-NH2 3.29Å; E267-C273 WeakPolarHBondContact O-CA 3.03Å; E267-Q274 PolarHBondContact N-O 2.99Å; E267-Q274 PolarHBondContact O-N 2.85Å; E267-C290 HydrophobicContact CB-CB 4.5Å; E267-C290 VanDerWaalsContact CB-SG 3.59Å; E267-C290 HydrophobicContact CG-CB 4.41Å; E267-C290 VanDerWaalsContact CG-SG 3.55Å; E267-C290 VanDerWaalsContact OE2-CB 3.26Å; E267-C290 WeakPolarHBondContact OE2-CB 3.32Å; E267-C290 PolarHBondContact OE2-N 2.91Å
268	E	94.6	Very high	94.2	Very high	110 Å²	110	47 Å²	47	51%	0.514	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	125.4	175.1	176.6	166.6	-159.5	0	0	110.5	L211 C262 E272	L211-E268 HydrophobicContact CD1-CB 4.34Å; L211-E268 HydrophobicContact CD2-CB 4.04Å; L211-E268 HydrophobicContact CD2-CG 3.72Å; L211-E268 HydrophobicContact CG-CG 4.31Å; C262-E268 PolarHBondContact SG-N 3.4Å; C262-E268 VanDerWaalsContact SG-N 3.43Å; E268-E272 CarbonylContact C-O 3.6Å; E268-E272 WeakPolarHBondContact CA-O 3.2Å
269	R	91.8	Very high	94.3	Very high	118 Å²	118	46.4 Å²	46.4	45%	0.445	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	121.2	172.3	-166.4	173.6	-65.4	-134.6	1.1	109.7	E267 G271 E272 Q274	E267-R269 PolarHBondContact O-N 3.24Å; E267-R269 IonicContact OE1-CZ 3.28Å; E267-R269 IonicContact OE1-NE 2.72Å; E267-R269 IonicContact OE1-NH2 2.91Å; E267-R269 PolarHBondContact OE1-NH2 3.29Å; R269-G271 PolarHBondContact O-N 3.28Å; R269-G271 VanDerWaalsContact O-N 3.12Å; R269-E272 PolarHBondContact N-O 2.69Å; R269-E272 PolarHBondContact O-N 2.84Å; R269-Q274 HydrophobicContact CB-CG 4.29Å
270	S	87.1	Confident	94.4	Very high	123 Å²	123	49.4 Å²	49.4	86%	0.86	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	24.3	179.7	-52.7	0	0	0	0	115.4
271	G	86.6	Confident	94.4	Very high	15 Å²	15	50 Å²	50	16%	0.155	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	90	-3.3	-175.2	0	0	0	0	0	114.9	V208 R269	V208-G271 WeakPolarHBondContact CG1-O 3.27Å; R269-G271 PolarHBondContact O-N 3.28Å; R269-G271 VanDerWaalsContact O-N 3.12Å
272	E	93.7	Very high	94.5	Very high	112 Å²	112	48.2 Å²	48.2	52%	0.523	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	156.2	174.7	-59.4	179.8	154.2	0	0	111.5	E268 R269 Q274	E268-E272 CarbonylContact C-O 3.6Å; E268-E272 WeakPolarHBondContact CA-O 3.2Å; R269-E272 PolarHBondContact N-O 2.69Å; R269-E272 PolarHBondContact O-N 2.84Å; E272-Q274 HydrophobicContact CB-CG 4.1Å; E272-Q274 PolarHBondContact OE2-NE2 3.12Å
273	C	95.8	Very high	94.3	Very high	7 Å²	7	49.7 Å²	49.7	5%	0.047	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	98	167.9	-69.5	0	0	0	0	110.5	N236 S237 C262 H266 E267	N236-C273 HydrophobicContact CB-CB 4.16Å; N236-C273 WeakPolarHBondContact O-CB 3.32Å; S237-C273 VanDerWaalsContact CB-SG 3.59Å; C262-C273 WeakPolarHBondContact CA-SG 3.35Å; C262-C273 HydrophobicContact CB-CB 3.66Å; C262-C273 WeakPolarHBondContact CB-SG 3.31Å; C262-C273 WeakPolarHBondContact SG-CA 3.21Å; C262-C273 WeakPolarHBondContact SG-CB 3.31Å; C262-C273 CovalentContact SG-SG 2.03Å; C262-C273 PolarHBondContact SG-SG 3.43Å; H266-C273 HydrophobicContact CB-CB 4.27Å; E267-C273 WeakPolarHBondContact O-CA 3.03Å
274	Q	95.7	Very high	94.1	Very high	61 Å²	61	52.6 Å²	52.6	29%	0.285	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	143.4	-176.8	-61.4	-168.7	-3.1	0	0	111.1	H266 E267 R269 E272	H266-Q274 CarbonylContact C-O 3.54Å; H266-Q274 WeakPolarHBondContact CA-O 3.46Å; E267-Q274 PolarHBondContact N-O 2.99Å; E267-Q274 PolarHBondContact O-N 2.85Å; R269-Q274 HydrophobicContact CB-CG 4.29Å; E272-Q274 HydrophobicContact CB-CG 4.1Å; E272-Q274 PolarHBondContact OE2-NE2 3.12Å
275	A	96.2	Very high	93.9	Very high	27 Å²	27	52.4 Å²	52.4	22%	0.223	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	137.6	-178.2	0	0	0	0	0	112.1	K277 E302	A275-K277 PolarHBondContact O-N 3.38Å; A275-E302 HydrophobicContact CB-CB 4.26Å
276	C	96.3	Very high	93.6	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-52.8	136.8	176	-67.7	0	0	0	0	111	G265 Y281 K282 C290 E302 G303	G265-C276 PolarHBondContact O-N 3.31Å; G265-C276 PolarHBondContact O-SG 3.34Å; C276-Y281 VanDerWaalsContact SG-C 3.58Å; C276-K282 VanDerWaalsContact SG-CB 3.55Å; C276-C290 WeakPolarHBondContact CA-SG 3.29Å; C276-C290 HydrophobicContact CB-CB 3.76Å; C276-C290 WeakPolarHBondContact CB-SG 3.27Å; C276-C290 WeakPolarHBondContact SG-CB 3.45Å; C276-C290 CovalentContact SG-SG 2.03Å; C276-C290 PolarHBondContact SG-SG 2.65Å; C276-E302 CarbonylContact O-C 3.45Å; C276-E302 WeakPolarHBondContact O-CA 3.42Å; C276-E302 WeakPolarHBondContact O-CB 3.01Å; C276-G303 PolarHBondContact O-N 3.07Å
277	K	96.1	Very high	93.3	Very high	83 Å²	83	58.3 Å²	58.3	36%	0.361	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-73.4	155.9	-179.3	-60.3	-51	-177	-169.5	0	112.6	A275 G279 Y280 E302	A275-K277 PolarHBondContact O-N 3.38Å; K277-G279 PolarHBondContact O-N 3.01Å; K277-Y280 HydrophobicContact CB-CD2 4.36Å; K277-Y280 WeakPolarHBondContact O-CA 3.47Å; K277-Y280 VanDerWaalsContact O-CB 3.27Å; K277-Y280 WeakPolarHBondContact O-CB 3.46Å; K277-Y280 PolarHBondContact O-N 3.46Å; K277-E302 WeakPolarHBondContact CD-OE1 3.48Å; K277-E302 WeakPolarHBondContact CE-OE1 3.03Å; K277-E302 IonicContact NZ-OE1 2.86Å; K277-E302 PolarHBondContact NZ-OE1 3.29Å; K277-E302 IonicContact NZ-OE2 3.4Å; K277-E302 PolarHBondContact NZ-OE2 3.15Å
278	I	95.8	Very high	92.8	Very high	89 Å²	89	61.6 Å²	61.6	46%	0.456	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	132	-179.9	-54.8	178.3	0	0	0	109.6	Y280 Y298 S299 E302	I278-Y280 VanDerWaalsContact C-N 3.34Å; I278-Y298 HydrophobicContact CG2-CE1 4.2Å; I278-S299 VanDerWaalsContact CG2-O 3.32Å; I278-S299 WeakPolarHBondContact CG2-O 3.47Å; I278-E302 HydrophobicContact CG1-CG 3.88Å
279	G	92.9	Very high	92.7	Very high	8 Å²	8	60.6 Å²	60.6	8%	0.082	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	3	-170.7	0	0	0	0	0	115.6	K277 C293 S299	K277-G279 PolarHBondContact O-N 3.01Å; G279-C293 PolarHBondContact O-N 3.12Å; G279-C293 PolarHBondContact O-SG 2.94Å; G279-C293 VanDerWaalsContact O-SG 3.41Å; G279-S299 VanDerWaalsContact C-OG 3.32Å; G279-S299 VanDerWaalsContact CA-OG 3.28Å; G279-S299 WeakPolarHBondContact CA-OG 3.35Å; G279-S299 PolarHBondContact N-O 3.08Å; G279-S299 PolarHBondContact N-OG 2.91Å; G279-S299 VanDerWaalsContact N-OG 3.08Å
280	Y	95.9	Very high	92.9	Very high	99 Å²	99	55.5 Å²	55.5	39%	0.388	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	163.2	170.4	-61.9	-109	0	0	0	110.6	K277 I278 A291 K292 S299	K277-Y280 HydrophobicContact CB-CD2 4.36Å; K277-Y280 WeakPolarHBondContact O-CA 3.47Å; K277-Y280 VanDerWaalsContact O-CB 3.27Å; K277-Y280 WeakPolarHBondContact O-CB 3.46Å; K277-Y280 PolarHBondContact O-N 3.46Å; I278-Y280 VanDerWaalsContact C-N 3.34Å; Y280-A291 CarbonylContact C-O 3.43Å; Y280-A291 WeakPolarHBondContact CA-O 3.49Å; Y280-A291 WeakPolarHBondContact CB-O 3.14Å; Y280-K292 VanDerWaalsContact CD1-CA 3.48Å; Y280-K292 HydrophobicContact CD1-CB 3.93Å; Y280-K292 HydrophobicContact CE1-CB 3.71Å; Y280-K292 HydrophobicContact CE1-CG 4.31Å; Y280-S299 PolarHBondContact N-OG 2.77Å; Y280-S299 VanDerWaalsContact N-OG 3.12Å; Y280-S299 WeakPolarHBondContact O-CB 3.48Å; Y280-S299 PolarHBondContact O-OG 2.95Å
281	Y	95.8	Very high	93.2	Very high	15 Å²	15	51.5 Å²	51.5	6%	0.059	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	165.8	178.6	77.3	-69	0	0	0	110.9	C276 A283 C290 A291 A304 C307 A321 S322	C276-Y281 VanDerWaalsContact SG-C 3.58Å; Y281-A283 HydrophobicContact CE2-CB 4.26Å; Y281-C290 CarbonylContact O-C 3.54Å; Y281-C290 WeakPolarHBondContact O-CA 3.44Å; Y281-A291 HydrophobicContact CD1-CB 4.35Å; Y281-A291 VanDerWaalsContact CD1-O 3.23Å; Y281-A291 WeakPolarHBondContact CD1-O 3.48Å; Y281-A291 HydrophobicContact CE1-CB 3.64Å; Y281-A291 PolarHBondContact N-O 2.97Å; Y281-A291 PolarHBondContact O-N 3.22Å; Y281-A304 CarbonylContact C-O 3.6Å; Y281-A304 WeakPolarHBondContact CA-O 3.15Å; Y281-A304 WeakPolarHBondContact CB-O 3.47Å; Y281-C307 WeakPolarHBondContact CD1-SG 3.27Å; Y281-C307 VanDerWaalsContact CG-SG 3.57Å; Y281-A321 HydrophobicContact CE2-CB 4.17Å; Y281-S322 WeakPolarHBondContact OH-CA 3.28Å; Y281-S322 VanDerWaalsContact OH-CB 3.24Å; Y281-S322 WeakPolarHBondContact OH-CB 3.24Å
282	K	96.2	Very high	93.6	Very high	6 Å²	6	58 Å²	58	3%	0.026	32%	0.323	C	S	.	.			trans	-145.5	117.6	170.5	-176	-167.9	-174.9	-171.6	0	109.8	C262 G265 H266 C276 L284 S285 D287 A304 T305	C262-K282 PolarHBondContact O-NZ 2.9Å; G265-K282 PolarHBondContact N-O 2.95Å; H266-K282 WeakPolarHBondContact O-CD 3.43Å; H266-K282 WeakPolarHBondContact O-CE 3.43Å; H266-K282 PolarHBondContact O-NZ 3.13Å; C276-K282 VanDerWaalsContact SG-CB 3.55Å; K282-L284 WeakPolarHBondContact CE-O 3.41Å; K282-S285 PolarHBondContact NZ-O 2.81Å; K282-D287 HydrophobicContact CD-CB 4.36Å; K282-D287 WeakPolarHBondContact CE-O 3.34Å; K282-D287 HydrophobicContact CG-CB 3.7Å; K282-D287 PolarHBondContact NZ-O 3.23Å; K282-D287 VanDerWaalsContact NZ-O 3.15Å; K282-A304 PolarHBondContact N-O 3.32Å; K282-T305 WeakPolarHBondContact O-CA 2.96Å
283	A	92.6	Very high	93.7	Very high	35 Å²	35	53.4 Å²	53.4	29%	0.289	30%	0.304	S	S	.	.			trans	-83.2	-37.9	-166.9	0	0	0	0	0	113.4	Y281 D287 T305 A321	Y281-A283 HydrophobicContact CE2-CB 4.26Å; A283-D287 PolarHBondContact N-OD2 2.7Å; A283-T305 VanDerWaalsContact CA-O 3.31Å; A283-T305 WeakPolarHBondContact CA-O 3.44Å; A283-A321 HydrophobicContact CB-CB 4.31Å
284	L	92.3	Very high	93.7	Very high	103 Å²	103	53.8 Å²	53.8	54%	0.539	31%	0.306	S	S	.	.	S	Bend	trans	-126.9	149.2	-176.2	-60.5	169.9	0	0	0	109.9	K282 T286 D287	K282-L284 WeakPolarHBondContact CE-O 3.41Å; L284-T286 WeakPolarHBondContact CB-OG1 3.47Å; L284-T286 PolarHBondContact O-N 2.85Å; L284-D287 PolarHBondContact N-OD2 2.04Å; L284-D287 WeakPolarHBondContact O-CB 3.28Å; L284-D287 PolarHBondContact O-N 2.92Å
285	S	89.9	Confident	93.7	Very high	31 Å²	31	55 Å²	55	22%	0.217	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-27.4	173.5	47.9	0	0	0	0	112.5	C262 K282 D287	C262-S285 WeakPolarHBondContact O-CA 3.35Å; C262-S285 WeakPolarHBondContact O-CB 3.3Å; K282-S285 PolarHBondContact NZ-O 2.81Å; S285-D287 VanDerWaalsContact C-N 3.29Å; S285-D287 PolarHBondContact O-N 3.34Å
286	T	89.4	Confident	93.6	Very high	102 Å²	102	57.9 Å²	57.9	63%	0.626	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-13.4	174.1	55.1	0	0	0	0	115.2	L261 L284	L261-T286 HydrophobicContact CD1-CG2 4.38Å; L284-T286 WeakPolarHBondContact CB-OG1 3.47Å; L284-T286 PolarHBondContact O-N 2.85Å
287	D	88.8	Confident	93.6	Very high	57 Å²	57	58.3 Å²	58.3	31%	0.305	33%	0.331	S	S	.	.	S	Bend	trans	-68.1	145.7	173.8	-62.3	-27.5	0	0	0	109.6	K282 A283 L284 S285	K282-D287 HydrophobicContact CD-CB 4.36Å; K282-D287 WeakPolarHBondContact CE-O 3.34Å; K282-D287 HydrophobicContact CG-CB 3.7Å; K282-D287 PolarHBondContact NZ-O 3.23Å; K282-D287 VanDerWaalsContact NZ-O 3.15Å; A283-D287 PolarHBondContact N-OD2 2.7Å; L284-D287 PolarHBondContact N-OD2 2.04Å; L284-D287 WeakPolarHBondContact O-CB 3.28Å; L284-D287 PolarHBondContact O-N 2.92Å; S285-D287 VanDerWaalsContact C-N 3.29Å; S285-D287 PolarHBondContact O-N 3.34Å
288	A	84.4	Confident	93.5	Very high	92 Å²	92	60 Å²	60	76%	0.76	34%	0.336	S	S	*	.	S	Bend	trans	-72.8	-47	-172.7	0	0	0	0	0	113.9
289	T	93.2	Very high	93.5	Very high	89 Å²	89	55.9 Å²	55.9	55%	0.546	32%	0.315	S	S	.	.	S	Bend	trans	-146.9	173.6	-176.7	59.2	0	0	0	0	110.2	A291	T289-A291 PolarHBondContact O-N 3.24Å
290	C	95.2	Very high	93.6	Very high	11 Å²	11	59.5 Å²	59.5	7%	0.074	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-70.5	120.6	174.6	-62.4	0	0	0	0	110.7	E267 C276 Y281	E267-C290 HydrophobicContact CB-CB 4.5Å; E267-C290 VanDerWaalsContact CB-SG 3.59Å; E267-C290 HydrophobicContact CG-CB 4.41Å; E267-C290 VanDerWaalsContact CG-SG 3.55Å; E267-C290 VanDerWaalsContact OE2-CB 3.26Å; E267-C290 WeakPolarHBondContact OE2-CB 3.32Å; E267-C290 PolarHBondContact OE2-N 2.91Å; C276-C290 WeakPolarHBondContact CA-SG 3.29Å; C276-C290 HydrophobicContact CB-CB 3.76Å; C276-C290 WeakPolarHBondContact CB-SG 3.27Å; C276-C290 WeakPolarHBondContact SG-CB 3.45Å; C276-C290 CovalentContact SG-SG 2.03Å; C276-C290 PolarHBondContact SG-SG 2.65Å; Y281-C290 CarbonylContact O-C 3.54Å; Y281-C290 WeakPolarHBondContact O-CA 3.44Å
291	A	94.8	Very high	93.4	Very high	40 Å²	40	64.5 Å²	64.5	33%	0.331	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	142.9	174.1	0	0	0	0	0	110.3	Y280 Y281 T289	Y280-A291 CarbonylContact C-O 3.43Å; Y280-A291 WeakPolarHBondContact CA-O 3.49Å; Y280-A291 WeakPolarHBondContact CB-O 3.14Å; Y281-A291 HydrophobicContact CD1-CB 4.35Å; Y281-A291 VanDerWaalsContact CD1-O 3.23Å; Y281-A291 WeakPolarHBondContact CD1-O 3.48Å; Y281-A291 HydrophobicContact CE1-CB 3.64Å; Y281-A291 PolarHBondContact N-O 2.97Å; Y281-A291 PolarHBondContact O-N 3.22Å; T289-A291 PolarHBondContact O-N 3.24Å
292	K	95.6	Very high	93.4	Very high	150 Å²	150	68.3 Å²	68.3	65%	0.652	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	142.9	169.3	-173	177.2	176.9	179.8	0	109.2	Y280	Y280-K292 VanDerWaalsContact CD1-CA 3.48Å; Y280-K292 HydrophobicContact CD1-CB 3.93Å; Y280-K292 HydrophobicContact CE1-CB 3.71Å; Y280-K292 HydrophobicContact CE1-CG 4.31Å
293	C	95.4	Very high	93.3	Very high	16 Å²	16	69.1 Å²	69.1	11%	0.108	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-54.2	132.5	176.4	-70.1	0	0	0	0	111.8	G279 S297 S299 C307	G279-C293 PolarHBondContact O-N 3.12Å; G279-C293 PolarHBondContact O-SG 2.94Å; G279-C293 VanDerWaalsContact O-SG 3.41Å; C293-S297 VanDerWaalsContact CB-O 3.31Å; C293-S297 WeakPolarHBondContact CB-O 3.48Å; C293-S299 PolarHBondContact SG-N 3.2Å; C293-S299 PolarHBondContact SG-OG 2.89Å; C293-C307 WeakPolarHBondContact CA-SG 3.32Å; C293-C307 HydrophobicContact CB-CB 3.7Å; C293-C307 WeakPolarHBondContact CB-SG 3.41Å; C293-C307 WeakPolarHBondContact SG-CB 3.41Å; C293-C307 CovalentContact SG-SG 2.03Å; C293-C307 PolarHBondContact SG-SG 3.11Å
294	P	95.3	Very high	93.4	Very high	16 Å²	16	68.1 Å²	68.1	10%	0.104	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-71.2	162.2	178	31.9	-36.7	0	0	0	111	S297 S322 M323 P324	P294-S297 WeakPolarHBondContact CD-OG 3.21Å; P294-S297 WeakPolarHBondContact CG-OG 3.35Å; P294-S297 PolarHBondContact O-N 2.88Å; P294-S297 PolarHBondContact O-OG 3.24Å; P294-S322 WeakPolarHBondContact CB-O 3.44Å; P294-M323 WeakPolarHBondContact CG-O 3.46Å; P294-P324 HydrophobicContact CB-CB 4.35Å
295	P	94.6	Very high	93.5	Very high	87 Å²	87	66.7 Å²	66.7	57%	0.565	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.4	143.5	-178.2	-31.2	34.7	0	0	0	114.9	S297 P324 C325	P295-S297 PolarHBondContact O-N 2.88Å; P295-P324 HydrophobicContact CB-CB 3.97Å; P295-P324 HydrophobicContact CG-CB 4.4Å; P295-P324 VanDerWaalsContact O-CA 3.29Å; P295-P324 WeakPolarHBondContact O-CA 3.23Å; P295-P324 WeakPolarHBondContact O-CB 3.4Å; P295-C325 PolarHBondContact O-N 3.21Å; P295-C325 VanDerWaalsContact O-N 3.08Å
296	H	95.3	Very high	93.7	Very high	87 Å²	87	68.1 Å²	68.1	40%	0.403	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	26.9	-176.4	-51	-58.8	0	0	0	115	D310 F313 C325	H296-D310 VanDerWaalsContact CA-OD2 3.24Å; H296-D310 WeakPolarHBondContact CA-OD2 3.39Å; H296-D310 PolarHBondContact O-N 3.33Å; H296-F313 HydrophobicContact CB-CB 4.01Å; H296-F313 HydrophobicContact CB-CD1 3.6Å; H296-F313 HydrophobicContact CB-CD2 4Å; H296-F313 HydrophobicContact CB-CE1 4Å; H296-F313 HydrophobicContact CB-CE2 4.37Å; H296-F313 HydrophobicContact CB-CG 3.61Å; H296-F313 HydrophobicContact CB-CZ 4.37Å; H296-F313 AromaticContact CD2-CD1 3.71Å; H296-F313 AromaticContact CD2-CE1 3.34Å; H296-F313 WeakPolarHBondContact CD2-CE1 3.44Å; H296-F313 AromaticContact CD2-CZ 3.9Å; H296-F313 AromaticContact CE1-CE1 3.83Å; H296-F313 AromaticContact CE1-CZ 3.58Å; H296-F313 AromaticContact CG-CD1 3.54Å; H296-F313 AromaticContact CG-CE1 3.39Å; H296-F313 AromaticContact CG-CG 3.93Å; H296-F313 AromaticContact CG-CZ 3.65Å; H296-F313 AromaticContact ND1-CE1 3.7Å; H296-F313 AromaticContact ND1-CE2 3.74Å; H296-F313 AromaticContact ND1-CZ 3.45Å; H296-F313 WeakPolarHBondContact ND1-CZ 3.4Å; H296-F313 AromaticContact NE2-CE1 3.63Å; H296-F313 AromaticContact NE2-CZ 3.86Å; H296-C325 HydrophobicContact CB-CB 4.22Å; H296-C325 VanDerWaalsContact O-CB 3.31Å; H296-C325 WeakPolarHBondContact O-CB 3.45Å
297	S	95.8	Very high	94	Very high	9 Å²	9	63.3 Å²	63.3	6%	0.063	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	153.9	172.7	73.6	0	0	0	0	112.4	C293 P294 P295 C307 T308 R315	C293-S297 VanDerWaalsContact CB-O 3.31Å; C293-S297 WeakPolarHBondContact CB-O 3.48Å; P294-S297 WeakPolarHBondContact CD-OG 3.21Å; P294-S297 WeakPolarHBondContact CG-OG 3.35Å; P294-S297 PolarHBondContact O-N 2.88Å; P294-S297 PolarHBondContact O-OG 3.24Å; P295-S297 PolarHBondContact O-N 2.88Å; S297-C307 WeakPolarHBondContact OG-CB 3.39Å; S297-T308 CarbonylContact C-O 3.54Å; S297-T308 WeakPolarHBondContact CA-O 3.34Å; S297-T308 WeakPolarHBondContact CB-O 3.1Å; S297-R315 PolarHBondContact OG-NH2 2.8Å
298	Y	94.9	Very high	94.3	Very high	118 Å²	118	65.5 Å²	65.5	46%	0.463	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	147.7	-176.3	-163.2	-104	0	0	0	112.5	I278 V300 C307 T308	I278-Y298 HydrophobicContact CG2-CE1 4.2Å; Y298-V300 HydrophobicContact CD1-CG1 3.81Å; Y298-V300 HydrophobicContact CE1-CG1 4.15Å; Y298-C307 CarbonylContact O-C 3.55Å; Y298-T308 PolarHBondContact N-O 3.06Å; Y298-T308 PolarHBondContact O-N 3.48Å
299	S	95.9	Very high	94.8	Very high	3 Å²	3	62.9 Å²	62.9	2%	0.021	34%	0.341	C	S	.	.			trans	-110.7	116.4	172.1	53.3	0	0	0	0	109.5	I278 G279 Y280 C293	I278-S299 VanDerWaalsContact CG2-O 3.32Å; I278-S299 WeakPolarHBondContact CG2-O 3.47Å; G279-S299 VanDerWaalsContact C-OG 3.32Å; G279-S299 VanDerWaalsContact CA-OG 3.28Å; G279-S299 WeakPolarHBondContact CA-OG 3.35Å; G279-S299 PolarHBondContact N-O 3.08Å; G279-S299 PolarHBondContact N-OG 2.91Å; G279-S299 VanDerWaalsContact N-OG 3.08Å; Y280-S299 PolarHBondContact N-OG 2.77Å; Y280-S299 VanDerWaalsContact N-OG 3.12Å; Y280-S299 WeakPolarHBondContact O-CB 3.48Å; Y280-S299 PolarHBondContact O-OG 2.95Å; C293-S299 PolarHBondContact SG-N 3.2Å; C293-S299 PolarHBondContact SG-OG 2.89Å
300	V	93.8	Very high	94.9	Very high	84 Å²	84	62 Å²	62	51%	0.509	33%	0.334	S	S	.	.			trans	-87.2	-10.1	-176.4	-62.3	0	0	0	0	113.9	Y298	Y298-V300 HydrophobicContact CD1-CG1 3.81Å; Y298-V300 HydrophobicContact CE1-CG1 4.15Å
301	W	92.9	Very high	94.8	Very high	203 Å²	203	73.6 Å²	73.6	77%	0.769	38%	0.376	S	S	*	.	S	Bend	trans	-117.5	153.4	-179.4	-55.7	116.8	0	0	0	110.5
302	E	94.8	Very high	94.6	Very high	96 Å²	96	73.4 Å²	73.4	45%	0.449	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	157.7	160.5	-63.8	-158.4	157.5	0	0	110.5	A275 C276 K277 I278 A304	A275-E302 HydrophobicContact CB-CB 4.26Å; C276-E302 CarbonylContact O-C 3.45Å; C276-E302 WeakPolarHBondContact O-CA 3.42Å; C276-E302 WeakPolarHBondContact O-CB 3.01Å; K277-E302 WeakPolarHBondContact CD-OE1 3.48Å; K277-E302 WeakPolarHBondContact CE-OE1 3.03Å; K277-E302 IonicContact NZ-OE1 2.86Å; K277-E302 PolarHBondContact NZ-OE1 3.29Å; K277-E302 IonicContact NZ-OE2 3.4Å; K277-E302 PolarHBondContact NZ-OE2 3.15Å; I278-E302 HydrophobicContact CG1-CG 3.88Å; E302-A304 VanDerWaalsContact C-N 3.32Å; E302-A304 PolarHBondContact O-N 3.43Å
303	G	94.2	Very high	94.5	Very high	22 Å²	22	68.1 Å²	68.1	23%	0.227	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	13.9	177.6	0	0	0	0	0	114.8	G265 C276 T305	G265-G303 WeakPolarHBondContact CA-O 3.33Å; G265-G303 WeakPolarHBondContact O-CA 3.29Å; C276-G303 PolarHBondContact O-N 3.07Å; G303-T305 PolarHBondContact O-N 3.4Å
304	A	95.7	Very high	94.5	Very high	15 Å²	15	70 Å²	70	12%	0.124	36%	0.361	C	S	.	.			trans	-65.7	132.3	-173.1	0	0	0	0	0	113.3	Y281 K282 E302	Y281-A304 CarbonylContact C-O 3.6Å; Y281-A304 WeakPolarHBondContact CA-O 3.15Å; Y281-A304 WeakPolarHBondContact CB-O 3.47Å; K282-A304 PolarHBondContact N-O 3.32Å; E302-A304 VanDerWaalsContact C-N 3.32Å; E302-A304 PolarHBondContact O-N 3.43Å
305	T	94.2	Very high	94.4	Very high	72 Å²	72	71.2 Å²	71.2	44%	0.442	36%	0.364	S	S	.	.	S	Bend	trans	-89.3	-15.4	173.4	59.9	0	0	0	0	113.2	A264 K282 A283 G303	A264-T305 HydrophobicContact CB-CG2 3.71Å; K282-T305 WeakPolarHBondContact O-CA 2.96Å; A283-T305 VanDerWaalsContact CA-O 3.31Å; A283-T305 WeakPolarHBondContact CA-O 3.44Å; G303-T305 PolarHBondContact O-N 3.4Å
306	S	93.9	Very high	94.3	Very high	62 Å²	62	67.8 Å²	67.8	43%	0.434	34%	0.342	S	S	.	.	S	Bend	trans	-154.6	161.7	175.2	58.2	0	0	0	0	110.8
307	C	94.9	Very high	93.9	Very high	1 Å²	1	69.5 Å²	69.5	1%	0.007	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-102	123.2	174.9	-57	0	0	0	0	110.3	Y281 C293 S297 Y298 R315	Y281-C307 WeakPolarHBondContact CD1-SG 3.27Å; Y281-C307 VanDerWaalsContact CG-SG 3.57Å; C293-C307 WeakPolarHBondContact CA-SG 3.32Å; C293-C307 HydrophobicContact CB-CB 3.7Å; C293-C307 WeakPolarHBondContact CB-SG 3.41Å; C293-C307 WeakPolarHBondContact SG-CB 3.41Å; C293-C307 CovalentContact SG-SG 2.03Å; C293-C307 PolarHBondContact SG-SG 3.11Å; S297-C307 WeakPolarHBondContact OG-CB 3.39Å; Y298-C307 CarbonylContact O-C 3.55Å; C307-R315 PolarHBondContact O-NH1 3.24Å
308	T	95.2	Very high	93.6	Very high	102 Å²	102	76.7 Å²	76.7	63%	0.626	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.5	138.5	175.1	-53	0	0	0	0	110	S297 Y298	S297-T308 CarbonylContact C-O 3.54Å; S297-T308 WeakPolarHBondContact CA-O 3.34Å; S297-T308 WeakPolarHBondContact CB-O 3.1Å; Y298-T308 PolarHBondContact N-O 3.06Å; Y298-T308 PolarHBondContact O-N 3.48Å
309	C	95.1	Very high	93.4	Very high	38 Å²	38	72.5 Å²	72.5	26%	0.257	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	146	177.8	-63.8	0	0	0	0	112.6	F313 C325	C309-F313 WeakPolarHBondContact CB-O 2.99Å; C309-C325 WeakPolarHBondContact CA-SG 3.43Å; C309-C325 HydrophobicContact CB-CB 3.62Å; C309-C325 WeakPolarHBondContact CB-SG 3.39Å; C309-C325 WeakPolarHBondContact SG-CB 3.47Å; C309-C325 CovalentContact SG-SG 2.03Å; C309-C325 PolarHBondContact SG-SG 3.19Å
310	D	94.9	Very high	93	Very high	71 Å²	71	74.6 Å²	74.6	38%	0.38	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65.3	154.1	170.8	-70.7	-18.9	0	0	0	111.4	H296 G312 F313	H296-D310 VanDerWaalsContact CA-OD2 3.24Å; H296-D310 WeakPolarHBondContact CA-OD2 3.39Å; H296-D310 PolarHBondContact O-N 3.33Å; D310-G312 PolarHBondContact O-N 2.96Å; D310-G312 VanDerWaalsContact O-N 3.1Å; D310-F313 HydrophobicContact CB-CD2 4.15Å; D310-F313 PolarHBondContact O-N 3.43Å
311	R	93.1	Very high	92.7	Very high	254 Å²	254	71.9 Å²	71.9	96%	0.958	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	117.1	-177.4	-176.2	179.6	179.1	-178.5	0.1	111.6
312	G	90.3	Very high	92.6	Very high	36 Å²	36	65.7 Å²	65.7	37%	0.371	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.8	1.5	-178.9	0	0	0	0	0	114.7	D310 F314	D310-G312 PolarHBondContact O-N 2.96Å; D310-G312 VanDerWaalsContact O-N 3.1Å; G312-F314 WeakPolarHBondContact O-CE2 3.43Å
313	F	94.9	Very high	92.4	Very high	39 Å²	39	65.4 Å²	65.4	17%	0.171	37%	0.369	C	S	.	.			trans	-115.1	152.6	171.4	-63.9	-98.7	0	0	0	110.4	H296 C309 D310 C325 T326 R327	H296-F313 HydrophobicContact CB-CB 4.01Å; H296-F313 HydrophobicContact CB-CD1 3.6Å; H296-F313 HydrophobicContact CB-CD2 4Å; H296-F313 HydrophobicContact CB-CE1 4Å; H296-F313 HydrophobicContact CB-CE2 4.37Å; H296-F313 HydrophobicContact CB-CG 3.61Å; H296-F313 HydrophobicContact CB-CZ 4.37Å; H296-F313 AromaticContact CD2-CD1 3.71Å; H296-F313 AromaticContact CD2-CE1 3.34Å; H296-F313 WeakPolarHBondContact CD2-CE1 3.44Å; H296-F313 AromaticContact CD2-CZ 3.9Å; H296-F313 AromaticContact CE1-CE1 3.83Å; H296-F313 AromaticContact CE1-CZ 3.58Å; H296-F313 AromaticContact CG-CD1 3.54Å; H296-F313 AromaticContact CG-CE1 3.39Å; H296-F313 AromaticContact CG-CG 3.93Å; H296-F313 AromaticContact CG-CZ 3.65Å; H296-F313 AromaticContact ND1-CE1 3.7Å; H296-F313 AromaticContact ND1-CE2 3.74Å; H296-F313 AromaticContact ND1-CZ 3.45Å; H296-F313 WeakPolarHBondContact ND1-CZ 3.4Å; H296-F313 AromaticContact NE2-CE1 3.63Å; H296-F313 AromaticContact NE2-CZ 3.86Å; C309-F313 WeakPolarHBondContact CB-O 2.99Å; D310-F313 HydrophobicContact CB-CD2 4.15Å; D310-F313 PolarHBondContact O-N 3.43Å; F313-C325 HydrophobicContact CB-CB 3.67Å; F313-T326 CarbonylContact C-O 3.44Å; F313-T326 WeakPolarHBondContact CA-O 3.49Å; F313-R327 HydrophobicContact CD1-CB 3.88Å; F313-R327 HydrophobicContact CD1-CG 4.27Å; F313-R327 HydrophobicContact CE1-CB 4.01Å; F313-R327 HydrophobicContact CE1-CG 3.92Å; F313-R327 HydrophobicContact CG-CB 4.49Å
314	F	94.4	Very high	92.5	Very high	54 Å²	54	66.9 Å²	66.9	24%	0.237	37%	0.374	C	S	.	.	B	Isolated β-bridge	trans	-145.7	169.9	-171.1	-48.9	-85.6	0	0	0	110.7	G312 C325 T326 V419 Y422 N423	G312-F314 WeakPolarHBondContact O-CE2 3.43Å; F314-C325 CarbonylContact O-C 3.54Å; F314-C325 WeakPolarHBondContact O-CA 3.48Å; F314-T326 PolarHBondContact N-O 2.94Å; F314-T326 PolarHBondContact O-N 3.09Å; F314-V419 HydrophobicContact CB-CB 4.12Å; F314-V419 HydrophobicContact CB-CG1 4.01Å; F314-Y422 HydrophobicContact CB-CD2 3.62Å; F314-Y422 HydrophobicContact CB-CE2 4.09Å; F314-Y422 HydrophobicContact CB-CG 4.31Å; F314-Y422 HydrophobicContact CD1-CD2 4.2Å; F314-Y422 HydrophobicContact CD1-CG 4.01Å; F314-Y422 HydrophobicContact CD2-CD2 4.48Å; F314-Y422 AromaticContact CG-CD2 3.85Å; F314-Y422 HydrophobicContact CG-CD2 3.85Å; F314-Y422 HydrophobicContact CG-CG 4.1Å; F314-N423 HydrophobicContact CE2-CB 3.95Å; F314-N423 HydrophobicContact CZ-CB 4.04Å
315	R	93.4	Very high	92.4	Very high	43 Å²	43	66.2 Å²	66.2	16%	0.162	37%	0.369	C	S	.	.			trans	-118.7	144.8	164.5	-75.8	-173	-174.2	95.2	2.2	109.1	S297 C307 D319 A321 M323 C325 Y422	S297-R315 PolarHBondContact OG-NH2 2.8Å; C307-R315 PolarHBondContact O-NH1 3.24Å; R315-D319 HydrophobicContact CB-CB 4.02Å; R315-D319 HydrophobicContact CG-CB 4.26Å; R315-A321 PolarHBondContact NH2-O 2.9Å; R315-A321 VanDerWaalsContact NH2-O 3.1Å; R315-M323 PolarHBondContact NE-O 3.48Å; R315-M323 PolarHBondContact NH2-O 3.25Å; R315-C325 PolarHBondContact NH1-SG 2.95Å; R315-C325 VanDerWaalsContact NH1-SG 3.38Å; R315-Y422 WeakPolarHBondContact O-CE2 3.44Å; R315-Y422 PolarHBondContact O-OH 2.8Å; R315-Y422 VanDerWaalsContact O-OH 3.11Å
316	A	92.1	Very high	92.5	Very high	14 Å²	14	63.1 Å²	63.1	12%	0.116	35%	0.35	C	S	.	.			trans	-74.3	160.8	166.5	0	0	0	0	0	109.9	N318 D319 V419	A316-N318 PolarHBondContact O-N 3.32Å; A316-D319 WeakPolarHBondContact CB-OD2 3.41Å; A316-D319 PolarHBondContact N-OD2 3.27Å; A316-D319 WeakPolarHBondContact O-CB 3.45Å; A316-D319 PolarHBondContact O-N 2.99Å; A316-V419 HydrophobicContact CB-CG1 4.48Å
317	D	88.4	Confident	92.5	Very high	123 Å²	123	65.1 Å²	65.1	66%	0.658	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.6	-172.5	-28.8	-86.8	0	0	0	113	K421 Y422	D317-K421 VanDerWaalsContact CG-NZ 3.28Å; D317-K421 IonicContact OD1-NZ 3.65Å; D317-K421 PolarHBondContact OD1-NZ 3.07Å; D317-K421 VanDerWaalsContact OD1-NZ 3.13Å; D317-K421 IonicContact OD2-NZ 2.72Å; D317-K421 PolarHBondContact OD2-NZ 3.41Å; D317-Y422 PolarHBondContact OD1-OH 2.92Å
318	N	88.5	Confident	92.6	Very high	160 Å²	160	65.9 Å²	65.9	86%	0.856	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-1.5	175.6	-63.5	-7.5	0	0	0	113.7	A316	A316-N318 PolarHBondContact O-N 3.32Å
319	D	90.1	Very high	92.6	Very high	31 Å²	31	61.1 Å²	61.1	17%	0.166	32%	0.324	C	S	.	.			trans	-81.2	129.1	-179.5	-71.8	-27.2	0	0	0	110.8	R315 A316 M323 R357	R315-D319 HydrophobicContact CB-CB 4.02Å; R315-D319 HydrophobicContact CG-CB 4.26Å; A316-D319 WeakPolarHBondContact CB-OD2 3.41Å; A316-D319 PolarHBondContact N-OD2 3.27Å; A316-D319 WeakPolarHBondContact O-CB 3.45Å; A316-D319 PolarHBondContact O-N 2.99Å; D319-M323 HydrophobicContact CB-CB 4.47Å; D319-M323 HydrophobicContact CB-SD 4.13Å; D319-R357 IonicContact OD1-CZ 2.74Å; D319-R357 IonicContact OD1-NH2 3.23Å; D319-R357 PolarHBondContact OD1-NH2 2.9Å; D319-R357 IonicContact OD2-CZ 2.71Å; D319-R357 IonicContact OD2-NE 2.68Å; D319-R357 IonicContact OD2-NH2 3.82Å; D319-R357 PolarHBondContact OD2-NH2 3.34Å
320	A	88.4	Confident	92.6	Very high	46 Å²	46	61 Å²	61	38%	0.38	32%	0.323	S	S	.	.			trans	-65.2	151.6	173.4	0	0	0	0	0	111.4	S322 M323	A320-S322 PolarHBondContact O-N 2.6Å; A320-M323 HydrophobicContact CB-CG 4.34Å; A320-M323 WeakPolarHBondContact O-CB 3.49Å; A320-M323 PolarHBondContact O-N 3.25Å
321	A	87.8	Confident	92.5	Very high	28 Å²	28	58.7 Å²	58.7	23%	0.231	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.5	176.8	0	0	0	0	0	113.5	Y281 A283 R315	Y281-A321 HydrophobicContact CE2-CB 4.17Å; A283-A321 HydrophobicContact CB-CB 4.31Å; R315-A321 PolarHBondContact NH2-O 2.9Å; R315-A321 VanDerWaalsContact NH2-O 3.1Å
322	S	89.5	Confident	92.6	Very high	72 Å²	72	46.8 Å²	46.8	50%	0.503	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-15.3	174.7	56.2	0	0	0	0	115	Y281 P294 A320	Y281-S322 WeakPolarHBondContact OH-CA 3.28Å; Y281-S322 VanDerWaalsContact OH-CB 3.24Å; Y281-S322 WeakPolarHBondContact OH-CB 3.24Å; P294-S322 WeakPolarHBondContact CB-O 3.44Å; A320-S322 PolarHBondContact O-N 2.6Å
323	M	92.3	Very high	92.5	Very high	91 Å²	91	48.3 Å²	48.3	45%	0.448	27%	0.269	S	S	.	.	S	Bend	trans	-74.9	143.3	172.1	-62.7	-173.1	177.2	0	0	110	P294 R315 D319 A320	P294-M323 WeakPolarHBondContact CG-O 3.46Å; R315-M323 PolarHBondContact NE-O 3.48Å; R315-M323 PolarHBondContact NH2-O 3.25Å; D319-M323 HydrophobicContact CB-CB 4.47Å; D319-M323 HydrophobicContact CB-SD 4.13Å; A320-M323 HydrophobicContact CB-CG 4.34Å; A320-M323 WeakPolarHBondContact O-CB 3.49Å; A320-M323 PolarHBondContact O-N 3.25Å
324	P	94.6	Very high	92.3	Very high	52 Å²	52	52.2 Å²	52.2	34%	0.338	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-61.2	152.6	173.5	27.9	-35.3	0	0	0	110.5	P294 P295	P294-P324 HydrophobicContact CB-CB 4.35Å; P295-P324 HydrophobicContact CB-CB 3.97Å; P295-P324 HydrophobicContact CG-CB 4.4Å; P295-P324 VanDerWaalsContact O-CA 3.29Å; P295-P324 WeakPolarHBondContact O-CA 3.23Å; P295-P324 WeakPolarHBondContact O-CB 3.4Å
325	C	95.1	Very high	92.1	Very high	1 Å²	1	51 Å²	51	1%	0.007	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-71.9	142.7	166.5	-57.8	0	0	0	0	109.1	P295 H296 C309 F313 F314 R315	P295-C325 PolarHBondContact O-N 3.21Å; P295-C325 VanDerWaalsContact O-N 3.08Å; H296-C325 HydrophobicContact CB-CB 4.22Å; H296-C325 VanDerWaalsContact O-CB 3.31Å; H296-C325 WeakPolarHBondContact O-CB 3.45Å; C309-C325 WeakPolarHBondContact CA-SG 3.43Å; C309-C325 HydrophobicContact CB-CB 3.62Å; C309-C325 WeakPolarHBondContact CB-SG 3.39Å; C309-C325 WeakPolarHBondContact SG-CB 3.47Å; C309-C325 CovalentContact SG-SG 2.03Å; C309-C325 PolarHBondContact SG-SG 3.19Å; F313-C325 HydrophobicContact CB-CB 3.67Å; F314-C325 CarbonylContact O-C 3.54Å; F314-C325 WeakPolarHBondContact O-CA 3.48Å; R315-C325 PolarHBondContact NH1-SG 2.95Å; R315-C325 VanDerWaalsContact NH1-SG 3.38Å
326	T	95.7	Very high	91.8	Very high	8 Å²	8	54 Å²	54	5%	0.049	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-126.1	164.7	-171.5	50.5	0	0	0	0	109.7	F313 F314 G355 R357	F313-T326 CarbonylContact C-O 3.44Å; F313-T326 WeakPolarHBondContact CA-O 3.49Å; F314-T326 PolarHBondContact N-O 2.94Å; F314-T326 PolarHBondContact O-N 3.09Å; T326-G355 VanDerWaalsContact CB-O 3.28Å; T326-G355 WeakPolarHBondContact CB-O 3.09Å; T326-R357 HydrophobicContact CG2-CG 3.66Å; T326-R357 VanDerWaalsContact OG1-CD 3.27Å; T326-R357 WeakPolarHBondContact OG1-CD 3.48Å; T326-R357 PolarHBondContact OG1-NE 3.45Å
327	R	94.8	Very high	91.7	Very high	104 Å²	104	55.3 Å²	55.3	39%	0.392	31%	0.314	S	S	.	.			trans	-124.7	168.8	-176.1	65.5	174.5	-172.5	166.7	0.7	111.3	F313 N353 G355 N417 V419	F313-R327 HydrophobicContact CD1-CB 3.88Å; F313-R327 HydrophobicContact CD1-CG 4.27Å; F313-R327 HydrophobicContact CE1-CB 4.01Å; F313-R327 HydrophobicContact CE1-CG 3.92Å; F313-R327 HydrophobicContact CG-CB 4.49Å; R327-N353 PolarHBondContact NE-OD1 3.07Å; R327-N353 PolarHBondContact NH2-ND2 3.21Å; R327-N353 PolarHBondContact NH2-OD1 2.91Å; R327-G355 PolarHBondContact N-O 3.44Å; R327-G355 VanDerWaalsContact N-O 3.09Å; R327-G355 VanDerWaalsContact O-CA 3.23Å; R327-G355 WeakPolarHBondContact O-CA 3.47Å; R327-N417 PolarHBondContact O-ND2 3.36Å; R327-V419 VanDerWaalsContact C-CG2 3.43Å; R327-V419 WeakPolarHBondContact O-CG2 3.26Å
328	P	95.4	Very high	91.6	Very high	16 Å²	16	54.3 Å²	54.3	10%	0.104	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-58.1	152.2	169	-20	32.2	0	0	0	111.3	N423 Q428	P328-N423 HydrophobicContact CG-CB 4.29Å; P328-Q428 VanDerWaalsContact CB-CD 3.42Å; P328-Q428 HydrophobicContact CB-CG 4.07Å
329	P	95.6	Very high	91.5	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.019	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-73.4	165.3	177.8	34	-35.4	0	0	0	111.2	P351 N353 A415 S420 Q428	P329-P351 HydrophobicContact CB-CB 4.29Å; P329-P351 HydrophobicContact CB-CG 4.24Å; P329-N353 CarbonylContact C-O 3.5Å; P329-N353 VanDerWaalsContact CA-O 3.28Å; P329-N353 WeakPolarHBondContact CA-O 3.44Å; P329-A415 HydrophobicContact CB-CB 4.16Å; P329-A415 HydrophobicContact CG-CB 3.62Å; P329-A415 WeakPolarHBondContact CG-O 3.28Å; P329-S420 WeakPolarHBondContact CD-OG 3.28Å; P329-Q428 WeakPolarHBondContact O-CG 3.29Å
330	S	94.9	Very high	91	Very high	35 Å²	35	51.5 Å²	51.5	25%	0.245	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-71.3	169.8	164.5	70.1	0	0	0	0	111	P351 Q352 N353	S330-P351 VanDerWaalsContact O-CB 3.3Å; S330-P351 WeakPolarHBondContact O-CB 3.4Å; S330-P351 WeakPolarHBondContact O-CG 3.39Å; S330-P351 WeakPolarHBondContact OG-CB 3.26Å; S330-Q352 PolarHBondContact OG-N 2.84Å; S330-N353 PolarHBondContact N-O 2.81Å; S330-N353 PolarHBondContact OG-N 3.2Å
331	A	94.1	Very high	90.7	Very high	22 Å²	22	55.2 Å²	55.2	18%	0.182	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-49	147.6	165	0	0	0	0	0	112.8	P351 D427 S429 V430	A331-P351 WeakPolarHBondContact O-CA 3.05Å; A331-D427 WeakPolarHBondContact CB-O 3.42Å; A331-D427 PolarHBondContact N-O 3.12Å; A331-S429 WeakPolarHBondContact CB-O 3.49Å; A331-V430 HydrophobicContact CB-CB 4.35Å
332	P	93.8	Very high	90.5	Very high	4 Å²	4	56 Å²	56	3%	0.026	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-55.6	152.9	164.8	-20.4	29.1	0	0	0	112.5	W348 Y362 I413 A415 V430	P332-W348 HydrophobicContact CB-CB 4.38Å; P332-W348 HydrophobicContact CB-CG 4.27Å; P332-Y362 HydrophobicContact CG-CD1 4.1Å; P332-Y362 HydrophobicContact CG-CE1 4.14Å; P332-I413 HydrophobicContact CG-CB 4.49Å; P332-I413 HydrophobicContact CG-CG2 3.95Å; P332-A415 HydrophobicContact CG-CB 4.1Å; P332-V430 HydrophobicContact CB-CG1 3.94Å; P332-V430 HydrophobicContact CG-CG1 4.16Å; P332-V430 WeakPolarHBondContact O-CG1 3.41Å
333	L	89.7	Confident	90.4	Very high	69 Å²	69	54 Å²	54	36%	0.361	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	156.9	178.8	-61.7	-178.8	0	0	0	111.6	L335 S349 Q352	L333-L335 PolarHBondContact O-N 2.9Å; L333-S349 VanDerWaalsContact C-OG 3.23Å; L333-S349 WeakPolarHBondContact CB-OG 3.02Å; L333-S349 PolarHBondContact N-O 3.43Å; L333-S349 VanDerWaalsContact N-O 3.12Å; L333-S349 PolarHBondContact O-N 2.94Å; L333-S349 PolarHBondContact O-OG 3.45Å; L333-Q352 HydrophobicContact CD1-CB 4Å
334	N	90.3	Very high	90.3	Very high	120 Å²	120	49.6 Å²	49.6	64%	0.642	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.3	50.9	171.1	-49.1	-59.4	0	0	0	113.6	I336 S349	N334-I336 PolarHBondContact O-N 2.91Å; N334-S349 PolarHBondContact ND2-OG 3.47Å
335	L	90.7	Very high	90.2	Very high	30 Å²	30	50 Å²	50	16%	0.157	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	119.8	174.4	176.2	60.2	0	0	0	110.5	L333 W348 I413 V430 V432	L333-L335 PolarHBondContact O-N 2.9Å; L335-W348 HydrophobicContact CD1-CB 4.32Å; L335-W348 HydrophobicContact CD1-CE3 4.29Å; L335-I413 HydrophobicContact CD1-CD1 3.73Å; L335-I413 HydrophobicContact CD1-CG1 3.99Å; L335-I413 HydrophobicContact CD2-CD1 3.57Å; L335-I413 HydrophobicContact CD2-CG1 4.41Å; L335-I413 HydrophobicContact CG-CD1 4.32Å; L335-V430 HydrophobicContact CB-CG1 4.07Å; L335-V430 HydrophobicContact CB-CG2 4.42Å; L335-V430 HydrophobicContact CD2-CG1 4.03Å; L335-V430 HydrophobicContact CD2-CG2 4.36Å; L335-V432 HydrophobicContact CD2-CB 3.67Å; L335-V432 HydrophobicContact CD2-CG1 3.71Å; L335-V432 HydrophobicContact CG-CB 4.11Å; L335-V432 HydrophobicContact CG-CG1 4.08Å
336	I	86.4	Confident	90.1	Very high	106 Å²	106	50.1 Å²	50.1	54%	0.544	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.7	-179.8	-63.5	167.9	0	0	0	108.4	N334 L346 E347	N334-I336 PolarHBondContact O-N 2.91Å; I336-L346 WeakPolarHBondContact O-CA 3.33Å; I336-E347 PolarHBondContact N-O 2.03Å; I336-E347 PolarHBondContact O-N 2.87Å
337	S	89.3	Confident	89.9	Confident	40 Å²	40	53.8 Å²	53.8	28%	0.28	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128.9	174.7	59.9	0	0	0	0	111.1
338	N	86.6	Confident	89.9	Confident	103 Å²	103	49.2 Å²	49.2	55%	0.551	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.7	126.5	174.4	-177.8	-6.8	0	0	0	109.5	V344 N345	N338-V344 WeakPolarHBondContact O-CA 3.46Å; N338-N345 HydrophobicContact CB-CB 4.43Å; N338-N345 PolarHBondContact N-O 3.44Å; N338-N345 PolarHBondContact O-N 2.99Å
339	V	86.4	Confident	89.7	Confident	33 Å²	33	50.2 Å²	50.2	20%	0.2	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.3	-174.7	-169.1	0	0	0	0	110	V344 V434 N437	V339-V344 HydrophobicContact CG1-CG2 4.49Å; V339-V344 HydrophobicContact CG2-CG2 4.43Å; V339-V434 HydrophobicContact CG2-CG2 3.2Å; V339-N437 WeakPolarHBondContact CG1-ND2 3.36Å; V339-N437 PolarHBondContact O-ND2 2.69Å
340	N	80.7	Confident	89.6	Confident	99 Å²	99	52.8 Å²	52.8	53%	0.529	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	112	170.2	-172.6	37.7	0	0	0	108.8	T342 S343	N340-T342 PolarHBondContact O-N 2.94Å; N340-T342 VanDerWaalsContact O-N 3.11Å; N340-S343 PolarHBondContact N-O 3.36Å; N340-S343 WeakPolarHBondContact O-CA 3.31Å; N340-S343 WeakPolarHBondContact O-CB 3.36Å; N340-S343 PolarHBondContact O-N 3Å; N340-S343 VanDerWaalsContact O-O 3.11Å
341	E	80.2	Confident	89.6	Confident	124 Å²	124	51.4 Å²	51.4	58%	0.579	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	-113.9	-175.8	-61.9	176.6	-161.6	0	0	113.3	N437	E341-N437 PolarHBondContact N-ND2 2.78Å; E341-N437 PolarHBondContact O-N 3.45Å; E341-N437 VanDerWaalsContact O-N 3.13Å
342	T	83.9	Confident	89.5	Confident	45 Å²	45	58.4 Å²	58.4	28%	0.276	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	11.7	178	50.3	0	0	0	0	113.7	N340 L403 A405	N340-T342 PolarHBondContact O-N 2.94Å; N340-T342 VanDerWaalsContact O-N 3.11Å; T342-L403 VanDerWaalsContact CB-O 3.22Å; T342-L403 WeakPolarHBondContact CB-O 3.39Å; T342-L403 WeakPolarHBondContact CG2-O 3.23Å; T342-L403 VanDerWaalsContact O-CB 3.26Å; T342-L403 WeakPolarHBondContact O-CB 3.19Å; T342-L403 PolarHBondContact O-N 3.06Å; T342-A405 HydrophobicContact CG2-CB 4.33Å
343	S	87.6	Confident	89.5	Confident	28 Å²	28	61.3 Å²	61.3	20%	0.196	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	144.5	-177.1	-58.4	0	0	0	0	111.8	N340 I400	N340-S343 PolarHBondContact N-O 3.36Å; N340-S343 WeakPolarHBondContact O-CA 3.31Å; N340-S343 WeakPolarHBondContact O-CB 3.36Å; N340-S343 PolarHBondContact O-N 3Å; N340-S343 VanDerWaalsContact O-O 3.11Å; S343-I400 CarbonylContact C-O 3.48Å; S343-I400 VanDerWaalsContact CA-O 3.23Å; S343-I400 WeakPolarHBondContact CA-O 3.26Å; S343-I400 WeakPolarHBondContact CB-O 2.88Å
344	V	91.3	Very high	89.7	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.6	176.6	175.9	0	0	0	0	108.8	N338 V339 L346 I400 L403 F411 V434 T436	N338-V344 WeakPolarHBondContact O-CA 3.46Å; V339-V344 HydrophobicContact CG1-CG2 4.49Å; V339-V344 HydrophobicContact CG2-CG2 4.43Å; V344-L346 HydrophobicContact CG1-CD2 3.64Å; V344-L346 HydrophobicContact CG1-CG 4.03Å; V344-I400 PolarHBondContact N-O 3.09Å; V344-I400 VanDerWaalsContact O-CD1 3.32Å; V344-I400 WeakPolarHBondContact O-CD1 3.01Å; V344-I400 PolarHBondContact O-N 3.42Å; V344-L403 HydrophobicContact CB-CD1 3.92Å; V344-L403 HydrophobicContact CG2-CD1 3.55Å; V344-F411 HydrophobicContact CB-CE2 4.33Å; V344-F411 HydrophobicContact CB-CZ 4.49Å; V344-F411 HydrophobicContact CG1-CE2 4.16Å; V344-F411 HydrophobicContact CG2-CE2 4.34Å; V344-V434 HydrophobicContact CG1-CG1 4.31Å; V344-V434 HydrophobicContact CG2-CG1 4.11Å; V344-T436 HydrophobicContact CG2-CG2 4.5Å
345	N	91.3	Very high	89.6	Confident	60 Å²	60	54.9 Å²	54.9	32%	0.321	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.9	168.8	-63.8	-64.3	0	0	0	108.6	N338 S399	N338-N345 HydrophobicContact CB-CB 4.43Å; N338-N345 PolarHBondContact N-O 3.44Å; N338-N345 PolarHBondContact O-N 2.99Å; N345-S399 VanDerWaalsContact OD1-CB 3.29Å; N345-S399 WeakPolarHBondContact OD1-CB 3.5Å; N345-S399 PolarHBondContact OD1-OG 2.96Å
346	L	92.9	Very high	89.6	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.016	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	134.7	175.3	-60.3	178.1	0	0	0	109.6	I336 V344 W348 V364 K397 V398 I400 F411 I413 V432	I336-L346 WeakPolarHBondContact O-CA 3.33Å; V344-L346 HydrophobicContact CG1-CD2 3.64Å; V344-L346 HydrophobicContact CG1-CG 4.03Å; L346-W348 HydrophobicContact CB-CE3 4.31Å; L346-W348 HydrophobicContact CB-CZ3 3.95Å; L346-V364 HydrophobicContact CD1-CG1 4.38Å; L346-K397 VanDerWaalsContact O-CA 3.3Å; L346-K397 WeakPolarHBondContact O-CA 3.38Å; L346-V398 HydrophobicContact CB-CG1 4.04Å; L346-V398 HydrophobicContact CD1-CG1 4.35Å; L346-V398 PolarHBondContact N-O 2.77Å; L346-V398 PolarHBondContact O-N 3.35Å; L346-I400 HydrophobicContact CB-CD1 4.45Å; L346-I400 HydrophobicContact CD1-CD1 3.56Å; L346-I400 HydrophobicContact CG-CD1 3.69Å; L346-F411 HydrophobicContact CD1-CB 3.64Å; L346-F411 HydrophobicContact CD1-CD1 3.93Å; L346-F411 HydrophobicContact CD1-CD2 4.28Å; L346-F411 HydrophobicContact CD1-CG 3.71Å; L346-I413 HydrophobicContact CD1-CD1 4.04Å; L346-V432 HydrophobicContact CD2-CG1 3.99Å
347	E	92	Very high	89.8	Confident	85 Å²	85	53.2 Å²	53.2	40%	0.397	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.5	176.1	175.8	159.7	-174.6	0	0	109.5	I336 T396 K397	I336-E347 PolarHBondContact N-O 2.03Å; I336-E347 PolarHBondContact O-N 2.87Å; E347-T396 WeakPolarHBondContact CA-O 3.14Å; E347-K397 HydrophobicContact CB-CG 4.32Å; E347-K397 HydrophobicContact CG-CD 4.38Å; E347-K397 HydrophobicContact CG-CG 4.1Å; E347-K397 WeakPolarHBondContact OE1-CE 3.33Å; E347-K397 IonicContact OE1-NZ 2.62Å; E347-K397 PolarHBondContact OE1-NZ 2.99Å; E347-K397 WeakPolarHBondContact OE2-CE 3.06Å; E347-K397 IonicContact OE2-NZ 2.65Å; E347-K397 PolarHBondContact OE2-NZ 3.18Å
348	W	94.4	Very high	89.9	Confident	8 Å²	8	60.7 Å²	60.7	3%	0.03	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	179.9	177.4	57.9	95.7	0	0	0	111	P332 L335 L346 Y362 V364 L393 T396 V398 I413	P332-W348 HydrophobicContact CB-CB 4.38Å; P332-W348 HydrophobicContact CB-CG 4.27Å; L335-W348 HydrophobicContact CD1-CB 4.32Å; L335-W348 HydrophobicContact CD1-CE3 4.29Å; L346-W348 HydrophobicContact CB-CE3 4.31Å; L346-W348 HydrophobicContact CB-CZ3 3.95Å; W348-Y362 AromaticContact CD1-CE1 3.99Å; W348-Y362 AromaticContact CE2-CG 3.83Å; W348-Y362 HydrophobicContact CZ2-CD2 4.01Å; W348-Y362 AromaticContact CZ2-CG 3.83Å; W348-Y362 HydrophobicContact CZ2-CG 3.83Å; W348-Y362 AromaticContact NE1-CD1 3.31Å; W348-Y362 VanDerWaalsContact NE1-CD1 3.31Å; W348-Y362 AromaticContact NE1-CD2 3.44Å; W348-Y362 AromaticContact NE1-CE1 3.52Å; W348-Y362 AromaticContact NE1-CE2 3.66Å; W348-Y362 AromaticContact NE1-CG 3.27Å; W348-Y362 VanDerWaalsContact NE1-CG 3.27Å; W348-Y362 AromaticContact NE1-CZ 3.7Å; W348-V364 HydrophobicContact CH2-CG2 4.33Å; W348-L393 HydrophobicContact CH2-CD2 4.23Å; W348-T396 VanDerWaalsContact CE2-CA 3.48Å; W348-T396 PolarHBondContact N-O 3.45Å; W348-T396 WeakPolarHBondContact O-CB 3.21Å; W348-T396 PolarHBondContact O-OG1 2.99Å; W348-V398 HydrophobicContact CH2-CB 4.31Å; W348-V398 HydrophobicContact CH2-CG1 4.08Å; W348-V398 HydrophobicContact CZ3-CG1 4.01Å; W348-I413 HydrophobicContact CD2-CG2 3.85Å; W348-I413 HydrophobicContact CE3-CG1 4.14Å; W348-I413 HydrophobicContact CE3-CG2 4.22Å; W348-I413 HydrophobicContact CG-CG2 4.32Å; W348-I413 HydrophobicContact CH2-CG2 4.35Å; W348-I413 HydrophobicContact CZ2-CG2 3.96Å; W348-I413 HydrophobicContact CZ3-CG1 4.25Å; W348-I413 HydrophobicContact CZ3-CG2 4.46Å
349	S	92.3	Very high	90.3	Very high	37 Å²	37	58.5 Å²	58.5	26%	0.259	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	163.5	174.6	59.5	0	0	0	0	111.1	L333 N334	L333-S349 VanDerWaalsContact C-OG 3.23Å; L333-S349 WeakPolarHBondContact CB-OG 3.02Å; L333-S349 PolarHBondContact N-O 3.43Å; L333-S349 VanDerWaalsContact N-O 3.12Å; L333-S349 PolarHBondContact O-N 2.94Å; L333-S349 PolarHBondContact O-OG 3.45Å; N334-S349 PolarHBondContact ND2-OG 3.47Å
350	S	92.8	Very high	90.7	Very high	57 Å²	57	58 Å²	58	40%	0.399	32%	0.318	S	S	.	.			trans	-54	145.3	-176.8	-178.6	0	0	0	0	112.5
351	P	94.8	Very high	91.4	Very high	6 Å²	6	54.3 Å²	54.3	4%	0.039	30%	0.299	C	S	.	.			trans	-45.6	143.5	164.2	-32.7	38.6	0	0	0	113.6	P329 S330 A331 N353 Y362 A415	P329-P351 HydrophobicContact CB-CB 4.29Å; P329-P351 HydrophobicContact CB-CG 4.24Å; S330-P351 VanDerWaalsContact O-CB 3.3Å; S330-P351 WeakPolarHBondContact O-CB 3.4Å; S330-P351 WeakPolarHBondContact O-CG 3.39Å; S330-P351 WeakPolarHBondContact OG-CB 3.26Å; A331-P351 WeakPolarHBondContact O-CA 3.05Å; P351-N353 PolarHBondContact O-N 2.92Å; P351-Y362 WeakPolarHBondContact CD-OH 3.41Å; P351-Y362 HydrophobicContact CG-CE1 4.42Å; P351-A415 HydrophobicContact CG-CB 3.55Å
352	Q	92.4	Very high	92.2	Very high	170 Å²	170	48.9 Å²	48.9	79%	0.794	27%	0.274	S	S	*	.	S	Bend	trans	-62.2	-34.7	173.5	-160.2	-173.8	19.8	0	0	111.8	S330 L333	S330-Q352 PolarHBondContact OG-N 2.84Å; L333-Q352 HydrophobicContact CD1-CB 4Å
353	N	93.3	Very high	92.7	Very high	64 Å²	64	48.9 Å²	48.9	34%	0.342	27%	0.272	S	S	.	.			trans	-125.8	117.9	174.9	-164.9	-81.1	0	0	0	109.1	R327 P329 S330 P351 G355	R327-N353 PolarHBondContact NE-OD1 3.07Å; R327-N353 PolarHBondContact NH2-ND2 3.21Å; R327-N353 PolarHBondContact NH2-OD1 2.91Å; P329-N353 CarbonylContact C-O 3.5Å; P329-N353 VanDerWaalsContact CA-O 3.28Å; P329-N353 WeakPolarHBondContact CA-O 3.44Å; S330-N353 PolarHBondContact N-O 2.81Å; S330-N353 PolarHBondContact OG-N 3.2Å; P351-N353 PolarHBondContact O-N 2.92Å; N353-G355 PolarHBondContact O-N 3.47Å; N353-G355 PolarHBondContact OD1-N 2.85Å; N353-G355 VanDerWaalsContact OD1-N 3.13Å
354	T	93.2	Very high	93.1	Very high	48 Å²	48	47.6 Å²	47.6	29%	0.294	26%	0.263	S	S	.	.			trans	-79.1	-0.2	-178.4	66.1	0	0	0	0	113.7	G356 R357 I360 N417	T354-G356 PolarHBondContact O-N 2.92Å; T354-G356 PolarHBondContact OG1-N 3.12Å; T354-R357 WeakPolarHBondContact CB-O 3.32Å; T354-R357 PolarHBondContact OG1-O 2.74Å; T354-I360 HydrophobicContact CG2-CD1 3.51Å; T354-N417 PolarHBondContact O-ND2 3.37Å
355	G	88.6	Confident	93.2	Very high	6 Å²	6	50.1 Å²	50.1	6%	0.062	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	2.5	-168.6	0	0	0	0	0	114.7	T326 R327 N353	T326-G355 VanDerWaalsContact CB-O 3.28Å; T326-G355 WeakPolarHBondContact CB-O 3.09Å; R327-G355 PolarHBondContact N-O 3.44Å; R327-G355 VanDerWaalsContact N-O 3.09Å; R327-G355 VanDerWaalsContact O-CA 3.23Å; R327-G355 WeakPolarHBondContact O-CA 3.47Å; N353-G355 PolarHBondContact O-N 3.47Å; N353-G355 PolarHBondContact OD1-N 2.85Å; N353-G355 VanDerWaalsContact OD1-N 3.13Å
356	G	90.3	Very high	93.2	Very high	63 Å²	63	47.5 Å²	47.5	65%	0.649	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	3.7	-177.3	0	0	0	0	0	114.7	T354	T354-G356 PolarHBondContact O-N 2.92Å; T354-G356 PolarHBondContact OG1-N 3.12Å
357	R	92.4	Very high	93.1	Very high	38 Å²	38	50.2 Å²	50.2	14%	0.143	28%	0.276	C	S	.	.			trans	-115.8	163.2	-178.2	-53.4	-177.2	105.9	-123.1	5.9	112.3	D319 T326 T354 D359	D319-R357 IonicContact OD1-CZ 2.74Å; D319-R357 IonicContact OD1-NH2 3.23Å; D319-R357 PolarHBondContact OD1-NH2 2.9Å; D319-R357 IonicContact OD2-CZ 2.71Å; D319-R357 IonicContact OD2-NE 2.68Å; D319-R357 IonicContact OD2-NH2 3.82Å; D319-R357 PolarHBondContact OD2-NH2 3.34Å; T326-R357 HydrophobicContact CG2-CG 3.66Å; T326-R357 VanDerWaalsContact OG1-CD 3.27Å; T326-R357 WeakPolarHBondContact OG1-CD 3.48Å; T326-R357 PolarHBondContact OG1-NE 3.45Å; T354-R357 WeakPolarHBondContact CB-O 3.32Å; T354-R357 PolarHBondContact OG1-O 2.74Å; R357-D359 WeakPolarHBondContact CB-OD1 3.28Å; R357-D359 IonicContact CZ-OD1 2.7Å; R357-D359 IonicContact NE-OD1 2.84Å; R357-D359 IonicContact NH1-OD1 3.87Å; R357-D359 PolarHBondContact NH1-OD1 2.78Å; R357-D359 IonicContact NH1-OD2 3.56Å; R357-D359 PolarHBondContact NH1-OD2 3.27Å
358	Q	91.5	Very high	92.9	Very high	197 Å²	197	50 Å²	50	92%	0.921	27%	0.274	S	S	*	.	S	Bend	trans	-108.1	-9	176.1	-64.1	-176.8	2	0	0	113.2	I360	Q358-I360 PolarHBondContact O-N 3.12Å
359	D	94.1	Very high	92.3	Very high	58 Å²	58	50.5 Å²	50.5	31%	0.31	28%	0.278	S	S	.	.			trans	-78.1	18.7	-177.7	75	-54.8	0	0	0	114	R357 K394 G418	R357-D359 WeakPolarHBondContact CB-OD1 3.28Å; R357-D359 IonicContact CZ-OD1 2.7Å; R357-D359 IonicContact NE-OD1 2.84Å; R357-D359 IonicContact NH1-OD1 3.87Å; R357-D359 PolarHBondContact NH1-OD1 2.78Å; R357-D359 IonicContact NH1-OD2 3.56Å; R357-D359 PolarHBondContact NH1-OD2 3.27Å; D359-K394 PolarHBondContact O-NZ 3.17Å; D359-G418 WeakPolarHBondContact OD2-CA 3.27Å; D359-G418 PolarHBondContact OD2-N 3.07Å
360	I	94.6	Very high	91.2	Very high	23 Å²	23	50.7 Å²	50.7	12%	0.118	29%	0.286	C	S	.	.			trans	-53.1	141.4	-178	-44.3	171.9	0	0	0	110.2	T354 Q358 Y362 K394 V416	T354-I360 HydrophobicContact CG2-CD1 3.51Å; Q358-I360 PolarHBondContact O-N 3.12Å; I360-Y362 HydrophobicContact CG2-CE1 4.23Å; I360-K394 WeakPolarHBondContact O-CD 3.05Å; I360-K394 PolarHBondContact O-NZ 2.94Å; I360-V416 CarbonylContact C-O 3.58Å; I360-V416 WeakPolarHBondContact CA-O 3.5Å
361	S	95.9	Very high	89.6	Confident	20 Å²	20	52.5 Å²	52.5	14%	0.14	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	164.2	168.6	9.8	0	0	0	0	109.9	L393 K394 V416	S361-L393 CarbonylContact C-O 3.43Å; S361-L393 WeakPolarHBondContact CA-O 3.24Å; S361-L393 WeakPolarHBondContact CB-O 3.16Å; S361-K394 PolarHBondContact OG-NZ 3.3Å; S361-V416 PolarHBondContact N-O 3.1Å; S361-V416 PolarHBondContact O-N 3.28Å
362	Y	96.1	Very high	87.9	Confident	11 Å²	11	56.3 Å²	56.3	4%	0.043	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	143	177.8	-50.8	-78	0	0	0	111.7	P332 W348 P351 I360 G392 L393 T395 T396 I413 W414 A415	P332-Y362 HydrophobicContact CG-CD1 4.1Å; P332-Y362 HydrophobicContact CG-CE1 4.14Å; W348-Y362 AromaticContact CD1-CE1 3.99Å; W348-Y362 AromaticContact CE2-CG 3.83Å; W348-Y362 HydrophobicContact CZ2-CD2 4.01Å; W348-Y362 AromaticContact CZ2-CG 3.83Å; W348-Y362 HydrophobicContact CZ2-CG 3.83Å; W348-Y362 AromaticContact NE1-CD1 3.31Å; W348-Y362 VanDerWaalsContact NE1-CD1 3.31Å; W348-Y362 AromaticContact NE1-CD2 3.44Å; W348-Y362 AromaticContact NE1-CE1 3.52Å; W348-Y362 AromaticContact NE1-CE2 3.66Å; W348-Y362 AromaticContact NE1-CG 3.27Å; W348-Y362 VanDerWaalsContact NE1-CG 3.27Å; W348-Y362 AromaticContact NE1-CZ 3.7Å; P351-Y362 WeakPolarHBondContact CD-OH 3.41Å; P351-Y362 HydrophobicContact CG-CE1 4.42Å; I360-Y362 HydrophobicContact CG2-CE1 4.23Å; Y362-G392 PolarHBondContact O-N 2.89Å; Y362-G392 VanDerWaalsContact O-N 3.1Å; Y362-L393 WeakPolarHBondContact CD2-O 3.33Å; Y362-L393 PolarHBondContact N-O 2.94Å; Y362-L393 VanDerWaalsContact O-CD1 3.24Å; Y362-L393 WeakPolarHBondContact O-CD1 3.27Å; Y362-L393 PolarHBondContact O-N 2.92Å; Y362-T395 WeakPolarHBondContact CD2-O 3.02Å; Y362-T396 HydrophobicContact CE2-CG2 3.74Å; Y362-I413 HydrophobicContact CD1-CG2 4.39Å; Y362-W414 CarbonylContact C-O 3.56Å; Y362-W414 WeakPolarHBondContact CA-O 3.38Å; Y362-A415 HydrophobicContact CD1-CB 4.21Å; Y362-A415 HydrophobicContact CE1-CB 4.06Å
363	N	95.6	Very high	86	Confident	45 Å²	45	50.5 Å²	50.5	24%	0.241	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.1	172.6	-68.5	-10	0	0	0	109.2	N391 G392 W414	N363-N391 WeakPolarHBondContact CB-OD1 3.39Å; N363-N391 WeakPolarHBondContact OD1-CA 3.4Å; N363-G392 PolarHBondContact OD1-N 2.84Å; N363-W414 HydrophobicContact CB-CB 4.31Å; N363-W414 PolarHBondContact N-O 3.37Å; N363-W414 PolarHBondContact O-N 3.12Å
364	V	94.9	Very high	84.3	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	112.5	-173.4	-175.5	0	0	0	0	110.6	L346 W348 Y386 Q390 L393 V398 F411	L346-V364 HydrophobicContact CD1-CG1 4.38Å; W348-V364 HydrophobicContact CH2-CG2 4.33Å; V364-Y386 HydrophobicContact CG1-CE1 4.31Å; V364-Q390 HydrophobicContact CB-CG 4.47Å; V364-Q390 PolarHBondContact N-O 2.97Å; V364-Q390 VanDerWaalsContact O-CG 3.26Å; V364-Q390 WeakPolarHBondContact O-CG 3.4Å; V364-Q390 PolarHBondContact O-NE2 2.94Å; V364-L393 HydrophobicContact CG2-CD1 4.45Å; V364-V398 HydrophobicContact CG2-CG1 4.14Å; V364-F411 HydrophobicContact CG1-CD1 4.29Å
365	V	93.1	Very high	82.7	Confident	53 Å²	53	55.1 Å²	55.1	32%	0.321	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	115.6	178.8	-176.8	0	0	0	0	109.2	K367 F411 E412	V365-K367 HydrophobicContact CG1-CG 4.42Å; V365-F411 WeakPolarHBondContact O-CA 3.48Å; V365-E412 HydrophobicContact CB-CB 4.25Å; V365-E412 PolarHBondContact N-O 2.57Å; V365-E412 PolarHBondContact O-N 3.45Å
366	C	92.2	Very high	81.7	Confident	5 Å²	5	61.8 Å²	61.8	3%	0.034	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.5	176.8	-179.4	0	0	0	0	110.7	C380 Y386 F411	C366-C380 HydrophobicContact CB-CB 3.61Å; C366-C380 WeakPolarHBondContact CB-SG 3.1Å; C366-C380 PolarHBondContact O-N 2.98Å; C366-C380 PolarHBondContact O-SG 3.3Å; C366-C380 VanDerWaalsContact O-SG 3.33Å; C366-C380 WeakPolarHBondContact SG-CB 3.33Å; C366-C380 CovalentContact SG-SG 2.03Å; C366-C380 PolarHBondContact SG-SG 2.97Å; C366-Y386 HydrophobicContact CB-CE1 4.4Å; C366-Y386 WeakPolarHBondContact CB-OH 3.47Å; C366-F411 HydrophobicContact CB-CD1 3.91Å; C366-F411 HydrophobicContact CB-CE1 3.71Å; C366-F411 WeakPolarHBondContact SG-CE1 3.31Å
367	K	90.4	Very high	81.2	Confident	61 Å²	61	60.8 Å²	60.8	27%	0.265	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	133.3	175	-60.9	177.6	-174.2	173.9	0	109.7	V365 C377 R378 C380 Y409 T410 E412	V365-K367 HydrophobicContact CG1-CG 4.42Å; K367-C377 HydrophobicContact CB-CB 4.2Å; K367-C377 HydrophobicContact CD-CB 4.46Å; K367-R378 CarbonylContact C-O 3.54Å; K367-R378 VanDerWaalsContact CA-O 3.29Å; K367-R378 WeakPolarHBondContact CA-O 2.87Å; K367-C380 PolarHBondContact N-SG 3.38Å; K367-Y409 CarbonylContact O-C 3.6Å; K367-Y409 VanDerWaalsContact O-CA 3.32Å; K367-Y409 WeakPolarHBondContact O-CA 3.42Å; K367-T410 PolarHBondContact N-O 2.84Å; K367-T410 PolarHBondContact O-N 3.5Å; K367-E412 WeakPolarHBondContact CE-OE1 3.35Å; K367-E412 WeakPolarHBondContact CE-OE2 3.38Å; K367-E412 IonicContact NZ-OE1 3.72Å; K367-E412 PolarHBondContact NZ-OE1 2.98Å; K367-E412 IonicContact NZ-OE2 3.66Å; K367-E412 PolarHBondContact NZ-OE2 3.28Å
368	K	87.8	Confident	80.9	Confident	81 Å²	81	68.2 Å²	68.2	35%	0.352	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.7	167.9	175.6	166.7	172.2	151	0	108.6	C377 R378 L404 T407 Y409	K368-C377 WeakPolarHBondContact O-CA 3.29Å; K368-R378 PolarHBondContact N-O 3.41Å; K368-R378 PolarHBondContact O-N 2.93Å; K368-L404 VanDerWaalsContact NZ-CD1 3.27Å; K368-T407 HydrophobicContact CD-CG2 3.68Å; K368-T407 VanDerWaalsContact CE-CG2 3.43Å; K368-T407 HydrophobicContact CG-CG2 3.89Å; K368-T407 PolarHBondContact NZ-OG1 2.94Å; K368-Y409 HydrophobicContact CB-CD1 4.08Å; K368-Y409 HydrophobicContact CB-CE1 3.9Å; K368-Y409 HydrophobicContact CD-CE1 4.4Å; K368-Y409 HydrophobicContact CG-CE1 4.36Å
369	C	82.4	Confident	80.7	Confident	17 Å²	17	64.1 Å²	64.1	12%	0.115	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	151.9	-173.6	-58.5	0	0	0	0	111.4	C377 N408 T410	C369-C377 HydrophobicContact CB-CB 4.19Å; C369-C377 WeakPolarHBondContact CB-SG 3.41Å; C369-C377 WeakPolarHBondContact SG-CB 3.4Å; C369-C377 CovalentContact SG-SG 2.04Å; C369-C377 PolarHBondContact SG-SG 2.92Å; C369-N408 PolarHBondContact N-O 2.89Å; C369-N408 VanDerWaalsContact N-O 3.11Å; C369-T410 PolarHBondContact SG-OG1 2.92Å
370	G	69.6	Low	80.3	Confident	41 Å²	41	62.5 Å²	62.5	42%	0.423	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	160	176.1	0	0	0	0	0	112.4	G372	G370-G372 PolarHBondContact O-N 3.43Å
371	A	59.2	Low	79.5	Confident	96 Å²	96	64 Å²	64	79%	0.793	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	113.1	169.5	0	0	0	0	0	109.9
372	G	57.5	Low	78.5	Confident	86 Å²	86	69.2 Å²	69.2	89%	0.887	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.4	-1.1	171.1	0	0	0	0	0	117.5	G370	G370-G372 PolarHBondContact O-N 3.43Å
373	D	53.8	Low	77.5	Confident	48 Å²	48	71.1 Å²	71.1	26%	0.257	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	102.1	-178.8	-173.4	-5.5	0	0	0	113	S375 K376	D373-S375 VanDerWaalsContact CG-OG 3.28Å; D373-S375 PolarHBondContact O-N 3.48Å; D373-S375 VanDerWaalsContact OD1-CB 3.29Å; D373-S375 WeakPolarHBondContact OD1-CB 3.16Å; D373-S375 PolarHBondContact OD1-N 3.13Å; D373-S375 PolarHBondContact OD1-OG 3.45Å; D373-S375 PolarHBondContact OD2-OG 3.07Å; D373-K376 IonicContact OD2-NZ 3.17Å; D373-K376 PolarHBondContact OD2-NZ 3.02Å
374	P	56.8	Low	77.2	Confident	114 Å²	114	69.8 Å²	69.8	74%	0.74	45%	0.452	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	-11.9	179.2	30.6	-35	0	0	0	113.6	K376 C377	P374-K376 VanDerWaalsContact C-N 3.28Å; P374-K376 PolarHBondContact O-N 3.38Å; P374-C377 PolarHBondContact O-SG 3.21Å; P374-C377 VanDerWaalsContact O-SG 3.4Å
375	S	60	Low	77	Confident	94 Å²	94	75.1 Å²	75.1	66%	0.657	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.6	-15.6	178.7	73.9	0	0	0	0	113.6	D373	D373-S375 VanDerWaalsContact CG-OG 3.28Å; D373-S375 PolarHBondContact O-N 3.48Å; D373-S375 VanDerWaalsContact OD1-CB 3.29Å; D373-S375 WeakPolarHBondContact OD1-CB 3.16Å; D373-S375 PolarHBondContact OD1-N 3.13Å; D373-S375 PolarHBondContact OD1-OG 3.45Å; D373-S375 PolarHBondContact OD2-OG 3.07Å
376	K	68.1	Low	77	Confident	146 Å²	146	74.3 Å²	74.3	64%	0.635	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	25.8	-174.1	-62.8	-170.1	-179.7	85.3	0	114.3	D373 P374	D373-K376 IonicContact OD2-NZ 3.17Å; D373-K376 PolarHBondContact OD2-NZ 3.02Å; P374-K376 VanDerWaalsContact C-N 3.28Å; P374-K376 PolarHBondContact O-N 3.38Å
377	C	79.8	Confident	77	Confident	43 Å²	43	78.1 Å²	78.1	29%	0.291	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	129.5	173.2	-64.8	0	0	0	0	111.9	K367 K368 C369 P374	K367-C377 HydrophobicContact CB-CB 4.2Å; K367-C377 HydrophobicContact CD-CB 4.46Å; K368-C377 WeakPolarHBondContact O-CA 3.29Å; C369-C377 HydrophobicContact CB-CB 4.19Å; C369-C377 WeakPolarHBondContact CB-SG 3.41Å; C369-C377 WeakPolarHBondContact SG-CB 3.4Å; C369-C377 CovalentContact SG-SG 2.04Å; C369-C377 PolarHBondContact SG-SG 2.92Å; P374-C377 PolarHBondContact O-SG 3.21Å; P374-C377 VanDerWaalsContact O-SG 3.4Å
378	R	85.8	Confident	77.1	Confident	194 Å²	194	79.2 Å²	79.2	73%	0.732	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	150.6	173.5	-67.9	-175.7	179	-177.8	-0.4	110.4	K367 K368	K367-R378 CarbonylContact C-O 3.54Å; K367-R378 VanDerWaalsContact CA-O 3.29Å; K367-R378 WeakPolarHBondContact CA-O 2.87Å; K368-R378 PolarHBondContact N-O 3.41Å; K368-R378 PolarHBondContact O-N 2.93Å
379	P	87.3	Confident	77.2	Confident	110 Å²	110	80 Å²	80	71%	0.714	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	147.2	172.1	27.3	-35.1	0	0	0	110.8
380	C	84.8	Confident	77.7	Confident	24 Å²	24	82.5 Å²	82.5	16%	0.162	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-66.4	139.7	173.2	-59.2	0	0	0	0	110.7	C366 K367 V384 Y409	C366-C380 HydrophobicContact CB-CB 3.61Å; C366-C380 WeakPolarHBondContact CB-SG 3.1Å; C366-C380 PolarHBondContact O-N 2.98Å; C366-C380 PolarHBondContact O-SG 3.3Å; C366-C380 VanDerWaalsContact O-SG 3.33Å; C366-C380 WeakPolarHBondContact SG-CB 3.33Å; C366-C380 CovalentContact SG-SG 2.03Å; C366-C380 PolarHBondContact SG-SG 2.97Å; K367-C380 PolarHBondContact N-SG 3.38Å; C380-V384 HydrophobicContact CB-CG2 4.26Å; C380-Y409 VanDerWaalsContact SG-CD1 3.59Å
381	G	78.6	Confident	78.9	Confident	56 Å²	56	84.6 Å²	84.6	58%	0.577	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-72.8	168.2	-179.3	0	0	0	0	0	113.3	G383 V384	G381-G383 PolarHBondContact O-N 3.15Å; G381-V384 PolarHBondContact O-N 3.31Å
382	S	74.5	Confident	80.5	Confident	129 Å²	129	81.4 Å²	81.4	90%	0.902	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	0.9	-176.2	57.2	0	0	0	0	116.1	V384	S382-V384 VanDerWaalsContact C-N 3.33Å
383	G	75.9	Confident	82.2	Confident	50 Å²	50	77.4 Å²	77.4	52%	0.515	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	8.9	173.5	0	0	0	0	0	114.3	G381 D402	G381-G383 PolarHBondContact O-N 3.15Å; G383-D402 WeakPolarHBondContact O-CB 3.36Å
384	V	88.9	Confident	84.1	Confident	18 Å²	18	81.6 Å²	81.6	11%	0.109	47%	0.471	C	S	.	.			trans	-104	122.4	177.5	176	0	0	0	0	108.9	C380 G381 S382 Y386 I400 L403	C380-V384 HydrophobicContact CB-CG2 4.26Å; G381-V384 PolarHBondContact O-N 3.31Å; S382-V384 VanDerWaalsContact C-N 3.33Å; V384-Y386 HydrophobicContact CB-CE2 4.45Å; V384-Y386 HydrophobicContact CG1-CE2 4.01Å; V384-Y386 WeakPolarHBondContact O-CE2 3.17Å; V384-I400 HydrophobicContact CG1-CG2 3.27Å; V384-L403 HydrophobicContact CG1-CD2 3.73Å; V384-L403 HydrophobicContact CG1-CG 4.5Å; V384-L403 HydrophobicContact CG2-CD2 3.97Å
385	H	90.8	Very high	85.8	Confident	111 Å²	111	79.6 Å²	79.6	51%	0.514	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	145.6	-177.3	-68.4	-85.6	0	0	0	112	I400 T401 D402	H385-I400 WeakPolarHBondContact O-CA 3.36Å; H385-T401 PolarHBondContact N-O 3.45Å; H385-T401 PolarHBondContact O-N 3.28Å; H385-D402 IonicContact CD2-OD2 2.86Å; H385-D402 PolarHBondContact CD2-OD2 2.89Å
386	Y	93.3	Very high	87.4	Confident	36 Å²	36	77.1 Å²	77.1	14%	0.141	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	113.9	-177.3	-57.4	-100.8	0	0	0	109.8	V364 C366 V384 P388 Q389 Q390 I400	V364-Y386 HydrophobicContact CG1-CE1 4.31Å; C366-Y386 HydrophobicContact CB-CE1 4.4Å; C366-Y386 WeakPolarHBondContact CB-OH 3.47Å; V384-Y386 HydrophobicContact CB-CE2 4.45Å; V384-Y386 HydrophobicContact CG1-CE2 4.01Å; V384-Y386 WeakPolarHBondContact O-CE2 3.17Å; Y386-P388 CarbonylContact O-C 3.59Å; Y386-Q389 WeakPolarHBondContact O-CA 3.39Å; Y386-Q389 PolarHBondContact O-N 3.3Å; Y386-Q390 HydrophobicContact CD1-CB 4.19Å; Y386-Q390 HydrophobicContact CD1-CG 3.9Å; Y386-Q390 HydrophobicContact CD2-CB 3.91Å; Y386-Q390 HydrophobicContact CD2-CG 4.01Å; Y386-Q390 HydrophobicContact CE1-CG 3.95Å; Y386-Q390 HydrophobicContact CE2-CB 4.44Å; Y386-Q390 HydrophobicContact CE2-CG 4.08Å; Y386-Q390 HydrophobicContact CG-CB 3.79Å; Y386-Q390 HydrophobicContact CG-CG 3.94Å; Y386-I400 HydrophobicContact CD1-CG1 3.65Å; Y386-I400 HydrophobicContact CD1-CG2 4.35Å; Y386-I400 HydrophobicContact CE1-CG1 3.84Å; Y386-I400 HydrophobicContact CE1-CG2 4.17Å
387	T	92	Very high	88.6	Confident	86 Å²	86	75.3 Å²	75.3	53%	0.528	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	124.6	178.8	-58.3	0	0	0	0	109.7	V398 S399	T387-V398 WeakPolarHBondContact O-CA 3.44Å; T387-V398 VanDerWaalsContact O-CG2 3.32Å; T387-V398 WeakPolarHBondContact O-CG2 3.46Å; T387-S399 PolarHBondContact N-O 2.84Å; T387-S399 PolarHBondContact O-N 2.88Å
388	P	91.2	Very high	89.3	Confident	84 Å²	84	73.4 Å²	73.4	55%	0.545	42%	0.417	S	S	.	.	S	Bend	cis	-81.2	-25.9	6	31.6	-35.4	0	0	0	115	Y386	Y386-P388 CarbonylContact O-C 3.59Å
389	Q	91.9	Very high	89.6	Confident	96 Å²	96	66.3 Å²	66.3	45%	0.449	40%	0.397	S	S	.	.			trans	-162.2	171.1	179.3	61.6	-164.6	59.4	0	0	110.2	Y386 N391 L393	Y386-Q389 WeakPolarHBondContact O-CA 3.39Å; Y386-Q389 PolarHBondContact O-N 3.3Å; Q389-N391 PolarHBondContact NE2-O 3.16Å; Q389-L393 HydrophobicContact CG-CD1 4.01Å; Q389-L393 HydrophobicContact CG-CG 3.85Å; Q389-L393 WeakPolarHBondContact O-CD1 3.46Å
390	Q	92.8	Very high	90	Very high	71 Å²	71	61 Å²	61	33%	0.332	36%	0.363	S	S	.	.	S	Bend	trans	-95.1	-33.4	180	-170.7	-174.2	3.8	0	0	114.4	V364 Y386 L393	V364-Q390 HydrophobicContact CB-CG 4.47Å; V364-Q390 PolarHBondContact N-O 2.97Å; V364-Q390 VanDerWaalsContact O-CG 3.26Å; V364-Q390 WeakPolarHBondContact O-CG 3.4Å; V364-Q390 PolarHBondContact O-NE2 2.94Å; Y386-Q390 HydrophobicContact CD1-CB 4.19Å; Y386-Q390 HydrophobicContact CD1-CG 3.9Å; Y386-Q390 HydrophobicContact CD2-CB 3.91Å; Y386-Q390 HydrophobicContact CD2-CG 4.01Å; Y386-Q390 HydrophobicContact CE1-CG 3.95Å; Y386-Q390 HydrophobicContact CE2-CB 4.44Å; Y386-Q390 HydrophobicContact CE2-CG 4.08Å; Y386-Q390 HydrophobicContact CG-CB 3.79Å; Y386-Q390 HydrophobicContact CG-CG 3.94Å; Q390-L393 VanDerWaalsContact O-CD1 3.29Å; Q390-L393 WeakPolarHBondContact O-CD1 3.35Å
391	N	93.8	Very high	90.2	Very high	84 Å²	84	61.8 Å²	61.8	45%	0.449	37%	0.367	S	S	.	.	S	Bend	trans	-127.7	153	-174.6	-66.1	-68.1	0	0	0	110.8	N363 Q389 L393	N363-N391 WeakPolarHBondContact CB-OD1 3.39Å; N363-N391 WeakPolarHBondContact OD1-CA 3.4Å; Q389-N391 PolarHBondContact NE2-O 3.16Å; N391-L393 VanDerWaalsContact C-N 3.29Å; N391-L393 PolarHBondContact O-N 3.24Å
392	G	92.6	Very high	90.7	Very high	29 Å²	29	63.5 Å²	63.5	30%	0.299	36%	0.363	S	S	.	.	S	Bend	trans	71.2	15.8	178.1	0	0	0	0	0	115.1	Y362 N363 K394	Y362-G392 PolarHBondContact O-N 2.89Å; Y362-G392 VanDerWaalsContact O-N 3.1Å; N363-G392 PolarHBondContact OD1-N 2.84Å; G392-K394 PolarHBondContact O-N 3.39Å
393	L	94.5	Very high	91.3	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-60.6	131.9	-175.6	-69.7	79.2	0	0	0	110.4	W348 S361 Y362 V364 Q389 Q390 N391 V398	W348-L393 HydrophobicContact CH2-CD2 4.23Å; S361-L393 CarbonylContact C-O 3.43Å; S361-L393 WeakPolarHBondContact CA-O 3.24Å; S361-L393 WeakPolarHBondContact CB-O 3.16Å; Y362-L393 WeakPolarHBondContact CD2-O 3.33Å; Y362-L393 PolarHBondContact N-O 2.94Å; Y362-L393 VanDerWaalsContact O-CD1 3.24Å; Y362-L393 WeakPolarHBondContact O-CD1 3.27Å; Y362-L393 PolarHBondContact O-N 2.92Å; V364-L393 HydrophobicContact CG2-CD1 4.45Å; Q389-L393 HydrophobicContact CG-CD1 4.01Å; Q389-L393 HydrophobicContact CG-CG 3.85Å; Q389-L393 WeakPolarHBondContact O-CD1 3.46Å; Q390-L393 VanDerWaalsContact O-CD1 3.29Å; Q390-L393 WeakPolarHBondContact O-CD1 3.35Å; N391-L393 VanDerWaalsContact C-N 3.29Å; N391-L393 PolarHBondContact O-N 3.24Å; L393-V398 HydrophobicContact CD2-CB 3.87Å; L393-V398 HydrophobicContact CD2-CG2 4.16Å
394	K	92.6	Very high	91.7	Very high	136 Å²	136	59.6 Å²	59.6	59%	0.591	32%	0.319	S	S	*	.	S	Bend	trans	-91.5	-16.3	167.9	-59.5	-52.6	-172.1	-170.7	0	113	D359 I360 S361 G392	D359-K394 PolarHBondContact O-NZ 3.17Å; I360-K394 WeakPolarHBondContact O-CD 3.05Å; I360-K394 PolarHBondContact O-NZ 2.94Å; S361-K394 PolarHBondContact OG-NZ 3.3Å; G392-K394 PolarHBondContact O-N 3.39Å
395	T	93.3	Very high	91.3	Very high	72 Å²	72	59.3 Å²	59.3	44%	0.442	32%	0.319	S	S	.	.	S	Bend	trans	-83.6	151.5	172.3	49.1	0	0	0	0	111.5	Y362 K397	Y362-T395 WeakPolarHBondContact CD2-O 3.02Å; T395-K397 VanDerWaalsContact C-N 3.28Å; T395-K397 PolarHBondContact O-N 3.15Å; T395-K397 PolarHBondContact OG1-O 3.38Å
396	T	92.9	Very high	90.9	Very high	43 Å²	43	58.8 Å²	58.8	26%	0.264	32%	0.317	S	S	.	.	S	Bend	trans	-94.3	28.5	173.6	64.4	0	0	0	0	113.3	E347 W348 Y362	E347-T396 WeakPolarHBondContact CA-O 3.14Å; W348-T396 VanDerWaalsContact CE2-CA 3.48Å; W348-T396 PolarHBondContact N-O 3.45Å; W348-T396 WeakPolarHBondContact O-CB 3.21Å; W348-T396 PolarHBondContact O-OG1 2.99Å; Y362-T396 HydrophobicContact CE2-CG2 3.74Å
397	K	92.4	Very high	90.4	Very high	108 Å²	108	58 Å²	58	47%	0.47	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	143.4	178.9	-53.9	-167.2	-171.3	-142.3	0	110.4	L346 E347 T395	L346-K397 VanDerWaalsContact O-CA 3.3Å; L346-K397 WeakPolarHBondContact O-CA 3.38Å; E347-K397 HydrophobicContact CB-CG 4.32Å; E347-K397 HydrophobicContact CG-CD 4.38Å; E347-K397 HydrophobicContact CG-CG 4.1Å; E347-K397 WeakPolarHBondContact OE1-CE 3.33Å; E347-K397 IonicContact OE1-NZ 2.62Å; E347-K397 PolarHBondContact OE1-NZ 2.99Å; E347-K397 WeakPolarHBondContact OE2-CE 3.06Å; E347-K397 IonicContact OE2-NZ 2.65Å; E347-K397 PolarHBondContact OE2-NZ 3.18Å; T395-K397 VanDerWaalsContact C-N 3.28Å; T395-K397 PolarHBondContact O-N 3.15Å; T395-K397 PolarHBondContact OG1-O 3.38Å
398	V	94.9	Very high	90.1	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.018	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	144.3	167.4	70.1	0	0	0	0	109.9	L346 W348 V364 T387 L393 I400	L346-V398 HydrophobicContact CB-CG1 4.04Å; L346-V398 HydrophobicContact CD1-CG1 4.35Å; L346-V398 PolarHBondContact N-O 2.77Å; L346-V398 PolarHBondContact O-N 3.35Å; W348-V398 HydrophobicContact CH2-CB 4.31Å; W348-V398 HydrophobicContact CH2-CG1 4.08Å; W348-V398 HydrophobicContact CZ3-CG1 4.01Å; V364-V398 HydrophobicContact CG2-CG1 4.14Å; T387-V398 WeakPolarHBondContact O-CA 3.44Å; T387-V398 VanDerWaalsContact O-CG2 3.32Å; T387-V398 WeakPolarHBondContact O-CG2 3.46Å; L393-V398 HydrophobicContact CD2-CB 3.87Å; L393-V398 HydrophobicContact CD2-CG2 4.16Å; V398-I400 HydrophobicContact CG1-CD1 3.7Å; V398-I400 HydrophobicContact CG1-CG1 4.4Å
399	S	92.8	Very high	90	Very high	44 Å²	44	52.6 Å²	52.6	31%	0.308	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	121.5	168.4	-61.7	0	0	0	0	108.9	N345 T387	N345-S399 VanDerWaalsContact OD1-CB 3.29Å; N345-S399 WeakPolarHBondContact OD1-CB 3.5Å; N345-S399 PolarHBondContact OD1-OG 2.96Å; T387-S399 PolarHBondContact N-O 2.84Å; T387-S399 PolarHBondContact O-N 2.88Å
400	I	94.6	Very high	89.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	124.3	173.3	-53.6	96.3	0	0	0	108.4	S343 V344 L346 V384 H385 Y386 V398 L403 F411	S343-I400 CarbonylContact C-O 3.48Å; S343-I400 VanDerWaalsContact CA-O 3.23Å; S343-I400 WeakPolarHBondContact CA-O 3.26Å; S343-I400 WeakPolarHBondContact CB-O 2.88Å; V344-I400 PolarHBondContact N-O 3.09Å; V344-I400 VanDerWaalsContact O-CD1 3.32Å; V344-I400 WeakPolarHBondContact O-CD1 3.01Å; V344-I400 PolarHBondContact O-N 3.42Å; L346-I400 HydrophobicContact CB-CD1 4.45Å; L346-I400 HydrophobicContact CD1-CD1 3.56Å; L346-I400 HydrophobicContact CG-CD1 3.69Å; V384-I400 HydrophobicContact CG1-CG2 3.27Å; H385-I400 WeakPolarHBondContact O-CA 3.36Å; Y386-I400 HydrophobicContact CD1-CG1 3.65Å; Y386-I400 HydrophobicContact CD1-CG2 4.35Å; Y386-I400 HydrophobicContact CE1-CG1 3.84Å; Y386-I400 HydrophobicContact CE1-CG2 4.17Å; V398-I400 HydrophobicContact CG1-CD1 3.7Å; V398-I400 HydrophobicContact CG1-CG1 4.4Å; I400-L403 HydrophobicContact CB-CD1 4.35Å; I400-L403 HydrophobicContact CG2-CD1 3.98Å; I400-L403 HydrophobicContact CG2-CD2 3.91Å; I400-L403 HydrophobicContact CG2-CG 4.01Å; I400-F411 HydrophobicContact CB-CE1 4.34Å; I400-F411 HydrophobicContact CB-CZ 4.46Å; I400-F411 HydrophobicContact CD1-CD1 4.32Å; I400-F411 HydrophobicContact CD1-CE1 3.98Å; I400-F411 HydrophobicContact CD1-CZ 4.39Å; I400-F411 HydrophobicContact CG1-CE1 3.89Å; I400-F411 HydrophobicContact CG1-CZ 4.42Å; I400-F411 HydrophobicContact CG2-CE1 4.15Å; I400-F411 HydrophobicContact CG2-CZ 4.31Å
401	T	90.3	Very high	89.9	Confident	40 Å²	40	45.4 Å²	45.4	25%	0.245	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	172.3	179.6	61.8	0	0	0	0	111.3	H385 L403	H385-T401 PolarHBondContact N-O 3.45Å; H385-T401 PolarHBondContact O-N 3.28Å; T401-L403 PolarHBondContact O-N 3.42Å
402	D	87.9	Confident	89.9	Confident	92 Å²	92	43.2 Å²	43.2	49%	0.492	23%	0.233	S	C	.	.			trans	64.3	26.9	171.4	-48.5	-72.3	0	0	0	114.2	G383 H385	G383-D402 WeakPolarHBondContact O-CB 3.36Å; H385-D402 IonicContact CD2-OD2 2.86Å; H385-D402 PolarHBondContact CD2-OD2 2.89Å
403	L	87.1	Confident	90	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-76.1	147.6	172	-58	162.6	0	0	0	110.1	T342 V344 V384 I400 T401 A405 Y409 F411 T436	T342-L403 VanDerWaalsContact CB-O 3.22Å; T342-L403 WeakPolarHBondContact CB-O 3.39Å; T342-L403 WeakPolarHBondContact CG2-O 3.23Å; T342-L403 VanDerWaalsContact O-CB 3.26Å; T342-L403 WeakPolarHBondContact O-CB 3.19Å; T342-L403 PolarHBondContact O-N 3.06Å; V344-L403 HydrophobicContact CB-CD1 3.92Å; V344-L403 HydrophobicContact CG2-CD1 3.55Å; V384-L403 HydrophobicContact CG1-CD2 3.73Å; V384-L403 HydrophobicContact CG1-CG 4.5Å; V384-L403 HydrophobicContact CG2-CD2 3.97Å; I400-L403 HydrophobicContact CB-CD1 4.35Å; I400-L403 HydrophobicContact CG2-CD1 3.98Å; I400-L403 HydrophobicContact CG2-CD2 3.91Å; I400-L403 HydrophobicContact CG2-CG 4.01Å; T401-L403 PolarHBondContact O-N 3.42Å; L403-A405 PolarHBondContact O-N 3.23Å; L403-Y409 HydrophobicContact CB-CD2 4.43Å; L403-Y409 HydrophobicContact CB-CE2 3.8Å; L403-Y409 HydrophobicContact CD2-CD1 4.06Å; L403-Y409 HydrophobicContact CD2-CD2 4.33Å; L403-Y409 HydrophobicContact CD2-CE1 3.75Å; L403-Y409 HydrophobicContact CD2-CE2 4.06Å; L403-Y409 HydrophobicContact CD2-CG 4.32Å; L403-Y409 HydrophobicContact CG-CE2 4.45Å; L403-F411 HydrophobicContact CD1-CZ 4.01Å; L403-F411 HydrophobicContact CD2-CZ 4.21Å; L403-T436 HydrophobicContact CB-CG2 3.86Å; L403-T436 HydrophobicContact CD1-CG2 4.24Å
404	L	84.9	Confident	90.1	Very high	92 Å²	92	44.6 Å²	44.6	48%	0.482	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-66	136	176.7	-65.2	167.1	0	0	0	109.8	K368 T407 Y409 T436	K368-L404 VanDerWaalsContact NZ-CD1 3.27Å; L404-T407 WeakPolarHBondContact O-CB 3.39Å; L404-Y409 PolarHBondContact N-OH 2.03Å; L404-T436 WeakPolarHBondContact O-CB 3.35Å; L404-T436 PolarHBondContact O-OG1 3.06Å
405	A	81.2	Confident	90.3	Very high	12 Å²	12	38.1 Å²	38.1	10%	0.099	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	155.9	175.4	0	0	0	0	0	112.1	T342 L403 T407 T436 A439 N468	T342-A405 HydrophobicContact CG2-CB 4.33Å; L403-A405 PolarHBondContact O-N 3.23Å; A405-T407 PolarHBondContact O-N 3.27Å; A405-T407 PolarHBondContact O-OG1 2.92Å; A405-T436 VanDerWaalsContact C-OG1 3.28Å; A405-A439 HydrophobicContact CB-CB 3.89Å; A405-N468 HydrophobicContact CB-CB 3.99Å
406	H	81.8	Confident	90.4	Very high	101 Å²	101	36.4 Å²	36.4	47%	0.468	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	43	42.6	178.5	-159.6	50.7	0	0	0	114.8	T436 N437	H406-T436 WeakPolarHBondContact CA-O 3.19Å; H406-T436 PolarHBondContact N-OG1 3.3Å; H406-T436 VanDerWaalsContact N-OG1 3.08Å; H406-N437 PolarHBondContact N-O 2.97Å
407	T	83.1	Confident	90.5	Very high	18 Å²	18	34.7 Å²	34.7	11%	0.11	18%	0.179	C	C	.	.			trans	-124.9	140.3	-174.7	-69.2	0	0	0	0	110.8	K368 L404 A405 Y409 T435 T436	K368-T407 HydrophobicContact CD-CG2 3.68Å; K368-T407 VanDerWaalsContact CE-CG2 3.43Å; K368-T407 HydrophobicContact CG-CG2 3.89Å; K368-T407 PolarHBondContact NZ-OG1 2.94Å; L404-T407 WeakPolarHBondContact O-CB 3.39Å; A405-T407 PolarHBondContact O-N 3.27Å; A405-T407 PolarHBondContact O-OG1 2.92Å; T407-Y409 HydrophobicContact CG2-CD2 3.82Å; T407-Y409 HydrophobicContact CG2-CE1 4.49Å; T407-Y409 HydrophobicContact CG2-CE2 3.34Å; T407-Y409 WeakPolarHBondContact O-CD2 3.33Å; T407-T435 WeakPolarHBondContact O-CA 3.38Å; T407-T436 PolarHBondContact N-OG1 3.15Å; T407-T436 PolarHBondContact O-N 3.15Å; T407-T436 VanDerWaalsContact O-N 3.1Å; T407-T436 PolarHBondContact O-OG1 2.81Å
408	N	86.4	Confident	90.5	Very high	49 Å²	49	30.6 Å²	30.6	26%	0.262	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	122.7	173.9	-66.9	-0.5	0	0	0	111.4	C369 V434 T435	C369-N408 PolarHBondContact N-O 2.89Å; C369-N408 VanDerWaalsContact N-O 3.11Å; N408-V434 WeakPolarHBondContact CA-O 3.46Å; N408-T435 WeakPolarHBondContact OD1-CG2 3.45Å; N408-T435 PolarHBondContact OD1-OG1 2.98Å; N408-T435 VanDerWaalsContact OD1-OG1 3.08Å
409	Y	88.4	Confident	90.4	Very high	8 Å²	8	30.4 Å²	30.4	3%	0.031	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	138.8	174.1	-71.5	-85.5	0	0	0	110.3	K367 K368 C380 L403 L404 T407 T433 V434 T436	K367-Y409 CarbonylContact O-C 3.6Å; K367-Y409 VanDerWaalsContact O-CA 3.32Å; K367-Y409 WeakPolarHBondContact O-CA 3.42Å; K368-Y409 HydrophobicContact CB-CD1 4.08Å; K368-Y409 HydrophobicContact CB-CE1 3.9Å; K368-Y409 HydrophobicContact CD-CE1 4.4Å; K368-Y409 HydrophobicContact CG-CE1 4.36Å; C380-Y409 VanDerWaalsContact SG-CD1 3.59Å; L403-Y409 HydrophobicContact CB-CD2 4.43Å; L403-Y409 HydrophobicContact CB-CE2 3.8Å; L403-Y409 HydrophobicContact CD2-CD1 4.06Å; L403-Y409 HydrophobicContact CD2-CD2 4.33Å; L403-Y409 HydrophobicContact CD2-CE1 3.75Å; L403-Y409 HydrophobicContact CD2-CE2 4.06Å; L403-Y409 HydrophobicContact CD2-CG 4.32Å; L403-Y409 HydrophobicContact CG-CE2 4.45Å; L404-Y409 PolarHBondContact N-OH 2.03Å; T407-Y409 HydrophobicContact CG2-CD2 3.82Å; T407-Y409 HydrophobicContact CG2-CE1 4.49Å; T407-Y409 HydrophobicContact CG2-CE2 3.34Å; T407-Y409 WeakPolarHBondContact O-CD2 3.33Å; Y409-T433 CarbonylContact O-C 3.53Å; Y409-T433 WeakPolarHBondContact O-CA 3.29Å; Y409-V434 PolarHBondContact N-O 3.45Å; Y409-V434 PolarHBondContact O-N 2.85Å; Y409-T436 HydrophobicContact CD2-CG2 4.12Å; Y409-T436 HydrophobicContact CE2-CG2 4.18Å
410	T	90.3	Very high	90.5	Very high	16 Å²	16	28.6 Å²	28.6	10%	0.098	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.3	170.5	-56.7	0	0	0	0	108.4	K367 C369 V432 T433	K367-T410 PolarHBondContact N-O 2.84Å; K367-T410 PolarHBondContact O-N 3.5Å; C369-T410 PolarHBondContact SG-OG1 2.92Å; T410-V432 CarbonylContact C-O 3.56Å; T410-V432 VanDerWaalsContact CA-O 3.32Å; T410-V432 WeakPolarHBondContact CA-O 3.16Å; T410-T433 WeakPolarHBondContact CG2-OG1 3.47Å; T410-T433 PolarHBondContact OG1-OG1 3.21Å
411	F	92.5	Very high	90.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	127.8	177.9	-65.7	-87.9	0	0	0	109.6	V344 L346 V364 V365 C366 I400 L403 I413 S431 V432 V434	V344-F411 HydrophobicContact CB-CE2 4.33Å; V344-F411 HydrophobicContact CB-CZ 4.49Å; V344-F411 HydrophobicContact CG1-CE2 4.16Å; V344-F411 HydrophobicContact CG2-CE2 4.34Å; L346-F411 HydrophobicContact CD1-CB 3.64Å; L346-F411 HydrophobicContact CD1-CD1 3.93Å; L346-F411 HydrophobicContact CD1-CD2 4.28Å; L346-F411 HydrophobicContact CD1-CG 3.71Å; V364-F411 HydrophobicContact CG1-CD1 4.29Å; V365-F411 WeakPolarHBondContact O-CA 3.48Å; C366-F411 HydrophobicContact CB-CD1 3.91Å; C366-F411 HydrophobicContact CB-CE1 3.71Å; C366-F411 WeakPolarHBondContact SG-CE1 3.31Å; I400-F411 HydrophobicContact CB-CE1 4.34Å; I400-F411 HydrophobicContact CB-CZ 4.46Å; I400-F411 HydrophobicContact CD1-CD1 4.32Å; I400-F411 HydrophobicContact CD1-CE1 3.98Å; I400-F411 HydrophobicContact CD1-CZ 4.39Å; I400-F411 HydrophobicContact CG1-CE1 3.89Å; I400-F411 HydrophobicContact CG1-CZ 4.42Å; I400-F411 HydrophobicContact CG2-CE1 4.15Å; I400-F411 HydrophobicContact CG2-CZ 4.31Å; L403-F411 HydrophobicContact CD1-CZ 4.01Å; L403-F411 HydrophobicContact CD2-CZ 4.21Å; F411-I413 HydrophobicContact CB-CD1 4.13Å; F411-S431 CarbonylContact O-C 3.56Å; F411-S431 VanDerWaalsContact O-CA 3.25Å; F411-S431 WeakPolarHBondContact O-CA 3.25Å; F411-V432 HydrophobicContact CB-CG1 4.28Å; F411-V432 PolarHBondContact N-O 3.17Å; F411-V432 PolarHBondContact O-N 3.43Å; F411-V434 HydrophobicContact CD2-CG1 3.87Å; F411-V434 HydrophobicContact CE2-CG1 3.69Å
412	E	93.5	Very high	90.4	Very high	38 Å²	38	36.6 Å²	36.6	18%	0.178	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.3	174	-65.1	165.8	176.2	0	0	109.2	V365 K367 V430	V365-E412 HydrophobicContact CB-CB 4.25Å; V365-E412 PolarHBondContact N-O 2.57Å; V365-E412 PolarHBondContact O-N 3.45Å; K367-E412 WeakPolarHBondContact CE-OE1 3.35Å; K367-E412 WeakPolarHBondContact CE-OE2 3.38Å; K367-E412 IonicContact NZ-OE1 3.72Å; K367-E412 PolarHBondContact NZ-OE1 2.98Å; K367-E412 IonicContact NZ-OE2 3.66Å; K367-E412 PolarHBondContact NZ-OE2 3.28Å; E412-V430 WeakPolarHBondContact CA-O 3.46Å
413	I	95.3	Very high	90.7	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	111.1	-179.5	-60.3	61.6	0	0	0	106.4	P332 L335 L346 W348 Y362 F411 S429 V430	P332-I413 HydrophobicContact CG-CB 4.49Å; P332-I413 HydrophobicContact CG-CG2 3.95Å; L335-I413 HydrophobicContact CD1-CD1 3.73Å; L335-I413 HydrophobicContact CD1-CG1 3.99Å; L335-I413 HydrophobicContact CD2-CD1 3.57Å; L335-I413 HydrophobicContact CD2-CG1 4.41Å; L335-I413 HydrophobicContact CG-CD1 4.32Å; L346-I413 HydrophobicContact CD1-CD1 4.04Å; W348-I413 HydrophobicContact CD2-CG2 3.85Å; W348-I413 HydrophobicContact CE3-CG1 4.14Å; W348-I413 HydrophobicContact CE3-CG2 4.22Å; W348-I413 HydrophobicContact CG-CG2 4.32Å; W348-I413 HydrophobicContact CH2-CG2 4.35Å; W348-I413 HydrophobicContact CZ2-CG2 3.96Å; W348-I413 HydrophobicContact CZ3-CG1 4.25Å; W348-I413 HydrophobicContact CZ3-CG2 4.46Å; Y362-I413 HydrophobicContact CD1-CG2 4.39Å; F411-I413 HydrophobicContact CB-CD1 4.13Å; I413-S429 VanDerWaalsContact O-CA 3.3Å; I413-S429 WeakPolarHBondContact O-CA 3.37Å; I413-V430 PolarHBondContact N-O 2.68Å; I413-V430 PolarHBondContact O-N 3.49Å; I413-V430 VanDerWaalsContact O-N 3.11Å
414	W	96.3	Very high	90.8	Very high	61 Å²	61	40.4 Å²	40.4	23%	0.231	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.3	-179.2	-71	68.8	0	0	0	110	Y362 N363 V416 S425 P426 Q428	Y362-W414 CarbonylContact C-O 3.56Å; Y362-W414 WeakPolarHBondContact CA-O 3.38Å; N363-W414 HydrophobicContact CB-CB 4.31Å; N363-W414 PolarHBondContact N-O 3.37Å; N363-W414 PolarHBondContact O-N 3.12Å; W414-V416 HydrophobicContact CB-CG2 4.32Å; W414-S425 WeakPolarHBondContact CZ3-O 3.33Å; W414-P426 HydrophobicContact CH2-CB 4.26Å; W414-Q428 HydrophobicContact CE3-CB 4.23Å
415	A	95.9	Very high	91	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	132	165.9	0	0	0	0	0	110	P329 P332 P351 Y362 Q428	P329-A415 HydrophobicContact CB-CB 4.16Å; P329-A415 HydrophobicContact CG-CB 3.62Å; P329-A415 WeakPolarHBondContact CG-O 3.28Å; P332-A415 HydrophobicContact CG-CB 4.1Å; P351-A415 HydrophobicContact CG-CB 3.55Å; Y362-A415 HydrophobicContact CD1-CB 4.21Å; Y362-A415 HydrophobicContact CE1-CB 4.06Å; A415-Q428 PolarHBondContact N-O 3.08Å
416	V	95.8	Very high	91.2	Very high	36 Å²	36	41.5 Å²	41.5	22%	0.218	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	131.9	-172.6	-175.8	0	0	0	0	109.6	I360 S361 W414	I360-V416 CarbonylContact C-O 3.58Å; I360-V416 WeakPolarHBondContact CA-O 3.5Å; S361-V416 PolarHBondContact N-O 3.1Å; S361-V416 PolarHBondContact O-N 3.28Å; W414-V416 HydrophobicContact CB-CG2 4.32Å
417	N	94.3	Very high	91.5	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.032	23%	0.226	C	C	.	.			trans	-124.4	175.1	168.7	71.7	17	0	0	0	110.3	R327 T354 V419 S420	R327-N417 PolarHBondContact O-ND2 3.36Å; T354-N417 PolarHBondContact O-ND2 3.37Å; N417-V419 PolarHBondContact O-N 2.84Å; N417-V419 WeakPolarHBondContact OD1-CG2 3.45Å; N417-V419 PolarHBondContact OD1-N 2.69Å; N417-V419 VanDerWaalsContact OD1-N 3.09Å; N417-S420 PolarHBondContact N-OG 3.4Å; N417-S420 WeakPolarHBondContact O-CB 3.36Å; N417-S420 PolarHBondContact O-N 3.29Å; N417-S420 PolarHBondContact OD1-N 2.83Å; N417-S420 VanDerWaalsContact OD1-N 3.13Å
418	G	92.1	Very high	91.9	Very high	22 Å²	22	41 Å²	41	23%	0.227	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-12	-177.2	0	0	0	0	0	116.7	D359	D359-G418 WeakPolarHBondContact OD2-CA 3.27Å; D359-G418 PolarHBondContact OD2-N 3.07Å
419	V	94.6	Very high	92.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-9.3	174.7	-63.2	0	0	0	0	114.2	F314 A316 R327 N417 K421 Y422	F314-V419 HydrophobicContact CB-CB 4.12Å; F314-V419 HydrophobicContact CB-CG1 4.01Å; A316-V419 HydrophobicContact CB-CG1 4.48Å; R327-V419 VanDerWaalsContact C-CG2 3.43Å; R327-V419 WeakPolarHBondContact O-CG2 3.26Å; N417-V419 PolarHBondContact O-N 2.84Å; N417-V419 WeakPolarHBondContact OD1-CG2 3.45Å; N417-V419 PolarHBondContact OD1-N 2.69Å; N417-V419 VanDerWaalsContact OD1-N 3.09Å; V419-K421 PolarHBondContact O-N 3.38Å; V419-K421 VanDerWaalsContact O-N 3.08Å; V419-Y422 HydrophobicContact CB-CD2 4.03Å; V419-Y422 HydrophobicContact CB-CE2 4.37Å; V419-Y422 HydrophobicContact CG1-CD2 4.28Å; V419-Y422 HydrophobicContact CG1-CE2 4.16Å; V419-Y422 WeakPolarHBondContact O-CD2 3.17Å; V419-Y422 PolarHBondContact O-N 3.09Å
420	S	93.3	Very high	92.5	Very high	6 Å²	6	41.5 Å²	41.5	4%	0.042	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-53.4	-28.8	172.5	-75.1	0	0	0	0	113.1	P329 N417 Y422 N423 Q428	P329-S420 WeakPolarHBondContact CD-OG 3.28Å; N417-S420 PolarHBondContact N-OG 3.4Å; N417-S420 WeakPolarHBondContact O-CB 3.36Å; N417-S420 PolarHBondContact O-N 3.29Å; N417-S420 PolarHBondContact OD1-N 2.83Å; N417-S420 VanDerWaalsContact OD1-N 3.13Å; S420-Y422 PolarHBondContact O-N 3.32Å; S420-N423 CarbonylContact O-C 3.54Å; S420-N423 PolarHBondContact O-N 3.1Å; S420-Q428 PolarHBondContact OG-OE1 2.84Å; S420-Q428 VanDerWaalsContact OG-OE1 3.09Å
421	K	92.2	Very high	92.6	Very high	116 Å²	116	44.2 Å²	44.2	50%	0.504	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-60.9	-25	177.3	62.8	167.3	177.6	157.8	0	114.6	D317 V419	D317-K421 VanDerWaalsContact CG-NZ 3.28Å; D317-K421 IonicContact OD1-NZ 3.65Å; D317-K421 PolarHBondContact OD1-NZ 3.07Å; D317-K421 VanDerWaalsContact OD1-NZ 3.13Å; D317-K421 IonicContact OD2-NZ 2.72Å; D317-K421 PolarHBondContact OD2-NZ 3.41Å; V419-K421 PolarHBondContact O-N 3.38Å; V419-K421 VanDerWaalsContact O-N 3.08Å
422	Y	92.3	Very high	92.5	Very high	91 Å²	91	45.5 Å²	45.5	36%	0.357	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-87.4	-18.4	-179	-55.1	-68.6	0	0	0	113.4	F314 R315 D317 V419 S420	F314-Y422 HydrophobicContact CB-CD2 3.62Å; F314-Y422 HydrophobicContact CB-CE2 4.09Å; F314-Y422 HydrophobicContact CB-CG 4.31Å; F314-Y422 HydrophobicContact CD1-CD2 4.2Å; F314-Y422 HydrophobicContact CD1-CG 4.01Å; F314-Y422 HydrophobicContact CD2-CD2 4.48Å; F314-Y422 AromaticContact CG-CD2 3.85Å; F314-Y422 HydrophobicContact CG-CD2 3.85Å; F314-Y422 HydrophobicContact CG-CG 4.1Å; R315-Y422 WeakPolarHBondContact O-CE2 3.44Å; R315-Y422 PolarHBondContact O-OH 2.8Å; R315-Y422 VanDerWaalsContact O-OH 3.11Å; D317-Y422 PolarHBondContact OD1-OH 2.92Å; V419-Y422 HydrophobicContact CB-CD2 4.03Å; V419-Y422 HydrophobicContact CB-CE2 4.37Å; V419-Y422 HydrophobicContact CG1-CD2 4.28Å; V419-Y422 HydrophobicContact CG1-CE2 4.16Å; V419-Y422 WeakPolarHBondContact O-CD2 3.17Å; V419-Y422 PolarHBondContact O-N 3.09Å; S420-Y422 PolarHBondContact O-N 3.32Å
423	N	92.4	Very high	92.3	Very high	81 Å²	81	47.9 Å²	47.9	43%	0.433	27%	0.273	S	S	.	.	S	Bend	trans	-152.8	74.2	177.8	-173.6	35.1	0	0	0	111	F314 P328 S420 Q428	F314-N423 HydrophobicContact CE2-CB 3.95Å; F314-N423 HydrophobicContact CZ-CB 4.04Å; P328-N423 HydrophobicContact CG-CB 4.29Å; S420-N423 CarbonylContact O-C 3.54Å; S420-N423 PolarHBondContact O-N 3.1Å; N423-Q428 PolarHBondContact O-NE2 3.12Å
424	P	89.4	Confident	91.8	Very high	96 Å²	96	48.5 Å²	48.5	62%	0.623	28%	0.277	S	S	*	.			trans	-74.9	125.8	175.9	30.3	-33.6	0	0	0	110.6
425	S	89.1	Confident	91.3	Very high	35 Å²	35	48.8 Å²	48.8	25%	0.245	29%	0.285	C	S	.	.			trans	-148	143.4	-174.3	170.3	0	0	0	0	110.6	W414 D427 Q428	W414-S425 WeakPolarHBondContact CZ3-O 3.33Å; S425-D427 WeakPolarHBondContact CB-OD1 3.31Å; S425-D427 PolarHBondContact O-N 3.48Å; S425-D427 PolarHBondContact OG-OD1 3.18Å; S425-Q428 VanDerWaalsContact O-CB 3.28Å; S425-Q428 WeakPolarHBondContact O-CB 3.23Å; S425-Q428 WeakPolarHBondContact O-CG 3.3Å; S425-Q428 PolarHBondContact O-N 3.18Å; S425-Q428 VanDerWaalsContact O-N 3.11Å
426	P	86.3	Confident	90.7	Very high	91 Å²	91	48.9 Å²	48.9	59%	0.591	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-68.1	-15	-170.8	26.7	-35.8	0	0	0	115	W414 Q428 S429	W414-P426 HydrophobicContact CH2-CB 4.26Å; P426-Q428 PolarHBondContact O-N 3.17Å; P426-S429 PolarHBondContact O-N 2.75Å; P426-S429 PolarHBondContact O-OG 3.43Å
427	D	86.9	Confident	89.8	Confident	105 Å²	105	50.8 Å²	50.8	56%	0.561	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-66.3	-9.2	170.8	69.2	-39.8	0	0	0	113.7	A331 S425 S429	A331-D427 WeakPolarHBondContact CB-O 3.42Å; A331-D427 PolarHBondContact N-O 3.12Å; S425-D427 WeakPolarHBondContact CB-OD1 3.31Å; S425-D427 PolarHBondContact O-N 3.48Å; S425-D427 PolarHBondContact OG-OD1 3.18Å; D427-S429 PolarHBondContact O-N 2.88Å
428	Q	92.3	Very high	88.9	Confident	5 Å²	5	53.1 Å²	53.1	2%	0.023	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-79.5	-0.5	168.3	-60.9	169.2	48.1	0	0	112.3	P328 P329 W414 A415 S420 N423 S425 P426	P328-Q428 VanDerWaalsContact CB-CD 3.42Å; P328-Q428 HydrophobicContact CB-CG 4.07Å; P329-Q428 WeakPolarHBondContact O-CG 3.29Å; W414-Q428 HydrophobicContact CE3-CB 4.23Å; A415-Q428 PolarHBondContact N-O 3.08Å; S420-Q428 PolarHBondContact OG-OE1 2.84Å; S420-Q428 VanDerWaalsContact OG-OE1 3.09Å; N423-Q428 PolarHBondContact O-NE2 3.12Å; S425-Q428 VanDerWaalsContact O-CB 3.28Å; S425-Q428 WeakPolarHBondContact O-CB 3.23Å; S425-Q428 WeakPolarHBondContact O-CG 3.3Å; S425-Q428 PolarHBondContact O-N 3.18Å; S425-Q428 VanDerWaalsContact O-N 3.11Å; P426-Q428 PolarHBondContact O-N 3.17Å
429	S	94.4	Very high	88	Confident	25 Å²	25	53 Å²	53	18%	0.175	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	153.9	-174.4	77	0	0	0	0	113.9	A331 I413 P426 D427	A331-S429 WeakPolarHBondContact CB-O 3.49Å; I413-S429 VanDerWaalsContact O-CA 3.3Å; I413-S429 WeakPolarHBondContact O-CA 3.37Å; P426-S429 PolarHBondContact O-N 2.75Å; P426-S429 PolarHBondContact O-OG 3.43Å; D427-S429 PolarHBondContact O-N 2.88Å
430	V	93.3	Very high	87.2	Confident	42 Å²	42	55 Å²	55	26%	0.255	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.2	168.8	60	0	0	0	0	109.1	A331 P332 L335 E412 I413	A331-V430 HydrophobicContact CB-CB 4.35Å; P332-V430 HydrophobicContact CB-CG1 3.94Å; P332-V430 HydrophobicContact CG-CG1 4.16Å; P332-V430 WeakPolarHBondContact O-CG1 3.41Å; L335-V430 HydrophobicContact CB-CG1 4.07Å; L335-V430 HydrophobicContact CB-CG2 4.42Å; L335-V430 HydrophobicContact CD2-CG1 4.03Å; L335-V430 HydrophobicContact CD2-CG2 4.36Å; E412-V430 WeakPolarHBondContact CA-O 3.46Å; I413-V430 PolarHBondContact N-O 2.68Å; I413-V430 PolarHBondContact O-N 3.49Å; I413-V430 VanDerWaalsContact O-N 3.11Å
431	S	91.6	Very high	86.9	Confident	72 Å²	72	54.9 Å²	54.9	50%	0.503	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	148.5	-177.5	77.1	0	0	0	0	112.8	F411	F411-S431 CarbonylContact O-C 3.56Å; F411-S431 VanDerWaalsContact O-CA 3.25Å; F411-S431 WeakPolarHBondContact O-CA 3.25Å
432	V	90.3	Very high	86.5	Confident	27 Å²	27	50.4 Å²	50.4	16%	0.164	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	139	167.8	68.4	0	0	0	0	109.3	L335 L346 T410 F411	L335-V432 HydrophobicContact CD2-CB 3.67Å; L335-V432 HydrophobicContact CD2-CG1 3.71Å; L335-V432 HydrophobicContact CG-CB 4.11Å; L335-V432 HydrophobicContact CG-CG1 4.08Å; L346-V432 HydrophobicContact CD2-CG1 3.99Å; T410-V432 CarbonylContact C-O 3.56Å; T410-V432 VanDerWaalsContact CA-O 3.32Å; T410-V432 WeakPolarHBondContact CA-O 3.16Å; F411-V432 HydrophobicContact CB-CG1 4.28Å; F411-V432 PolarHBondContact N-O 3.17Å; F411-V432 PolarHBondContact O-N 3.43Å
433	T	89.3	Confident	86.3	Confident	89 Å²	89	48.6 Å²	48.6	55%	0.546	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	132	172.2	-60.2	0	0	0	0	109.3	Y409 T410	Y409-T433 CarbonylContact O-C 3.53Å; Y409-T433 WeakPolarHBondContact O-CA 3.29Å; T410-T433 WeakPolarHBondContact CG2-OG1 3.47Å; T410-T433 PolarHBondContact OG1-OG1 3.21Å
434	V	86.1	Confident	86.2	Confident	13 Å²	13	44.9 Å²	44.9	8%	0.079	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	146	-168.6	67.8	0	0	0	0	110.3	V339 V344 N408 Y409 F411	V339-V434 HydrophobicContact CG2-CG2 3.2Å; V344-V434 HydrophobicContact CG1-CG1 4.31Å; V344-V434 HydrophobicContact CG2-CG1 4.11Å; N408-V434 WeakPolarHBondContact CA-O 3.46Å; Y409-V434 PolarHBondContact N-O 3.45Å; Y409-V434 PolarHBondContact O-N 2.85Å; F411-V434 HydrophobicContact CD2-CG1 3.87Å; F411-V434 HydrophobicContact CE2-CG1 3.69Å
435	T	84.8	Confident	86	Confident	66 Å²	66	44.2 Å²	44.2	41%	0.405	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	128.9	175.4	-47.2	0	0	0	0	108.6	T407 N408	T407-T435 WeakPolarHBondContact O-CA 3.38Å; N408-T435 WeakPolarHBondContact OD1-CG2 3.45Å; N408-T435 PolarHBondContact OD1-OG1 2.98Å; N408-T435 VanDerWaalsContact OD1-OG1 3.08Å
436	T	83.5	Confident	86	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.018	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-67.2	151.9	172.7	45.1	0	0	0	0	111.3	V344 L403 L404 A405 H406 T407 Y409	V344-T436 HydrophobicContact CG2-CG2 4.5Å; L403-T436 HydrophobicContact CB-CG2 3.86Å; L403-T436 HydrophobicContact CD1-CG2 4.24Å; L404-T436 WeakPolarHBondContact O-CB 3.35Å; L404-T436 PolarHBondContact O-OG1 3.06Å; A405-T436 VanDerWaalsContact C-OG1 3.28Å; H406-T436 WeakPolarHBondContact CA-O 3.19Å; H406-T436 PolarHBondContact N-OG1 3.3Å; H406-T436 VanDerWaalsContact N-OG1 3.08Å; T407-T436 PolarHBondContact N-OG1 3.15Å; T407-T436 PolarHBondContact O-N 3.15Å; T407-T436 VanDerWaalsContact O-N 3.1Å; T407-T436 PolarHBondContact O-OG1 2.81Å; Y409-T436 HydrophobicContact CD2-CG2 4.12Å; Y409-T436 HydrophobicContact CE2-CG2 4.18Å
437	N	76.5	Confident	86.2	Confident	75 Å²	75	42.6 Å²	42.6	40%	0.401	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-68.4	171.9	179.8	-73.2	-47.6	0	0	0	111.4	V339 E341 H406	V339-N437 WeakPolarHBondContact CG1-ND2 3.36Å; V339-N437 PolarHBondContact O-ND2 2.69Å; E341-N437 PolarHBondContact N-ND2 2.78Å; E341-N437 PolarHBondContact O-N 3.45Å; E341-N437 VanDerWaalsContact O-N 3.13Å; H406-N437 PolarHBondContact N-O 2.97Å
438	Q	76.2	Confident	86.5	Confident	55 Å²	55	41.4 Å²	41.4	26%	0.257	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-74.4	148.9	170	-57.6	-169.4	15.7	0	0	110.5	N468 G469 A519	Q438-N468 CarbonylContact C-O 3.53Å; Q438-N468 WeakPolarHBondContact CA-O 3.35Å; Q438-G469 VanDerWaalsContact CD-CA 3.47Å; Q438-A519 WeakPolarHBondContact O-CB 3.46Å
439	A	73.6	Confident	86.3	Confident	21 Å²	21	43 Å²	43	17%	0.174	27%	0.273	C	S	.	.			trans	-126.5	175.9	171.9	0	0	0	0	0	110.4	A405 N468 T517	A405-A439 HydrophobicContact CB-CB 3.89Å; A439-N468 HydrophobicContact CB-CB 4.13Å; A439-N468 PolarHBondContact N-O 3.1Å; A439-T517 PolarHBondContact O-OG1 2.92Å
440	A	77.9	Confident	86.1	Confident	40 Å²	40	48.1 Å²	48.1	33%	0.331	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-59.4	139.1	173	0	0	0	0	0	110.5	N468	A440-N468 WeakPolarHBondContact O-CB 3.49Å; A440-N468 PolarHBondContact O-ND2 3.4Å
441	P	85.7	Confident	85.7	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.032	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-68.3	159.3	177	28.7	-32.1	0	0	0	110.9	P464 R466 A515 T517 G522	P441-P464 HydrophobicContact CB-CG 3.91Å; P441-R466 WeakPolarHBondContact CA-O 3.45Å; P441-A515 HydrophobicContact CB-CB 4.21Å; P441-A515 HydrophobicContact CG-CB 3.71Å; P441-A515 WeakPolarHBondContact CG-O 3.41Å; P441-T517 HydrophobicContact CB-CG2 4.33Å; P441-T517 HydrophobicContact CG-CG2 4.17Å; P441-G522 WeakPolarHBondContact O-CA 3.48Å
442	S	83.6	Confident	85.5	Confident	21 Å²	21	50.4 Å²	50.4	15%	0.147	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-65.6	167.6	168	63.5	0	0	0	0	111.9	P464 D465 R466	S442-P464 WeakPolarHBondContact O-CB 3.39Å; S442-P464 WeakPolarHBondContact OG-CB 3.47Å; S442-D465 PolarHBondContact OG-N 2.85Å; S442-R466 PolarHBondContact N-O 3.43Å; S442-R466 PolarHBondContact OG-N 3.26Å; S442-R466 VanDerWaalsContact OG-N 3.14Å
443	S	88.5	Confident	85.2	Confident	54 Å²	54	49.7 Å²	49.7	38%	0.378	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-58.3	158.8	168.1	52.7	0	0	0	0	111.9	P464	S443-P464 WeakPolarHBondContact O-CB 3.44Å
444	I	90.4	Very high	84.8	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.015	28%	0.279	C	S	.	.			trans	-92.7	112.2	178	-66.3	165.4	0	0	0	108.3	L446 V447 W461 L462 P464 Y474 V513 A515 S525	I444-L446 VanDerWaalsContact C-N 3.28Å; I444-L446 PolarHBondContact O-N 3.17Å; I444-V447 HydrophobicContact CG2-CG2 4.26Å; I444-W461 HydrophobicContact CG2-CB 4.01Å; I444-L462 WeakPolarHBondContact CG2-O 3.29Å; I444-P464 HydrophobicContact CG1-CB 4.27Å; I444-Y474 HydrophobicContact CD1-CD1 3.65Å; I444-Y474 HydrophobicContact CD1-CE1 3.77Å; I444-V513 HydrophobicContact CD1-CB 4.27Å; I444-V513 HydrophobicContact CD1-CG1 3.79Å; I444-A515 HydrophobicContact CD1-CB 4.3Å; I444-S525 VanDerWaalsContact O-CB 3.22Å; I444-S525 WeakPolarHBondContact O-CB 3.26Å
445	A	84.9	Confident	84.7	Confident	82 Å²	82	53 Å²	53	68%	0.678	29%	0.292	S	S	*	.	S	Bend	trans	-70.6	-16.1	-172.6	0	0	0	0	0	115
446	L	88.8	Confident	84.9	Confident	75 Å²	75	50.2 Å²	50.2	39%	0.393	28%	0.275	S	S	.	.			trans	-148.5	122.1	-176.2	-174.1	61.3	0	0	0	113	I444 Q448 W461 L462	I444-L446 VanDerWaalsContact C-N 3.28Å; I444-L446 PolarHBondContact O-N 3.17Å; L446-Q448 HydrophobicContact CD1-CG 4.28Å; L446-Q448 HydrophobicContact CG-CG 4.3Å; L446-W461 WeakPolarHBondContact O-CA 3.17Å; L446-W461 WeakPolarHBondContact O-CB 3.43Å; L446-L462 HydrophobicContact CB-CD1 4.08Å; L446-L462 HydrophobicContact CB-CG 4.3Å; L446-L462 HydrophobicContact CD2-CD1 4.01Å; L446-L462 HydrophobicContact CD2-CG 4.4Å; L446-L462 PolarHBondContact O-N 3.15Å
447	V	92.3	Very high	85.2	Confident	16 Å²	16	50 Å²	50	10%	0.097	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.8	172.1	-173.5	0	0	0	0	108.3	I444 W461 V513 S525 L528	I444-V447 HydrophobicContact CG2-CG2 4.26Å; V447-W461 HydrophobicContact CB-CB 4.41Å; V447-W461 HydrophobicContact CG1-CB 4.44Å; V447-W461 HydrophobicContact CG1-CE3 4.48Å; V447-W461 HydrophobicContact CG2-CB 4.06Å; V447-V513 HydrophobicContact CB-CG2 4.39Å; V447-V513 HydrophobicContact CG1-CG2 3.7Å; V447-V513 HydrophobicContact CG2-CB 3.96Å; V447-V513 HydrophobicContact CG2-CG2 3.71Å; V447-S525 WeakPolarHBondContact CG2-OG 3.34Å; V447-L528 HydrophobicContact CB-CD2 4.38Å; V447-L528 HydrophobicContact CG1-CD2 3.88Å
448	Q	91.8	Very high	86	Confident	80 Å²	80	47.3 Å²	47.3	37%	0.374	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	139.4	-177.4	-63.4	-177	-11.1	0	0	111.5	L446 L459 A460	L446-Q448 HydrophobicContact CD1-CG 4.28Å; L446-Q448 HydrophobicContact CG-CG 4.3Å; Q448-L459 CarbonylContact O-C 3.51Å; Q448-L459 WeakPolarHBondContact O-CA 3.38Å; Q448-A460 PolarHBondContact N-O 3.07Å; Q448-A460 PolarHBondContact O-N 2.86Å
449	A	89.3	Confident	86.9	Confident	38 Å²	38	44.8 Å²	44.8	31%	0.314	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	137.5	161.8	0	0	0	0	0	109.9	V457 A458 L459 V530	A449-V457 HydrophobicContact CB-CG1 4.31Å; A449-A458 CarbonylContact C-O 3.55Å; A449-A458 WeakPolarHBondContact CA-O 3.31Å; A449-L459 HydrophobicContact CB-CD2 4.42Å; A449-V530 HydrophobicContact CB-CG1 4.2Å; A449-V530 HydrophobicContact CB-CG2 3.96Å
450	K	89.6	Confident	87.8	Confident	134 Å²	134	44.9 Å²	44.9	58%	0.583	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	-37.1	-179.6	-65.1	-55.1	-166.4	-175.5	0	112.8	A458 A460	K450-A458 PolarHBondContact N-O 2.97Å; K450-A460 HydrophobicContact CG-CB 3.87Å
451	E	85.1	Confident	88.6	Confident	127 Å²	127	43.7 Å²	43.7	59%	0.593	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-143.1	147.6	174.6	-172.1	174.5	-178	0	0	108.8	A458	E451-A458 HydrophobicContact CB-CB 3.99Å; E451-A458 PolarHBondContact O-N 2.84Å
452	V	86.4	Confident	88.9	Confident	35 Å²	35	48.3 Å²	48.3	21%	0.212	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	132.9	177.4	179.2	0	0	0	0	107.9	V457 V530 T531 N533	V452-V457 HydrophobicContact CG1-CG2 4.22Å; V452-V457 HydrophobicContact CG2-CG2 4.35Å; V452-V530 HydrophobicContact CG2-CG1 3.65Å; V452-T531 WeakPolarHBondContact CG1-O 3.37Å; V452-N533 HydrophobicContact CG1-CB 4.41Å; V452-N533 PolarHBondContact O-ND2 2.83Å
453	T	84.1	Confident	89.2	Confident	11 Å²	11	51.6 Å²	51.6	7%	0.067	28%	0.275	C	S	.	.			trans	-122.3	-175.5	173.7	77.2	0	0	0	0	110.3	Y455 S456 N533 V535 S537	T453-Y455 VanDerWaalsContact C-N 3.29Å; T453-Y455 PolarHBondContact OG1-N 3.15Å; T453-S456 PolarHBondContact N-O 3.13Å; T453-S456 PolarHBondContact OG1-N 2.94Å; T453-S456 PolarHBondContact OG1-OG 3.38Å; T453-N533 WeakPolarHBondContact CA-OD1 3.29Å; T453-N533 PolarHBondContact O-N 3.11Å; T453-N533 PolarHBondContact O-OD1 2.89Å; T453-V535 WeakPolarHBondContact CB-O 3.37Å; T453-S537 PolarHBondContact OG1-OG 2.82Å
454	R	82.1	Confident	89.1	Confident	82 Å²	82	49.1 Å²	49.1	31%	0.309	26%	0.257	S	S	.	.	S	Bend	trans	-72.1	-22.9	176.4	81.9	174.1	62.5	171.9	-5.1	113.4	P505 N533 T534 V535	R454-P505 HydrophobicContact CB-CB 4.26Å; R454-P505 WeakPolarHBondContact O-CA 3.46Å; R454-P505 WeakPolarHBondContact O-CB 3.31Å; R454-N533 VanDerWaalsContact CA-O 3.22Å; R454-N533 WeakPolarHBondContact CA-O 3.34Å; R454-N533 WeakPolarHBondContact CB-O 3.5Å; R454-N533 PolarHBondContact N-OD1 2.89Å; R454-T534 VanDerWaalsContact CZ-O 3.23Å; R454-T534 PolarHBondContact NE-O 2.92Å; R454-T534 PolarHBondContact NH2-O 3.47Å; R454-V535 VanDerWaalsContact CB-O 3.31Å; R454-V535 WeakPolarHBondContact CB-O 3.16Å; R454-V535 WeakPolarHBondContact CG-O 3.1Å; R454-V535 PolarHBondContact N-O 2.94Å
455	Y	84.3	Confident	88.8	Confident	91 Å²	91	55.5 Å²	55.5	36%	0.357	29%	0.292	S	S	.	.	S	Bend	trans	-128.1	9.1	-179.8	-49.8	-49.7	0	0	0	113.5	T453 K501 G502 L503 P505	T453-Y455 VanDerWaalsContact C-N 3.29Å; T453-Y455 PolarHBondContact OG1-N 3.15Å; Y455-K501 CarbonylContact O-C 3.49Å; Y455-K501 WeakPolarHBondContact O-CA 3.32Å; Y455-G502 PolarHBondContact O-N 3.07Å; Y455-L503 WeakPolarHBondContact CA-O 3.37Å; Y455-L503 PolarHBondContact O-N 2.9Å; Y455-L503 VanDerWaalsContact O-N 3.07Å; Y455-P505 HydrophobicContact CE1-CB 4.37Å; Y455-P505 HydrophobicContact CE1-CG 4.2Å
456	S	87.6	Confident	88.5	Confident	6 Å²	6	59.2 Å²	59.2	4%	0.042	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	159.9	176.7	83.6	0	0	0	0	115.9	T453 D499 I500	T453-S456 PolarHBondContact N-O 3.13Å; T453-S456 PolarHBondContact OG1-N 2.94Å; T453-S456 PolarHBondContact OG1-OG 3.38Å; S456-D499 VanDerWaalsContact CB-OD1 3.23Å; S456-D499 WeakPolarHBondContact CB-OD1 3.31Å; S456-D499 PolarHBondContact OG-OD1 3.27Å; S456-I500 CarbonylContact C-O 3.55Å; S456-I500 WeakPolarHBondContact CA-O 3.46Å; S456-I500 VanDerWaalsContact CB-O 3.23Å; S456-I500 WeakPolarHBondContact CB-O 3.41Å
457	V	91.4	Very high	88	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	120.5	170.7	173.1	0	0	0	0	108.8	A449 V452 L459 I500 L503 F511 V530 T532	A449-V457 HydrophobicContact CB-CG1 4.31Å; V452-V457 HydrophobicContact CG1-CG2 4.22Å; V452-V457 HydrophobicContact CG2-CG2 4.35Å; V457-L459 HydrophobicContact CG1-CD2 3.82Å; V457-L459 HydrophobicContact CG1-CG 4.19Å; V457-I500 PolarHBondContact N-O 2.9Å; V457-I500 PolarHBondContact O-N 3.22Å; V457-L503 HydrophobicContact CB-CD1 4.04Å; V457-L503 HydrophobicContact CG2-CD1 3.68Å; V457-F511 HydrophobicContact CB-CZ 3.98Å; V457-F511 HydrophobicContact CG1-CE2 4.3Å; V457-F511 HydrophobicContact CG1-CZ 4.15Å; V457-F511 HydrophobicContact CG2-CE2 4.47Å; V457-F511 HydrophobicContact CG2-CZ 4.11Å; V457-V530 HydrophobicContact CG1-CB 4.33Å; V457-V530 HydrophobicContact CG1-CG1 4.1Å; V457-V530 HydrophobicContact CG1-CG2 4.28Å; V457-V530 HydrophobicContact CG2-CB 4.39Å; V457-V530 HydrophobicContact CG2-CG1 4.04Å; V457-T532 HydrophobicContact CG2-CG2 4.25Å
458	A	92	Very high	87.3	Confident	18 Å²	18	58.9 Å²	58.9	15%	0.149	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	128	172.8	0	0	0	0	0	110.8	A449 K450 E451 T498 D499	A449-A458 CarbonylContact C-O 3.55Å; A449-A458 WeakPolarHBondContact CA-O 3.31Å; K450-A458 PolarHBondContact N-O 2.97Å; E451-A458 HydrophobicContact CB-CB 3.99Å; E451-A458 PolarHBondContact O-N 2.84Å; A458-T498 CarbonylContact C-O 3.57Å; A458-T498 WeakPolarHBondContact CA-O 3.23Å; A458-D499 HydrophobicContact CB-CB 4.34Å
459	L	94.9	Very high	86.7	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	148.1	-175.2	-63.5	174.2	0	0	0	111.1	Q448 A449 V457 W461 V476 N497 T498 I500 F511 L528	Q448-L459 CarbonylContact O-C 3.51Å; Q448-L459 WeakPolarHBondContact O-CA 3.38Å; A449-L459 HydrophobicContact CB-CD2 4.42Å; V457-L459 HydrophobicContact CG1-CD2 3.82Å; V457-L459 HydrophobicContact CG1-CG 4.19Å; L459-W461 HydrophobicContact CB-CE3 4.21Å; L459-W461 HydrophobicContact CB-CZ3 3.85Å; L459-V476 HydrophobicContact CD1-CG1 3.79Å; L459-N497 CarbonylContact O-C 3.59Å; L459-N497 WeakPolarHBondContact O-CA 3.21Å; L459-N497 WeakPolarHBondContact O-CB 3.47Å; L459-T498 PolarHBondContact N-O 2.86Å; L459-T498 PolarHBondContact O-N 2.95Å; L459-I500 HydrophobicContact CD1-CG1 4.02Å; L459-F511 HydrophobicContact CD1-CB 4.11Å; L459-F511 HydrophobicContact CD1-CD1 3.6Å; L459-F511 HydrophobicContact CD1-CE1 4.25Å; L459-F511 HydrophobicContact CD1-CG 3.97Å; L459-F511 HydrophobicContact CD2-CG 4.44Å; L459-L528 HydrophobicContact CD2-CD2 3.8Å
460	A	94.1	Very high	86.4	Confident	22 Å²	22	58 Å²	58	18%	0.182	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	153.4	167.9	0	0	0	0	0	111.1	Q448 K450 R496 N497	Q448-A460 PolarHBondContact N-O 3.07Å; Q448-A460 PolarHBondContact O-N 2.86Å; K450-A460 HydrophobicContact CG-CB 3.87Å; A460-R496 WeakPolarHBondContact CA-O 3.31Å; A460-N497 HydrophobicContact CB-CB 4Å
461	W	94.5	Very high	86.1	Confident	15 Å²	15	53.2 Å²	53.2	6%	0.057	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	167.3	-172.7	51.5	88.5	0	0	0	112.9	I444 L446 V447 L459 Y474 V476 T493 A495 R496 T498 V513	I444-W461 HydrophobicContact CG2-CB 4.01Å; L446-W461 WeakPolarHBondContact O-CA 3.17Å; L446-W461 WeakPolarHBondContact O-CB 3.43Å; V447-W461 HydrophobicContact CB-CB 4.41Å; V447-W461 HydrophobicContact CG1-CB 4.44Å; V447-W461 HydrophobicContact CG1-CE3 4.48Å; V447-W461 HydrophobicContact CG2-CB 4.06Å; L459-W461 HydrophobicContact CB-CE3 4.21Å; L459-W461 HydrophobicContact CB-CZ3 3.85Å; W461-Y474 AromaticContact CD1-CD1 3.79Å; W461-Y474 AromaticContact CD1-CE1 3.81Å; W461-Y474 AromaticContact CE2-CG 3.99Å; W461-Y474 HydrophobicContact CZ2-CG 4.05Å; W461-Y474 AromaticContact NE1-CD1 3.07Å; W461-Y474 AromaticContact NE1-CD2 3.9Å; W461-Y474 AromaticContact NE1-CE1 3.44Å; W461-Y474 AromaticContact NE1-CG 3.32Å; W461-Y474 VanDerWaalsContact NE1-CG 3.32Å; W461-V476 HydrophobicContact CH2-CG2 3.59Å; W461-V476 HydrophobicContact CZ2-CG2 4.38Å; W461-V476 HydrophobicContact CZ3-CG2 3.84Å; W461-T493 HydrophobicContact CH2-CG2 3.74Å; W461-T493 HydrophobicContact CZ2-CG2 3.68Å; W461-A495 WeakPolarHBondContact CZ2-O 3.35Å; W461-R496 PolarHBondContact N-O 2.79Å; W461-R496 VanDerWaalsContact N-O 3.11Å; W461-T498 HydrophobicContact CH2-CG2 3.97Å; W461-T498 HydrophobicContact CZ3-CG2 4.12Å; W461-V513 HydrophobicContact CD2-CB 4.47Å; W461-V513 HydrophobicContact CD2-CG1 3.76Å; W461-V513 HydrophobicContact CD2-CG2 4.21Å; W461-V513 HydrophobicContact CE3-CG1 4.19Å; W461-V513 HydrophobicContact CE3-CG2 3.9Å; W461-V513 HydrophobicContact CG-CG1 4.1Å; W461-V513 HydrophobicContact CH2-CG1 4.43Å; W461-V513 HydrophobicContact CZ2-CG1 4.05Å; W461-V513 HydrophobicContact CZ3-CG1 4.49Å; W461-V513 HydrophobicContact CZ3-CG2 4.25Å
462	L	91.6	Very high	86	Confident	102 Å²	102	51.2 Å²	51.2	53%	0.534	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-84.1	165.9	173.7	-66.3	-177.4	0	0	0	112.3	I444 L446	I444-L462 WeakPolarHBondContact CG2-O 3.29Å; L446-L462 HydrophobicContact CB-CD1 4.08Å; L446-L462 HydrophobicContact CB-CG 4.3Å; L446-L462 HydrophobicContact CD2-CD1 4.01Å; L446-L462 HydrophobicContact CD2-CG 4.4Å; L446-L462 PolarHBondContact O-N 3.15Å
463	E	89	Confident	86.1	Confident	90 Å²	90	51 Å²	51	42%	0.421	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-76.6	142.7	167.3	-159.8	162.2	141.7	0	0	109.4	I471 R496	E463-I471 HydrophobicContact CG-CD1 3.66Å; E463-R496 IonicContact OE2-CZ 3.67Å; E463-R496 IonicContact OE2-NH1 3.71Å; E463-R496 PolarHBondContact OE2-NH1 3.38Å
464	P	88.1	Confident	86.5	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.019	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-65.8	138.9	-179.9	26	-35.1	0	0	0	112.5	P441 S442 S443 I444 R466 P467 I471 A515	P441-P464 HydrophobicContact CB-CG 3.91Å; S442-P464 WeakPolarHBondContact O-CB 3.39Å; S442-P464 WeakPolarHBondContact OG-CB 3.47Å; S443-P464 WeakPolarHBondContact O-CB 3.44Å; I444-P464 HydrophobicContact CG1-CB 4.27Å; P464-R466 PolarHBondContact O-N 2.79Å; P464-P467 VanDerWaalsContact O-CD 3.23Å; P464-P467 WeakPolarHBondContact O-CD 3.16Å; P464-P467 WeakPolarHBondContact O-CG 3.42Å; P464-I471 HydrophobicContact CG-CD1 3.8Å; P464-A515 HydrophobicContact CG-CB 4.09Å
465	D	83.3	Confident	87.1	Confident	137 Å²	137	47.4 Å²	47.4	73%	0.733	24%	0.242	S	C	*	.	S	Bend	trans	-51	-31	-176	-64.4	-21.2	0	0	0	114.5	S442	S442-D465 PolarHBondContact OG-N 2.85Å
466	R	79.5	Confident	87.5	Confident	160 Å²	160	43.1 Å²	43.1	60%	0.604	23%	0.225	S	C	*	.			trans	-124.9	91.6	172.8	-68.9	176.8	-69.2	-175	0.2	108.7	P441 S442 P464 N468	P441-R466 WeakPolarHBondContact CA-O 3.45Å; S442-R466 PolarHBondContact N-O 3.43Å; S442-R466 PolarHBondContact OG-N 3.26Å; S442-R466 VanDerWaalsContact OG-N 3.14Å; P464-R466 PolarHBondContact O-N 2.79Å; R466-N468 PolarHBondContact O-N 3.35Å
467	P	77.4	Confident	87.7	Confident	39 Å²	39	44.1 Å²	44.1	25%	0.253	23%	0.229	S	C	.	.			trans	-61.9	-25.4	176.4	-25.3	36.1	0	0	0	113	P464 G469 I471 T517	P464-P467 VanDerWaalsContact O-CD 3.23Å; P464-P467 WeakPolarHBondContact O-CD 3.16Å; P464-P467 WeakPolarHBondContact O-CG 3.42Å; P467-G469 PolarHBondContact O-N 3.43Å; P467-I471 HydrophobicContact CB-CD1 4.15Å; P467-I471 HydrophobicContact CB-CG1 4.31Å; P467-T517 VanDerWaalsContact O-CG2 3.25Å; P467-T517 WeakPolarHBondContact O-CG2 2.86Å
468	N	77.6	Confident	87.7	Confident	45 Å²	45	44.6 Å²	44.6	24%	0.241	23%	0.231	C	C	.	.			trans	53.9	11.8	178.6	-68.4	-23.3	0	0	0	115.6	A405 Q438 A439 A440 R466	A405-N468 HydrophobicContact CB-CB 3.99Å; Q438-N468 CarbonylContact C-O 3.53Å; Q438-N468 WeakPolarHBondContact CA-O 3.35Å; A439-N468 HydrophobicContact CB-CB 4.13Å; A439-N468 PolarHBondContact N-O 3.1Å; A440-N468 WeakPolarHBondContact O-CB 3.49Å; A440-N468 PolarHBondContact O-ND2 3.4Å; R466-N468 PolarHBondContact O-N 3.35Å
469	G	78.3	Confident	87.6	Confident	12 Å²	12	45.4 Å²	45.4	12%	0.124	23%	0.23	C	C	.	.	S	Bend	trans	163.7	-164.1	-174.4	0	0	0	0	0	111	Q438 P467	Q438-G469 VanDerWaalsContact CD-CA 3.47Å; P467-G469 PolarHBondContact O-N 3.43Å
470	V	82.7	Confident	87.2	Confident	86 Å²	86	46.9 Å²	46.9	52%	0.521	24%	0.237	S	C	.	.			trans	-89.7	120.5	173.8	179.7	0	0	0	0	108.2	L472 T517	V470-L472 PolarHBondContact O-N 3.19Å; V470-T517 WeakPolarHBondContact O-CA 3.44Å
471	I	83.9	Confident	86.6	Confident	34 Å²	34	49.9 Å²	49.9	17%	0.174	25%	0.246	C	C	.	.			trans	-71.8	120.2	175.9	-60.4	171.3	0	0	0	108.4	E463 P464 P467 E473 Y474 A515 T517	E463-I471 HydrophobicContact CG-CD1 3.66Å; P464-I471 HydrophobicContact CG-CD1 3.8Å; P467-I471 HydrophobicContact CB-CD1 4.15Å; P467-I471 HydrophobicContact CB-CG1 4.31Å; I471-E473 WeakPolarHBondContact CG2-O 3.43Å; I471-Y474 HydrophobicContact CG2-CD2 4.4Å; I471-Y474 HydrophobicContact CG2-CE1 4.41Å; I471-Y474 HydrophobicContact CG2-CE2 3.85Å; I471-A515 HydrophobicContact CD1-CB 4.27Å; I471-A515 HydrophobicContact CG1-CB 4.47Å; I471-A515 HydrophobicContact CG2-CB 4.07Å; I471-T517 HydrophobicContact CG1-CG2 4.42Å
472	L	84.2	Confident	85.7	Confident	85 Å²	85	56.4 Å²	56.4	45%	0.445	28%	0.282	S	S	.	.			trans	-85.4	-38.5	-179.3	-55.1	-179.5	0	0	0	111.4	V470 R516 A518	V470-L472 PolarHBondContact O-N 3.19Å; L472-R516 PolarHBondContact N-O 3.45Å; L472-A518 HydrophobicContact CD1-CB 4.46Å
473	E	88.1	Confident	84.4	Confident	32 Å²	32	56.2 Å²	56.2	15%	0.15	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	171.6	-177.1	62.8	-177.9	-138.8	0	0	111.3	I471 R492 R516	I471-E473 WeakPolarHBondContact CG2-O 3.43Å; E473-R492 IonicContact OE1-CZ 3.71Å; E473-R492 IonicContact OE1-NE 2.66Å; E473-R492 PolarHBondContact OE1-NE 3.41Å; E473-R492 IonicContact OE1-NH2 2.7Å; E473-R492 PolarHBondContact OE1-NH2 2.91Å; E473-R492 IonicContact OE2-NH2 3.67Å; E473-R516 HydrophobicContact CG-CB 3.85Å; E473-R516 HydrophobicContact CG-CG 4.48Å; E473-R516 PolarHBondContact O-N 3.23Å; E473-R516 IonicContact OE1-CZ 3.85Å; E473-R516 IonicContact OE1-NE 2.68Å; E473-R516 PolarHBondContact OE1-NE 2.98Å; E473-R516 IonicContact OE1-NH2 3.98Å; E473-R516 PolarHBondContact OE1-NH2 2.84Å; E473-R516 IonicContact OE2-CZ 3.71Å; E473-R516 IonicContact OE2-NE 3.81Å; E473-R516 IonicContact OE2-NH2 2.78Å; E473-R516 PolarHBondContact OE2-NH2 3.08Å
474	Y	92	Very high	83.2	Confident	8 Å²	8	58.5 Å²	58.5	3%	0.031	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	151.4	169.8	-63.4	-92.6	0	0	0	110.2	I444 W461 I471 R492 T493 R496 V513 R514 A515	I444-Y474 HydrophobicContact CD1-CD1 3.65Å; I444-Y474 HydrophobicContact CD1-CE1 3.77Å; W461-Y474 AromaticContact CD1-CD1 3.79Å; W461-Y474 AromaticContact CD1-CE1 3.81Å; W461-Y474 AromaticContact CE2-CG 3.99Å; W461-Y474 HydrophobicContact CZ2-CG 4.05Å; W461-Y474 AromaticContact NE1-CD1 3.07Å; W461-Y474 AromaticContact NE1-CD2 3.9Å; W461-Y474 AromaticContact NE1-CE1 3.44Å; W461-Y474 AromaticContact NE1-CG 3.32Å; W461-Y474 VanDerWaalsContact NE1-CG 3.32Å; I471-Y474 HydrophobicContact CG2-CD2 4.4Å; I471-Y474 HydrophobicContact CG2-CE1 4.41Å; I471-Y474 HydrophobicContact CG2-CE2 3.85Å; Y474-R492 WeakPolarHBondContact O-CA 3.24Å; Y474-T493 PolarHBondContact N-O 2.81Å; Y474-T493 PolarHBondContact O-N 2.99Å; Y474-R496 HydrophobicContact CD2-CG 4.49Å; Y474-R496 HydrophobicContact CE2-CG 3.68Å; Y474-V513 HydrophobicContact CD1-CG1 4.48Å; Y474-R514 CarbonylContact C-O 3.48Å; Y474-R514 VanDerWaalsContact CA-O 3.32Å; Y474-R514 WeakPolarHBondContact CA-O 3.32Å; Y474-A515 HydrophobicContact CD1-CB 3.89Å; Y474-A515 HydrophobicContact CE1-CB 3.77Å
475	E	94.1	Very high	82.1	Confident	9 Å²	9	62.7 Å²	62.7	4%	0.042	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.2	178.5	-174.7	175.1	91.1	0	0	110.5	I490 V491 R492 V513 R514 Y521	E475-I490 HydrophobicContact CG-CG2 3.5Å; E475-V491 WeakPolarHBondContact CA-O 3.24Å; E475-R492 HydrophobicContact CB-CG 4.18Å; E475-R492 HydrophobicContact CG-CG 3.89Å; E475-R492 IonicContact OE2-CZ 2.69Å; E475-R492 IonicContact OE2-NE 2.65Å; E475-V513 WeakPolarHBondContact O-CA 3.2Å; E475-R514 HydrophobicContact CB-CG 4.1Å; E475-R514 PolarHBondContact N-O 2.81Å; E475-R514 PolarHBondContact O-N 3.43Å; E475-R514 IonicContact OE1-CZ 3.93Å; E475-R514 VanDerWaalsContact OE1-CZ 3.23Å; E475-R514 IonicContact OE1-NE 2.89Å; E475-R514 PolarHBondContact OE1-NE 3.43Å; E475-R514 IonicContact OE1-NH2 3.66Å; E475-R514 PolarHBondContact OE1-NH2 2.78Å; E475-Y521 HydrophobicContact CB-CD1 4.49Å; E475-Y521 HydrophobicContact CB-CE1 3.87Å; E475-Y521 VanDerWaalsContact CD-CE1 3.48Å; E475-Y521 HydrophobicContact CG-CE1 4.33Å; E475-Y521 VanDerWaalsContact OE2-CE1 3.3Å; E475-Y521 WeakPolarHBondContact OE2-CE1 3.42Å; E475-Y521 VanDerWaalsContact OE2-CZ 3.27Å; E475-Y521 PolarHBondContact OE2-OH 3.21Å
476	V	92.9	Very high	81.1	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	121.4	178.1	-173.3	0	0	0	0	108.8	L459 W461 I490 V491 T498 I500 F511 H512 V513	L459-V476 HydrophobicContact CD1-CG1 3.79Å; W461-V476 HydrophobicContact CH2-CG2 3.59Å; W461-V476 HydrophobicContact CZ2-CG2 4.38Å; W461-V476 HydrophobicContact CZ3-CG2 3.84Å; V476-I490 CarbonylContact O-C 3.54Å; V476-I490 WeakPolarHBondContact O-CA 3.4Å; V476-V491 PolarHBondContact N-O 2.66Å; V476-V491 PolarHBondContact O-N 2.03Å; V476-T498 HydrophobicContact CG2-CG2 3.87Å; V476-I500 HydrophobicContact CB-CD1 4.49Å; V476-I500 HydrophobicContact CG1-CD1 4.22Å; V476-F511 HydrophobicContact CG1-CD1 4.43Å; V476-H512 CarbonylContact C-O 3.43Å; V476-H512 VanDerWaalsContact CA-O 3.3Å; V476-H512 WeakPolarHBondContact CA-O 3.48Å; V476-V513 HydrophobicContact CG1-CG2 4.34Å; V476-V513 HydrophobicContact CG2-CG1 4.3Å; V476-V513 HydrophobicContact CG2-CG2 4.1Å
477	K	92.1	Very high	80.7	Confident	27 Å²	27	63.4 Å²	63.4	12%	0.117	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.8	170.1	-179.7	-172.8	-173.8	-173.5	0	108.9	E485 Y488 R489 I490 F511 H512 F524	K477-E485 IonicContact NZ-OE1 3.47Å; K477-E485 PolarHBondContact NZ-OE1 2.87Å; K477-Y488 HydrophobicContact CD-CD2 4.42Å; K477-Y488 HydrophobicContact CG-CD2 4.05Å; K477-Y488 HydrophobicContact CG-CG 4.35Å; K477-R489 WeakPolarHBondContact CA-O 3.45Å; K477-I490 HydrophobicContact CB-CD1 3.77Å; K477-I490 HydrophobicContact CG-CD1 3.87Å; K477-F511 CarbonylContact O-C 3.53Å; K477-F511 WeakPolarHBondContact O-CA 3.46Å; K477-H512 HydrophobicContact CB-CB 4.49Å; K477-H512 PolarHBondContact N-O 3.37Å; K477-H512 PolarHBondContact O-N 3.38Å; K477-F524 HydrophobicContact CB-CD1 4.42Å; K477-F524 HydrophobicContact CB-CE1 3.6Å; K477-F524 HydrophobicContact CB-CZ 3.78Å; K477-F524 HydrophobicContact CD-CE1 4.47Å; K477-F524 HydrophobicContact CD-CE2 4.21Å; K477-F524 HydrophobicContact CD-CZ 4.01Å; K477-F524 HydrophobicContact CG-CZ 4.48Å
478	Y	91.9	Very high	80.9	Confident	11 Å²	11	67.8 Å²	67.8	4%	0.043	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	152	175.1	77	-89	0	0	0	114	Y488 R489 V491 I500 L503 Y509 V510 F511	Y478-Y488 CarbonylContact O-C 3.48Å; Y478-Y488 WeakPolarHBondContact O-CA 3.29Å; Y478-R489 HydrophobicContact CD1-CB 4.02Å; Y478-R489 HydrophobicContact CD2-CB 4.49Å; Y478-R489 HydrophobicContact CE1-CB 3.55Å; Y478-R489 HydrophobicContact CE2-CB 4.06Å; Y478-R489 HydrophobicContact CE2-CG 4.38Å; Y478-R489 HydrophobicContact CG-CB 4.47Å; Y478-R489 VanDerWaalsContact CZ-CD 3.44Å; Y478-R489 PolarHBondContact N-O 3.34Å; Y478-R489 PolarHBondContact O-N 2.92Å; Y478-R489 WeakPolarHBondContact OH-CD 3.21Å; Y478-R489 PolarHBondContact OH-NH1 2.82Å; Y478-V491 HydrophobicContact CE1-CG2 4.16Å; Y478-I500 HydrophobicContact CD1-CD1 4.38Å; Y478-I500 HydrophobicContact CD1-CG2 3.81Å; Y478-I500 HydrophobicContact CD2-CG2 4.29Å; Y478-I500 HydrophobicContact CE1-CD1 4.36Å; Y478-I500 HydrophobicContact CE1-CG2 3.32Å; Y478-I500 HydrophobicContact CE2-CG2 3.88Å; Y478-I500 HydrophobicContact CG-CG2 4.26Å; Y478-L503 HydrophobicContact CD2-CD2 4.04Å; Y478-L503 HydrophobicContact CE2-CD2 3.36Å; Y478-Y509 AromaticContact CD2-CD1 3.89Å; Y478-Y509 HydrophobicContact CD2-CD1 3.89Å; Y478-Y509 HydrophobicContact CD2-CE1 4.32Å; Y478-Y509 HydrophobicContact CE2-CD1 4.31Å; Y478-Y509 HydrophobicContact CE2-CE1 4.29Å; Y478-V510 WeakPolarHBondContact CA-O 3.31Å; Y478-V510 WeakPolarHBondContact CB-O 3.35Å; Y478-F511 HydrophobicContact CD2-CE1 4.18Å; Y478-F511 HydrophobicContact CG-CD1 4.08Å; Y478-F511 AromaticContact CG-CE1 3.89Å; Y478-F511 HydrophobicContact CG-CE1 3.89Å
479	Y	88.8	Confident	81.4	Confident	35 Å²	35	71 Å²	71	14%	0.137	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	160.9	179.8	54.9	-88.5	0	0	0	111.7	E485 Y509 V510 H512	Y479-E485 HydrophobicContact CD1-CG 4.14Å; Y479-E485 HydrophobicContact CE1-CG 4.03Å; Y479-E485 HydrophobicContact CE2-CB 4.39Å; Y479-Y509 VanDerWaalsContact O-CA 3.32Å; Y479-Y509 WeakPolarHBondContact O-CA 3.13Å; Y479-V510 HydrophobicContact CD2-CB 4.35Å; Y479-V510 HydrophobicContact CE1-CB 4.16Å; Y479-V510 HydrophobicContact CE1-CG1 4.23Å; Y479-V510 HydrophobicContact CE2-CB 3.83Å; Y479-V510 HydrophobicContact CE2-CG1 4.41Å; Y479-V510 HydrophobicContact CE2-CG2 4.05Å; Y479-V510 PolarHBondContact N-O 2.65Å; Y479-V510 VanDerWaalsContact N-O 3.11Å; Y479-V510 PolarHBondContact O-N 2.88Å; Y479-H512 AromaticContact CE1-CD2 3.95Å; Y479-H512 AromaticContact CE1-NE2 3.79Å; Y479-H512 PolarHBondContact OH-NE2 3.38Å
480	E	87.4	Confident	81.9	Confident	32 Å²	32	73.7 Å²	73.7	15%	0.15	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	129.3	173.1	-68.6	177.4	-178.6	0	0	109.9	D482 Q483 N504 T507 Y509	E480-D482 VanDerWaalsContact C-N 3.33Å; E480-D482 PolarHBondContact O-N 3Å; E480-Q483 HydrophobicContact CB-CB 4.37Å; E480-Q483 HydrophobicContact CB-CG 4.15Å; E480-Q483 PolarHBondContact O-N 3.18Å; E480-Q483 VanDerWaalsContact O-N 3.13Å; E480-Q483 PolarHBondContact OE2-NE2 3.32Å; E480-N504 PolarHBondContact OE1-ND2 2.76Å; E480-T507 HydrophobicContact CG-CG2 4.04Å; E480-Y509 HydrophobicContact CB-CE1 4.36Å; E480-Y509 HydrophobicContact CG-CD1 3.79Å; E480-Y509 HydrophobicContact CG-CE1 3.17Å; E480-Y509 HydrophobicContact CG-CE2 4.47Å; E480-Y509 PolarHBondContact OE1-OH 2.03Å
481	K	82.3	Confident	82.3	Confident	86 Å²	86	71.7 Å²	71.7	37%	0.374	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-56.6	-46.6	-174.7	178.7	167	169.9	175.8	0	112.2	Q483 N484 S508 V510 E529	K481-Q483 PolarHBondContact O-N 3.46Å; K481-Q483 VanDerWaalsContact O-N 3.17Å; K481-N484 PolarHBondContact O-N 3.39Å; K481-S508 PolarHBondContact N-O 3.31Å; K481-V510 HydrophobicContact CB-CG2 4.27Å; K481-E529 VanDerWaalsContact CD-CD 3.48Å; K481-E529 HydrophobicContact CD-CG 4.46Å; K481-E529 WeakPolarHBondContact CD-OE1 3.41Å; K481-E529 IonicContact NZ-OE1 3.74Å; K481-E529 PolarHBondContact NZ-OE1 3.44Å; K481-E529 IonicContact NZ-OE2 2.66Å; K481-E529 PolarHBondContact NZ-OE2 2.85Å
482	D	74.1	Confident	82.6	Confident	151 Å²	151	76.3 Å²	76.3	81%	0.807	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-68	-16	-176.5	-60.5	-10.9	0	0	0	113.4	E480	E480-D482 VanDerWaalsContact C-N 3.33Å; E480-D482 PolarHBondContact O-N 3Å
483	Q	64.3	Low	82.8	Confident	98 Å²	98	73.6 Å²	73.6	46%	0.458	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-93.5	1.8	178.5	-60.8	-156.4	41.3	0	0	114.1	E480 K481 R486	E480-Q483 HydrophobicContact CB-CB 4.37Å; E480-Q483 HydrophobicContact CB-CG 4.15Å; E480-Q483 PolarHBondContact O-N 3.18Å; E480-Q483 VanDerWaalsContact O-N 3.13Å; E480-Q483 PolarHBondContact OE2-NE2 3.32Å; K481-Q483 PolarHBondContact O-N 3.46Å; K481-Q483 VanDerWaalsContact O-N 3.17Å; Q483-R486 PolarHBondContact O-N 2.93Å
484	N	63.7	Low	82.8	Confident	138 Å²	138	76.1 Å²	76.1	74%	0.738	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	45	67.5	174.2	-80.9	-27.9	0	0	0	114.3	K481 R486	K481-N484 PolarHBondContact O-N 3.39Å; N484-R486 PolarHBondContact O-N 3.1Å
485	E	66.4	Low	82.7	Confident	92 Å²	92	77.7 Å²	77.7	43%	0.43	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	-8.2	172.9	-150.2	176.5	-144.4	0	0	117.2	K477 Y479 S487	K477-E485 IonicContact NZ-OE1 3.47Å; K477-E485 PolarHBondContact NZ-OE1 2.87Å; Y479-E485 HydrophobicContact CD1-CG 4.14Å; Y479-E485 HydrophobicContact CE1-CG 4.03Å; Y479-E485 HydrophobicContact CE2-CB 4.39Å; E485-S487 PolarHBondContact O-N 2.86Å; E485-S487 VanDerWaalsContact O-N 3.1Å
486	R	60.7	Low	82.6	Confident	238 Å²	238	83.2 Å²	83.2	90%	0.898	40%	0.4	S	S	*	.	S	Bend	trans	-65.5	-16.4	-174.1	-124.2	179.6	-173	-172.9	2.5	115	Q483 N484	Q483-R486 PolarHBondContact O-N 2.93Å; N484-R486 PolarHBondContact O-N 3.1Å
487	S	71.8	Confident	82.6	Confident	73 Å²	73	87.6 Å²	87.6	51%	0.51	42%	0.424	S	S	.	.	S	Bend	trans	-140.5	77.9	178.4	-163.1	0	0	0	0	109.8	E485	E485-S487 PolarHBondContact O-N 2.86Å; E485-S487 VanDerWaalsContact O-N 3.1Å
488	Y	82.1	Confident	82.6	Confident	131 Å²	131	87.7 Å²	87.7	51%	0.514	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	152	176.5	70.5	-94.7	0	0	0	112.2	K477 Y478 I490	K477-Y488 HydrophobicContact CD-CD2 4.42Å; K477-Y488 HydrophobicContact CG-CD2 4.05Å; K477-Y488 HydrophobicContact CG-CG 4.35Å; Y478-Y488 CarbonylContact O-C 3.48Å; Y478-Y488 WeakPolarHBondContact O-CA 3.29Å; Y488-I490 HydrophobicContact CD2-CD1 3.86Å; Y488-I490 HydrophobicContact CD2-CG1 4.13Å; Y488-I490 HydrophobicContact CE2-CD1 3.92Å; Y488-I490 HydrophobicContact CE2-CG1 4.03Å
489	R	87.2	Confident	82.5	Confident	112 Å²	112	90.1 Å²	90.1	42%	0.423	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	154.6	176.4	-63.4	176.6	-177.3	176.4	4.1	109.6	K477 Y478 G502	K477-R489 WeakPolarHBondContact CA-O 3.45Å; Y478-R489 HydrophobicContact CD1-CB 4.02Å; Y478-R489 HydrophobicContact CD2-CB 4.49Å; Y478-R489 HydrophobicContact CE1-CB 3.55Å; Y478-R489 HydrophobicContact CE2-CB 4.06Å; Y478-R489 HydrophobicContact CE2-CG 4.38Å; Y478-R489 HydrophobicContact CG-CB 4.47Å; Y478-R489 VanDerWaalsContact CZ-CD 3.44Å; Y478-R489 PolarHBondContact N-O 3.34Å; Y478-R489 PolarHBondContact O-N 2.92Å; Y478-R489 WeakPolarHBondContact OH-CD 3.21Å; Y478-R489 PolarHBondContact OH-NH1 2.82Å; R489-G502 PolarHBondContact NH1-O 2.65Å
490	I	89.8	Confident	82.7	Confident	70 Å²	70	88.6 Å²	88.6	36%	0.359	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	137.8	-177.4	-58.1	-64.9	0	0	0	109.9	E475 V476 K477 Y488 R492	E475-I490 HydrophobicContact CG-CG2 3.5Å; V476-I490 CarbonylContact O-C 3.54Å; V476-I490 WeakPolarHBondContact O-CA 3.4Å; K477-I490 HydrophobicContact CB-CD1 3.77Å; K477-I490 HydrophobicContact CG-CD1 3.87Å; Y488-I490 HydrophobicContact CD2-CD1 3.86Å; Y488-I490 HydrophobicContact CD2-CG1 4.13Å; Y488-I490 HydrophobicContact CE2-CD1 3.92Å; Y488-I490 HydrophobicContact CE2-CG1 4.03Å; I490-R492 HydrophobicContact CG2-CG 4.29Å
491	V	90.6	Very high	82.7	Confident	44 Å²	44	92.9 Å²	92.9	27%	0.267	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.7	169.9	174.8	0	0	0	0	109	E475 V476 Y478 T498 I500	E475-V491 WeakPolarHBondContact CA-O 3.24Å; V476-V491 PolarHBondContact N-O 2.66Å; V476-V491 PolarHBondContact O-N 2.03Å; Y478-V491 HydrophobicContact CE1-CG2 4.16Å; V491-T498 HydrophobicContact CG1-CG2 4.4Å; V491-I500 HydrophobicContact CB-CD1 3.82Å; V491-I500 HydrophobicContact CG1-CD1 4.13Å; V491-I500 HydrophobicContact CG2-CD1 3.67Å
492	R	90.3	Very high	82.7	Confident	130 Å²	130	90.8 Å²	90.8	49%	0.491	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142.3	-178.8	-67.5	163.5	82.1	157.4	7.4	110.2	E473 Y474 E475 I490 Y521	E473-R492 IonicContact OE1-CZ 3.71Å; E473-R492 IonicContact OE1-NE 2.66Å; E473-R492 PolarHBondContact OE1-NE 3.41Å; E473-R492 IonicContact OE1-NH2 2.7Å; E473-R492 PolarHBondContact OE1-NH2 2.91Å; E473-R492 IonicContact OE2-NH2 3.67Å; Y474-R492 WeakPolarHBondContact O-CA 3.24Å; E475-R492 HydrophobicContact CB-CG 4.18Å; E475-R492 HydrophobicContact CG-CG 3.89Å; E475-R492 IonicContact OE2-CZ 2.69Å; E475-R492 IonicContact OE2-NE 2.65Å; I490-R492 HydrophobicContact CG2-CG 4.29Å; R492-Y521 VanDerWaalsContact CZ-OH 3.27Å; R492-Y521 PolarHBondContact NH2-OH 3.12Å; R492-Y521 VanDerWaalsContact NH2-OH 3.12Å
493	T	88.6	Confident	83.3	Confident	28 Å²	28	83.8 Å²	83.8	17%	0.172	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	145.3	-175	176.1	0	0	0	0	111	W461 Y474 A495 N497	W461-T493 HydrophobicContact CH2-CG2 3.74Å; W461-T493 HydrophobicContact CZ2-CG2 3.68Å; Y474-T493 PolarHBondContact N-O 2.81Å; Y474-T493 PolarHBondContact O-N 2.99Å; T493-A495 WeakPolarHBondContact CG2-O 3.09Å; T493-A495 PolarHBondContact OG1-N 3.18Å; T493-A495 VanDerWaalsContact OG1-N 3.08Å; T493-A495 PolarHBondContact OG1-O 2.87Å; T493-N497 PolarHBondContact OG1-O 3.01Å
494	A	87.6	Confident	84.2	Confident	85 Å²	85	83 Å²	83	70%	0.702	42%	0.417	S	S	*	.	S	Bend	trans	-81.9	-19.5	169.9	0	0	0	0	0	112.5
495	A	90.9	Very high	85.2	Confident	42 Å²	42	79.2 Å²	79.2	35%	0.347	40%	0.4	S	S	.	.	S	Bend	trans	-84.7	154.2	179.1	0	0	0	0	0	111.6	W461 T493 N497	W461-A495 WeakPolarHBondContact CZ2-O 3.35Å; T493-A495 WeakPolarHBondContact CG2-O 3.09Å; T493-A495 PolarHBondContact OG1-N 3.18Å; T493-A495 VanDerWaalsContact OG1-N 3.08Å; T493-A495 PolarHBondContact OG1-O 2.87Å; A495-N497 PolarHBondContact O-N 2.86Å
496	R	91.6	Very high	86	Confident	124 Å²	124	80.9 Å²	80.9	47%	0.468	41%	0.411	S	S	.	.	S	Bend	trans	-76.2	30.7	171.8	-63.3	-176.1	-61.7	-152.8	4.7	113.3	A460 W461 E463 Y474	A460-R496 WeakPolarHBondContact CA-O 3.31Å; W461-R496 PolarHBondContact N-O 2.79Å; W461-R496 VanDerWaalsContact N-O 3.11Å; E463-R496 IonicContact OE2-CZ 3.67Å; E463-R496 IonicContact OE2-NH1 3.71Å; E463-R496 PolarHBondContact OE2-NH1 3.38Å; Y474-R496 HydrophobicContact CD2-CG 4.49Å; Y474-R496 HydrophobicContact CE2-CG 3.68Å
497	N	91.8	Very high	87.2	Confident	93 Å²	93	71.2 Å²	71.2	50%	0.497	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	161.1	177.9	59.6	72.5	0	0	0	111.8	L459 A460 T493 A495	L459-N497 CarbonylContact O-C 3.59Å; L459-N497 WeakPolarHBondContact O-CA 3.21Å; L459-N497 WeakPolarHBondContact O-CB 3.47Å; A460-N497 HydrophobicContact CB-CB 4Å; T493-N497 PolarHBondContact OG1-O 3.01Å; A495-N497 PolarHBondContact O-N 2.86Å
498	T	92.7	Very high	88	Confident	28 Å²	28	68.7 Å²	68.7	17%	0.172	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	161.3	170.8	-164.4	0	0	0	0	111.1	A458 L459 W461 V476 V491 I500	A458-T498 CarbonylContact C-O 3.57Å; A458-T498 WeakPolarHBondContact CA-O 3.23Å; L459-T498 PolarHBondContact N-O 2.86Å; L459-T498 PolarHBondContact O-N 2.95Å; W461-T498 HydrophobicContact CH2-CG2 3.97Å; W461-T498 HydrophobicContact CZ3-CG2 4.12Å; V476-T498 HydrophobicContact CG2-CG2 3.87Å; V491-T498 HydrophobicContact CG1-CG2 4.4Å; T498-I500 HydrophobicContact CG2-CD1 3.56Å; T498-I500 HydrophobicContact CG2-CG1 4.14Å
499	D	90.7	Very high	88.4	Confident	63 Å²	63	62.6 Å²	62.6	34%	0.337	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	107.9	173.6	177.2	27.2	0	0	0	109.9	S456 A458 K501	S456-D499 VanDerWaalsContact CB-OD1 3.23Å; S456-D499 WeakPolarHBondContact CB-OD1 3.31Å; S456-D499 PolarHBondContact OG-OD1 3.27Å; A458-D499 HydrophobicContact CB-CB 4.34Å; D499-K501 PolarHBondContact O-N 3.49Å; D499-K501 WeakPolarHBondContact OD2-CE 3.11Å; D499-K501 IonicContact OD2-NZ 3.78Å
500	I	91.4	Very high	88.6	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	101.8	-175.5	-53.6	-63.8	0	0	0	108.7	S456 V457 L459 V476 Y478 V491 T498 L503 F511	S456-I500 CarbonylContact C-O 3.55Å; S456-I500 WeakPolarHBondContact CA-O 3.46Å; S456-I500 VanDerWaalsContact CB-O 3.23Å; S456-I500 WeakPolarHBondContact CB-O 3.41Å; V457-I500 PolarHBondContact N-O 2.9Å; V457-I500 PolarHBondContact O-N 3.22Å; L459-I500 HydrophobicContact CD1-CG1 4.02Å; V476-I500 HydrophobicContact CB-CD1 4.49Å; V476-I500 HydrophobicContact CG1-CD1 4.22Å; Y478-I500 HydrophobicContact CD1-CD1 4.38Å; Y478-I500 HydrophobicContact CD1-CG2 3.81Å; Y478-I500 HydrophobicContact CD2-CG2 4.29Å; Y478-I500 HydrophobicContact CE1-CD1 4.36Å; Y478-I500 HydrophobicContact CE1-CG2 3.32Å; Y478-I500 HydrophobicContact CE2-CG2 3.88Å; Y478-I500 HydrophobicContact CG-CG2 4.26Å; V491-I500 HydrophobicContact CB-CD1 3.82Å; V491-I500 HydrophobicContact CG1-CD1 4.13Å; V491-I500 HydrophobicContact CG2-CD1 3.67Å; T498-I500 HydrophobicContact CG2-CD1 3.56Å; T498-I500 HydrophobicContact CG2-CG1 4.14Å; I500-L503 HydrophobicContact CG2-CD1 4.41Å; I500-L503 HydrophobicContact CG2-CD2 3.9Å; I500-L503 HydrophobicContact CG2-CG 4.33Å; I500-F511 HydrophobicContact CB-CE1 4.23Å; I500-F511 HydrophobicContact CG1-CD1 4.4Å; I500-F511 HydrophobicContact CG1-CE1 4Å; I500-F511 HydrophobicContact CG2-CE1 4.19Å
501	K	87.3	Confident	88.8	Confident	122 Å²	122	54.5 Å²	54.5	53%	0.53	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	160.5	-177.6	-61.7	171.7	-174	176.4	0	112.6	Y455 D499	Y455-K501 CarbonylContact O-C 3.49Å; Y455-K501 WeakPolarHBondContact O-CA 3.32Å; D499-K501 PolarHBondContact O-N 3.49Å; D499-K501 WeakPolarHBondContact OD2-CE 3.11Å; D499-K501 IonicContact OD2-NZ 3.78Å
502	G	82.6	Confident	88.9	Confident	42 Å²	42	53.6 Å²	53.6	43%	0.433	30%	0.296	S	S	.	.	S	Bend	trans	80.2	35	178.8	0	0	0	0	0	113	Y455 R489	Y455-G502 PolarHBondContact O-N 3.07Å; R489-G502 PolarHBondContact NH1-O 2.65Å
503	L	87.1	Confident	89.1	Confident	5 Å²	5	47.4 Å²	47.4	3%	0.026	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-88.7	152.4	173.6	-58.2	-178.6	0	0	0	110.9	Y455 V457 Y478 I500 Y509 F511 T532	Y455-L503 WeakPolarHBondContact CA-O 3.37Å; Y455-L503 PolarHBondContact O-N 2.9Å; Y455-L503 VanDerWaalsContact O-N 3.07Å; V457-L503 HydrophobicContact CB-CD1 4.04Å; V457-L503 HydrophobicContact CG2-CD1 3.68Å; Y478-L503 HydrophobicContact CD2-CD2 4.04Å; Y478-L503 HydrophobicContact CE2-CD2 3.36Å; I500-L503 HydrophobicContact CG2-CD1 4.41Å; I500-L503 HydrophobicContact CG2-CD2 3.9Å; I500-L503 HydrophobicContact CG2-CG 4.33Å; L503-Y509 HydrophobicContact CB-CD2 4.42Å; L503-Y509 HydrophobicContact CB-CE2 3.74Å; L503-Y509 HydrophobicContact CD1-CD2 4.26Å; L503-Y509 HydrophobicContact CD1-CE2 4.4Å; L503-Y509 HydrophobicContact CD2-CD1 4.08Å; L503-Y509 HydrophobicContact CD2-CD2 4.25Å; L503-Y509 HydrophobicContact CD2-CE1 3.79Å; L503-Y509 HydrophobicContact CD2-CE2 3.99Å; L503-Y509 HydrophobicContact CD2-CG 4.3Å; L503-Y509 HydrophobicContact CG-CE2 4.26Å; L503-F511 HydrophobicContact CD1-CZ 4.33Å; L503-T532 HydrophobicContact CB-CG2 3.79Å; L503-T532 HydrophobicContact CD1-CG2 3.75Å; L503-T532 HydrophobicContact CG-CG2 4.44Å
504	N	84.4	Confident	89.3	Confident	80 Å²	80	48.7 Å²	48.7	43%	0.428	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-71.1	143	169.4	-71.9	-41.1	0	0	0	110.1	E480 T507 Y509 T532	E480-N504 PolarHBondContact OE1-ND2 2.76Å; N504-T507 HydrophobicContact CB-CG2 4.29Å; N504-T507 WeakPolarHBondContact CB-OG1 3.43Å; N504-Y509 WeakPolarHBondContact CB-OH 3.38Å; N504-Y509 PolarHBondContact N-OH 2.89Å; N504-T532 WeakPolarHBondContact O-CB 3.28Å; N504-T532 PolarHBondContact O-OG1 3.05Å
505	P	83.1	Confident	89.4	Confident	60 Å²	60	44.7 Å²	44.7	39%	0.39	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	153.1	178.2	31.5	-35.2	0	0	0	111.9	R454 Y455 T507 T532	R454-P505 HydrophobicContact CB-CB 4.26Å; R454-P505 WeakPolarHBondContact O-CA 3.46Å; R454-P505 WeakPolarHBondContact O-CB 3.31Å; Y455-P505 HydrophobicContact CE1-CB 4.37Å; Y455-P505 HydrophobicContact CE1-CG 4.2Å; P505-T507 PolarHBondContact O-N 3.39Å; P505-T507 PolarHBondContact O-OG1 3.22Å; P505-T532 VanDerWaalsContact C-OG1 3.27Å; P505-T532 WeakPolarHBondContact CA-OG1 3.19Å
506	L	83	Confident	89.1	Confident	126 Å²	126	46 Å²	46	66%	0.66	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	29	-179.6	-60.8	172.5	0	0	0	114.2	T532 T534	L506-T532 VanDerWaalsContact CA-O 3.31Å; L506-T532 WeakPolarHBondContact CA-O 3.45Å; L506-T532 PolarHBondContact N-O 3.04Å; L506-T532 PolarHBondContact N-OG1 3.15Å; L506-T534 HydrophobicContact CD2-CG2 4.19Å; L506-T534 HydrophobicContact CG-CG2 4.5Å
507	T	86.9	Confident	88.8	Confident	36 Å²	36	40.1 Å²	40.1	22%	0.221	22%	0.215	C	C	.	.			trans	-115.6	136.5	-173.4	-58.1	0	0	0	0	109.8	E480 N504 P505 Y509 T531 T532	E480-T507 HydrophobicContact CG-CG2 4.04Å; N504-T507 HydrophobicContact CB-CG2 4.29Å; N504-T507 WeakPolarHBondContact CB-OG1 3.43Å; P505-T507 PolarHBondContact O-N 3.39Å; P505-T507 PolarHBondContact O-OG1 3.22Å; T507-Y509 HydrophobicContact CG2-CD2 4.31Å; T507-Y509 HydrophobicContact CG2-CE2 3.74Å; T507-Y509 WeakPolarHBondContact O-CD2 3.33Å; T507-T531 WeakPolarHBondContact O-CA 3.23Å; T507-T532 PolarHBondContact N-OG1 2.93Å; T507-T532 PolarHBondContact O-N 2.85Å; T507-T532 VanDerWaalsContact O-N 3.1Å; T507-T532 PolarHBondContact O-OG1 3Å
508	S	89.1	Confident	88	Confident	20 Å²	20	39.4 Å²	39.4	14%	0.14	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.6	178.5	-159.6	0	0	0	0	111.8	K481 E529	K481-S508 PolarHBondContact N-O 3.31Å; S508-E529 WeakPolarHBondContact OG-CG 3.38Å; S508-E529 PolarHBondContact OG-OE1 2.66Å
509	Y	90.3	Very high	86.9	Confident	3 Å²	3	40.9 Å²	40.9	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	141.5	178.4	-73.3	-87.7	0	0	0	110.6	Y478 Y479 E480 L503 N504 T507 F511 E529 V530 T532	Y478-Y509 AromaticContact CD2-CD1 3.89Å; Y478-Y509 HydrophobicContact CD2-CD1 3.89Å; Y478-Y509 HydrophobicContact CD2-CE1 4.32Å; Y478-Y509 HydrophobicContact CE2-CD1 4.31Å; Y478-Y509 HydrophobicContact CE2-CE1 4.29Å; Y479-Y509 VanDerWaalsContact O-CA 3.32Å; Y479-Y509 WeakPolarHBondContact O-CA 3.13Å; E480-Y509 HydrophobicContact CB-CE1 4.36Å; E480-Y509 HydrophobicContact CG-CD1 3.79Å; E480-Y509 HydrophobicContact CG-CE1 3.17Å; E480-Y509 HydrophobicContact CG-CE2 4.47Å; E480-Y509 PolarHBondContact OE1-OH 2.03Å; L503-Y509 HydrophobicContact CB-CD2 4.42Å; L503-Y509 HydrophobicContact CB-CE2 3.74Å; L503-Y509 HydrophobicContact CD1-CD2 4.26Å; L503-Y509 HydrophobicContact CD1-CE2 4.4Å; L503-Y509 HydrophobicContact CD2-CD1 4.08Å; L503-Y509 HydrophobicContact CD2-CD2 4.25Å; L503-Y509 HydrophobicContact CD2-CE1 3.79Å; L503-Y509 HydrophobicContact CD2-CE2 3.99Å; L503-Y509 HydrophobicContact CD2-CG 4.3Å; L503-Y509 HydrophobicContact CG-CE2 4.26Å; N504-Y509 WeakPolarHBondContact CB-OH 3.38Å; N504-Y509 PolarHBondContact N-OH 2.89Å; T507-Y509 HydrophobicContact CG2-CD2 4.31Å; T507-Y509 HydrophobicContact CG2-CE2 3.74Å; T507-Y509 WeakPolarHBondContact O-CD2 3.33Å; Y509-F511 VanDerWaalsContact CB-CE2 3.42Å; Y509-F511 HydrophobicContact CG-CZ 4.31Å; Y509-E529 WeakPolarHBondContact O-CA 3.17Å; Y509-V530 PolarHBondContact N-O 2.77Å; Y509-V530 PolarHBondContact O-N 3.24Å; Y509-T532 HydrophobicContact CD2-CG2 4.24Å; Y509-T532 HydrophobicContact CE2-CG2 4.26Å
510	V	91.7	Very high	86.2	Confident	12 Å²	12	39 Å²	39	7%	0.073	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	136.6	171.1	-177.2	0	0	0	0	109.1	Y478 Y479 K481 P527 L528	Y478-V510 WeakPolarHBondContact CA-O 3.31Å; Y478-V510 WeakPolarHBondContact CB-O 3.35Å; Y479-V510 HydrophobicContact CD2-CB 4.35Å; Y479-V510 HydrophobicContact CE1-CB 4.16Å; Y479-V510 HydrophobicContact CE1-CG1 4.23Å; Y479-V510 HydrophobicContact CE2-CB 3.83Å; Y479-V510 HydrophobicContact CE2-CG1 4.41Å; Y479-V510 HydrophobicContact CE2-CG2 4.05Å; Y479-V510 PolarHBondContact N-O 2.65Å; Y479-V510 VanDerWaalsContact N-O 3.11Å; Y479-V510 PolarHBondContact O-N 2.88Å; K481-V510 HydrophobicContact CB-CG2 4.27Å; V510-P527 HydrophobicContact CG1-CB 3.48Å; V510-P527 VanDerWaalsContact CG1-CB 3.48Å; V510-L528 CarbonylContact C-O 3.42Å; V510-L528 WeakPolarHBondContact CA-O 3.27Å
511	F	93.1	Very high	85.8	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	136.8	-177.5	-57.8	-93.3	0	0	0	111	V457 L459 V476 K477 Y478 I500 L503 Y509 L528 V530	V457-F511 HydrophobicContact CB-CZ 3.98Å; V457-F511 HydrophobicContact CG1-CE2 4.3Å; V457-F511 HydrophobicContact CG1-CZ 4.15Å; V457-F511 HydrophobicContact CG2-CE2 4.47Å; V457-F511 HydrophobicContact CG2-CZ 4.11Å; L459-F511 HydrophobicContact CD1-CB 4.11Å; L459-F511 HydrophobicContact CD1-CD1 3.6Å; L459-F511 HydrophobicContact CD1-CE1 4.25Å; L459-F511 HydrophobicContact CD1-CG 3.97Å; L459-F511 HydrophobicContact CD2-CG 4.44Å; V476-F511 HydrophobicContact CG1-CD1 4.43Å; K477-F511 CarbonylContact O-C 3.53Å; K477-F511 WeakPolarHBondContact O-CA 3.46Å; Y478-F511 HydrophobicContact CD2-CE1 4.18Å; Y478-F511 HydrophobicContact CG-CD1 4.08Å; Y478-F511 AromaticContact CG-CE1 3.89Å; Y478-F511 HydrophobicContact CG-CE1 3.89Å; I500-F511 HydrophobicContact CB-CE1 4.23Å; I500-F511 HydrophobicContact CG1-CD1 4.4Å; I500-F511 HydrophobicContact CG1-CE1 4Å; I500-F511 HydrophobicContact CG2-CE1 4.19Å; L503-F511 HydrophobicContact CD1-CZ 4.33Å; Y509-F511 VanDerWaalsContact CB-CE2 3.42Å; Y509-F511 HydrophobicContact CG-CZ 4.31Å; F511-L528 HydrophobicContact CB-CB 4.49Å; F511-L528 PolarHBondContact N-O 3Å; F511-L528 PolarHBondContact O-N 3.07Å; F511-V530 HydrophobicContact CD2-CB 4.36Å; F511-V530 HydrophobicContact CD2-CG2 3.92Å; F511-V530 HydrophobicContact CE2-CB 3.88Å; F511-V530 HydrophobicContact CE2-CG2 3.91Å
512	H	92.4	Very high	85.6	Confident	24 Å²	24	36.6 Å²	36.6	11%	0.111	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.7	171.3	-58.6	-100.3	0	0	0	110	V476 K477 Y479 F524 S525	V476-H512 CarbonylContact C-O 3.43Å; V476-H512 VanDerWaalsContact CA-O 3.3Å; V476-H512 WeakPolarHBondContact CA-O 3.48Å; K477-H512 HydrophobicContact CB-CB 4.49Å; K477-H512 PolarHBondContact N-O 3.37Å; K477-H512 PolarHBondContact O-N 3.38Å; Y479-H512 AromaticContact CE1-CD2 3.95Å; Y479-H512 AromaticContact CE1-NE2 3.79Å; Y479-H512 PolarHBondContact OH-NE2 3.38Å; H512-F524 HydrophobicContact CB-CB 4.03Å; H512-F524 HydrophobicContact CB-CD1 3.57Å; H512-F524 HydrophobicContact CB-CE1 4.31Å; H512-F524 HydrophobicContact CB-CG 4.02Å; H512-S525 WeakPolarHBondContact CA-OG 3.37Å; H512-S525 PolarHBondContact ND1-O 2.62Å
513	V	94.4	Very high	85.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139.9	178	-168.6	0	0	0	0	111.1	I444 V447 W461 Y474 E475 V476 S525	I444-V513 HydrophobicContact CD1-CB 4.27Å; I444-V513 HydrophobicContact CD1-CG1 3.79Å; V447-V513 HydrophobicContact CB-CG2 4.39Å; V447-V513 HydrophobicContact CG1-CG2 3.7Å; V447-V513 HydrophobicContact CG2-CB 3.96Å; V447-V513 HydrophobicContact CG2-CG2 3.71Å; W461-V513 HydrophobicContact CD2-CB 4.47Å; W461-V513 HydrophobicContact CD2-CG1 3.76Å; W461-V513 HydrophobicContact CD2-CG2 4.21Å; W461-V513 HydrophobicContact CE3-CG1 4.19Å; W461-V513 HydrophobicContact CE3-CG2 3.9Å; W461-V513 HydrophobicContact CG-CG1 4.1Å; W461-V513 HydrophobicContact CH2-CG1 4.43Å; W461-V513 HydrophobicContact CZ2-CG1 4.05Å; W461-V513 HydrophobicContact CZ3-CG1 4.49Å; W461-V513 HydrophobicContact CZ3-CG2 4.25Å; Y474-V513 HydrophobicContact CD1-CG1 4.48Å; E475-V513 WeakPolarHBondContact O-CA 3.2Å; V476-V513 HydrophobicContact CG1-CG2 4.34Å; V476-V513 HydrophobicContact CG2-CG1 4.3Å; V476-V513 HydrophobicContact CG2-CG2 4.1Å; V513-S525 PolarHBondContact N-OG 2.96Å; V513-S525 WeakPolarHBondContact O-CB 3.07Å; V513-S525 PolarHBondContact O-N 2.91Å
514	R	93	Very high	86	Confident	56 Å²	56	43.2 Å²	43.2	21%	0.211	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	153.6	170.1	60.6	-175.5	-175.4	162.6	-1	112	Y474 E475 Y521 G522 D523 F524	Y474-R514 CarbonylContact C-O 3.48Å; Y474-R514 VanDerWaalsContact CA-O 3.32Å; Y474-R514 WeakPolarHBondContact CA-O 3.32Å; E475-R514 HydrophobicContact CB-CG 4.1Å; E475-R514 PolarHBondContact N-O 2.81Å; E475-R514 PolarHBondContact O-N 3.43Å; E475-R514 IonicContact OE1-CZ 3.93Å; E475-R514 VanDerWaalsContact OE1-CZ 3.23Å; E475-R514 IonicContact OE1-NE 2.89Å; E475-R514 PolarHBondContact OE1-NE 3.43Å; E475-R514 IonicContact OE1-NH2 3.66Å; E475-R514 PolarHBondContact OE1-NH2 2.78Å; R514-Y521 HydrophobicContact CG-CD1 3.99Å; R514-G522 WeakPolarHBondContact CB-O 3.46Å; R514-G522 WeakPolarHBondContact CD-O 3.4Å; R514-D523 WeakPolarHBondContact CB-O 3.39Å; R514-F524 HydrophobicContact CB-CD1 3.98Å; R514-F524 HydrophobicContact CB-CE1 4.28Å; R514-F524 HydrophobicContact CB-CG 4.44Å; R514-F524 VanDerWaalsContact CD-CZ 3.48Å; R514-F524 HydrophobicContact CG-CD1 3.84Å; R514-F524 HydrophobicContact CG-CE1 3.61Å; R514-F524 HydrophobicContact CG-CG 4.48Å; R514-F524 HydrophobicContact CG-CZ 4.08Å; R514-F524 VanDerWaalsContact NE-CZ 3.3Å
515	A	89.5	Confident	86.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	157.5	173.1	0	0	0	0	0	111.3	P441 I444 P464 I471 Y474 Y521 G522	P441-A515 HydrophobicContact CB-CB 4.21Å; P441-A515 HydrophobicContact CG-CB 3.71Å; P441-A515 WeakPolarHBondContact CG-O 3.41Å; I444-A515 HydrophobicContact CD1-CB 4.3Å; P464-A515 HydrophobicContact CG-CB 4.09Å; I471-A515 HydrophobicContact CD1-CB 4.27Å; I471-A515 HydrophobicContact CG1-CB 4.47Å; I471-A515 HydrophobicContact CG2-CB 4.07Å; Y474-A515 HydrophobicContact CD1-CB 3.89Å; Y474-A515 HydrophobicContact CE1-CB 3.77Å; A515-Y521 WeakPolarHBondContact O-CA 3.28Å; A515-G522 PolarHBondContact O-N 3.07Å
516	R	85.8	Confident	86.7	Confident	70 Å²	70	44.4 Å²	44.4	26%	0.264	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.6	174.1	-176.6	166.2	79.3	96.1	-2.6	111.3	L472 E473 G520 Y521	L472-R516 PolarHBondContact N-O 3.45Å; E473-R516 HydrophobicContact CG-CB 3.85Å; E473-R516 HydrophobicContact CG-CG 4.48Å; E473-R516 PolarHBondContact O-N 3.23Å; E473-R516 IonicContact OE1-CZ 3.85Å; E473-R516 IonicContact OE1-NE 2.68Å; E473-R516 PolarHBondContact OE1-NE 2.98Å; E473-R516 IonicContact OE1-NH2 3.98Å; E473-R516 PolarHBondContact OE1-NH2 2.84Å; E473-R516 IonicContact OE2-CZ 3.71Å; E473-R516 IonicContact OE2-NE 3.81Å; E473-R516 IonicContact OE2-NH2 2.78Å; E473-R516 PolarHBondContact OE2-NH2 3.08Å; R516-G520 CarbonylContact C-O 3.21Å; R516-G520 WeakPolarHBondContact CA-O 3.43Å; R516-Y521 HydrophobicContact CB-CD1 3.84Å; R516-Y521 HydrophobicContact CB-CE1 4.13Å; R516-Y521 HydrophobicContact CB-CG 4.34Å; R516-Y521 HydrophobicContact CG-CD1 4.25Å; R516-Y521 HydrophobicContact CG-CE1 4.44Å; R516-Y521 HydrophobicContact CG-CG 4.36Å
517	T	84.1	Confident	87	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-177.4	166.4	60.6	0	0	0	0	110.1	A439 P441 P467 V470 I471 A519 G520	A439-T517 PolarHBondContact O-OG1 2.92Å; P441-T517 HydrophobicContact CB-CG2 4.33Å; P441-T517 HydrophobicContact CG-CG2 4.17Å; P467-T517 VanDerWaalsContact O-CG2 3.25Å; P467-T517 WeakPolarHBondContact O-CG2 2.86Å; V470-T517 WeakPolarHBondContact O-CA 3.44Å; I471-T517 HydrophobicContact CG1-CG2 4.42Å; T517-A519 PolarHBondContact O-N 3.27Å; T517-A519 PolarHBondContact OG1-N 2.83Å; T517-G520 PolarHBondContact N-O 2.9Å; T517-G520 PolarHBondContact O-N 3.17Å
518	A	76.2	Confident	87.3	Confident	78 Å²	78	42.2 Å²	42.2	65%	0.645	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-23.9	171.9	0	0	0	0	0	113.6	L472	L472-A518 HydrophobicContact CD1-CB 4.46Å
519	A	69.2	Low	87.4	Confident	59 Å²	59	45.7 Å²	45.7	49%	0.488	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-7.2	179.5	0	0	0	0	0	114.1	Q438 T517	Q438-A519 WeakPolarHBondContact O-CB 3.46Å; T517-A519 PolarHBondContact O-N 3.27Å; T517-A519 PolarHBondContact OG1-N 2.83Å
520	G	75.8	Confident	87.3	Confident	25 Å²	25	46.3 Å²	46.3	26%	0.258	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	130.7	-168.1	178.4	0	0	0	0	0	114	R516 T517	R516-G520 CarbonylContact C-O 3.21Å; R516-G520 WeakPolarHBondContact CA-O 3.43Å; T517-G520 PolarHBondContact N-O 2.9Å; T517-G520 PolarHBondContact O-N 3.17Å
521	Y	82.3	Confident	87.1	Confident	67 Å²	67	49.4 Å²	49.4	26%	0.263	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	143.7	178.9	-66.6	-91.6	0	0	0	111.3	E475 R492 R514 A515 R516	E475-Y521 HydrophobicContact CB-CD1 4.49Å; E475-Y521 HydrophobicContact CB-CE1 3.87Å; E475-Y521 VanDerWaalsContact CD-CE1 3.48Å; E475-Y521 HydrophobicContact CG-CE1 4.33Å; E475-Y521 VanDerWaalsContact OE2-CE1 3.3Å; E475-Y521 WeakPolarHBondContact OE2-CE1 3.42Å; E475-Y521 VanDerWaalsContact OE2-CZ 3.27Å; E475-Y521 PolarHBondContact OE2-OH 3.21Å; R492-Y521 VanDerWaalsContact CZ-OH 3.27Å; R492-Y521 PolarHBondContact NH2-OH 3.12Å; R492-Y521 VanDerWaalsContact NH2-OH 3.12Å; R514-Y521 HydrophobicContact CG-CD1 3.99Å; A515-Y521 WeakPolarHBondContact O-CA 3.28Å; R516-Y521 HydrophobicContact CB-CD1 3.84Å; R516-Y521 HydrophobicContact CB-CE1 4.13Å; R516-Y521 HydrophobicContact CB-CG 4.34Å; R516-Y521 HydrophobicContact CG-CD1 4.25Å; R516-Y521 HydrophobicContact CG-CE1 4.44Å; R516-Y521 HydrophobicContact CG-CG 4.36Å
522	G	84.4	Confident	86.7	Confident	5 Å²	5	49.5 Å²	49.5	5%	0.052	27%	0.273	C	S	.	.			trans	-76.5	175.1	161.4	0	0	0	0	0	111.9	P441 R514 A515	P441-G522 WeakPolarHBondContact O-CA 3.48Å; R514-G522 WeakPolarHBondContact CB-O 3.46Å; R514-G522 WeakPolarHBondContact CD-O 3.4Å; A515-G522 PolarHBondContact O-N 3.07Å
523	D	87.4	Confident	86.1	Confident	124 Å²	124	50.8 Å²	50.8	66%	0.663	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-65.5	154.5	173.5	-64.1	-55.8	0	0	0	112	R514	R514-D523 WeakPolarHBondContact CB-O 3.39Å
524	F	90.6	Very high	85.2	Confident	62 Å²	62	55.2 Å²	55.2	27%	0.272	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-67.6	148.2	174	-81.5	-69	0	0	0	111.6	K477 H512 R514	K477-F524 HydrophobicContact CB-CD1 4.42Å; K477-F524 HydrophobicContact CB-CE1 3.6Å; K477-F524 HydrophobicContact CB-CZ 3.78Å; K477-F524 HydrophobicContact CD-CE1 4.47Å; K477-F524 HydrophobicContact CD-CE2 4.21Å; K477-F524 HydrophobicContact CD-CZ 4.01Å; K477-F524 HydrophobicContact CG-CZ 4.48Å; H512-F524 HydrophobicContact CB-CB 4.03Å; H512-F524 HydrophobicContact CB-CD1 3.57Å; H512-F524 HydrophobicContact CB-CE1 4.31Å; H512-F524 HydrophobicContact CB-CG 4.02Å; R514-F524 HydrophobicContact CB-CD1 3.98Å; R514-F524 HydrophobicContact CB-CE1 4.28Å; R514-F524 HydrophobicContact CB-CG 4.44Å; R514-F524 VanDerWaalsContact CD-CZ 3.48Å; R514-F524 HydrophobicContact CG-CD1 3.84Å; R514-F524 HydrophobicContact CG-CE1 3.61Å; R514-F524 HydrophobicContact CG-CG 4.48Å; R514-F524 HydrophobicContact CG-CZ 4.08Å; R514-F524 VanDerWaalsContact NE-CZ 3.3Å
525	S	92.1	Very high	84.2	Confident	6 Å²	6	56 Å²	56	4%	0.042	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-60.8	161.8	166.5	71.3	0	0	0	0	111.7	I444 V447 H512 V513	I444-S525 VanDerWaalsContact O-CB 3.22Å; I444-S525 WeakPolarHBondContact O-CB 3.26Å; V447-S525 WeakPolarHBondContact CG2-OG 3.34Å; H512-S525 WeakPolarHBondContact CA-OG 3.37Å; H512-S525 PolarHBondContact ND1-O 2.62Å; V513-S525 PolarHBondContact N-OG 2.96Å; V513-S525 WeakPolarHBondContact O-CB 3.07Å; V513-S525 PolarHBondContact O-N 2.91Å
526	E	89.2	Confident	82.7	Confident	159 Å²	159	60.5 Å²	60.5	74%	0.743	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-51.1	149.8	161.3	-65.3	-55.3	140.3	0	0	111.6	L528	E526-L528 PolarHBondContact O-N 3.01Å
527	P	90.2	Very high	81	Confident	74 Å²	74	59 Å²	59	48%	0.481	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-68.1	122.1	-178	25.1	-32.4	0	0	0	112.1	V510	V510-P527 HydrophobicContact CG1-CB 3.48Å; V510-P527 VanDerWaalsContact CG1-CB 3.48Å
528	L	91.8	Very high	79.1	Confident	42 Å²	42	70.3 Å²	70.3	22%	0.22	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	118.6	166.9	176.4	66.9	0	0	0	109.6	V447 L459 V510 F511 E526 V530	V447-L528 HydrophobicContact CB-CD2 4.38Å; V447-L528 HydrophobicContact CG1-CD2 3.88Å; L459-L528 HydrophobicContact CD2-CD2 3.8Å; V510-L528 CarbonylContact C-O 3.42Å; V510-L528 WeakPolarHBondContact CA-O 3.27Å; F511-L528 HydrophobicContact CB-CB 4.49Å; F511-L528 PolarHBondContact N-O 3Å; F511-L528 PolarHBondContact O-N 3.07Å; E526-L528 PolarHBondContact O-N 3.01Å; L528-V530 HydrophobicContact CD2-CG2 4.17Å; L528-V530 HydrophobicContact CG-CG2 3.94Å
529	E	91.6	Very high	77.4	Confident	94 Å²	94	72.9 Å²	72.9	44%	0.439	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	133.1	174.2	-173.5	175.2	168.7	0	0	111.6	K481 S508 Y509	K481-E529 VanDerWaalsContact CD-CD 3.48Å; K481-E529 HydrophobicContact CD-CG 4.46Å; K481-E529 WeakPolarHBondContact CD-OE1 3.41Å; K481-E529 IonicContact NZ-OE1 3.74Å; K481-E529 PolarHBondContact NZ-OE1 3.44Å; K481-E529 IonicContact NZ-OE2 2.66Å; K481-E529 PolarHBondContact NZ-OE2 2.85Å; S508-E529 WeakPolarHBondContact OG-CG 3.38Å; S508-E529 PolarHBondContact OG-OE1 2.66Å; Y509-E529 WeakPolarHBondContact O-CA 3.17Å
530	V	89.6	Confident	75.9	Confident	16 Å²	16	78.3 Å²	78.3	10%	0.097	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	130.3	178.2	-163.4	0	0	0	0	110.5	A449 V452 V457 Y509 F511 L528	A449-V530 HydrophobicContact CB-CG1 4.2Å; A449-V530 HydrophobicContact CB-CG2 3.96Å; V452-V530 HydrophobicContact CG2-CG1 3.65Å; V457-V530 HydrophobicContact CG1-CB 4.33Å; V457-V530 HydrophobicContact CG1-CG1 4.1Å; V457-V530 HydrophobicContact CG1-CG2 4.28Å; V457-V530 HydrophobicContact CG2-CB 4.39Å; V457-V530 HydrophobicContact CG2-CG1 4.04Å; Y509-V530 PolarHBondContact N-O 2.77Å; Y509-V530 PolarHBondContact O-N 3.24Å; F511-V530 HydrophobicContact CD2-CB 4.36Å; F511-V530 HydrophobicContact CD2-CG2 3.92Å; F511-V530 HydrophobicContact CE2-CB 3.88Å; F511-V530 HydrophobicContact CE2-CG2 3.91Å; L528-V530 HydrophobicContact CD2-CG2 4.17Å; L528-V530 HydrophobicContact CG-CG2 3.94Å
531	T	87.4	Confident	73.9	Confident	77 Å²	77	80.2 Å²	80.2	47%	0.472	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130	174.6	-44.9	0	0	0	0	111	V452 T507	V452-T531 WeakPolarHBondContact CG1-O 3.37Å; T507-T531 WeakPolarHBondContact O-CA 3.23Å
532	T	84	Confident	71.4	Confident	2 Å²	2	85.6 Å²	85.6	1%	0.012	46%	0.464	C	S	.	.			trans	-67.1	152.3	175.4	49.7	0	0	0	0	112.1	V457 L503 N504 P505 L506 T507 Y509	V457-T532 HydrophobicContact CG2-CG2 4.25Å; L503-T532 HydrophobicContact CB-CG2 3.79Å; L503-T532 HydrophobicContact CD1-CG2 3.75Å; L503-T532 HydrophobicContact CG-CG2 4.44Å; N504-T532 WeakPolarHBondContact O-CB 3.28Å; N504-T532 PolarHBondContact O-OG1 3.05Å; P505-T532 VanDerWaalsContact C-OG1 3.27Å; P505-T532 WeakPolarHBondContact CA-OG1 3.19Å; L506-T532 VanDerWaalsContact CA-O 3.31Å; L506-T532 WeakPolarHBondContact CA-O 3.45Å; L506-T532 PolarHBondContact N-O 3.04Å; L506-T532 PolarHBondContact N-OG1 3.15Å; T507-T532 PolarHBondContact N-OG1 2.93Å; T507-T532 PolarHBondContact O-N 2.85Å; T507-T532 VanDerWaalsContact O-N 3.1Å; T507-T532 PolarHBondContact O-OG1 3Å; Y509-T532 HydrophobicContact CD2-CG2 4.24Å; Y509-T532 HydrophobicContact CE2-CG2 4.26Å
533	N	80.6	Confident	68.9	Low	51 Å²	51	88.4 Å²	88.4	27%	0.273	49%	0.493	S	S	.	.			trans	-111.3	-143.9	-173.4	68.8	28.9	0	0	0	113	V452 T453 R454 V535	V452-N533 HydrophobicContact CG1-CB 4.41Å; V452-N533 PolarHBondContact O-ND2 2.83Å; T453-N533 WeakPolarHBondContact CA-OD1 3.29Å; T453-N533 PolarHBondContact O-N 3.11Å; T453-N533 PolarHBondContact O-OD1 2.89Å; R454-N533 VanDerWaalsContact CA-O 3.22Å; R454-N533 WeakPolarHBondContact CA-O 3.34Å; R454-N533 WeakPolarHBondContact CB-O 3.5Å; R454-N533 PolarHBondContact N-OD1 2.89Å; N533-V535 PolarHBondContact OD1-N 3.06Å
534	T	74.1	Confident	66.2	Low	93 Å²	93	86.9 Å²	86.9	57%	0.571	50%	0.497	S	S	*	.	S	Bend	trans	-119.4	10.3	-177.3	55.3	0	0	0	0	114.5	R454 L506	R454-T534 VanDerWaalsContact CZ-O 3.23Å; R454-T534 PolarHBondContact NE-O 2.92Å; R454-T534 PolarHBondContact NH2-O 3.47Å; L506-T534 HydrophobicContact CD2-CG2 4.19Å; L506-T534 HydrophobicContact CG-CG2 4.5Å
535	V	71.4	Confident	63.6	Low	72 Å²	72	91.4 Å²	91.4	44%	0.436	53%	0.525	S	S	.	.			trans	-80	128.9	179	-178.3	0	0	0	0	112	T453 R454 N533	T453-V535 WeakPolarHBondContact CB-O 3.37Å; R454-V535 VanDerWaalsContact CB-O 3.31Å; R454-V535 WeakPolarHBondContact CB-O 3.16Å; R454-V535 WeakPolarHBondContact CG-O 3.1Å; R454-V535 PolarHBondContact N-O 2.94Å; N533-V535 PolarHBondContact OD1-N 3.06Å
536	P	58.3	Low	60.9	Low	94 Å²	94	94.8 Å²	94.8	61%	0.61	55%	0.548	S	S	*	.			trans	-69.1	149.9	-177	-14.8	27.4	0	0	0	115.3
537	S	50.7	Low	58.4	Low	39 Å²	39	93.5 Å²	93.5	27%	0.273	55%	0.551	S	S	.	*			trans	-123.8	154.4	-177.9	-27.6	0	0	0	0	112	T453	T453-S537 PolarHBondContact OG1-OG 2.82Å
538	R	44.6	Very low	55.8	Low	238 Å²	238	95.9 Å²	95.9	90%	0.898	56%	0.564	S	S	*	*			trans	-114.8	146.6	179.9	-62	179.7	-179.1	175.2	0.1	111.8
539	I	40.4	Very low	53	Low	132 Å²	132	101 Å²	101	68%	0.677	59%	0.591	S	S	*	*			trans	-137.1	133.3	-173.5	-56.6	177.7	0	0	0	112.1
540	I	36.4	Very low	50.3	Low	173 Å²	173	103 Å²	103	89%	0.887	60%	0.604	S	S	*	*			trans	-141.5	153.3	152.6	-59.3	-176.8	0	0	0	105.6
541	G	34.2	Very low	47.8	Very low	64 Å²	64	108.5 Å²	108.5	66%	0.66	64%	0.638	S	S	*	*			trans	-157.5	-148.5	-177.7	0	0	0	0	0	114.3
542	D	30.7	Very low	45.3	Very low	180 Å²	180	110 Å²	110	96%	0.963	65%	0.651	S	S	*	*			trans	79.2	146.3	-172.5	-140	25.1	0	0	0	114.7
543	G	30.8	Very low	43.3	Very low	64 Å²	64	116.2 Å²	116.2	66%	0.66	69%	0.689	S	S	*	*			cis	-161.7	174.7	-0.8	0	0	0	0	0	113.6
544	A	30.6	Very low	41.3	Very low	92 Å²	92	119.7 Å²	119.7	76%	0.76	72%	0.717	S	S	*	*			trans	-93.1	-165	176.9	0	0	0	0	0	111.7
545	N	37.3	Very low	40.2	Very low	158 Å²	158	118.4 Å²	118.4	85%	0.845	72%	0.723	S	S	*	*			cis	-170.9	-176.9	19.1	-117.3	-17.5	0	0	0	107.5
546	S	35.9	Very low	39.2	Very low	77 Å²	77	120 Å²	120	54%	0.538	74%	0.736	S	S	.	*			cis	-175.1	146.2	-18	171.9	0	0	0	0	111.5
547	T	36.4	Very low	38.8	Very low	131 Å²	131	121.1 Å²	121.1	80%	0.804	74%	0.741	S	S	*	*			trans	60.2	-174.1	157.4	49.5	0	0	0	0	117.2
548	V	35.1	Very low	39.1	Very low	125 Å²	125	124.1 Å²	124.1	76%	0.758	76%	0.758	S	S	*	*			cis	-158.3	169.6	8.1	83	0	0	0	0	108.5
549	L	33.4	Very low	39.5	Very low	148 Å²	148	118.6 Å²	118.6	78%	0.775	75%	0.746	S	S	*	*			cis	-152.9	-159.7	8.2	-135.8	-151.3	0	0	0	112.5
550	L	34.5	Very low	40.3	Very low	138 Å²	138	116.6 Å²	116.6	72%	0.723	74%	0.74	S	S	*	*			trans	-85.1	169.2	175.1	-69.6	166.9	0	0	0	113.3
551	V	37.6	Very low	41.3	Very low	131 Å²	131	112.9 Å²	112.9	79%	0.794	72%	0.724	S	S	*	*			cis	98.7	117.8	26.9	173.2	0	0	0	0	116.8
552	S	34.3	Very low	42.7	Very low	109 Å²	109	114.9 Å²	114.9	76%	0.762	72%	0.719	S	S	*	*			trans	-175.3	124.3	157.4	-174.6	0	0	0	0	108.3
553	V	42.4	Very low	43.9	Very low	132 Å²	132	111.8 Å²	111.8	80%	0.8	70%	0.702	S	S	*	*				80.1	102.2	54	-178	0	0	0	0	115.5
554	S	38.6	Very low	45.4	Very low	123 Å²	123	114 Å²	114	86%	0.86	70%	0.697	S	S	*	*			trans	-160.4	134.2	143.2	62	0	0	0	0	110
555	G	50.2	Low	46.7	Very low	67 Å²	67	111.9 Å²	111.9	69%	0.691	68%	0.68	S	S	*	*			trans	-150.6	28.1	-165.5	0	0	0	0	0	115.6
556	S	50	Low	47.6	Very low	104 Å²	104	107.1 Å²	107.1	73%	0.727	66%	0.662	S	S	*	*			trans	-101.4	-3	-160.2	-44.4	0	0	0	0	115.9
557	V	51.6	Low	48.6	Very low	118 Å²	118	109.4 Å²	109.4	72%	0.715	66%	0.663	S	S	*	*	S	Bend	trans	-92.9	-33.9	-171.6	-177.9	0	0	0	0	113.2	L559	V557-L559 PolarHBondContact O-N 3.02Å
558	V	55.2	Low	49.8	Very low	103 Å²	103	107.1 Å²	107.1	62%	0.624	65%	0.649	S	S	*	*	H	α-helix	trans	-68.8	-34.9	-171.5	-179.1	0	0	0	0	112.7	V560 V561 I562	V558-V560 VanDerWaalsContact C-N 3.33Å; V558-V560 PolarHBondContact O-N 3.01Å; V558-V561 PolarHBondContact O-N 3.27Å; V558-I562 HydrophobicContact CG1-CD1 4Å; V558-I562 PolarHBondContact O-N 2.92Å
559	L	53.1	Low	50.8	Low	122 Å²	122	106.1 Å²	106.1	64%	0.639	64%	0.638	S	S	*	*	H	α-helix	trans	-69	-30.8	-170.4	-144	152.9	0	0	0	112.6	V557 L563	V557-L559 PolarHBondContact O-N 3.02Å; L559-L563 HydrophobicContact CD2-CD1 4.29Å; L559-L563 PolarHBondContact O-N 3.1Å
560	V	57	Low	51.9	Low	90 Å²	90	102.2 Å²	102.2	55%	0.545	62%	0.623	S	S	.	*	H	α-helix	trans	-69	-39	175.9	-178.5	0	0	0	0	111.6	V558 I562 L563 I564	V558-V560 VanDerWaalsContact C-N 3.33Å; V558-V560 PolarHBondContact O-N 3.01Å; V560-I562 PolarHBondContact O-N 3.19Å; V560-L563 PolarHBondContact O-N 3.46Å; V560-I564 HydrophobicContact CG1-CD1 4.25Å; V560-I564 PolarHBondContact O-N 3.15Å
561	V	58.9	Low	52.5	Low	94 Å²	94	104.1 Å²	104.1	57%	0.57	62%	0.621	S	S	*	*	H	α-helix	trans	-65.8	-39.1	-179.6	-177.2	0	0	0	0	111.2	V558 L563 I564 A565	V558-V561 PolarHBondContact O-N 3.27Å; V561-L563 PolarHBondContact O-N 3.48Å; V561-I564 PolarHBondContact O-N 3.06Å; V561-A565 PolarHBondContact O-N 3.08Å
562	I	62.2	Low	53.1	Low	106 Å²	106	107.9 Å²	107.9	54%	0.544	62%	0.621	S	S	.	*	H	α-helix	trans	-63.5	-41	178.9	-66.4	171.2	0	0	0	111.5	V558 V560 A565 A566	V558-I562 HydrophobicContact CG1-CD1 4Å; V558-I562 PolarHBondContact O-N 2.92Å; V560-I562 PolarHBondContact O-N 3.19Å; I562-A565 PolarHBondContact O-N 3.4Å; I562-A566 PolarHBondContact O-N 2.83Å
563	L	56.4	Low	53.8	Low	115 Å²	115	112.4 Å²	112.4	60%	0.602	62%	0.621	S	S	*	*	H	α-helix	trans	-66	-38.8	178.9	-68.8	171	0	0	0	112.4	L559 V560 V561 A566 F567	L559-L563 HydrophobicContact CD2-CD1 4.29Å; L559-L563 PolarHBondContact O-N 3.1Å; V560-L563 PolarHBondContact O-N 3.46Å; V561-L563 PolarHBondContact O-N 3.48Å; L563-A566 PolarHBondContact O-N 2.8Å; L563-F567 PolarHBondContact O-N 3.17Å; L563-F567 VanDerWaalsContact O-N 3.12Å
564	I	61.9	Low	53.9	Low	110 Å²	110	110.3 Å²	110.3	56%	0.564	61%	0.612	S	S	*	*	H	α-helix	trans	-66.5	-42.2	175.7	-64.3	169.8	0	0	0	110.6	V560 V561 A566 F567 V568	V560-I564 HydrophobicContact CG1-CD1 4.25Å; V560-I564 PolarHBondContact O-N 3.15Å; V561-I564 PolarHBondContact O-N 3.06Å; I564-A566 PolarHBondContact O-N 3Å; I564-F567 PolarHBondContact O-N 3.35Å; I564-V568 WeakPolarHBondContact O-CG2 3.45Å; I564-V568 PolarHBondContact O-N 2.81Å; I564-V568 VanDerWaalsContact O-N 3.16Å
565	A	58.5	Low	54.2	Low	49 Å²	49	113.3 Å²	113.3	41%	0.405	61%	0.61	S	S	.	*	H	α-helix	trans	-61.3	-43.5	175.6	0	0	0	0	0	112.3	V561 I562 F567 V568 I569	V561-A565 PolarHBondContact O-N 3.08Å; I562-A565 PolarHBondContact O-N 3.4Å; A565-F567 VanDerWaalsContact C-N 3.35Å; A565-F567 PolarHBondContact O-N 3.22Å; A565-V568 PolarHBondContact O-N 2.75Å; A565-I569 WeakPolarHBondContact O-CG1 3.34Å; A565-I569 PolarHBondContact O-N 3.23Å
566	A	56	Low	53.7	Low	57 Å²	57	120.2 Å²	120.2	47%	0.471	62%	0.616	S	S	.	*	H	α-helix	trans	-60.8	-41	176.7	0	0	0	0	0	112.6	I562 L563 I564 I569 S570	I562-A566 PolarHBondContact O-N 2.83Å; L563-A566 PolarHBondContact O-N 2.8Å; I564-A566 PolarHBondContact O-N 3Å; A566-I569 PolarHBondContact O-N 3.41Å; A566-S570 PolarHBondContact O-N 2.91Å
567	F	57	Low	53.3	Low	125 Å²	125	119.9 Å²	119.9	55%	0.548	61%	0.614	S	S	.	*	H	α-helix	trans	-65.6	-35.9	177.8	-171.6	-102.4	0	0	0	113.3	L563 I564 A565 S570 R571	L563-F567 PolarHBondContact O-N 3.17Å; L563-F567 VanDerWaalsContact O-N 3.12Å; I564-F567 PolarHBondContact O-N 3.35Å; A565-F567 VanDerWaalsContact C-N 3.35Å; A565-F567 PolarHBondContact O-N 3.22Å; F567-S570 PolarHBondContact O-OG 2.78Å; F567-S570 VanDerWaalsContact O-OG 3.05Å; F567-R571 PolarHBondContact O-N 2.65Å
568	V	61.1	Low	52.5	Low	84 Å²	84	121.1 Å²	121.1	51%	0.509	61%	0.61	S	S	.	*	H	α-helix	trans	-72.1	-38.9	175.8	174.4	0	0	0	0	111.5	I564 A565 R572	I564-V568 WeakPolarHBondContact O-CG2 3.45Å; I564-V568 PolarHBondContact O-N 2.81Å; I564-V568 VanDerWaalsContact O-N 3.16Å; A565-V568 PolarHBondContact O-N 2.75Å; V568-R572 PolarHBondContact O-N 2.89Å
569	I	57.8	Low	51.8	Low	103 Å²	103	120.5 Å²	120.5	53%	0.528	62%	0.616	S	S	.	*	H	α-helix	trans	-69.2	-39.2	179.7	-68.1	168.2	0	0	0	111.5	A565 A566 R572 R573	A565-I569 WeakPolarHBondContact O-CG1 3.34Å; A565-I569 PolarHBondContact O-N 3.23Å; A566-I569 PolarHBondContact O-N 3.41Å; I569-R572 PolarHBondContact O-N 3.4Å; I569-R573 PolarHBondContact O-N 3.39Å; I569-R573 VanDerWaalsContact O-N 3.14Å
570	S	54.6	Low	51	Low	66 Å²	66	123.9 Å²	123.9	46%	0.462	63%	0.625	S	S	.	*	H	α-helix	trans	-62.6	-43.7	176.7	70.4	0	0	0	0	111.9	A566 F567 R572 R573 S574	A566-S570 PolarHBondContact O-N 2.91Å; F567-S570 PolarHBondContact O-OG 2.78Å; F567-S570 VanDerWaalsContact O-OG 3.05Å; S570-R572 VanDerWaalsContact C-N 3.28Å; S570-R572 PolarHBondContact O-N 3.21Å; S570-R573 PolarHBondContact O-N 2.71Å; S570-S574 PolarHBondContact O-N 3.34Å; S570-S574 VanDerWaalsContact O-N 3.12Å
571	R	47.4	Very low	50	Low	178 Å²	178	126.9 Å²	126.9	67%	0.672	63%	0.633	S	S	*	*	H	α-helix	trans	-62.1	-29.5	174.6	-89.8	-173.7	162.8	-170.6	-4.1	113.7	F567	F567-R571 PolarHBondContact O-N 2.65Å
572	R	51.5	Low	48.9	Very low	211 Å²	211	129 Å²	129	80%	0.796	64%	0.637	S	S	*	*	H	α-helix	trans	-77.1	-30.9	173.6	-85.1	-170.4	169.1	-171.6	-3	113.9	V568 I569 S570	V568-R572 PolarHBondContact O-N 2.89Å; I569-R572 PolarHBondContact O-N 3.4Å; S570-R572 VanDerWaalsContact C-N 3.28Å; S570-R572 PolarHBondContact O-N 3.21Å
573	R	48.3	Very low	47.5	Very low	203 Å²	203	128.2 Å²	128.2	77%	0.766	65%	0.646	S	S	*	*	H	α-helix	trans	-74.7	-32.4	174.5	-74.9	-172.7	171.4	-178.6	-2.4	113.4	I569 S570 K575 Y576	I569-R573 PolarHBondContact O-N 3.39Å; I569-R573 VanDerWaalsContact O-N 3.14Å; S570-R573 PolarHBondContact O-N 2.71Å; R573-K575 PolarHBondContact O-N 3.13Å; R573-Y576 PolarHBondContact O-N 3.06Å
574	S	43.8	Very low	46.5	Very low	88 Å²	88	129.7 Å²	129.7	62%	0.615	66%	0.655	S	S	*	*	H	α-helix	trans	-59.5	-30.7	177	178.5	0	0	0	0	113.8	S570	S570-S574 PolarHBondContact O-N 3.34Å; S570-S574 VanDerWaalsContact O-N 3.12Å
575	K	44.8	Very low	45.1	Very low	186 Å²	186	132.8 Å²	132.8	81%	0.809	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	3.6	-178.8	-77	-160.3	171	-165.2	0	116	R573	R573-K575 PolarHBondContact O-N 3.13Å
576	Y	40.2	Very low	43.9	Very low	212 Å²	212	139 Å²	139	83%	0.831	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-10.2	172.2	-145.9	-99.6	0	0	0	113.4	R573 K578	R573-Y576 PolarHBondContact O-N 3.06Å; Y576-K578 VanDerWaalsContact C-N 3.3Å; Y576-K578 PolarHBondContact O-N 3.2Å
577	S	41.3	Very low	42.8	Very low	97 Å²	97	145.4 Å²	145.4	68%	0.678	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	3.5	175.3	-165.4	0	0	0	0	113.9
578	K	35.2	Very low	41.8	Very low	145 Å²	145	148 Å²	148	63%	0.63	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	25.4	-173.1	-130.1	-173.7	178.2	-98.9	0	114.1	Y576 E582	Y576-K578 VanDerWaalsContact C-N 3.3Å; Y576-K578 PolarHBondContact O-N 3.2Å; K578-E582 IonicContact NZ-OE1 2.72Å
579	A	39.8	Very low	40.5	Very low	90 Å²	90	151.8 Å²	151.8	74%	0.744	74%	0.735	S	S	*	*	S	Bend	trans	-122.3	22.2	175.5	0	0	0	0	0	112.4
580	K	37.3	Very low	39.1	Very low	193 Å²	193	154.3 Å²	154.3	84%	0.839	75%	0.749	S	S	*	*	S	Bend	trans	-139.6	23.6	177.7	-155	-172.8	172.8	179.5	0	112.4
581	Q	36	Very low	38.1	Very low	152 Å²	152	161 Å²	161	71%	0.71	77%	0.773	S	S	*	*	S	Bend	trans	-143	21.4	-179.2	-154.4	171.5	2.2	0	0	111.8
582	E	35	Very low	37.5	Very low	140 Å²	140	155.2 Å²	155.2	65%	0.654	77%	0.769	S	S	*	*	S	Bend	trans	-126.5	24.5	175.1	-67.2	174.4	-178	0	0	109.5	K578	K578-E582 IonicContact NZ-OE1 2.72Å
583	A	33.9	Very low	37	Very low	88 Å²	88	150.8 Å²	150.8	73%	0.727	77%	0.765	S	S	*	*	S	Bend	trans	-120.5	-6.5	177.2	0	0	0	0	0	113.6
584	D	35.9	Very low	37.3	Very low	147 Å²	147	151.5 Å²	151.5	79%	0.786	77%	0.768	S	S	*	*	S	Bend	trans	-103.7	-11.8	178	-89.7	-40	0	0	0	113.3
585	E	31.9	Very low	38.6	Very low	174 Å²	174	151 Å²	151	81%	0.813	76%	0.761	S	S	*	*	S	Bend	trans	-101.7	-3.9	-179.1	-75.7	-168.3	130.6	0	0	114.8	K587	E585-K587 VanDerWaalsContact C-N 3.33Å; E585-K587 PolarHBondContact O-N 3.3Å
586	E	33.3	Very low	40.2	Very low	181 Å²	181	143.8 Å²	143.8	85%	0.846	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	37.6	173.3	-152.6	178.3	-161.7	0	0	113.2
587	K	33.2	Very low	42	Very low	190 Å²	190	136.6 Å²	136.6	83%	0.826	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	5.6	173.2	-121.3	173.5	-175.6	174.4	0	115.2	E585	E585-K587 VanDerWaalsContact C-N 3.33Å; E585-K587 PolarHBondContact O-N 3.3Å
588	H	36.4	Very low	43.5	Very low	179 Å²	179	133.9 Å²	133.9	83%	0.829	69%	0.685	S	S	*	*	S	Bend	trans	-120.5	12.5	-178.8	-88.7	-88.7	0	0	0	115.2
589	L	32.1	Very low	45	Very low	165 Å²	165	127.1 Å²	127.1	86%	0.864	66%	0.656	S	S	*	*	S	Bend	trans	-135.4	48.5	172.5	-157.8	72.7	0	0	0	113.8
590	N	29.4	Very low	46.3	Very low	155 Å²	155	126.5 Å²	126.5	83%	0.829	64%	0.637	S	S	*	*			trans	-147.6	93.3	160	-103.3	-44.6	0	0	0	109.8	G592	N590-G592 PolarHBondContact O-N 2.89Å
591	Q	33.4	Very low	47.7	Very low	206 Å²	206	122.2 Å²	122.2	96%	0.963	63%	0.627	S	S	*	*			trans	-80.3	51.5	172	-162.5	170.9	4.9	0	0	110.6
592	G	34.6	Very low	48.8	Very low	57 Å²	57	116.9 Å²	116.9	59%	0.588	60%	0.6	S	S	*	*			trans	-68.7	153	168.7	0	0	0	0	0	110.6	N590 R594	N590-G592 PolarHBondContact O-N 2.89Å; G592-R594 PolarHBondContact O-N 3.09Å
593	V	41.1	Very low	50.1	Low	119 Å²	119	120 Å²	120	72%	0.721	62%	0.615	S	S	*	*			trans	-60.3	125.2	174.9	179.5	0	0	0	0	108.7	T595	V593-T595 VanDerWaalsContact C-N 3.28Å; V593-T595 PolarHBondContact O-N 2.86Å
594	R	55.5	Low	51.7	Low	217 Å²	217	118.3 Å²	118.3	82%	0.819	59%	0.594	S	S	*	*			trans	-81.7	74.6	-177.4	-161.4	179.1	-167	-177.2	1.8	109.7	G592 M740	G592-R594 PolarHBondContact O-N 3.09Å; R594-M740 WeakPolarHBondContact O-CE 3.49Å
595	T	70.8	Confident	53.2	Low	77 Å²	77	112 Å²	112	47%	0.472	56%	0.561	S	S	.	*			trans	-62.6	146.4	-179.9	-44.8	0	0	0	0	111.5	V593	V593-T595 VanDerWaalsContact C-N 3.28Å; V593-T595 PolarHBondContact O-N 2.86Å
596	Y	78	Confident	55.2	Low	35 Å²	35	105.1 Å²	105.1	14%	0.137	53%	0.529	C	S	.	.			trans	-56.6	139.3	168.8	166.4	-98.6	0	0	0	111.7	D598 P599 I673 F677 M740 Y742	Y596-D598 HydrophobicContact CE1-CB 3.92Å; Y596-P599 VanDerWaalsContact OH-CD 3.27Å; Y596-P599 WeakPolarHBondContact OH-CD 3.43Å; Y596-I673 HydrophobicContact CE2-CG1 4.3Å; Y596-I673 HydrophobicContact CE2-CG2 4.21Å; Y596-F677 HydrophobicContact CD2-CE1 4.04Å; Y596-F677 AromaticContact CD2-CZ 3.83Å; Y596-F677 HydrophobicContact CD2-CZ 3.83Å; Y596-F677 HydrophobicContact CE2-CZ 4.25Å; Y596-M740 WeakPolarHBondContact CB-O 3.47Å; Y596-M740 PolarHBondContact N-O 2.98Å; Y596-Y742 AromaticContact CD1-CD2 3.88Å; Y596-Y742 HydrophobicContact CD1-CD2 3.88Å; Y596-Y742 AromaticContact CD2-CD2 3.71Å; Y596-Y742 HydrophobicContact CD2-CD2 3.71Å; Y596-Y742 HydrophobicContact CD2-CE2 4.34Å; Y596-Y742 AromaticContact CE1-CD2 3.77Å; Y596-Y742 HydrophobicContact CE1-CD2 3.77Å; Y596-Y742 HydrophobicContact CE1-CE2 4.13Å; Y596-Y742 AromaticContact CE2-CD2 3.59Å; Y596-Y742 HydrophobicContact CE2-CD2 3.59Å; Y596-Y742 AromaticContact CE2-CE2 3.76Å; Y596-Y742 HydrophobicContact CE2-CE2 3.76Å; Y596-Y742 AromaticContact CG-CD2 3.84Å; Y596-Y742 HydrophobicContact CG-CD2 3.84Å; Y596-Y742 AromaticContact CZ-CD2 3.61Å; Y596-Y742 AromaticContact CZ-CE2 3.63Å
597	V	77.7	Confident	57.3	Low	62 Å²	62	101.1 Å²	101.1	38%	0.376	51%	0.511	S	S	.	.			trans	-112.2	123.6	173.9	-179.6	0	0	0	0	108.4	P599 Y602 F612 Q676	V597-P599 VanDerWaalsContact O-CD 3.23Å; V597-P599 WeakPolarHBondContact O-CD 3.38Å; V597-Y602 HydrophobicContact CG1-CE2 4.14Å; V597-F612 HydrophobicContact CB-CZ 4.24Å; V597-F612 HydrophobicContact CG1-CZ 4.43Å; V597-Q676 PolarHBondContact O-NE2 3.42Å; V597-Q676 PolarHBondContact O-OE1 2.86Å
598	D	72.1	Confident	59.4	Low	40 Å²	40	92 Å²	92	21%	0.214	47%	0.471	C	S	.	.			trans	-70.7	117.8	-179.3	-167.4	-30.9	0	0	0	111.2	Y596 F600 T601	Y596-D598 HydrophobicContact CE1-CB 3.92Å; D598-F600 PolarHBondContact O-N 3.11Å; D598-F600 VanDerWaalsContact O-N 3.11Å; D598-F600 WeakPolarHBondContact OD1-CB 3.46Å; D598-F600 VanDerWaalsContact OD1-CD2 3.25Å; D598-F600 WeakPolarHBondContact OD1-CD2 3.46Å; D598-F600 PolarHBondContact OD1-N 2.92Å; D598-T601 HydrophobicContact CB-CG2 4.31Å; D598-T601 WeakPolarHBondContact O-CB 3.39Å; D598-T601 PolarHBondContact O-N 3.26Å; D598-T601 PolarHBondContact O-OG1 2.91Å
599	P	67	Low	61.6	Low	3 Å²	3	83.8 Å²	83.8	2%	0.019	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-59.9	-19.9	178.4	-27	38.9	0	0	0	114.6	Y596 V597 T601 Y602 A608 I673	Y596-P599 VanDerWaalsContact OH-CD 3.27Å; Y596-P599 WeakPolarHBondContact OH-CD 3.43Å; V597-P599 VanDerWaalsContact O-CD 3.23Å; V597-P599 WeakPolarHBondContact O-CD 3.38Å; P599-T601 PolarHBondContact O-N 2.92Å; P599-Y602 PolarHBondContact O-N 2.81Å; P599-A608 HydrophobicContact CB-CB 3.94Å; P599-I673 HydrophobicContact CG-CG1 4Å
600	F	66.8	Low	64.1	Low	77 Å²	77	83.7 Å²	83.7	34%	0.338	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-71.8	-5.5	173.9	-65	-67.6	0	0	0	113.5	D598 Y602 S669 V770	D598-F600 PolarHBondContact O-N 3.11Å; D598-F600 VanDerWaalsContact O-N 3.11Å; D598-F600 WeakPolarHBondContact OD1-CB 3.46Å; D598-F600 VanDerWaalsContact OD1-CD2 3.25Å; D598-F600 WeakPolarHBondContact OD1-CD2 3.46Å; D598-F600 PolarHBondContact OD1-N 2.92Å; F600-Y602 VanDerWaalsContact C-N 3.25Å; F600-S669 WeakPolarHBondContact CZ-OG 3.45Å; F600-V770 HydrophobicContact CB-CG2 4.19Å
601	T	67.3	Low	66.6	Low	102 Å²	102	81.9 Å²	81.9	63%	0.626	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-76.6	-8.4	168.2	60.5	0	0	0	0	113.8	D598 P599	D598-T601 HydrophobicContact CB-CG2 4.31Å; D598-T601 WeakPolarHBondContact O-CB 3.39Å; D598-T601 PolarHBondContact O-N 3.26Å; D598-T601 PolarHBondContact O-OG1 2.91Å; P599-T601 PolarHBondContact O-N 2.92Å
602	Y	60.4	Low	69.2	Low	40 Å²	40	74.1 Å²	74.1	16%	0.157	37%	0.371	C	S	.	.	S	Bend	trans	-98.2	130	178.6	-66.8	-111.8	0	0	0	111	V597 P599 F600 D604 Q607 A608 E611 F612	V597-Y602 HydrophobicContact CG1-CE2 4.14Å; P599-Y602 PolarHBondContact O-N 2.81Å; F600-Y602 VanDerWaalsContact C-N 3.25Å; Y602-D604 VanDerWaalsContact C-N 3.29Å; Y602-D604 PolarHBondContact O-N 3.1Å; Y602-Q607 HydrophobicContact CD1-CB 4.07Å; Y602-Q607 HydrophobicContact CD1-CG 3.83Å; Y602-Q607 HydrophobicContact CE1-CG 4.14Å; Y602-A608 HydrophobicContact CD1-CB 4.29Å; Y602-A608 HydrophobicContact CD2-CB 4.03Å; Y602-A608 HydrophobicContact CE2-CB 4.39Å; Y602-A608 HydrophobicContact CG-CB 3.98Å; Y602-E611 WeakPolarHBondContact CE1-OE2 3.46Å; Y602-E611 PolarHBondContact OH-OE2 3.42Å; Y602-F612 AromaticContact CE2-CE2 3.98Å; Y602-F612 HydrophobicContact CE2-CE2 3.98Å; Y602-F612 HydrophobicContact CE2-CZ 4.34Å; Y602-F612 AromaticContact CZ-CE2 3.97Å; Y602-F612 VanDerWaalsContact OH-CZ 3.32Å; Y602-F612 WeakPolarHBondContact OH-CZ 3.21Å
603	E	60.4	Low	71.8	Confident	207 Å²	207	72 Å²	72	97%	0.967	35%	0.349	S	S	*	.	S	Bend	trans	-63.7	-33.2	177.2	-61.1	-175.4	157.3	0	0	112.9
604	D	68.8	Low	74.2	Confident	52 Å²	52	71.2 Å²	71.2	28%	0.278	34%	0.335	S	S	.	.			trans	-113	109.2	173.1	172.3	28	0	0	0	110.4	Y602 N606 Q607 R610	Y602-D604 VanDerWaalsContact C-N 3.29Å; Y602-D604 PolarHBondContact O-N 3.1Å; D604-N606 PolarHBondContact O-N 2.92Å; D604-N606 VanDerWaalsContact O-N 3.11Å; D604-N606 VanDerWaalsContact OD1-CB 3.25Å; D604-N606 WeakPolarHBondContact OD1-CB 3.42Å; D604-N606 PolarHBondContact OD1-N 2.84Å; D604-N606 PolarHBondContact OD1-ND2 3.34Å; D604-N606 WeakPolarHBondContact OD2-CB 3.29Å; D604-Q607 HydrophobicContact CB-CB 4.32Å; D604-Q607 WeakPolarHBondContact O-CA 3.25Å; D604-Q607 WeakPolarHBondContact O-CB 3.48Å; D604-Q607 PolarHBondContact O-N 3.22Å; D604-Q607 PolarHBondContact OD2-N 2.93Å; D604-R610 IonicContact OD2-CZ 3.2Å; D604-R610 IonicContact OD2-NH1 3.72Å; D604-R610 IonicContact OD2-NH2 3.07Å; D604-R610 PolarHBondContact OD2-NH2 2.95Å
605	P	66.8	Low	76	Confident	15 Å²	15	63.3 Å²	63.3	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-61.3	-18.7	173.8	-31.4	40.8	0	0	0	114.4	Q607 A608 V609 R665	P605-Q607 PolarHBondContact O-N 3.34Å; P605-A608 PolarHBondContact O-N 2.93Å; P605-V609 VanDerWaalsContact O-CG2 3.27Å; P605-V609 WeakPolarHBondContact O-CG2 3.3Å; P605-V609 PolarHBondContact O-N 3.43Å; P605-R665 HydrophobicContact CB-CG 4.48Å; P605-R665 HydrophobicContact CG-CB 4.16Å; P605-R665 HydrophobicContact CG-CG 3.81Å
606	N	74.3	Confident	77	Confident	28 Å²	28	60.1 Å²	60.1	15%	0.15	29%	0.288	C	S	.	.	H	α-helix	trans	-69.2	-20.4	170.3	-52.3	-98.3	0	0	0	111.4	D604 R610 R664	D604-N606 PolarHBondContact O-N 2.92Å; D604-N606 VanDerWaalsContact O-N 3.11Å; D604-N606 VanDerWaalsContact OD1-CB 3.25Å; D604-N606 WeakPolarHBondContact OD1-CB 3.42Å; D604-N606 PolarHBondContact OD1-N 2.84Å; D604-N606 PolarHBondContact OD1-ND2 3.34Å; D604-N606 WeakPolarHBondContact OD2-CB 3.29Å; N606-R610 VanDerWaalsContact CB-NH1 3.28Å; N606-R610 WeakPolarHBondContact O-CB 3.46Å; N606-R610 WeakPolarHBondContact O-CG 3.39Å; N606-R610 PolarHBondContact O-N 2.69Å; N606-R610 PolarHBondContact O-NE 2.87Å; N606-R610 PolarHBondContact O-NH1 2.94Å; N606-R664 PolarHBondContact ND2-NH1 2.97Å; N606-R664 VanDerWaalsContact ND2-NH1 3.14Å; N606-R664 PolarHBondContact OD1-NH1 3.36Å; N606-R664 PolarHBondContact OD1-NH2 3.06Å
607	Q	77.9	Confident	77.6	Confident	97 Å²	97	63.3 Å²	63.3	45%	0.453	31%	0.307	S	S	.	.	H	α-helix	trans	-73.2	-48.1	171.2	-172	175.1	-35	0	0	111.4	Y602 D604 P605 V609 R610 E611	Y602-Q607 HydrophobicContact CD1-CB 4.07Å; Y602-Q607 HydrophobicContact CD1-CG 3.83Å; Y602-Q607 HydrophobicContact CE1-CG 4.14Å; D604-Q607 HydrophobicContact CB-CB 4.32Å; D604-Q607 WeakPolarHBondContact O-CA 3.25Å; D604-Q607 WeakPolarHBondContact O-CB 3.48Å; D604-Q607 PolarHBondContact O-N 3.22Å; D604-Q607 PolarHBondContact OD2-N 2.93Å; P605-Q607 PolarHBondContact O-N 3.34Å; Q607-V609 VanDerWaalsContact C-N 3.31Å; Q607-V609 PolarHBondContact O-N 2.85Å; Q607-R610 VanDerWaalsContact CA-NH2 3.3Å; Q607-R610 PolarHBondContact O-N 2.98Å; Q607-R610 VanDerWaalsContact O-N 3.08Å; Q607-E611 PolarHBondContact O-N 2.85Å
608	A	77.6	Confident	78.1	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.8	-42.8	174.3	0	0	0	0	0	111.5	P599 Y602 P605 R610 E611 F612	P599-A608 HydrophobicContact CB-CB 3.94Å; Y602-A608 HydrophobicContact CD1-CB 4.29Å; Y602-A608 HydrophobicContact CD2-CB 4.03Å; Y602-A608 HydrophobicContact CE2-CB 4.39Å; Y602-A608 HydrophobicContact CG-CB 3.98Å; P605-A608 PolarHBondContact O-N 2.93Å; A608-R610 PolarHBondContact O-N 2.89Å; A608-E611 PolarHBondContact O-N 3.07Å; A608-F612 HydrophobicContact CB-CD2 4.26Å; A608-F612 HydrophobicContact CB-CE2 4.33Å; A608-F612 VanDerWaalsContact O-CD2 3.22Å; A608-F612 WeakPolarHBondContact O-CD2 3.31Å; A608-F612 PolarHBondContact O-N 3.37Å
609	V	82.5	Confident	79	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.03	33%	0.329	C	S	.	.	H	α-helix	trans	-60	-43.2	172.7	172.6	0	0	0	0	111.8	P605 Q607 E611 A613 L668 S672 V688 T690	P605-V609 VanDerWaalsContact O-CG2 3.27Å; P605-V609 WeakPolarHBondContact O-CG2 3.3Å; P605-V609 PolarHBondContact O-N 3.43Å; Q607-V609 VanDerWaalsContact C-N 3.31Å; Q607-V609 PolarHBondContact O-N 2.85Å; V609-E611 PolarHBondContact O-N 3.1Å; V609-A613 HydrophobicContact CG1-CB 4.17Å; V609-A613 CarbonylContact O-C 3.54Å; V609-A613 WeakPolarHBondContact O-CA 3.27Å; V609-A613 WeakPolarHBondContact O-CB 3.38Å; V609-A613 PolarHBondContact O-N 2.79Å; V609-L668 HydrophobicContact CG2-CB 3.8Å; V609-L668 HydrophobicContact CG2-CD2 4.12Å; V609-L668 HydrophobicContact CG2-CG 4.37Å; V609-L668 WeakPolarHBondContact CG2-O 3.49Å; V609-S672 VanDerWaalsContact CG2-OG 3.22Å; V609-S672 WeakPolarHBondContact CG2-OG 3.32Å; V609-S672 PolarHBondContact N-OG 2.93Å; V609-V688 HydrophobicContact CG1-CG2 3.79Å; V609-T690 HydrophobicContact CG1-CG2 4.11Å
610	R	83	Confident	80.1	Confident	163 Å²	163	66.3 Å²	66.3	62%	0.615	34%	0.336	S	S	*	.	H	α-helix	trans	-66.7	-21.9	177.7	-77.8	178.3	-57.2	-103	3.2	113.6	D604 N606 Q607 A608	D604-R610 IonicContact OD2-CZ 3.2Å; D604-R610 IonicContact OD2-NH1 3.72Å; D604-R610 IonicContact OD2-NH2 3.07Å; D604-R610 PolarHBondContact OD2-NH2 2.95Å; N606-R610 VanDerWaalsContact CB-NH1 3.28Å; N606-R610 WeakPolarHBondContact O-CB 3.46Å; N606-R610 WeakPolarHBondContact O-CG 3.39Å; N606-R610 PolarHBondContact O-N 2.69Å; N606-R610 PolarHBondContact O-NE 2.87Å; N606-R610 PolarHBondContact O-NH1 2.94Å; Q607-R610 VanDerWaalsContact CA-NH2 3.3Å; Q607-R610 PolarHBondContact O-N 2.98Å; Q607-R610 VanDerWaalsContact O-N 3.08Å; A608-R610 PolarHBondContact O-N 2.89Å
611	E	83.3	Confident	81.3	Confident	118 Å²	118	63.8 Å²	63.8	55%	0.551	33%	0.326	S	S	*	.	H	α-helix	trans	-91.9	-41.1	179.7	-171.8	166.8	-177.7	0	0	112.6	Y602 Q607 A608 V609	Y602-E611 WeakPolarHBondContact CE1-OE2 3.46Å; Y602-E611 PolarHBondContact OH-OE2 3.42Å; Q607-E611 PolarHBondContact O-N 2.85Å; A608-E611 PolarHBondContact O-N 3.07Å; V609-E611 PolarHBondContact O-N 3.1Å
612	F	86.5	Confident	82.5	Confident	42 Å²	42	64.6 Å²	64.6	18%	0.184	32%	0.32	C	S	.	.	H	α-helix	trans	-104.1	-19.8	-173.2	-53.9	-54.4	0	0	0	114.7	V597 Y602 A608 G675 Q676	V597-F612 HydrophobicContact CB-CZ 4.24Å; V597-F612 HydrophobicContact CG1-CZ 4.43Å; Y602-F612 AromaticContact CE2-CE2 3.98Å; Y602-F612 HydrophobicContact CE2-CE2 3.98Å; Y602-F612 HydrophobicContact CE2-CZ 4.34Å; Y602-F612 AromaticContact CZ-CE2 3.97Å; Y602-F612 VanDerWaalsContact OH-CZ 3.32Å; Y602-F612 WeakPolarHBondContact OH-CZ 3.21Å; A608-F612 HydrophobicContact CB-CD2 4.26Å; A608-F612 HydrophobicContact CB-CE2 4.33Å; A608-F612 VanDerWaalsContact O-CD2 3.22Å; A608-F612 WeakPolarHBondContact O-CD2 3.31Å; A608-F612 PolarHBondContact O-N 3.37Å; F612-G675 CarbonylContact O-C 3.59Å; F612-G675 VanDerWaalsContact O-CA 3.24Å; F612-G675 WeakPolarHBondContact O-CA 3.49Å; F612-Q676 HydrophobicContact CB-CG 4.1Å; F612-Q676 HydrophobicContact CD1-CG 3.59Å; F612-Q676 HydrophobicContact CD2-CG 4.2Å; F612-Q676 HydrophobicContact CE1-CG 4.05Å; F612-Q676 HydrophobicContact CG-CG 3.69Å
613	A	90.1	Very high	84	Confident	14 Å²	14	66.8 Å²	66.8	12%	0.116	33%	0.334	C	S	.	.	S	Bend	trans	-120.3	145.8	-176.6	0	0	0	0	0	112.9	V609 L685 V688	V609-A613 HydrophobicContact CG1-CB 4.17Å; V609-A613 CarbonylContact O-C 3.54Å; V609-A613 WeakPolarHBondContact O-CA 3.27Å; V609-A613 WeakPolarHBondContact O-CB 3.38Å; V609-A613 PolarHBondContact O-N 2.79Å; A613-L685 HydrophobicContact CB-CD2 3.78Å; A613-V688 HydrophobicContact CB-CG1 4.11Å; A613-V688 HydrophobicContact CB-CG2 4.07Å
614	K	91.6	Very high	85.4	Confident	102 Å²	102	60.8 Å²	60.8	44%	0.443	31%	0.306	S	S	.	.			trans	-88.3	119.1	179	176.1	-175.1	158	-142.6	0	110.7	I616 G687 V688	K614-I616 PolarHBondContact O-N 3.08Å; K614-G687 CarbonylContact O-C 3.56Å; K614-G687 WeakPolarHBondContact O-CA 3.35Å; K614-V688 PolarHBondContact O-N 2.89Å
615	E	93.1	Very high	86.3	Confident	51 Å²	51	65.3 Å²	65.3	24%	0.238	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-67.6	131.3	169.7	-174.8	76.3	-178.2	0	0	110.6	V688 T690 K691	E615-V688 CarbonylContact C-O 3.54Å; E615-V688 WeakPolarHBondContact CA-O 3.36Å; E615-T690 VanDerWaalsContact CD-OG1 3.31Å; E615-T690 PolarHBondContact OE1-N 3.16Å; E615-T690 PolarHBondContact OE1-OG1 2.94Å; E615-T690 WeakPolarHBondContact OE2-CB 3.16Å; E615-T690 PolarHBondContact OE2-N 2.9Å; E615-T690 VanDerWaalsContact OE2-N 3.12Å; E615-T690 PolarHBondContact OE2-OG1 3.01Å; E615-K691 HydrophobicContact CG-CD 3.92Å; E615-K691 HydrophobicContact CG-CG 4.47Å; E615-K691 WeakPolarHBondContact OE1-CB 3.4Å; E615-K691 WeakPolarHBondContact OE1-CD 3.24Å; E615-K691 VanDerWaalsContact OE1-CG 3.26Å; E615-K691 WeakPolarHBondContact OE1-CG 3.44Å; E615-K691 PolarHBondContact OE1-N 3.44Å
616	I	92.1	Very high	87.3	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.051	34%	0.338	C	S	.	.			trans	-109.2	144.4	175.5	-64.5	175.7	0	0	0	108.3	K614 C620 I621 L640 V688 V689 I698	K614-I616 PolarHBondContact O-N 3.08Å; I616-C620 HydrophobicContact CG2-CB 4.09Å; I616-I621 HydrophobicContact CG2-CD1 3.81Å; I616-I621 HydrophobicContact CG2-CG1 4.02Å; I616-L640 HydrophobicContact CD1-CD1 4.11Å; I616-L640 HydrophobicContact CD1-CD2 3.87Å; I616-L640 HydrophobicContact CG2-CD1 3.83Å; I616-V688 PolarHBondContact N-O 3.22Å; I616-V689 HydrophobicContact CB-CG2 4.32Å; I616-I698 HydrophobicContact CD1-CB 4.39Å; I616-I698 HydrophobicContact CD1-CD1 4.44Å
617	D	89.7	Confident	87.8	Confident	101 Å²	101	70.2 Å²	70.2	54%	0.54	35%	0.35	S	S	.	.			trans	-78	131.9	169.5	-169	-73.9	0	0	0	110.3	S619 C620	D617-S619 PolarHBondContact O-N 3.15Å; D617-S619 VanDerWaalsContact O-N 3.12Å; D617-S619 VanDerWaalsContact OD1-CB 3.3Å; D617-S619 WeakPolarHBondContact OD1-CB 3.43Å; D617-S619 PolarHBondContact OD1-N 2.98Å; D617-S619 PolarHBondContact OD1-OG 2.68Å; D617-C620 VanDerWaalsContact O-CB 3.25Å; D617-C620 WeakPolarHBondContact O-CB 3.3Å; D617-C620 PolarHBondContact O-N 3.02Å
618	A	90.1	Very high	87.8	Confident	36 Å²	36	67 Å²	67	30%	0.298	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-58.5	-27.1	-177.1	0	0	0	0	0	113.6	C620 I621 V689	A618-C620 PolarHBondContact O-N 2.65Å; A618-I621 PolarHBondContact O-N 2.66Å; A618-I621 VanDerWaalsContact O-N 3.11Å; A618-V689 HydrophobicContact CB-CG1 4.28Å
619	S	89.2	Confident	87.6	Confident	107 Å²	107	72 Å²	72	75%	0.748	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-67.7	-16	175	65.8	0	0	0	0	114	D617 I621	D617-S619 PolarHBondContact O-N 3.15Å; D617-S619 VanDerWaalsContact O-N 3.12Å; D617-S619 VanDerWaalsContact OD1-CB 3.3Å; D617-S619 WeakPolarHBondContact OD1-CB 3.43Å; D617-S619 PolarHBondContact OD1-N 2.98Å; D617-S619 PolarHBondContact OD1-OG 2.68Å; S619-I621 VanDerWaalsContact C-N 3.28Å
620	C	90.9	Very high	86.7	Confident	26 Å²	26	73 Å²	73	18%	0.176	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-79.2	-8.7	172.6	-60.9	0	0	0	0	113.2	I616 D617 A618 L640 K641	I616-C620 HydrophobicContact CG2-CB 4.09Å; D617-C620 VanDerWaalsContact O-CB 3.25Å; D617-C620 WeakPolarHBondContact O-CB 3.3Å; D617-C620 PolarHBondContact O-N 3.02Å; A618-C620 PolarHBondContact O-N 2.65Å; C620-L640 HydrophobicContact CB-CD1 4.05Å; C620-K641 PolarHBondContact O-N 2.88Å
621	I	92.6	Very high	85.9	Confident	24 Å²	24	72 Å²	72	12%	0.123	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	133.2	-171	-62.5	166.2	0	0	0	110.2	I616 A618 S619 R639 L640 I652 V689 I698	I616-I621 HydrophobicContact CG2-CD1 3.81Å; I616-I621 HydrophobicContact CG2-CG1 4.02Å; A618-I621 PolarHBondContact O-N 2.66Å; A618-I621 VanDerWaalsContact O-N 3.11Å; S619-I621 VanDerWaalsContact C-N 3.28Å; I621-R639 WeakPolarHBondContact CA-O 3.42Å; I621-L640 HydrophobicContact CG1-CD1 3.9Å; I621-I652 HydrophobicContact CG2-CD1 3.54Å; I621-I652 HydrophobicContact CG2-CG1 4.43Å; I621-V689 HydrophobicContact CD1-CG2 3.53Å; I621-I698 HydrophobicContact CD1-CD1 3.8Å; I621-I698 HydrophobicContact CD1-CG1 3.86Å
622	K	91.9	Very high	85	Confident	118 Å²	118	67 Å²	67	51%	0.513	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	111.8	170.6	-179.9	-163.8	171	-149.2	0	109.2	E624 G638 R639	K622-E624 HydrophobicContact CD-CG 4.43Å; K622-E624 IonicContact NZ-OE1 3.46Å; K622-E624 PolarHBondContact NZ-OE1 2.84Å; K622-G638 CarbonylContact O-C 3.57Å; K622-G638 WeakPolarHBondContact O-CA 3.26Å; K622-R639 HydrophobicContact CB-CB 4.29Å; K622-R639 PolarHBondContact N-O 2.91Å; K622-R639 PolarHBondContact O-N 3.12Å
623	I	91.7	Very high	84.5	Confident	87 Å²	87	65 Å²	65	45%	0.446	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	134.9	171.5	-61	172.7	0	0	0	108.4	C636 I652 M696	I623-C636 HydrophobicContact CG2-CB 3.76Å; I623-I652 HydrophobicContact CG1-CD1 3.87Å; I623-M696 HydrophobicContact CD1-SD 4.47Å
624	E	88.9	Confident	84.2	Confident	80 Å²	80	68.3 Å²	68.3	37%	0.374	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-44	-178.5	-65.5	-167.4	141.3	0	0	113.5	K622 S637 R639	K622-E624 HydrophobicContact CD-CG 4.43Å; K622-E624 IonicContact NZ-OE1 3.46Å; K622-E624 PolarHBondContact NZ-OE1 2.84Å; E624-S637 PolarHBondContact N-O 3.45Å; E624-R639 HydrophobicContact CG-CG 4.45Å; E624-R639 WeakPolarHBondContact OE1-CG 3.18Å; E624-R639 IonicContact OE1-NE 3.47Å; E624-R639 PolarHBondContact OE1-NE 2.78Å; E624-R639 IonicContact OE2-CZ 2.73Å; E624-R639 IonicContact OE2-NE 2.76Å; E624-R639 PolarHBondContact OE2-NE 3.38Å; E624-R639 IonicContact OE2-NH2 3.61Å; E624-R639 PolarHBondContact OE2-NH2 3.46Å
625	K	88.9	Confident	84	Confident	148 Å²	148	65.2 Å²	65.2	64%	0.643	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-159.6	142.2	-177	-170.1	-165	165.1	-178.6	0	111.7	I627 C636 S637	K625-I627 PolarHBondContact O-N 3.08Å; K625-C636 CarbonylContact O-C 3.52Å; K625-C636 WeakPolarHBondContact O-CA 3.31Å; K625-C636 WeakPolarHBondContact O-CB 3.35Å; K625-S637 PolarHBondContact N-O 3.37Å; K625-S637 PolarHBondContact O-N 3.24Å; K625-S637 PolarHBondContact O-OG 3.09Å
626	V	87.8	Confident	83.9	Confident	68 Å²	68	63 Å²	63	41%	0.412	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.4	165.5	-174.6	0	0	0	0	109.9	E634	V626-E634 HydrophobicContact CG1-CB 4.36Å; V626-E634 HydrophobicContact CG1-CG 4.48Å
627	I	83.9	Confident	83.9	Confident	77 Å²	77	63.3 Å²	63.3	40%	0.395	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-15.5	178.4	60.7	175.2	0	0	0	113.1	K625 V635 A651 Y701	K625-I627 PolarHBondContact O-N 3.08Å; I627-V635 HydrophobicContact CD1-CG1 4.01Å; I627-V635 HydrophobicContact CG1-CB 4.14Å; I627-V635 HydrophobicContact CG1-CG1 3.97Å; I627-V635 VanDerWaalsContact CG1-O 3.23Å; I627-V635 WeakPolarHBondContact CG1-O 3.49Å; I627-V635 PolarHBondContact N-O 3.27Å; I627-A651 HydrophobicContact CD1-CB 4.45Å; I627-Y701 HydrophobicContact CD1-CD2 4.35Å; I627-Y701 HydrophobicContact CD1-CE2 3.83Å
628	G	78.4	Confident	84.2	Confident	30 Å²	30	58.6 Å²	58.6	31%	0.309	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.3	174.7	173.8	0	0	0	0	0	112.7	V635	G628-V635 PolarHBondContact N-O 3.01Å; G628-V635 VanDerWaalsContact N-O 3.15Å; G628-V635 PolarHBondContact O-N 3.13Å
629	V	73.2	Confident	84.3	Confident	105 Å²	105	60.7 Å²	60.7	64%	0.636	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	121.3	174.8	-176.6	0	0	0	0	108.2	E634	V629-E634 HydrophobicContact CG2-CG 4.46Å
630	G	63.9	Low	84.6	Confident	26 Å²	26	55.7 Å²	55.7	27%	0.268	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-179.6	175.3	0	0	0	0	0	112.7	F632 G633	G630-F632 VanDerWaalsContact C-N 3.28Å; G630-F632 PolarHBondContact O-N 3.09Å; G630-G633 PolarHBondContact N-O 2.96Å; G630-G633 PolarHBondContact O-N 2.78Å
631	E	65.3	Low	84.6	Confident	142 Å²	142	61 Å²	61	66%	0.664	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-45.7	-178.3	-176.5	175.2	-175.8	0	0	112.8
632	F	65.9	Low	84.2	Confident	13 Å²	13	61.3 Å²	61.3	6%	0.057	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-17.4	-174.2	-57.4	-71.5	0	0	0	115	G630 L655 K656 Q663 D666 F667	G630-F632 VanDerWaalsContact C-N 3.28Å; G630-F632 PolarHBondContact O-N 3.09Å; F632-L655 HydrophobicContact CB-CD1 3.91Å; F632-L655 HydrophobicContact CD1-CD1 4.36Å; F632-K656 WeakPolarHBondContact O-CG 3.48Å; F632-K656 PolarHBondContact O-N 3.29Å; F632-Q663 HydrophobicContact CD1-CB 4.45Å; F632-D666 HydrophobicContact CE1-CB 3.87Å; F632-D666 HydrophobicContact CZ-CB 3.9Å; F632-F667 HydrophobicContact CB-CD2 3.46Å; F632-F667 VanDerWaalsContact CB-CD2 3.46Å; F632-F667 HydrophobicContact CB-CE2 3.93Å; F632-F667 HydrophobicContact CB-CG 4.37Å; F632-F667 HydrophobicContact CD1-CB 3.97Å; F632-F667 HydrophobicContact CD1-CD2 4.32Å; F632-F667 AromaticContact CD2-CD2 3.84Å; F632-F667 HydrophobicContact CD2-CD2 3.84Å; F632-F667 HydrophobicContact CE1-CB 4.28Å; F632-F667 HydrophobicContact CG-CB 4.1Å; F632-F667 AromaticContact CG-CD2 3.62Å; F632-F667 HydrophobicContact CG-CD2 3.62Å; F632-F667 HydrophobicContact CG-CG 4.33Å
633	G	75.1	Confident	83.6	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.7	-170.3	-170.5	0	0	0	0	0	115.6	G630 T654	G630-G633 PolarHBondContact N-O 2.96Å; G630-G633 PolarHBondContact O-N 2.78Å; G633-T654 VanDerWaalsContact CA-O 3.26Å; G633-T654 WeakPolarHBondContact CA-O 3.41Å
634	E	83.8	Confident	82.9	Confident	83 Å²	83	61.3 Å²	61.3	39%	0.388	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	137.5	-177.7	-67.6	174.5	-171	0	0	110.1	V626 V629 T654	V626-E634 HydrophobicContact CG1-CB 4.36Å; V626-E634 HydrophobicContact CG1-CG 4.48Å; V629-E634 HydrophobicContact CG2-CG 4.46Å; E634-T654 PolarHBondContact N-OG1 2.7Å; E634-T654 PolarHBondContact O-N 3.18Å; E634-T654 PolarHBondContact O-OG1 2.85Å
635	V	88.1	Confident	82.7	Confident	37 Å²	37	64.5 Å²	64.5	22%	0.224	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	124.1	167.9	-164.8	0	0	0	0	107.1	I627 G628 I652 K653	I627-V635 HydrophobicContact CD1-CG1 4.01Å; I627-V635 HydrophobicContact CG1-CB 4.14Å; I627-V635 HydrophobicContact CG1-CG1 3.97Å; I627-V635 VanDerWaalsContact CG1-O 3.23Å; I627-V635 WeakPolarHBondContact CG1-O 3.49Å; I627-V635 PolarHBondContact N-O 3.27Å; G628-V635 PolarHBondContact N-O 3.01Å; G628-V635 VanDerWaalsContact N-O 3.15Å; G628-V635 PolarHBondContact O-N 3.13Å; V635-I652 WeakPolarHBondContact CA-O 3.31Å; V635-K653 HydrophobicContact CG2-CG 4.34Å
636	C	90.5	Very high	82.6	Confident	5 Å²	5	68.3 Å²	68.3	3%	0.034	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	144.7	-179	-59.9	0	0	0	0	111.5	I623 K625 A651 I652	I623-C636 HydrophobicContact CG2-CB 3.76Å; K625-C636 CarbonylContact O-C 3.52Å; K625-C636 WeakPolarHBondContact O-CA 3.31Å; K625-C636 WeakPolarHBondContact O-CB 3.35Å; C636-A651 CarbonylContact O-C 3.59Å; C636-A651 WeakPolarHBondContact O-CA 3.44Å; C636-I652 HydrophobicContact CB-CB 4.49Å; C636-I652 PolarHBondContact N-O 3.48Å; C636-I652 PolarHBondContact O-N 2.99Å
637	S	92.9	Very high	82.7	Confident	17 Å²	17	70.1 Å²	70.1	12%	0.119	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	143.3	160.4	58.4	0	0	0	0	109.8	E624 K625	E624-S637 PolarHBondContact N-O 3.45Å; K625-S637 PolarHBondContact N-O 3.37Å; K625-S637 PolarHBondContact O-N 3.24Å; K625-S637 PolarHBondContact O-OG 3.09Å
638	G	94.2	Very high	83.1	Confident	2 Å²	2	69.3 Å²	69.3	2%	0.021	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	-171.8	175.6	0	0	0	0	0	114	K622 V650	K622-G638 CarbonylContact O-C 3.57Å; K622-G638 WeakPolarHBondContact O-CA 3.26Å; G638-V650 PolarHBondContact N-O 3.26Å; G638-V650 PolarHBondContact O-N 2.93Å
639	R	93.8	Very high	83.9	Confident	80 Å²	80	70.6 Å²	70.6	30%	0.302	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	138.8	174.5	-54.4	-65.6	163.4	161.2	-7.7	110.6	I621 K622 E624 E647 I648 C649	I621-R639 WeakPolarHBondContact CA-O 3.42Å; K622-R639 HydrophobicContact CB-CB 4.29Å; K622-R639 PolarHBondContact N-O 2.91Å; K622-R639 PolarHBondContact O-N 3.12Å; E624-R639 HydrophobicContact CG-CG 4.45Å; E624-R639 WeakPolarHBondContact OE1-CG 3.18Å; E624-R639 IonicContact OE1-NE 3.47Å; E624-R639 PolarHBondContact OE1-NE 2.78Å; E624-R639 IonicContact OE2-CZ 2.73Å; E624-R639 IonicContact OE2-NE 2.76Å; E624-R639 PolarHBondContact OE2-NE 3.38Å; E624-R639 IonicContact OE2-NH2 3.61Å; E624-R639 PolarHBondContact OE2-NH2 3.46Å; R639-E647 HydrophobicContact CB-CG 3.81Å; R639-E647 HydrophobicContact CG-CG 4.29Å; R639-I648 WeakPolarHBondContact CA-O 3.39Å; R639-C649 PolarHBondContact NH1-SG 2.81Å
640	L	94.4	Very high	84.9	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.9	166.9	175.6	62.3	0	0	0	109.3	I616 C620 I621 V642 E647 I648 V650 E686 I698	I616-L640 HydrophobicContact CD1-CD1 4.11Å; I616-L640 HydrophobicContact CD1-CD2 3.87Å; I616-L640 HydrophobicContact CG2-CD1 3.83Å; C620-L640 HydrophobicContact CB-CD1 4.05Å; I621-L640 HydrophobicContact CG1-CD1 3.9Å; L640-V642 HydrophobicContact CD1-CG2 4.2Å; L640-V642 HydrophobicContact CD2-CG2 4.02Å; L640-V642 HydrophobicContact CG-CG2 3.87Å; L640-E647 WeakPolarHBondContact O-CA 3.48Å; L640-I648 HydrophobicContact CB-CG1 4.07Å; L640-I648 HydrophobicContact CD2-CD1 4.38Å; L640-I648 PolarHBondContact N-O 2.93Å; L640-I648 PolarHBondContact O-N 3.44Å; L640-V650 HydrophobicContact CB-CB 4.48Å; L640-V650 HydrophobicContact CB-CG1 3.65Å; L640-V650 HydrophobicContact CB-CG2 3.97Å; L640-V650 HydrophobicContact CD2-CG1 4.23Å; L640-E686 HydrophobicContact CD2-CB 3.82Å; L640-E686 HydrophobicContact CD2-CG 4.2Å; L640-I698 HydrophobicContact CD2-CG2 4.39Å
641	K	91.9	Very high	86.4	Confident	137 Å²	137	64.9 Å²	64.9	60%	0.596	34%	0.337	S	S	*	.			trans	-116.3	80.4	-178.6	-172.7	178	178	177.6	0	110.4	C620 E647	C620-K641 PolarHBondContact O-N 2.88Å; K641-E647 HydrophobicContact CB-CG 4.43Å
642	V	84.3	Confident	87.8	Confident	31 Å²	31	58.1 Å²	58.1	19%	0.188	31%	0.305	C	S	.	.			trans	-71.8	132.5	175.7	-173.4	0	0	0	0	109.9	L640 G644 K645	L640-V642 HydrophobicContact CD1-CG2 4.2Å; L640-V642 HydrophobicContact CD2-CG2 4.02Å; L640-V642 HydrophobicContact CG-CG2 3.87Å; V642-G644 PolarHBondContact O-N 3.09Å; V642-K645 HydrophobicContact CB-CB 4.27Å; V642-K645 HydrophobicContact CB-CD 4.45Å; V642-K645 PolarHBondContact O-N 2.93Å
643	P	78.9	Confident	89.1	Confident	112 Å²	112	59 Å²	59	73%	0.727	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	130.8	174.4	-29	35.9	0	0	0	112.6	K645	P643-K645 VanDerWaalsContact C-N 3.27Å; P643-K645 PolarHBondContact O-N 3.06Å
644	G	76.6	Confident	89.8	Confident	93 Å²	93	59.9 Å²	59.9	96%	0.959	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-6	-179.1	0	0	0	0	0	116.2	V642	V642-G644 PolarHBondContact O-N 3.09Å
645	K	85.6	Confident	89.8	Confident	147 Å²	147	56.2 Å²	56.2	64%	0.639	30%	0.297	S	S	*	.	S	Bend	trans	-105	166.6	171	-69.7	-167.3	174.8	-171.2	0	111.6	V642 P643	V642-K645 HydrophobicContact CB-CB 4.27Å; V642-K645 HydrophobicContact CB-CD 4.45Å; V642-K645 PolarHBondContact O-N 2.93Å; P643-K645 VanDerWaalsContact C-N 3.27Å; P643-K645 PolarHBondContact O-N 3.06Å
646	R	85.9	Confident	89.4	Confident	229 Å²	229	59.8 Å²	59.8	86%	0.864	31%	0.31	S	S	*	.			trans	-69.4	152.6	163.8	-67.7	-176.6	178.5	179.9	-0.4	109.7
647	E	90.3	Very high	88.8	Confident	105 Å²	105	64.6 Å²	64.6	49%	0.491	35%	0.349	S	S	.	.			trans	-68.6	136.5	171.7	-175.5	173.1	-112.1	0	0	110.2	R639 L640 K641	R639-E647 HydrophobicContact CB-CG 3.81Å; R639-E647 HydrophobicContact CG-CG 4.29Å; L640-E647 WeakPolarHBondContact O-CA 3.48Å; K641-E647 HydrophobicContact CB-CG 4.43Å
648	I	93.1	Very high	88	Confident	60 Å²	60	67.6 Å²	67.6	31%	0.308	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	152	-177	58.9	171.7	0	0	0	111.7	R639 L640 V650 E686	R639-I648 WeakPolarHBondContact CA-O 3.39Å; L640-I648 HydrophobicContact CB-CG1 4.07Å; L640-I648 HydrophobicContact CD2-CD1 4.38Å; L640-I648 PolarHBondContact N-O 2.93Å; L640-I648 PolarHBondContact O-N 3.44Å; I648-V650 HydrophobicContact CD1-CG1 4.25Å; I648-V650 HydrophobicContact CG1-CG1 4.18Å; I648-E686 VanDerWaalsContact CD1-CD 3.46Å; I648-E686 HydrophobicContact CD1-CG 4.06Å; I648-E686 VanDerWaalsContact CD1-OE1 3.3Å; I648-E686 WeakPolarHBondContact CD1-OE1 3.45Å
649	C	93.6	Very high	87.3	Confident	57 Å²	57	70.4 Å²	70.4	39%	0.385	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.9	171.2	-58	0	0	0	0	109.8	R639 Y701	R639-C649 PolarHBondContact NH1-SG 2.81Å; C649-Y701 HydrophobicContact CB-CD1 4.12Å; C649-Y701 HydrophobicContact CB-CG 4.24Å; C649-Y701 PolarHBondContact O-N 2.85Å
650	V	95.9	Very high	86.6	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	152.4	179	-69.8	0	0	0	0	111.7	G638 L640 I648 I652 E686 I698 T699	G638-V650 PolarHBondContact N-O 3.26Å; G638-V650 PolarHBondContact O-N 2.93Å; L640-V650 HydrophobicContact CB-CB 4.48Å; L640-V650 HydrophobicContact CB-CG1 3.65Å; L640-V650 HydrophobicContact CB-CG2 3.97Å; L640-V650 HydrophobicContact CD2-CG1 4.23Å; I648-V650 HydrophobicContact CD1-CG1 4.25Å; I648-V650 HydrophobicContact CG1-CG1 4.18Å; V650-I652 HydrophobicContact CG2-CD1 4.1Å; V650-I652 HydrophobicContact CG2-CG1 3.91Å; V650-E686 HydrophobicContact CG1-CG 4.28Å; V650-I698 HydrophobicContact CB-CG2 3.6Å; V650-I698 HydrophobicContact CG1-CG2 3.71Å; V650-I698 HydrophobicContact CG2-CG2 3.86Å; V650-T699 CarbonylContact C-O 3.55Å; V650-T699 VanDerWaalsContact CA-O 3.31Å; V650-T699 WeakPolarHBondContact CA-O 3.45Å; V650-T699 VanDerWaalsContact CB-O 3.31Å; V650-T699 WeakPolarHBondContact CB-O 3.26Å
651	A	95.2	Very high	85.9	Confident	12 Å²	12	75.4 Å²	75.4	10%	0.099	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	135.5	162	0	0	0	0	0	109.1	I627 C636 I698 T699 Y701	I627-A651 HydrophobicContact CD1-CB 4.45Å; C636-A651 CarbonylContact O-C 3.59Å; C636-A651 WeakPolarHBondContact O-CA 3.44Å; A651-I698 WeakPolarHBondContact O-CA 3.46Å; A651-T699 PolarHBondContact N-O 3.26Å; A651-T699 PolarHBondContact O-N 3.05Å; A651-Y701 HydrophobicContact CB-CD2 4.38Å
652	I	94.3	Very high	85.1	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	102.5	-171.8	-56.1	165.9	0	0	0	106.9	I621 I623 V635 C636 V650 T654 M696 I697 I698	I621-I652 HydrophobicContact CG2-CD1 3.54Å; I621-I652 HydrophobicContact CG2-CG1 4.43Å; I623-I652 HydrophobicContact CG1-CD1 3.87Å; V635-I652 WeakPolarHBondContact CA-O 3.31Å; C636-I652 HydrophobicContact CB-CB 4.49Å; C636-I652 PolarHBondContact N-O 3.48Å; C636-I652 PolarHBondContact O-N 2.99Å; V650-I652 HydrophobicContact CG2-CD1 4.1Å; V650-I652 HydrophobicContact CG2-CG1 3.91Å; I652-T654 HydrophobicContact CG2-CG2 4.29Å; I652-M696 HydrophobicContact CG2-CB 4.19Å; I652-M696 HydrophobicContact CG2-CG 4.09Å; I652-M696 HydrophobicContact CG2-SD 3.76Å; I652-I697 WeakPolarHBondContact CA-O 3.42Å; I652-I698 HydrophobicContact CG1-CG1 4.48Å
653	K	92	Very high	84.9	Confident	32 Å²	32	76.8 Å²	76.8	14%	0.139	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	121.9	171.6	-150.4	-178.9	-165.4	176.7	0	107.4	V635 F667 E670 M696 I697	V635-K653 HydrophobicContact CG2-CG 4.34Å; K653-F667 HydrophobicContact CB-CE2 4.28Å; K653-F667 HydrophobicContact CD-CE2 4.02Å; K653-F667 HydrophobicContact CG-CE2 4Å; K653-E670 IonicContact NZ-OE1 2.9Å; K653-E670 PolarHBondContact NZ-OE1 2.93Å; K653-E670 IonicContact NZ-OE2 2.7Å; K653-E670 PolarHBondContact NZ-OE2 3.28Å; K653-M696 CarbonylContact O-C 3.48Å; K653-M696 VanDerWaalsContact O-CA 3.31Å; K653-M696 WeakPolarHBondContact O-CA 3.45Å; K653-I697 HydrophobicContact CB-CB 4.17Å; K653-I697 PolarHBondContact N-O 3.33Å; K653-I697 PolarHBondContact O-N 3.35Å
654	T	89.6	Confident	85.2	Confident	17 Å²	17	74 Å²	74	10%	0.104	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	152	178.3	62.1	0	0	0	0	110.8	G633 E634 I652 M696	G633-T654 VanDerWaalsContact CA-O 3.26Å; G633-T654 WeakPolarHBondContact CA-O 3.41Å; E634-T654 PolarHBondContact N-OG1 2.7Å; E634-T654 PolarHBondContact O-N 3.18Å; E634-T654 PolarHBondContact O-OG1 2.85Å; I652-T654 HydrophobicContact CG2-CG2 4.29Å; T654-M696 HydrophobicContact CG2-CG 4.23Å
655	L	85.1	Confident	85.4	Confident	7 Å²	7	75.2 Å²	75.2	4%	0.037	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-101.4	121.8	172.3	-172.9	62.5	0	0	0	110.4	F632 Y659 R664 F667 V695	F632-L655 HydrophobicContact CB-CD1 3.91Å; F632-L655 HydrophobicContact CD1-CD1 4.36Å; L655-Y659 HydrophobicContact CD2-CD1 3.41Å; L655-Y659 VanDerWaalsContact CD2-CD1 3.41Å; L655-Y659 HydrophobicContact CD2-CD2 4.28Å; L655-Y659 HydrophobicContact CD2-CE1 3.68Å; L655-Y659 HydrophobicContact CD2-CG 3.75Å; L655-Y659 HydrophobicContact CG-CD1 3.55Å; L655-Y659 HydrophobicContact CG-CE1 4.2Å; L655-Y659 HydrophobicContact CG-CG 3.99Å; L655-R664 HydrophobicContact CD2-CB 4.36Å; L655-R664 HydrophobicContact CD2-CG 4.2Å; L655-F667 HydrophobicContact CB-CD1 4.06Å; L655-F667 HydrophobicContact CB-CE1 3.76Å; L655-F667 HydrophobicContact CB-CE2 4.33Å; L655-F667 HydrophobicContact CB-CG 4.47Å; L655-F667 HydrophobicContact CB-CZ 3.89Å; L655-F667 HydrophobicContact CD1-CB 4.07Å; L655-F667 HydrophobicContact CD1-CD1 4.25Å; L655-F667 HydrophobicContact CD1-CD2 4.15Å; L655-F667 HydrophobicContact CD1-CG 3.93Å; L655-F667 HydrophobicContact CD2-CD1 4Å; L655-F667 HydrophobicContact CD2-CE1 4.43Å; L655-F667 HydrophobicContact CD2-CG 4.43Å; L655-F667 HydrophobicContact CG-CD1 4.33Å; L655-V695 HydrophobicContact CB-CB 4.14Å; L655-V695 HydrophobicContact CD2-CB 4.2Å; L655-V695 HydrophobicContact CD2-CG2 4.38Å; L655-V695 PolarHBondContact N-O 3.31Å
656	K	79.6	Confident	85	Confident	112 Å²	112	69.1 Å²	69.1	49%	0.487	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-56.8	145	-176.7	-68.8	176.9	-172.4	-178.9	0	112.7	F632 Y659	F632-K656 WeakPolarHBondContact O-CG 3.48Å; F632-K656 PolarHBondContact O-N 3.29Å; K656-Y659 VanDerWaalsContact O-CD1 3.31Å; K656-Y659 WeakPolarHBondContact O-CD1 3.43Å; K656-Y659 PolarHBondContact O-N 2.96Å
657	A	77.4	Confident	85	Confident	105 Å²	105	58.2 Å²	58.2	87%	0.868	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	144.5	167.9	0	0	0	0	0	111
658	G	76.4	Confident	84.9	Confident	80 Å²	80	53.3 Å²	53.3	83%	0.825	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	13.5	-177.4	0	0	0	0	0	115.5
659	Y	78.5	Confident	84.4	Confident	62 Å²	62	50.9 Å²	50.9	24%	0.243	28%	0.283	C	S	.	.			trans	-55.2	147.4	175	63.4	-109.3	0	0	0	112.9	L655 K656 R664	L655-Y659 HydrophobicContact CD2-CD1 3.41Å; L655-Y659 VanDerWaalsContact CD2-CD1 3.41Å; L655-Y659 HydrophobicContact CD2-CD2 4.28Å; L655-Y659 HydrophobicContact CD2-CE1 3.68Å; L655-Y659 HydrophobicContact CD2-CG 3.75Å; L655-Y659 HydrophobicContact CG-CD1 3.55Å; L655-Y659 HydrophobicContact CG-CE1 4.2Å; L655-Y659 HydrophobicContact CG-CG 3.99Å; K656-Y659 VanDerWaalsContact O-CD1 3.31Å; K656-Y659 WeakPolarHBondContact O-CD1 3.43Å; K656-Y659 PolarHBondContact O-N 2.96Å; Y659-R664 HydrophobicContact CD2-CB 3.77Å; Y659-R664 HydrophobicContact CD2-CG 4.33Å; Y659-R664 HydrophobicContact CE2-CB 3.77Å; Y659-R664 HydrophobicContact CE2-CG 3.88Å
660	T	80.6	Confident	84	Confident	76 Å²	76	48.6 Å²	48.6	47%	0.466	27%	0.267	S	S	.	.			trans	-79	156.3	165.6	61.4	0	0	0	0	111.3	K662 Q663 R664	T660-K662 PolarHBondContact O-N 3.29Å; T660-Q663 PolarHBondContact O-N 3.14Å; T660-Q663 WeakPolarHBondContact OG1-CG 3.22Å; T660-Q663 PolarHBondContact OG1-N 3.26Å; T660-Q663 PolarHBondContact OG1-OE1 2.55Å; T660-R664 PolarHBondContact O-N 3.36Å
661	D	78.1	Confident	83.7	Confident	109 Å²	109	48.6 Å²	48.6	58%	0.583	27%	0.267	S	S	*	.	H	α-helix	trans	-59.4	-28.8	174.5	-73.5	-52	0	0	0	113	R664 R665	D661-R664 PolarHBondContact O-N 2.86Å; D661-R665 WeakPolarHBondContact O-CG 3.28Å; D661-R665 PolarHBondContact O-N 3.01Å
662	K	76.9	Confident	83.3	Confident	118 Å²	118	48 Å²	48	51%	0.513	26%	0.262	S	S	.	.	H	α-helix	trans	-63.2	-52.6	171.2	-176	178.7	177.2	179.3	0	110.8	T660 R664 R665 D666	T660-K662 PolarHBondContact O-N 3.29Å; K662-R664 PolarHBondContact O-N 2.8Å; K662-R665 PolarHBondContact O-N 2.98Å; K662-D666 WeakPolarHBondContact O-CB 3.47Å; K662-D666 PolarHBondContact O-N 3.42Å; K662-D666 VanDerWaalsContact O-OD1 3.1Å
663	Q	78.9	Confident	83	Confident	79 Å²	79	48.1 Å²	48.1	37%	0.369	26%	0.262	S	S	.	.	H	α-helix	trans	-59.3	-35	177.2	-72.2	160.2	-54.9	0	0	112.1	F632 T660 F667	F632-Q663 HydrophobicContact CD1-CB 4.45Å; T660-Q663 PolarHBondContact O-N 3.14Å; T660-Q663 WeakPolarHBondContact OG1-CG 3.22Å; T660-Q663 PolarHBondContact OG1-N 3.26Å; T660-Q663 PolarHBondContact OG1-OE1 2.55Å; Q663-F667 WeakPolarHBondContact O-CB 3.44Å; Q663-F667 PolarHBondContact O-N 3.34Å
664	R	84.6	Confident	82.9	Confident	53 Å²	53	46.9 Å²	46.9	20%	0.2	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-45.8	172.6	-167.2	-169.7	-178.3	-117.5	-13.6	112.1	N606 L655 Y659 T660 D661 K662 L668	N606-R664 PolarHBondContact ND2-NH1 2.97Å; N606-R664 VanDerWaalsContact ND2-NH1 3.14Å; N606-R664 PolarHBondContact OD1-NH1 3.36Å; N606-R664 PolarHBondContact OD1-NH2 3.06Å; L655-R664 HydrophobicContact CD2-CB 4.36Å; L655-R664 HydrophobicContact CD2-CG 4.2Å; Y659-R664 HydrophobicContact CD2-CB 3.77Å; Y659-R664 HydrophobicContact CD2-CG 4.33Å; Y659-R664 HydrophobicContact CE2-CB 3.77Å; Y659-R664 HydrophobicContact CE2-CG 3.88Å; T660-R664 PolarHBondContact O-N 3.36Å; D661-R664 PolarHBondContact O-N 2.86Å; K662-R664 PolarHBondContact O-N 2.8Å; R664-L668 HydrophobicContact CG-CD1 4.17Å; R664-L668 WeakPolarHBondContact O-CB 3.39Å; R664-L668 VanDerWaalsContact O-CG 3.29Å; R664-L668 WeakPolarHBondContact O-CG 3.42Å; R664-L668 PolarHBondContact O-N 2.77Å
665	R	80.8	Confident	82.9	Confident	119 Å²	119	47.4 Å²	47.4	45%	0.449	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-47.9	178	-72.6	-168.2	-61.1	-91.5	5.8	111.4	P605 D661 K662 F667 L668 S669	P605-R665 HydrophobicContact CB-CG 4.48Å; P605-R665 HydrophobicContact CG-CB 4.16Å; P605-R665 HydrophobicContact CG-CG 3.81Å; D661-R665 WeakPolarHBondContact O-CG 3.28Å; D661-R665 PolarHBondContact O-N 3.01Å; K662-R665 PolarHBondContact O-N 2.98Å; R665-F667 PolarHBondContact O-N 2.94Å; R665-L668 PolarHBondContact O-N 3.45Å; R665-S669 WeakPolarHBondContact O-CB 3.35Å; R665-S669 PolarHBondContact O-N 2.91Å
666	D	78.9	Confident	83.2	Confident	20 Å²	20	48.5 Å²	48.5	11%	0.107	27%	0.271	C	S	.	.	H	α-helix	trans	-59.2	-46.7	179.1	-67.8	22.8	0	0	0	110.3	F632 K662 S669 E670 R769	F632-D666 HydrophobicContact CE1-CB 3.87Å; F632-D666 HydrophobicContact CZ-CB 3.9Å; K662-D666 WeakPolarHBondContact O-CB 3.47Å; K662-D666 PolarHBondContact O-N 3.42Å; K662-D666 VanDerWaalsContact O-OD1 3.1Å; D666-S669 PolarHBondContact O-N 3.2Å; D666-S669 PolarHBondContact O-OG 3.11Å; D666-E670 PolarHBondContact O-N 3.35Å; D666-R769 IonicContact OD2-CZ 3.52Å; D666-R769 IonicContact OD2-NE 3.51Å; D666-R769 IonicContact OD2-NH2 3.58Å; D666-R769 PolarHBondContact OD2-NH2 3.23Å
667	F	85.5	Confident	83.8	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-46.7	174.6	-176.9	-105.4	0	0	0	113.3	F632 K653 L655 Q663 R665 S669 E670 V695 I697	F632-F667 HydrophobicContact CB-CD2 3.46Å; F632-F667 VanDerWaalsContact CB-CD2 3.46Å; F632-F667 HydrophobicContact CB-CE2 3.93Å; F632-F667 HydrophobicContact CB-CG 4.37Å; F632-F667 HydrophobicContact CD1-CB 3.97Å; F632-F667 HydrophobicContact CD1-CD2 4.32Å; F632-F667 AromaticContact CD2-CD2 3.84Å; F632-F667 HydrophobicContact CD2-CD2 3.84Å; F632-F667 HydrophobicContact CE1-CB 4.28Å; F632-F667 HydrophobicContact CG-CB 4.1Å; F632-F667 AromaticContact CG-CD2 3.62Å; F632-F667 HydrophobicContact CG-CD2 3.62Å; F632-F667 HydrophobicContact CG-CG 4.33Å; K653-F667 HydrophobicContact CB-CE2 4.28Å; K653-F667 HydrophobicContact CD-CE2 4.02Å; K653-F667 HydrophobicContact CG-CE2 4Å; L655-F667 HydrophobicContact CB-CD1 4.06Å; L655-F667 HydrophobicContact CB-CE1 3.76Å; L655-F667 HydrophobicContact CB-CE2 4.33Å; L655-F667 HydrophobicContact CB-CG 4.47Å; L655-F667 HydrophobicContact CB-CZ 3.89Å; L655-F667 HydrophobicContact CD1-CB 4.07Å; L655-F667 HydrophobicContact CD1-CD1 4.25Å; L655-F667 HydrophobicContact CD1-CD2 4.15Å; L655-F667 HydrophobicContact CD1-CG 3.93Å; L655-F667 HydrophobicContact CD2-CD1 4Å; L655-F667 HydrophobicContact CD2-CE1 4.43Å; L655-F667 HydrophobicContact CD2-CG 4.43Å; L655-F667 HydrophobicContact CG-CD1 4.33Å; Q663-F667 WeakPolarHBondContact O-CB 3.44Å; Q663-F667 PolarHBondContact O-N 3.34Å; R665-F667 PolarHBondContact O-N 2.94Å; F667-S669 VanDerWaalsContact C-N 3.31Å; F667-S669 PolarHBondContact O-N 3.09Å; F667-E670 WeakPolarHBondContact O-CB 3.44Å; F667-E670 PolarHBondContact O-N 3.5Å; F667-V695 HydrophobicContact CD1-CG1 4.33Å; F667-V695 HydrophobicContact CE1-CB 4.3Å; F667-V695 HydrophobicContact CE1-CG1 3.93Å; F667-I697 HydrophobicContact CD1-CD1 3.95Å; F667-I697 HydrophobicContact CD1-CG1 4.25Å; F667-I697 HydrophobicContact CD2-CD1 3.78Å; F667-I697 HydrophobicContact CE1-CD1 3.77Å; F667-I697 HydrophobicContact CE1-CG1 3.66Å; F667-I697 HydrophobicContact CE2-CD1 3.63Å; F667-I697 HydrophobicContact CE2-CG1 4.13Å; F667-I697 HydrophobicContact CG-CD1 3.98Å; F667-I697 HydrophobicContact CZ-CB 4.46Å; F667-I697 HydrophobicContact CZ-CD1 3.63Å; F667-I697 HydrophobicContact CZ-CG1 3.61Å; F667-I697 WeakPolarHBondContact O-CD1 3.44Å
668	L	87.3	Confident	84.5	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-70.6	-25.8	178.3	-71.2	-179.2	0	0	0	113	V609 R664 R665 S672 T690 V695	V609-L668 HydrophobicContact CG2-CB 3.8Å; V609-L668 HydrophobicContact CG2-CD2 4.12Å; V609-L668 HydrophobicContact CG2-CG 4.37Å; V609-L668 WeakPolarHBondContact CG2-O 3.49Å; R664-L668 HydrophobicContact CG-CD1 4.17Å; R664-L668 WeakPolarHBondContact O-CB 3.39Å; R664-L668 VanDerWaalsContact O-CG 3.29Å; R664-L668 WeakPolarHBondContact O-CG 3.42Å; R664-L668 PolarHBondContact O-N 2.77Å; R665-L668 PolarHBondContact O-N 3.45Å; L668-S672 PolarHBondContact O-N 2.75Å; L668-S672 PolarHBondContact O-OG 2.98Å; L668-T690 HydrophobicContact CD2-CG2 4.01Å; L668-V695 HydrophobicContact CD2-CG1 4Å
669	S	82.6	Confident	85.4	Confident	8 Å²	8	42.4 Å²	42.4	6%	0.056	21%	0.209	C	C	.	.	H	α-helix	trans	-67.1	-39.5	173.5	78.4	0	0	0	0	111.4	F600 R665 D666 F667 A671 S672 I673	F600-S669 WeakPolarHBondContact CZ-OG 3.45Å; R665-S669 WeakPolarHBondContact O-CB 3.35Å; R665-S669 PolarHBondContact O-N 2.91Å; D666-S669 PolarHBondContact O-N 3.2Å; D666-S669 PolarHBondContact O-OG 3.11Å; F667-S669 VanDerWaalsContact C-N 3.31Å; F667-S669 PolarHBondContact O-N 3.09Å; S669-A671 VanDerWaalsContact C-N 3.33Å; S669-A671 PolarHBondContact O-N 2.86Å; S669-S672 CarbonylContact O-C 3.58Å; S669-S672 WeakPolarHBondContact O-CA 3.34Å; S669-S672 WeakPolarHBondContact O-CB 3.38Å; S669-S672 PolarHBondContact O-N 2.89Å; S669-I673 WeakPolarHBondContact O-CG1 3.48Å; S669-I673 PolarHBondContact O-N 3Å
670	E	85.6	Confident	86.2	Confident	10 Å²	10	43.6 Å²	43.6	5%	0.047	22%	0.224	C	C	.	.	H	α-helix	trans	-56.9	-45.6	176.3	-163.2	-166.5	143.8	0	0	111.4	K653 D666 F667 I673 M674	K653-E670 IonicContact NZ-OE1 2.9Å; K653-E670 PolarHBondContact NZ-OE1 2.93Å; K653-E670 IonicContact NZ-OE2 2.7Å; K653-E670 PolarHBondContact NZ-OE2 3.28Å; D666-E670 PolarHBondContact O-N 3.35Å; F667-E670 WeakPolarHBondContact O-CB 3.44Å; F667-E670 PolarHBondContact O-N 3.5Å; E670-I673 PolarHBondContact O-N 3.36Å; E670-M674 HydrophobicContact CG-CE 4.11Å; E670-M674 WeakPolarHBondContact O-CG 3.49Å; E670-M674 PolarHBondContact O-N 2.9Å
671	A	89.6	Confident	87	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.8	-36.9	173.8	0	0	0	0	0	113	S669 I673 M674 G675 L685 V688 I697	S669-A671 VanDerWaalsContact C-N 3.33Å; S669-A671 PolarHBondContact O-N 2.86Å; A671-I673 VanDerWaalsContact C-N 3.27Å; A671-I673 PolarHBondContact O-N 3.18Å; A671-M674 PolarHBondContact O-N 3.45Å; A671-G675 PolarHBondContact O-N 3Å; A671-L685 HydrophobicContact CB-CD2 4.44Å; A671-L685 WeakPolarHBondContact O-CD2 3.49Å; A671-V688 HydrophobicContact CB-CG1 3.67Å; A671-I697 HydrophobicContact CB-CD1 4.05Å; A671-I697 HydrophobicContact CB-CG1 4.06Å; A671-I697 HydrophobicContact CB-CG2 4.1Å
672	S	87.8	Confident	87.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.2	-24.7	178.1	-55.2	0	0	0	0	113.1	V609 L668 S669 Q676	V609-S672 VanDerWaalsContact CG2-OG 3.22Å; V609-S672 WeakPolarHBondContact CG2-OG 3.32Å; V609-S672 PolarHBondContact N-OG 2.93Å; L668-S672 PolarHBondContact O-N 2.75Å; L668-S672 PolarHBondContact O-OG 2.98Å; S669-S672 CarbonylContact O-C 3.58Å; S669-S672 WeakPolarHBondContact O-CA 3.34Å; S669-S672 WeakPolarHBondContact O-CB 3.38Å; S669-S672 PolarHBondContact O-N 2.89Å; S672-Q676 PolarHBondContact O-NE2 3.43Å; S672-Q676 VanDerWaalsContact O-NE2 3.08Å
673	I	87.1	Confident	88.8	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-77.1	-53.4	170.9	-65	160.4	0	0	0	109.6	Y596 P599 S669 E670 A671 G675 Q676 F677 Y742 F765 S768	Y596-I673 HydrophobicContact CE2-CG1 4.3Å; Y596-I673 HydrophobicContact CE2-CG2 4.21Å; P599-I673 HydrophobicContact CG-CG1 4Å; S669-I673 WeakPolarHBondContact O-CG1 3.48Å; S669-I673 PolarHBondContact O-N 3Å; E670-I673 PolarHBondContact O-N 3.36Å; A671-I673 VanDerWaalsContact C-N 3.27Å; A671-I673 PolarHBondContact O-N 3.18Å; I673-G675 VanDerWaalsContact C-N 3.26Å; I673-G675 PolarHBondContact O-N 3.37Å; I673-Q676 PolarHBondContact O-N 3.46Å; I673-Q676 VanDerWaalsContact O-N 3.08Å; I673-F677 HydrophobicContact CG2-CD2 4.39Å; I673-F677 HydrophobicContact CG2-CE2 3.55Å; I673-F677 HydrophobicContact CG2-CZ 4.11Å; I673-Y742 HydrophobicContact CG2-CE2 3.9Å; I673-F765 HydrophobicContact CB-CB 4.35Å; I673-F765 HydrophobicContact CD1-CB 4.31Å; I673-F765 HydrophobicContact CG2-CB 3.82Å; I673-F765 HydrophobicContact CG2-CD1 4.06Å; I673-F765 HydrophobicContact CG2-CG 3.88Å; I673-S768 WeakPolarHBondContact CD1-OG 3.27Å
674	M	90.4	Very high	89.6	Confident	6 Å²	6	30 Å²	30	3%	0.03	16%	0.155	C	C	.	.	H	α-helix	trans	-58.5	-36.7	-178.9	-71.3	-173.2	-69.9	0	0	113	E670 A671 Q676 F677 I683 L685 I697 T699 F765	E670-M674 HydrophobicContact CG-CE 4.11Å; E670-M674 WeakPolarHBondContact O-CG 3.49Å; E670-M674 PolarHBondContact O-N 2.9Å; A671-M674 PolarHBondContact O-N 3.45Å; M674-Q676 PolarHBondContact O-N 3.07Å; M674-F677 PolarHBondContact O-N 3.25Å; M674-F677 VanDerWaalsContact O-N 3.12Å; M674-I683 HydrophobicContact SD-CG2 3.93Å; M674-L685 HydrophobicContact CB-CB 4.09Å; M674-L685 HydrophobicContact CB-CD2 4.42Å; M674-L685 HydrophobicContact CE-CD1 4.44Å; M674-I697 HydrophobicContact CE-CG2 3.78Å; M674-T699 HydrophobicContact CE-CG2 4.34Å; M674-T699 HydrophobicContact SD-CG2 4.19Å; M674-F765 HydrophobicContact CG-CD2 3.41Å; M674-F765 VanDerWaalsContact CG-CD2 3.41Å; M674-F765 HydrophobicContact CG-CE2 3.65Å; M674-F765 HydrophobicContact CG-CG 4.5Å; M674-F765 HydrophobicContact SD-CD2 4.13Å; M674-F765 HydrophobicContact SD-CE2 4.34Å
675	G	90.1	Very high	90.1	Very high	29 Å²	29	28.3 Å²	28.3	30%	0.299	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.3	178.1	0	0	0	0	0	115.4	F612 A671 I673	F612-G675 CarbonylContact O-C 3.59Å; F612-G675 VanDerWaalsContact O-CA 3.24Å; F612-G675 WeakPolarHBondContact O-CA 3.49Å; A671-G675 PolarHBondContact O-N 3Å; I673-G675 VanDerWaalsContact C-N 3.26Å; I673-G675 PolarHBondContact O-N 3.37Å
676	Q	90.4	Very high	90.7	Very high	29 Å²	29	24.2 Å²	24.2	14%	0.136	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86	-9.6	175.3	-67.1	178.6	61.8	0	0	113.6	V597 F612 S672 I673 M674	V597-Q676 PolarHBondContact O-NE2 3.42Å; V597-Q676 PolarHBondContact O-OE1 2.86Å; F612-Q676 HydrophobicContact CB-CG 4.1Å; F612-Q676 HydrophobicContact CD1-CG 3.59Å; F612-Q676 HydrophobicContact CD2-CG 4.2Å; F612-Q676 HydrophobicContact CE1-CG 4.05Å; F612-Q676 HydrophobicContact CG-CG 3.69Å; S672-Q676 PolarHBondContact O-NE2 3.43Å; S672-Q676 VanDerWaalsContact O-NE2 3.08Å; I673-Q676 PolarHBondContact O-N 3.46Å; I673-Q676 VanDerWaalsContact O-N 3.08Å; M674-Q676 PolarHBondContact O-N 3.07Å
677	F	92.1	Very high	91.4	Very high	7 Å²	7	23.2 Å²	23.2	3%	0.031	13%	0.13	C	C	.	.			trans	-112.3	129.6	-170.7	-58.3	-35.7	0	0	0	112.9	Y596 I673 M674 I682 Y736 L737 M740 Y742 F765	Y596-F677 HydrophobicContact CD2-CE1 4.04Å; Y596-F677 AromaticContact CD2-CZ 3.83Å; Y596-F677 HydrophobicContact CD2-CZ 3.83Å; Y596-F677 HydrophobicContact CE2-CZ 4.25Å; I673-F677 HydrophobicContact CG2-CD2 4.39Å; I673-F677 HydrophobicContact CG2-CE2 3.55Å; I673-F677 HydrophobicContact CG2-CZ 4.11Å; M674-F677 PolarHBondContact O-N 3.25Å; M674-F677 VanDerWaalsContact O-N 3.12Å; F677-I682 HydrophobicContact CB-CG2 3.98Å; F677-I682 HydrophobicContact CD2-CG2 4.38Å; F677-Y736 HydrophobicContact CB-CE1 3.96Å; F677-Y736 AromaticContact CD1-CE1 3.93Å; F677-Y736 HydrophobicContact CD1-CE1 3.93Å; F677-Y736 HydrophobicContact CG-CE1 4.2Å; F677-L737 HydrophobicContact CD1-CD2 4.05Å; F677-L737 HydrophobicContact CD2-CD2 3.74Å; F677-L737 HydrophobicContact CE1-CD2 3.88Å; F677-L737 HydrophobicContact CE2-CD2 3.53Å; F677-L737 HydrophobicContact CG-CD2 4Å; F677-L737 HydrophobicContact CZ-CD2 3.63Å; F677-M740 HydrophobicContact CD1-CE 4.37Å; F677-M740 HydrophobicContact CE1-CB 4.43Å; F677-M740 HydrophobicContact CE1-CE 4.46Å; F677-Y742 HydrophobicContact CE2-CD1 4.36Å; F677-Y742 HydrophobicContact CE2-CD2 4.49Å; F677-Y742 HydrophobicContact CE2-CE1 4.49Å; F677-Y742 HydrophobicContact CE2-CG 4.35Å; F677-Y742 HydrophobicContact CZ-CD1 4.07Å; F677-Y742 AromaticContact CZ-CD2 3.78Å; F677-Y742 HydrophobicContact CZ-CD2 3.78Å; F677-Y742 HydrophobicContact CZ-CE2 4.28Å; F677-Y742 AromaticContact CZ-CG 3.65Å; F677-Y742 HydrophobicContact CZ-CG 3.65Å; F677-F765 HydrophobicContact CD2-CE1 4.25Å; F677-F765 HydrophobicContact CD2-CZ 4.13Å; F677-F765 HydrophobicContact CE2-CD1 4.29Å; F677-F765 AromaticContact CE2-CE1 3.94Å; F677-F765 HydrophobicContact CE2-CE1 3.94Å; F677-F765 HydrophobicContact CE2-CZ 4.28Å
678	D	92.4	Very high	91.9	Very high	126 Å²	126	23.2 Å²	23.2	67%	0.674	13%	0.13	S	C	*	.			trans	-136.8	99.6	174.1	-175.9	18.9	0	0	0	109.7	Y736	D678-Y736 PolarHBondContact N-OH 3.17Å
679	H	95.8	Very high	92.2	Very high	36 Å²	36	23.2 Å²	23.2	17%	0.167	13%	0.13	C	C	.	.			trans	-159.9	138.4	180	177.1	-91.9	0	0	0	110.3	N681 I682 S732 Y736	H679-N681 PolarHBondContact ND1-N 2.92Å; H679-N681 VanDerWaalsContact ND1-N 3.16Å; H679-N681 PolarHBondContact O-N 3.19Å; H679-I682 HydrophobicContact CB-CB 4.44Å; H679-I682 HydrophobicContact CB-CG1 3.93Å; H679-I682 PolarHBondContact O-N 2.88Å; H679-S732 VanDerWaalsContact CE1-C 3.43Å; H679-S732 PolarHBondContact CE1-O 3.24Å; H679-S732 PolarHBondContact NE2-OG 3.13Å; H679-Y736 HydrophobicContact CB-CD1 3.71Å; H679-Y736 HydrophobicContact CB-CD2 3.89Å; H679-Y736 HydrophobicContact CB-CE1 3.95Å; H679-Y736 HydrophobicContact CB-CE2 4.12Å; H679-Y736 HydrophobicContact CB-CG 3.67Å; H679-Y736 AromaticContact CD2-CG 3.98Å; H679-Y736 AromaticContact CG-CG 3.78Å
680	P	95.7	Very high	92.6	Very high	88 Å²	88	24.6 Å²	24.6	57%	0.571	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.7	-172.6	24.2	-36.6	0	0	0	116.4	K761	P680-K761 WeakPolarHBondContact O-CE 3.41Å
681	N	97.6	Very high	92.6	Very high	17 Å²	17	32.6 Å²	32.6	9%	0.091	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	18.3	172.3	-58.5	106	0	0	0	113.9	H679 G729 C760 K761 V762	H679-N681 PolarHBondContact ND1-N 2.92Å; H679-N681 VanDerWaalsContact ND1-N 3.16Å; H679-N681 PolarHBondContact O-N 3.19Å; N681-G729 WeakPolarHBondContact CB-O 3.29Å; N681-G729 WeakPolarHBondContact ND2-CA 3.32Å; N681-G729 PolarHBondContact OD1-O 2.59Å; N681-C760 PolarHBondContact ND2-O 2.86Å; N681-K761 WeakPolarHBondContact O-CA 3.38Å; N681-V762 PolarHBondContact O-N 3.31Å
682	I	96.4	Very high	92.2	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.015	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-112.8	146.2	166.3	-56.1	-58.9	0	0	0	107.7	F677 H679 H684 Y736 L737 K761 V762 F765	F677-I682 HydrophobicContact CB-CG2 3.98Å; F677-I682 HydrophobicContact CD2-CG2 4.38Å; H679-I682 HydrophobicContact CB-CB 4.44Å; H679-I682 HydrophobicContact CB-CG1 3.93Å; H679-I682 PolarHBondContact O-N 2.88Å; I682-H684 PolarHBondContact O-N 3.08Å; I682-Y736 HydrophobicContact CG1-CD1 3.97Å; I682-Y736 HydrophobicContact CG1-CE1 4.44Å; I682-L737 HydrophobicContact CD1-CD1 3.86Å; I682-L737 HydrophobicContact CD1-CD2 4.14Å; I682-L737 HydrophobicContact CD1-CG 3.79Å; I682-K761 WeakPolarHBondContact O-CD 3.19Å; I682-V762 HydrophobicContact CD1-CB 3.81Å; I682-V762 HydrophobicContact CD1-CG2 4.13Å; I682-F765 HydrophobicContact CG2-CZ 3.99Å
683	I	95.6	Very high	92	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.021	23%	0.225	C	C	.	.			trans	-66.3	128.2	175.7	-165.9	70.6	0	0	0	110.6	M674 T699 E700 M702 L753 K761 V762 F765	M674-I683 HydrophobicContact SD-CG2 3.93Å; I683-T699 HydrophobicContact CG1-CG2 4.42Å; I683-E700 HydrophobicContact CD1-CG 3.53Å; I683-E700 HydrophobicContact CG1-CG 4.4Å; I683-M702 HydrophobicContact CD1-CG 3.65Å; I683-M702 HydrophobicContact CD1-SD 4.14Å; I683-L753 HydrophobicContact CD1-CD1 3.92Å; I683-L753 HydrophobicContact CG1-CD1 4.4Å; I683-K761 HydrophobicContact CD1-CD 4.49Å; I683-V762 WeakPolarHBondContact CG2-O 3.32Å; I683-V762 PolarHBondContact N-O 3.12Å; I683-F765 HydrophobicContact CG2-CE2 4Å
684	H	94.6	Very high	92	Very high	73 Å²	73	46 Å²	46	34%	0.338	24%	0.243	S	C	.	.			trans	-89.9	134	-175	-171.7	66.8	0	0	0	112.2	I682 E686 T699 E700	I682-H684 PolarHBondContact O-N 3.08Å; H684-E686 IonicContact CD2-OE1 2.59Å; H684-T699 WeakPolarHBondContact O-CA 3.17Å; H684-T699 VanDerWaalsContact O-CB 3.26Å; H684-T699 WeakPolarHBondContact O-CB 3.45Å; H684-E700 VanDerWaalsContact CB-OE1 3.31Å; H684-E700 WeakPolarHBondContact CB-OE1 3.39Å; H684-E700 PolarHBondContact N-OE1 2.77Å; H684-E700 PolarHBondContact O-N 2.86Å; H684-E700 VanDerWaalsContact O-N 3.08Å
685	L	95.3	Very high	92	Very high	17 Å²	17	45.9 Å²	45.9	9%	0.089	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	108.4	173.2	-178.8	72.1	0	0	0	110.4	A613 A671 M674 G687 I697 T699	A613-L685 HydrophobicContact CB-CD2 3.78Å; A671-L685 HydrophobicContact CB-CD2 4.44Å; A671-L685 WeakPolarHBondContact O-CD2 3.49Å; M674-L685 HydrophobicContact CB-CB 4.09Å; M674-L685 HydrophobicContact CB-CD2 4.42Å; M674-L685 HydrophobicContact CE-CD1 4.44Å; L685-G687 VanDerWaalsContact C-N 3.32Å; L685-G687 WeakPolarHBondContact CD1-O 3.44Å; L685-I697 HydrophobicContact CD1-CG2 3.49Å; L685-I697 VanDerWaalsContact CD1-CG2 3.49Å; L685-T699 HydrophobicContact CD1-CG2 4.45Å
686	E	94.6	Very high	92.1	Very high	32 Å²	32	45 Å²	45	15%	0.15	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	-30.2	172.5	-75.6	-72.3	163.2	0	0	112	L640 I648 V650 H684 I698	L640-E686 HydrophobicContact CD2-CB 3.82Å; L640-E686 HydrophobicContact CD2-CG 4.2Å; I648-E686 VanDerWaalsContact CD1-CD 3.46Å; I648-E686 HydrophobicContact CD1-CG 4.06Å; I648-E686 VanDerWaalsContact CD1-OE1 3.3Å; I648-E686 WeakPolarHBondContact CD1-OE1 3.45Å; V650-E686 HydrophobicContact CG1-CG 4.28Å; H684-E686 IonicContact CD2-OE1 2.59Å; E686-I698 HydrophobicContact CB-CG2 4.19Å; E686-I698 PolarHBondContact N-O 3.37Å
687	G	93.6	Very high	92.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.6	-165.3	172.5	0	0	0	0	0	114.7	K614 L685 I698	K614-G687 CarbonylContact O-C 3.56Å; K614-G687 WeakPolarHBondContact O-CA 3.35Å; L685-G687 VanDerWaalsContact C-N 3.32Å; L685-G687 WeakPolarHBondContact CD1-O 3.44Å; G687-I698 PolarHBondContact N-O 2.88Å; G687-I698 PolarHBondContact O-N 2.96Å
688	V	94.9	Very high	92.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	160	-178.8	-67.4	0	0	0	0	111.1	V609 A613 K614 E615 I616 A671 T690 M696 I697	V609-V688 HydrophobicContact CG1-CG2 3.79Å; A613-V688 HydrophobicContact CB-CG1 4.11Å; A613-V688 HydrophobicContact CB-CG2 4.07Å; K614-V688 PolarHBondContact O-N 2.89Å; E615-V688 CarbonylContact C-O 3.54Å; E615-V688 WeakPolarHBondContact CA-O 3.36Å; I616-V688 PolarHBondContact N-O 3.22Å; A671-V688 HydrophobicContact CB-CG1 3.67Å; V688-T690 HydrophobicContact CB-CG2 4.26Å; V688-T690 HydrophobicContact CG2-CG2 4.02Å; V688-M696 CarbonylContact C-O 3.52Å; V688-M696 VanDerWaalsContact CA-O 3.31Å; V688-M696 WeakPolarHBondContact CA-O 3.36Å; V688-I697 HydrophobicContact CG1-CG1 4.48Å
689	V	93.5	Very high	92.6	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.3	164.5	-179.9	0	0	0	0	107.7	I616 A618 I621 C692 V695 M696 I698	I616-V689 HydrophobicContact CB-CG2 4.32Å; A618-V689 HydrophobicContact CB-CG1 4.28Å; I621-V689 HydrophobicContact CD1-CG2 3.53Å; V689-C692 WeakPolarHBondContact CG1-SG 3.37Å; V689-V695 WeakPolarHBondContact O-CA 3.29Å; V689-V695 VanDerWaalsContact O-CG1 3.32Å; V689-V695 WeakPolarHBondContact O-CG1 3.37Å; V689-M696 HydrophobicContact CB-CB 4.15Å; V689-M696 HydrophobicContact CB-CE 4.02Å; V689-M696 HydrophobicContact CG1-CE 4.07Å; V689-M696 HydrophobicContact CG2-CB 4.43Å; V689-M696 HydrophobicContact CG2-CE 4.05Å; V689-M696 PolarHBondContact N-O 2.76Å; V689-M696 PolarHBondContact O-N 2.91Å; V689-I698 HydrophobicContact CG2-CD1 3.94Å
690	T	91	Very high	92.5	Very high	37 Å²	37	38.5 Å²	38.5	23%	0.227	20%	0.198	C	C	.	.			trans	-120.3	-19.6	-178.6	66.8	0	0	0	0	113.5	V609 E615 L668 V688 C692 V695	V609-T690 HydrophobicContact CG1-CG2 4.11Å; E615-T690 VanDerWaalsContact CD-OG1 3.31Å; E615-T690 PolarHBondContact OE1-N 3.16Å; E615-T690 PolarHBondContact OE1-OG1 2.94Å; E615-T690 WeakPolarHBondContact OE2-CB 3.16Å; E615-T690 PolarHBondContact OE2-N 2.9Å; E615-T690 VanDerWaalsContact OE2-N 3.12Å; E615-T690 PolarHBondContact OE2-OG1 3.01Å; L668-T690 HydrophobicContact CD2-CG2 4.01Å; V688-T690 HydrophobicContact CB-CG2 4.26Å; V688-T690 HydrophobicContact CG2-CG2 4.02Å; T690-C692 PolarHBondContact O-N 3.22Å; T690-V695 HydrophobicContact CG2-CG1 4.45Å
691	K	86.1	Confident	92.5	Very high	179 Å²	179	37.6 Å²	37.6	78%	0.778	18%	0.184	S	C	*	.	S	Bend	trans	-75.4	-14.7	-178.2	-72.1	165.4	-177.7	167.4	0	115.5	E615	E615-K691 HydrophobicContact CG-CD 3.92Å; E615-K691 HydrophobicContact CG-CG 4.47Å; E615-K691 WeakPolarHBondContact OE1-CB 3.4Å; E615-K691 WeakPolarHBondContact OE1-CD 3.24Å; E615-K691 VanDerWaalsContact OE1-CG 3.26Å; E615-K691 WeakPolarHBondContact OE1-CG 3.44Å; E615-K691 PolarHBondContact OE1-N 3.44Å
692	C	82.1	Confident	92.3	Very high	53 Å²	53	37.4 Å²	37.4	36%	0.358	18%	0.182	S	C	.	.	S	Bend	trans	-137.2	179.6	177.4	67.2	0	0	0	0	111.7	V689 T690	V689-C692 WeakPolarHBondContact CG1-SG 3.37Å; T690-C692 PolarHBondContact O-N 3.22Å
693	K	81.7	Confident	92.2	Very high	168 Å²	168	41.5 Å²	41.5	73%	0.73	20%	0.201	S	C	*	.	S	Bend	trans	-112.6	142	175.8	-68.3	-175	178.5	-178.7	0	110
694	P	88.1	Confident	92.1	Very high	60 Å²	60	44 Å²	44	39%	0.39	22%	0.215	S	C	.	.	S	Bend	cis	-67.3	154.1	-5	30.6	-36	0	0	0	112.3	M696	P694-M696 HydrophobicContact CG-CE 4.48Å; P694-M696 HydrophobicContact CG-CG 4.32Å; P694-M696 HydrophobicContact CG-SD 4.41Å
695	V	90.4	Very high	92	Very high	4 Å²	4	42 Å²	42	2%	0.024	21%	0.213	C	C	.	.			trans	-73.2	136.5	169.4	-173.1	0	0	0	0	107.4	L655 F667 L668 V689 T690	L655-V695 HydrophobicContact CB-CB 4.14Å; L655-V695 HydrophobicContact CD2-CB 4.2Å; L655-V695 HydrophobicContact CD2-CG2 4.38Å; L655-V695 PolarHBondContact N-O 3.31Å; F667-V695 HydrophobicContact CD1-CG1 4.33Å; F667-V695 HydrophobicContact CE1-CB 4.3Å; F667-V695 HydrophobicContact CE1-CG1 3.93Å; L668-V695 HydrophobicContact CD2-CG1 4Å; V689-V695 WeakPolarHBondContact O-CA 3.29Å; V689-V695 VanDerWaalsContact O-CG1 3.32Å; V689-V695 WeakPolarHBondContact O-CG1 3.37Å; T690-V695 HydrophobicContact CG2-CG1 4.45Å
696	M	93.3	Very high	92	Very high	12 Å²	12	42.7 Å²	42.7	6%	0.059	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	146.7	-173.3	-64	177.5	-87.5	0	0	112.7	I623 I652 K653 T654 V688 V689 P694 I698	I623-M696 HydrophobicContact CD1-SD 4.47Å; I652-M696 HydrophobicContact CG2-CB 4.19Å; I652-M696 HydrophobicContact CG2-CG 4.09Å; I652-M696 HydrophobicContact CG2-SD 3.76Å; K653-M696 CarbonylContact O-C 3.48Å; K653-M696 VanDerWaalsContact O-CA 3.31Å; K653-M696 WeakPolarHBondContact O-CA 3.45Å; T654-M696 HydrophobicContact CG2-CG 4.23Å; V688-M696 CarbonylContact C-O 3.52Å; V688-M696 VanDerWaalsContact CA-O 3.31Å; V688-M696 WeakPolarHBondContact CA-O 3.36Å; V689-M696 HydrophobicContact CB-CB 4.15Å; V689-M696 HydrophobicContact CB-CE 4.02Å; V689-M696 HydrophobicContact CG1-CE 4.07Å; V689-M696 HydrophobicContact CG2-CB 4.43Å; V689-M696 HydrophobicContact CG2-CE 4.05Å; V689-M696 PolarHBondContact N-O 2.76Å; V689-M696 PolarHBondContact O-N 2.91Å; P694-M696 HydrophobicContact CG-CE 4.48Å; P694-M696 HydrophobicContact CG-CG 4.32Å; P694-M696 HydrophobicContact CG-SD 4.41Å; M696-I698 HydrophobicContact CB-CD1 3.94Å
697	I	93.4	Very high	92.1	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.8	168.3	-54.4	169.8	0	0	0	106.8	I652 K653 F667 A671 M674 L685 V688	I652-I697 WeakPolarHBondContact CA-O 3.42Å; K653-I697 HydrophobicContact CB-CB 4.17Å; K653-I697 PolarHBondContact N-O 3.33Å; K653-I697 PolarHBondContact O-N 3.35Å; F667-I697 HydrophobicContact CD1-CD1 3.95Å; F667-I697 HydrophobicContact CD1-CG1 4.25Å; F667-I697 HydrophobicContact CD2-CD1 3.78Å; F667-I697 HydrophobicContact CE1-CD1 3.77Å; F667-I697 HydrophobicContact CE1-CG1 3.66Å; F667-I697 HydrophobicContact CE2-CD1 3.63Å; F667-I697 HydrophobicContact CE2-CG1 4.13Å; F667-I697 HydrophobicContact CG-CD1 3.98Å; F667-I697 HydrophobicContact CZ-CB 4.46Å; F667-I697 HydrophobicContact CZ-CD1 3.63Å; F667-I697 HydrophobicContact CZ-CG1 3.61Å; F667-I697 WeakPolarHBondContact O-CD1 3.44Å; A671-I697 HydrophobicContact CB-CD1 4.05Å; A671-I697 HydrophobicContact CB-CG1 4.06Å; A671-I697 HydrophobicContact CB-CG2 4.1Å; M674-I697 HydrophobicContact CE-CG2 3.78Å; L685-I697 HydrophobicContact CD1-CG2 3.49Å; L685-I697 VanDerWaalsContact CD1-CG2 3.49Å; V688-I697 HydrophobicContact CG1-CG1 4.48Å
698	I	94.8	Very high	92.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	111.4	-172.8	-57.7	88.1	0	0	0	108.6	I616 I621 L640 V650 A651 I652 E686 G687 V689 M696	I616-I698 HydrophobicContact CD1-CB 4.39Å; I616-I698 HydrophobicContact CD1-CD1 4.44Å; I621-I698 HydrophobicContact CD1-CD1 3.8Å; I621-I698 HydrophobicContact CD1-CG1 3.86Å; L640-I698 HydrophobicContact CD2-CG2 4.39Å; V650-I698 HydrophobicContact CB-CG2 3.6Å; V650-I698 HydrophobicContact CG1-CG2 3.71Å; V650-I698 HydrophobicContact CG2-CG2 3.86Å; A651-I698 WeakPolarHBondContact O-CA 3.46Å; I652-I698 HydrophobicContact CG1-CG1 4.48Å; E686-I698 HydrophobicContact CB-CG2 4.19Å; E686-I698 PolarHBondContact N-O 3.37Å; G687-I698 PolarHBondContact N-O 2.88Å; G687-I698 PolarHBondContact O-N 2.96Å; V689-I698 HydrophobicContact CG2-CD1 3.94Å; M696-I698 HydrophobicContact CB-CD1 3.94Å
699	T	95.3	Very high	92.1	Very high	20 Å²	20	44.4 Å²	44.4	12%	0.123	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	169.2	174.8	66.5	0	0	0	0	110.6	V650 A651 M674 I683 H684 L685	V650-T699 CarbonylContact C-O 3.55Å; V650-T699 VanDerWaalsContact CA-O 3.31Å; V650-T699 WeakPolarHBondContact CA-O 3.45Å; V650-T699 VanDerWaalsContact CB-O 3.31Å; V650-T699 WeakPolarHBondContact CB-O 3.26Å; A651-T699 PolarHBondContact N-O 3.26Å; A651-T699 PolarHBondContact O-N 3.05Å; M674-T699 HydrophobicContact CE-CG2 4.34Å; M674-T699 HydrophobicContact SD-CG2 4.19Å; I683-T699 HydrophobicContact CG1-CG2 4.42Å; H684-T699 WeakPolarHBondContact O-CA 3.17Å; H684-T699 VanDerWaalsContact O-CB 3.26Å; H684-T699 WeakPolarHBondContact O-CB 3.45Å; L685-T699 HydrophobicContact CD1-CG2 4.45Å
700	E	94.4	Very high	92.2	Very high	38 Å²	38	45 Å²	45	18%	0.178	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	152.6	164.4	71.4	-169.3	123.7	0	0	111.7	I683 H684 M702 K761	I683-E700 HydrophobicContact CD1-CG 3.53Å; I683-E700 HydrophobicContact CG1-CG 4.4Å; H684-E700 VanDerWaalsContact CB-OE1 3.31Å; H684-E700 WeakPolarHBondContact CB-OE1 3.39Å; H684-E700 PolarHBondContact N-OE1 2.77Å; H684-E700 PolarHBondContact O-N 2.86Å; H684-E700 VanDerWaalsContact O-N 3.08Å; E700-M702 HydrophobicContact CG-CG 4.46Å; E700-M702 HydrophobicContact CG-SD 4.13Å; E700-K761 WeakPolarHBondContact OE1-CD 3.47Å; E700-K761 WeakPolarHBondContact OE1-CE 3.45Å; E700-K761 IonicContact OE1-NZ 2.74Å; E700-K761 PolarHBondContact OE1-NZ 2.9Å; E700-K761 VanDerWaalsContact OE2-CE 3.32Å; E700-K761 WeakPolarHBondContact OE2-CE 3.41Å; E700-K761 IonicContact OE2-NZ 2.87Å; E700-K761 PolarHBondContact OE2-NZ 2.86Å
701	Y	94.9	Very high	92.4	Very high	70 Å²	70	43.3 Å²	43.3	28%	0.275	23%	0.228	S	C	.	.			trans	-90.3	136	175.6	-175.7	-111.7	0	0	0	111.4	I627 C649 A651 E703	I627-Y701 HydrophobicContact CD1-CD2 4.35Å; I627-Y701 HydrophobicContact CD1-CE2 3.83Å; C649-Y701 HydrophobicContact CB-CD1 4.12Å; C649-Y701 HydrophobicContact CB-CG 4.24Å; C649-Y701 PolarHBondContact O-N 2.85Å; A651-Y701 HydrophobicContact CB-CD2 4.38Å; Y701-E703 HydrophobicContact CD1-CG 3.92Å; Y701-E703 HydrophobicContact CE1-CB 4.15Å; Y701-E703 HydrophobicContact CE1-CG 3.81Å
702	M	94.9	Very high	92.7	Very high	12 Å²	12	40.9 Å²	40.9	6%	0.059	21%	0.214	C	C	.	.			trans	-118.9	100.5	-176.5	-61.9	-66.5	-74.4	0	0	108.9	I683 E700 N704 G705 L753 V754 N755 K761	I683-M702 HydrophobicContact CD1-CG 3.65Å; I683-M702 HydrophobicContact CD1-SD 4.14Å; E700-M702 HydrophobicContact CG-CG 4.46Å; E700-M702 HydrophobicContact CG-SD 4.13Å; M702-N704 PolarHBondContact O-N 3.45Å; M702-N704 VanDerWaalsContact O-N 3.15Å; M702-G705 PolarHBondContact O-N 2.94Å; M702-L753 HydrophobicContact CB-CB 3.89Å; M702-L753 HydrophobicContact CB-CD1 4.49Å; M702-L753 VanDerWaalsContact CE-C 3.48Å; M702-L753 HydrophobicContact CE-CB 3.92Å; M702-L753 VanDerWaalsContact CE-O 3.27Å; M702-L753 WeakPolarHBondContact CE-O 3.37Å; M702-L753 HydrophobicContact CG-CB 3.78Å; M702-L753 HydrophobicContact CG-CD1 4.15Å; M702-V754 CarbonylContact C-O 3.47Å; M702-N755 HydrophobicContact CE-CB 3.93Å; M702-N755 HydrophobicContact SD-CB 3.93Å; M702-K761 HydrophobicContact CE-CB 3.87Å; M702-K761 HydrophobicContact CE-CD 3.79Å; M702-K761 HydrophobicContact CE-CG 3.68Å; M702-K761 HydrophobicContact SD-CD 3.92Å; M702-K761 HydrophobicContact SD-CG 4.47Å
703	E	93.2	Very high	93.1	Very high	89 Å²	89	46.3 Å²	46.3	42%	0.416	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-22.7	-161.2	-53	96.5	133.4	0	0	114.6	Y701 N755 S756	Y701-E703 HydrophobicContact CD1-CG 3.92Å; Y701-E703 HydrophobicContact CE1-CB 4.15Å; Y701-E703 HydrophobicContact CE1-CG 3.81Å; E703-N755 WeakPolarHBondContact OE2-CA 3.34Å; E703-N755 VanDerWaalsContact OE2-CB 3.29Å; E703-N755 WeakPolarHBondContact OE2-CB 3.41Å; E703-S756 VanDerWaalsContact CD-CB 3.48Å; E703-S756 WeakPolarHBondContact OE1-CB 3.2Å; E703-S756 PolarHBondContact OE1-OG 3.36Å; E703-S756 PolarHBondContact OE2-N 3.32Å
704	N	94	Very high	93.5	Very high	58 Å²	58	39.6 Å²	39.6	31%	0.31	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-2.9	-176.9	-78	-47.7	0	0	0	113.7	M702 F710 V754 N755	M702-N704 PolarHBondContact O-N 3.45Å; M702-N704 VanDerWaalsContact O-N 3.15Å; N704-F710 HydrophobicContact CB-CD2 3.52Å; N704-F710 HydrophobicContact CB-CE2 3.71Å; N704-F710 HydrophobicContact CB-CG 4.08Å; N704-F710 HydrophobicContact CB-CZ 4.42Å; N704-F710 VanDerWaalsContact OD1-CE2 3.28Å; N704-F710 WeakPolarHBondContact OD1-CE2 3.35Å; N704-V754 HydrophobicContact CB-CB 3.93Å; N704-V754 HydrophobicContact CB-CG1 4.13Å; N704-V754 WeakPolarHBondContact CB-O 3.28Å; N704-V754 PolarHBondContact N-O 3.06Å; N704-N755 PolarHBondContact ND2-O 2.96Å
705	G	93.1	Very high	93.4	Very high	29 Å²	29	41.1 Å²	41.1	30%	0.299	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	73.2	-148.5	179.1	0	0	0	0	0	113.5	M702 L753 V754	M702-G705 PolarHBondContact O-N 2.94Å; G705-L753 CarbonylContact O-C 3.59Å; G705-L753 WeakPolarHBondContact O-CA 3.13Å; G705-V754 PolarHBondContact O-N 2.98Å
706	S	94.9	Very high	92.9	Very high	32 Å²	32	43.2 Å²	43.2	22%	0.224	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	144.9	178	64.9	0	0	0	0	112.2	D708 A709 F710 R750 I752	S706-D708 VanDerWaalsContact C-N 3.32Å; S706-D708 VanDerWaalsContact CB-OD1 3.3Å; S706-D708 WeakPolarHBondContact CB-OD1 3.15Å; S706-D708 PolarHBondContact O-N 3.36Å; S706-D708 PolarHBondContact OG-OD1 3.09Å; S706-A709 PolarHBondContact O-N 3.11Å; S706-F710 VanDerWaalsContact O-CB 3.28Å; S706-F710 WeakPolarHBondContact O-CB 3.4Å; S706-F710 PolarHBondContact O-N 2.86Å; S706-R750 VanDerWaalsContact CB-O 3.29Å; S706-R750 WeakPolarHBondContact CB-O 3.49Å; S706-I752 CarbonylContact C-O 3.18Å; S706-I752 WeakPolarHBondContact CA-O 3.28Å
707	L	97.1	Very high	92.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-36.8	-175.5	177.5	60.1	0	0	0	112.1	F710 L711 M726 I730 A749 I752 V754 V817	L707-F710 HydrophobicContact CD1-CD1 4.43Å; L707-F710 PolarHBondContact O-N 3.11Å; L707-L711 HydrophobicContact CD1-CD1 3.84Å; L707-L711 HydrophobicContact CD1-CD2 4.39Å; L707-L711 HydrophobicContact CD1-CG 3.83Å; L707-L711 HydrophobicContact CG-CD1 3.78Å; L707-L711 HydrophobicContact CG-CG 4.26Å; L707-L711 VanDerWaalsContact O-CB 3.31Å; L707-L711 WeakPolarHBondContact O-CB 3.39Å; L707-L711 WeakPolarHBondContact O-CD1 3.4Å; L707-L711 WeakPolarHBondContact O-CG 3.47Å; L707-L711 PolarHBondContact O-N 2.97Å; L707-M726 HydrophobicContact CD1-SD 4Å; L707-I730 HydrophobicContact CD2-CD1 3.66Å; L707-A749 WeakPolarHBondContact CB-O 3.36Å; L707-A749 PolarHBondContact N-O 3.01Å; L707-I752 HydrophobicContact CB-CB 3.92Å; L707-I752 HydrophobicContact CB-CG2 4.06Å; L707-I752 HydrophobicContact CD2-CB 4.02Å; L707-I752 HydrophobicContact CD2-CG1 4.46Å; L707-I752 HydrophobicContact CD2-CG2 3.79Å; L707-I752 PolarHBondContact N-O 3.43Å; L707-V754 HydrophobicContact CB-CG2 3.72Å; L707-V754 HydrophobicContact CD1-CG2 3.66Å; L707-V754 HydrophobicContact CG-CG2 4.25Å; L707-V817 HydrophobicContact CD2-CG2 3.76Å; L707-V817 HydrophobicContact CG-CG2 4.43Å
708	D	94.4	Very high	92.4	Very high	25 Å²	25	52.5 Å²	52.5	13%	0.134	27%	0.266	C	S	.	.	H	α-helix	trans	-64.2	-44.1	179.2	78.8	-50	0	0	0	112.7	S706 R712 A749 R750	S706-D708 VanDerWaalsContact C-N 3.32Å; S706-D708 VanDerWaalsContact CB-OD1 3.3Å; S706-D708 WeakPolarHBondContact CB-OD1 3.15Å; S706-D708 PolarHBondContact O-N 3.36Å; S706-D708 PolarHBondContact OG-OD1 3.09Å; D708-R712 WeakPolarHBondContact O-CG 3.25Å; D708-R712 PolarHBondContact O-N 3.39Å; D708-R712 IonicContact OD2-CZ 2.69Å; D708-R712 IonicContact OD2-NH1 3.32Å; D708-R712 PolarHBondContact OD2-NH1 2.81Å; D708-R712 VanDerWaalsContact OD2-NH1 3.17Å; D708-R712 IonicContact OD2-NH2 2.8Å; D708-R712 PolarHBondContact OD2-NH2 2.8Å; D708-A749 HydrophobicContact CB-CB 3.84Å; D708-A749 PolarHBondContact N-O 3.08Å; D708-R750 WeakPolarHBondContact OD1-CA 3.29Å
709	A	93.4	Very high	92.2	Very high	44 Å²	44	56 Å²	56	36%	0.364	29%	0.288	S	S	.	.	H	α-helix	trans	-71.7	-37.3	175.6	0	0	0	0	0	111.7	S706 K713	S706-A709 PolarHBondContact O-N 3.11Å; A709-K713 VanDerWaalsContact O-CB 3.29Å; A709-K713 WeakPolarHBondContact O-CB 3.41Å; A709-K713 PolarHBondContact O-N 3.08Å; A709-K713 VanDerWaalsContact O-N 3.12Å
710	F	95.9	Very high	91.9	Very high	14 Å²	14	57.3 Å²	57.3	6%	0.061	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-40.7	176.3	178.5	-110.5	0	0	0	112.6	N704 S706 L707 N714 F718 M726 V754 L758	N704-F710 HydrophobicContact CB-CD2 3.52Å; N704-F710 HydrophobicContact CB-CE2 3.71Å; N704-F710 HydrophobicContact CB-CG 4.08Å; N704-F710 HydrophobicContact CB-CZ 4.42Å; N704-F710 VanDerWaalsContact OD1-CE2 3.28Å; N704-F710 WeakPolarHBondContact OD1-CE2 3.35Å; S706-F710 VanDerWaalsContact O-CB 3.28Å; S706-F710 WeakPolarHBondContact O-CB 3.4Å; S706-F710 PolarHBondContact O-N 2.86Å; L707-F710 HydrophobicContact CD1-CD1 4.43Å; L707-F710 PolarHBondContact O-N 3.11Å; F710-N714 WeakPolarHBondContact CE2-ND2 3.36Å; F710-N714 PolarHBondContact O-N 3.48Å; F710-N714 PolarHBondContact O-ND2 3.41Å; F710-F718 HydrophobicContact CD1-CE2 4.36Å; F710-F718 HydrophobicContact CD1-CZ 4.33Å; F710-F718 HydrophobicContact CE1-CE1 4.32Å; F710-F718 AromaticContact CE1-CE2 3.79Å; F710-F718 HydrophobicContact CE1-CE2 3.79Å; F710-F718 AromaticContact CE1-CZ 3.4Å; F710-F718 HydrophobicContact CE1-CZ 3.4Å; F710-F718 HydrophobicContact CE2-CZ 4.47Å; F710-F718 HydrophobicContact CZ-CE1 4.27Å; F710-F718 HydrophobicContact CZ-CE2 4.3Å; F710-F718 AromaticContact CZ-CZ 3.5Å; F710-F718 HydrophobicContact CZ-CZ 3.5Å; F710-F718 VanDerWaalsContact CZ-CZ 3.5Å; F710-M726 HydrophobicContact CE1-CE 4Å; F710-V754 HydrophobicContact CD1-CB 4.41Å; F710-V754 HydrophobicContact CD1-CG1 4.1Å; F710-V754 HydrophobicContact CD1-CG2 4.26Å; F710-V754 HydrophobicContact CE1-CG1 4.06Å; F710-L758 HydrophobicContact CE1-CD2 3.78Å; F710-L758 HydrophobicContact CZ-CD2 3.53Å
711	L	94.4	Very high	91.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.3	-52.6	175.8	-75.1	164.7	0	0	0	111.6	L707 K713 N714 D715 F718 L723 V817 Y820	L707-L711 HydrophobicContact CD1-CD1 3.84Å; L707-L711 HydrophobicContact CD1-CD2 4.39Å; L707-L711 HydrophobicContact CD1-CG 3.83Å; L707-L711 HydrophobicContact CG-CD1 3.78Å; L707-L711 HydrophobicContact CG-CG 4.26Å; L707-L711 VanDerWaalsContact O-CB 3.31Å; L707-L711 WeakPolarHBondContact O-CB 3.39Å; L707-L711 WeakPolarHBondContact O-CD1 3.4Å; L707-L711 WeakPolarHBondContact O-CG 3.47Å; L707-L711 PolarHBondContact O-N 2.97Å; L711-K713 PolarHBondContact O-N 2.73Å; L711-N714 CarbonylContact O-C 3.45Å; L711-N714 WeakPolarHBondContact O-CA 3.18Å; L711-N714 PolarHBondContact O-N 2.65Å; L711-D715 PolarHBondContact O-N 3.06Å; L711-D715 VanDerWaalsContact O-N 3.1Å; L711-F718 HydrophobicContact CD2-CD2 4.23Å; L711-F718 HydrophobicContact CD2-CE2 4.32Å; L711-L723 HydrophobicContact CD2-CD2 3.9Å; L711-V817 HydrophobicContact CD1-CB 4.36Å; L711-V817 HydrophobicContact CD1-CG2 4.11Å; L711-Y820 CarbonylContact C-O 3.52Å; L711-Y820 HydrophobicContact CB-CD1 4.4Å; L711-Y820 WeakPolarHBondContact CB-O 3.47Å; L711-Y820 HydrophobicContact CD2-CD1 4.01Å; L711-Y820 HydrophobicContact CD2-CE1 4.42Å
712	R	92.3	Very high	91.7	Very high	129 Å²	129	58.9 Å²	58.9	49%	0.487	31%	0.307	S	S	.	.	H	α-helix	trans	-58.1	-34.1	179.6	-72.6	-171.6	-64.6	-90.8	-2.7	112.5	D708 N714 Y820 G821	D708-R712 WeakPolarHBondContact O-CG 3.25Å; D708-R712 PolarHBondContact O-N 3.39Å; D708-R712 IonicContact OD2-CZ 2.69Å; D708-R712 IonicContact OD2-NH1 3.32Å; D708-R712 PolarHBondContact OD2-NH1 2.81Å; D708-R712 VanDerWaalsContact OD2-NH1 3.17Å; D708-R712 IonicContact OD2-NH2 2.8Å; D708-R712 PolarHBondContact OD2-NH2 2.8Å; R712-N714 VanDerWaalsContact C-N 3.25Å; R712-N714 PolarHBondContact O-N 3.12Å; R712-Y820 WeakPolarHBondContact CA-O 3.34Å; R712-Y820 WeakPolarHBondContact CG-O 3.32Å; R712-Y820 PolarHBondContact N-O 2.97Å; R712-Y820 VanDerWaalsContact N-O 3.12Å; R712-G821 WeakPolarHBondContact CD-O 3.41Å; R712-G821 PolarHBondContact NH1-O 3.18Å
713	K	91.9	Very high	91.7	Very high	166 Å²	166	58.5 Å²	58.5	72%	0.722	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-16.9	175	-174	173.6	178.2	-177.5	0	113.9	A709 L711	A709-K713 VanDerWaalsContact O-CB 3.29Å; A709-K713 WeakPolarHBondContact O-CB 3.41Å; A709-K713 PolarHBondContact O-N 3.08Å; A709-K713 VanDerWaalsContact O-N 3.12Å; L711-K713 PolarHBondContact O-N 2.73Å
714	N	89.6	Confident	91.7	Very high	27 Å²	27	54.2 Å²	54.2	14%	0.144	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	32.7	-175.9	-66.9	-72.8	0	0	0	112.4	F710 L711 R712 G716 R717 F718 Y820	F710-N714 WeakPolarHBondContact CE2-ND2 3.36Å; F710-N714 PolarHBondContact O-N 3.48Å; F710-N714 PolarHBondContact O-ND2 3.41Å; L711-N714 CarbonylContact O-C 3.45Å; L711-N714 WeakPolarHBondContact O-CA 3.18Å; L711-N714 PolarHBondContact O-N 2.65Å; R712-N714 VanDerWaalsContact C-N 3.25Å; R712-N714 PolarHBondContact O-N 3.12Å; N714-G716 PolarHBondContact O-N 3.45Å; N714-R717 HydrophobicContact CB-CB 4.28Å; N714-R717 HydrophobicContact CB-CG 4.43Å; N714-R717 VanDerWaalsContact O-CB 3.27Å; N714-R717 WeakPolarHBondContact O-CB 3.46Å; N714-R717 WeakPolarHBondContact O-CG 3.1Å; N714-R717 PolarHBondContact O-N 3.36Å; N714-R717 PolarHBondContact OD1-NH1 3.17Å; N714-F718 HydrophobicContact CB-CE2 3.63Å; N714-F718 HydrophobicContact CB-CZ 3.7Å; N714-Y820 VanDerWaalsContact O-CE1 3.26Å; N714-Y820 WeakPolarHBondContact O-CE1 3.42Å
715	D	86.5	Confident	91.8	Very high	92 Å²	92	53.1 Å²	53.1	49%	0.492	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	133.7	179.5	-177.7	30.8	0	0	0	112.4	L711 R717	L711-D715 PolarHBondContact O-N 3.06Å; L711-D715 VanDerWaalsContact O-N 3.1Å; D715-R717 WeakPolarHBondContact O-CG 3.39Å; D715-R717 PolarHBondContact O-N 3.36Å; D715-R717 VanDerWaalsContact O-N 3.09Å
716	G	79.3	Confident	92	Very high	49 Å²	49	51.9 Å²	51.9	51%	0.505	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	-1.1	-175.9	0	0	0	0	0	116.9	N714	N714-G716 PolarHBondContact O-N 3.45Å
717	R	86	Confident	92.2	Very high	180 Å²	180	50.4 Å²	50.4	68%	0.679	26%	0.264	S	S	*	.			trans	-86.4	-15.2	-171	-59.3	-174.9	-178.3	179.7	-7.4	115.5	N714 D715 Y820	N714-R717 HydrophobicContact CB-CB 4.28Å; N714-R717 HydrophobicContact CB-CG 4.43Å; N714-R717 VanDerWaalsContact O-CB 3.27Å; N714-R717 WeakPolarHBondContact O-CB 3.46Å; N714-R717 WeakPolarHBondContact O-CG 3.1Å; N714-R717 PolarHBondContact O-N 3.36Å; N714-R717 PolarHBondContact OD1-NH1 3.17Å; D715-R717 WeakPolarHBondContact O-CG 3.39Å; D715-R717 PolarHBondContact O-N 3.36Å; D715-R717 VanDerWaalsContact O-N 3.09Å; R717-Y820 PolarHBondContact N-OH 3.28Å
718	F	89.9	Confident	92.2	Very high	28 Å²	28	53.8 Å²	53.8	12%	0.123	28%	0.276	C	S	.	.	S	Bend	trans	-99	137.6	-179.3	-58.2	-56.5	0	0	0	111.4	F710 L711 N714 Q722 L723 M726 L758 Y820	F710-F718 HydrophobicContact CD1-CE2 4.36Å; F710-F718 HydrophobicContact CD1-CZ 4.33Å; F710-F718 HydrophobicContact CE1-CE1 4.32Å; F710-F718 AromaticContact CE1-CE2 3.79Å; F710-F718 HydrophobicContact CE1-CE2 3.79Å; F710-F718 AromaticContact CE1-CZ 3.4Å; F710-F718 HydrophobicContact CE1-CZ 3.4Å; F710-F718 HydrophobicContact CE2-CZ 4.47Å; F710-F718 HydrophobicContact CZ-CE1 4.27Å; F710-F718 HydrophobicContact CZ-CE2 4.3Å; F710-F718 AromaticContact CZ-CZ 3.5Å; F710-F718 HydrophobicContact CZ-CZ 3.5Å; F710-F718 VanDerWaalsContact CZ-CZ 3.5Å; L711-F718 HydrophobicContact CD2-CD2 4.23Å; L711-F718 HydrophobicContact CD2-CE2 4.32Å; N714-F718 HydrophobicContact CB-CE2 3.63Å; N714-F718 HydrophobicContact CB-CZ 3.7Å; F718-Q722 HydrophobicContact CB-CB 4.32Å; F718-L723 HydrophobicContact CB-CD2 3.81Å; F718-L723 HydrophobicContact CB-CG 4.02Å; F718-L723 HydrophobicContact CD2-CD2 4Å; F718-L723 HydrophobicContact CG-CD2 4.28Å; F718-M726 HydrophobicContact CD1-CE 4.42Å; F718-M726 HydrophobicContact CD2-CE 4.2Å; F718-M726 HydrophobicContact CE1-CE 4.4Å; F718-M726 HydrophobicContact CE2-CE 4.18Å; F718-M726 HydrophobicContact CG-CE 4.35Å; F718-M726 HydrophobicContact CZ-CE 4.31Å; F718-L758 HydrophobicContact CE1-CD1 4.32Å; F718-L758 HydrophobicContact CE1-CD2 4.25Å; F718-Y820 WeakPolarHBondContact CA-OH 3.32Å; F718-Y820 HydrophobicContact CB-CE1 4.43Å; F718-Y820 AromaticContact CD2-CE1 3.71Å; F718-Y820 HydrophobicContact CD2-CE1 3.71Å; F718-Y820 HydrophobicContact CE2-CE1 4.45Å; F718-Y820 HydrophobicContact CG-CE1 4.48Å; F718-Y820 PolarHBondContact N-OH 2.58Å; F718-Y820 PolarHBondContact O-OH 2.91Å
719	T	90.8	Very high	92.3	Very high	74 Å²	74	52.9 Å²	52.9	45%	0.454	27%	0.273	S	S	.	.			trans	-66.6	148.8	167.1	62.4	0	0	0	0	109.9	I721 Q722 L723	T719-I721 PolarHBondContact O-N 3.14Å; T719-I721 VanDerWaalsContact O-N 3.09Å; T719-I721 VanDerWaalsContact OG1-CG2 3.24Å; T719-I721 WeakPolarHBondContact OG1-CG2 3.39Å; T719-Q722 WeakPolarHBondContact O-CB 3.26Å; T719-Q722 PolarHBondContact O-N 2.69Å; T719-Q722 WeakPolarHBondContact OG1-CG 3.23Å; T719-Q722 PolarHBondContact OG1-OE1 3.19Å; T719-L723 PolarHBondContact O-N 3.31Å
720	V	89.7	Confident	92.5	Very high	47 Å²	47	50.8 Å²	50.8	29%	0.285	26%	0.256	S	S	.	.	H	α-helix	trans	-52.3	-35.9	177.8	177.1	0	0	0	0	112	Q722 L723 V724 P850 L888	V720-Q722 VanDerWaalsContact C-N 3.35Å; V720-Q722 PolarHBondContact O-N 3.41Å; V720-L723 PolarHBondContact O-N 3.05Å; V720-V724 HydrophobicContact CG1-CG2 4.35Å; V720-V724 VanDerWaalsContact O-CG2 3.29Å; V720-V724 WeakPolarHBondContact O-CG2 3.44Å; V720-V724 PolarHBondContact O-N 2.82Å; V720-P850 HydrophobicContact CG1-CG 3.55Å; V720-L888 HydrophobicContact CG1-CB 4.22Å; V720-L888 HydrophobicContact CG1-CD1 4.36Å; V720-L888 HydrophobicContact CG1-CD2 4.23Å
721	I	90.6	Very high	92.6	Very high	65 Å²	65	50.1 Å²	50.1	33%	0.333	25%	0.253	S	S	.	.	H	α-helix	trans	-67.3	-30.8	177.7	-172.7	62.9	0	0	0	113.2	T719 G725 I882 L888	T719-I721 PolarHBondContact O-N 3.14Å; T719-I721 VanDerWaalsContact O-N 3.09Å; T719-I721 VanDerWaalsContact OG1-CG2 3.24Å; T719-I721 WeakPolarHBondContact OG1-CG2 3.39Å; I721-G725 PolarHBondContact O-N 3.35Å; I721-I882 HydrophobicContact CD1-CB 4.2Å; I721-I882 HydrophobicContact CD1-CG1 3.97Å; I721-I882 HydrophobicContact CD1-CG2 4.26Å; I721-L888 HydrophobicContact CD1-CD1 3.97Å
722	Q	93.4	Very high	92.8	Very high	76 Å²	76	50.9 Å²	50.9	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-70.9	-42.4	172.1	-71.1	163.7	-69.1	0	0	111.3	F718 T719 V720 V724 G725 M726	F718-Q722 HydrophobicContact CB-CB 4.32Å; T719-Q722 WeakPolarHBondContact O-CB 3.26Å; T719-Q722 PolarHBondContact O-N 2.69Å; T719-Q722 WeakPolarHBondContact OG1-CG 3.23Å; T719-Q722 PolarHBondContact OG1-OE1 3.19Å; V720-Q722 VanDerWaalsContact C-N 3.35Å; V720-Q722 PolarHBondContact O-N 3.41Å; Q722-V724 PolarHBondContact O-N 3.28Å; Q722-G725 WeakPolarHBondContact O-CA 3.36Å; Q722-G725 PolarHBondContact O-N 3.13Å; Q722-G725 VanDerWaalsContact O-N 3.09Å; Q722-M726 WeakPolarHBondContact O-CG 3.07Å; Q722-M726 PolarHBondContact O-N 3.45Å
723	L	94.7	Very high	93	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-61.4	-43.2	174.8	-62	177.9	0	0	0	111.4	L711 F718 T719 V720 G725 M726 L727 V817 M818 Y820	L711-L723 HydrophobicContact CD2-CD2 3.9Å; F718-L723 HydrophobicContact CB-CD2 3.81Å; F718-L723 HydrophobicContact CB-CG 4.02Å; F718-L723 HydrophobicContact CD2-CD2 4Å; F718-L723 HydrophobicContact CG-CD2 4.28Å; T719-L723 PolarHBondContact O-N 3.31Å; V720-L723 PolarHBondContact O-N 3.05Å; L723-G725 VanDerWaalsContact C-N 3.29Å; L723-G725 PolarHBondContact O-N 2.83Å; L723-M726 HydrophobicContact CD2-SD 4.2Å; L723-M726 WeakPolarHBondContact O-CB 3.24Å; L723-M726 PolarHBondContact O-N 3.23Å; L723-L727 WeakPolarHBondContact O-CG 3.38Å; L723-L727 PolarHBondContact O-N 3.26Å; L723-V817 HydrophobicContact CB-CG1 4.04Å; L723-V817 HydrophobicContact CD2-CG1 3.92Å; L723-M818 HydrophobicContact CB-SD 4.02Å; L723-M818 HydrophobicContact CD1-CE 4.27Å; L723-M818 HydrophobicContact CD1-SD 3.99Å; L723-Y820 HydrophobicContact CD1-CE2 4.05Å
724	V	94.3	Very high	93.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.7	-35.9	172.4	174.6	0	0	0	0	111.6	V720 Q722 L727 R728 L853 L878 I882 L888	V720-V724 HydrophobicContact CG1-CG2 4.35Å; V720-V724 VanDerWaalsContact O-CG2 3.29Å; V720-V724 WeakPolarHBondContact O-CG2 3.44Å; V720-V724 PolarHBondContact O-N 2.82Å; Q722-V724 PolarHBondContact O-N 3.28Å; V724-L727 PolarHBondContact O-N 2.81Å; V724-R728 VanDerWaalsContact O-CB 3.24Å; V724-R728 WeakPolarHBondContact O-CB 3.33Å; V724-R728 PolarHBondContact O-N 3.44Å; V724-L853 HydrophobicContact CG2-CD1 3.53Å; V724-L853 HydrophobicContact CG2-CD2 4.1Å; V724-L853 HydrophobicContact CG2-CG 4.37Å; V724-L878 HydrophobicContact CG1-CD2 4.19Å; V724-I882 HydrophobicContact CG1-CD1 4.08Å; V724-I882 HydrophobicContact CG1-CG1 3.61Å; V724-L888 HydrophobicContact CG2-CD1 4.21Å; V724-L888 HydrophobicContact CG2-CD2 3.99Å
725	G	95.3	Very high	93.6	Very high	35 Å²	35	39.1 Å²	39.1	36%	0.361	21%	0.209	S	C	.	.	H	α-helix	trans	-61.3	-45.7	172.3	0	0	0	0	0	113.2	I721 Q722 L723 R728 G729	I721-G725 PolarHBondContact O-N 3.35Å; Q722-G725 WeakPolarHBondContact O-CA 3.36Å; Q722-G725 PolarHBondContact O-N 3.13Å; Q722-G725 VanDerWaalsContact O-N 3.09Å; L723-G725 VanDerWaalsContact C-N 3.29Å; L723-G725 PolarHBondContact O-N 2.83Å; G725-R728 PolarHBondContact O-N 3.27Å; G725-G729 PolarHBondContact O-N 2.73Å
726	M	97.8	Very high	94.1	Very high	3 Å²	3	37 Å²	37	2%	0.015	20%	0.195	C	C	.	.	H	α-helix	trans	-58.3	-49.5	174	-67.6	173.6	-176.3	0	0	111.1	L707 F710 F718 Q722 L723 R728 G729 I730 L758 C760	L707-M726 HydrophobicContact CD1-SD 4Å; F710-M726 HydrophobicContact CE1-CE 4Å; F718-M726 HydrophobicContact CD1-CE 4.42Å; F718-M726 HydrophobicContact CD2-CE 4.2Å; F718-M726 HydrophobicContact CE1-CE 4.4Å; F718-M726 HydrophobicContact CE2-CE 4.18Å; F718-M726 HydrophobicContact CG-CE 4.35Å; F718-M726 HydrophobicContact CZ-CE 4.31Å; Q722-M726 WeakPolarHBondContact O-CG 3.07Å; Q722-M726 PolarHBondContact O-N 3.45Å; L723-M726 HydrophobicContact CD2-SD 4.2Å; L723-M726 WeakPolarHBondContact O-CB 3.24Å; L723-M726 PolarHBondContact O-N 3.23Å; M726-R728 PolarHBondContact O-N 3.02Å; M726-G729 PolarHBondContact O-N 3.21Å; M726-I730 WeakPolarHBondContact O-CG1 3.41Å; M726-I730 PolarHBondContact O-N 2.65Å; M726-I730 VanDerWaalsContact O-N 3.07Å; M726-L758 HydrophobicContact CE-CB 4.11Å; M726-L758 HydrophobicContact CE-CD1 4.23Å; M726-L758 HydrophobicContact CE-CD2 4.12Å; M726-L758 HydrophobicContact CE-CG 4.39Å; M726-C760 VanDerWaalsContact CB-SG 3.59Å
727	L	98.1	Very high	94.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-61	-42.5	177.9	-70.4	176.5	0	0	0	112.7	L723 V724 G729 I730 G731 Y810 M814 V817 L878	L723-L727 WeakPolarHBondContact O-CG 3.38Å; L723-L727 PolarHBondContact O-N 3.26Å; V724-L727 PolarHBondContact O-N 2.81Å; L727-G729 VanDerWaalsContact C-N 3.29Å; L727-G729 PolarHBondContact O-N 2.95Å; L727-I730 HydrophobicContact CD2-CD1 4.46Å; L727-I730 PolarHBondContact O-N 2.76Å; L727-G731 PolarHBondContact O-N 3.14Å; L727-Y810 PolarHBondContact O-OH 2.78Å; L727-M814 HydrophobicContact CD1-CB 4.39Å; L727-M814 HydrophobicContact CD1-CG 4.12Å; L727-M814 HydrophobicContact CD2-CB 4.36Å; L727-M814 HydrophobicContact CD2-CG 3.96Å; L727-V817 HydrophobicContact CD1-CB 4.47Å; L727-V817 HydrophobicContact CD1-CG1 4.35Å; L727-V817 HydrophobicContact CD2-CB 3.81Å; L727-V817 HydrophobicContact CD2-CG1 4.16Å; L727-V817 HydrophobicContact CD2-CG2 3.69Å; L727-V817 HydrophobicContact CG-CB 4.18Å; L727-V817 HydrophobicContact CG-CG1 4Å; L727-V817 HydrophobicContact CG-CG2 4.41Å; L727-L878 HydrophobicContact CB-CD1 4.41Å
728	R	97.6	Very high	94.8	Very high	71 Å²	71	27.6 Å²	27.6	27%	0.268	15%	0.149	S	C	.	.	H	α-helix	trans	-63.2	-35.7	176.4	-173.3	-89.9	-177.9	-125.2	-12.4	111.8	V724 G725 M726 S732 L878 D879 I882	V724-R728 VanDerWaalsContact O-CB 3.24Å; V724-R728 WeakPolarHBondContact O-CB 3.33Å; V724-R728 PolarHBondContact O-N 3.44Å; G725-R728 PolarHBondContact O-N 3.27Å; M726-R728 PolarHBondContact O-N 3.02Å; R728-S732 PolarHBondContact NH1-OG 3.45Å; R728-S732 WeakPolarHBondContact O-CB 3.3Å; R728-S732 PolarHBondContact O-N 3.21Å; R728-L878 HydrophobicContact CB-CB 4.1Å; R728-L878 HydrophobicContact CB-CD1 4.36Å; R728-L878 HydrophobicContact CG-CB 4.18Å; R728-D879 WeakPolarHBondContact CG-OD1 3.34Å; R728-D879 IonicContact CZ-OD1 2.81Å; R728-D879 IonicContact CZ-OD2 3.13Å; R728-D879 IonicContact NE-OD1 3.38Å; R728-D879 PolarHBondContact NE-OD1 3.27Å; R728-D879 IonicContact NE-OD2 2.87Å; R728-D879 IonicContact NH2-OD1 3.18Å; R728-D879 PolarHBondContact NH2-OD1 3Å; R728-D879 IonicContact NH2-OD2 3.49Å; R728-D879 PolarHBondContact NH2-OD2 2.86Å; R728-I882 HydrophobicContact CB-CD1 3.86Å; R728-I882 HydrophobicContact CG-CD1 3.83Å
729	G	96.7	Very high	94.7	Very high	6 Å²	6	30.5 Å²	30.5	6%	0.062	17%	0.166	C	C	.	.	H	α-helix	trans	-60.7	-55.8	171.1	0	0	0	0	0	112.1	N681 G725 M726 L727 G731 S732 G733	N681-G729 WeakPolarHBondContact CB-O 3.29Å; N681-G729 WeakPolarHBondContact ND2-CA 3.32Å; N681-G729 PolarHBondContact OD1-O 2.59Å; G725-G729 PolarHBondContact O-N 2.73Å; M726-G729 PolarHBondContact O-N 3.21Å; L727-G729 VanDerWaalsContact C-N 3.29Å; L727-G729 PolarHBondContact O-N 2.95Å; G729-G731 VanDerWaalsContact C-N 3.32Å; G729-G731 PolarHBondContact O-N 3.32Å; G729-S732 WeakPolarHBondContact O-CB 3.24Å; G729-S732 PolarHBondContact O-N 2.95Å; G729-G733 PolarHBondContact O-N 3.36Å
730	I	98.4	Very high	94.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-46.5	179.1	-59.6	159.8	0	0	0	110.8	L707 M726 L727 S732 G733 M734 L747 I752 C760 V762 Y810 V813	L707-I730 HydrophobicContact CD2-CD1 3.66Å; M726-I730 WeakPolarHBondContact O-CG1 3.41Å; M726-I730 PolarHBondContact O-N 2.65Å; M726-I730 VanDerWaalsContact O-N 3.07Å; L727-I730 HydrophobicContact CD2-CD1 4.46Å; L727-I730 PolarHBondContact O-N 2.76Å; I730-S732 VanDerWaalsContact C-N 3.29Å; I730-S732 PolarHBondContact O-N 3.19Å; I730-G733 PolarHBondContact O-N 3.27Å; I730-G733 VanDerWaalsContact O-N 3.14Å; I730-M734 HydrophobicContact CG2-CG 4.47Å; I730-M734 PolarHBondContact O-N 2.83Å; I730-L747 HydrophobicContact CG2-CD1 4.39Å; I730-I752 HydrophobicContact CD1-CG1 4.12Å; I730-I752 HydrophobicContact CD1-CG2 4Å; I730-I752 HydrophobicContact CG1-CD1 4.23Å; I730-I752 HydrophobicContact CG1-CG1 4.23Å; I730-I752 HydrophobicContact CG1-CG2 3.87Å; I730-I752 HydrophobicContact CG2-CD1 3.87Å; I730-I752 HydrophobicContact CG2-CG1 4.43Å; I730-C760 HydrophobicContact CD1-CB 4.2Å; I730-C760 HydrophobicContact CG1-CB 3.67Å; I730-V762 HydrophobicContact CG2-CG2 4.36Å; I730-Y810 HydrophobicContact CB-CE2 4.03Å; I730-Y810 HydrophobicContact CG2-CD2 3.93Å; I730-Y810 HydrophobicContact CG2-CE2 3.75Å; I730-V813 HydrophobicContact CD1-CG1 4.02Å
731	G	98.1	Very high	94	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.5	-33.3	177.6	0	0	0	0	0	113.2	L727 G729 K735 V875	L727-G731 PolarHBondContact O-N 3.14Å; G729-G731 VanDerWaalsContact C-N 3.32Å; G729-G731 PolarHBondContact O-N 3.32Å; G731-K735 VanDerWaalsContact O-CB 3.3Å; G731-K735 WeakPolarHBondContact O-CB 3.42Å; G731-K735 PolarHBondContact O-N 3.11Å; G731-V875 WeakPolarHBondContact O-CG2 3.48Å
732	S	98.3	Very high	93.7	Very high	17 Å²	17	27 Å²	27	12%	0.119	15%	0.149	C	C	.	.	H	α-helix	trans	-68.6	-39.4	173.7	-159.1	0	0	0	0	111.7	H679 R728 G729 I730 Y736	H679-S732 VanDerWaalsContact CE1-C 3.43Å; H679-S732 PolarHBondContact CE1-O 3.24Å; H679-S732 PolarHBondContact NE2-OG 3.13Å; R728-S732 PolarHBondContact NH1-OG 3.45Å; R728-S732 WeakPolarHBondContact O-CB 3.3Å; R728-S732 PolarHBondContact O-N 3.21Å; G729-S732 WeakPolarHBondContact O-CB 3.24Å; G729-S732 PolarHBondContact O-N 2.95Å; I730-S732 VanDerWaalsContact C-N 3.29Å; I730-S732 PolarHBondContact O-N 3.19Å; S732-Y736 PolarHBondContact O-N 3.29Å; S732-Y736 VanDerWaalsContact O-N 3.11Å
733	G	97.1	Very high	93.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63	-49.2	172.5	0	0	0	0	0	112.2	G729 I730 K735 Y736 L737	G729-G733 PolarHBondContact O-N 3.36Å; I730-G733 PolarHBondContact O-N 3.27Å; I730-G733 VanDerWaalsContact O-N 3.14Å; G733-K735 VanDerWaalsContact C-N 3.33Å; G733-K735 PolarHBondContact O-N 3.14Å; G733-Y736 WeakPolarHBondContact O-CB 3.15Å; G733-Y736 PolarHBondContact O-N 2.72Å; G733-Y736 VanDerWaalsContact O-N 3.11Å; G733-L737 PolarHBondContact O-N 2.71Å
734	M	97.3	Very high	93.1	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-66.8	-31.8	178.5	-67.4	-52.8	-52.6	0	0	113.6	I730 L737 S738 H744 L747 V762 D806 F871	I730-M734 HydrophobicContact CG2-CG 4.47Å; I730-M734 PolarHBondContact O-N 2.83Å; M734-L737 HydrophobicContact CE-CD1 4.31Å; M734-L737 HydrophobicContact SD-CD1 3.92Å; M734-S738 WeakPolarHBondContact O-CB 3.47Å; M734-S738 PolarHBondContact O-N 2.89Å; M734-H744 HydrophobicContact CE-CB 3.93Å; M734-H744 HydrophobicContact SD-CB 4.48Å; M734-L747 HydrophobicContact CE-CD2 4.02Å; M734-L747 HydrophobicContact CG-CD1 4.24Å; M734-L747 HydrophobicContact CG-CD2 3.72Å; M734-L747 HydrophobicContact SD-CD1 3.87Å; M734-L747 HydrophobicContact SD-CD2 3.83Å; M734-L747 HydrophobicContact SD-CG 4.4Å; M734-V762 HydrophobicContact CG-CG2 4.37Å; M734-V762 HydrophobicContact SD-CG1 4.01Å; M734-V762 HydrophobicContact SD-CG2 4.15Å; M734-D806 HydrophobicContact CE-CB 3.89Å; M734-D806 WeakPolarHBondContact CE-OD2 3.16Å; M734-F871 HydrophobicContact CB-CD1 3.6Å; M734-F871 HydrophobicContact CB-CD2 4.03Å; M734-F871 HydrophobicContact CB-CE1 3.41Å; M734-F871 VanDerWaalsContact CB-CE1 3.41Å; M734-F871 HydrophobicContact CB-CE2 3.85Å; M734-F871 HydrophobicContact CB-CG 3.91Å; M734-F871 HydrophobicContact CB-CZ 3.54Å; M734-F871 HydrophobicContact CE-CE2 4.12Å; M734-F871 HydrophobicContact CE-CZ 4.05Å; M734-F871 HydrophobicContact CG-CE1 4.04Å; M734-F871 HydrophobicContact CG-CZ 4.07Å
735	K	96.6	Very high	92.8	Very high	74 Å²	74	26.9 Å²	26.9	32%	0.322	15%	0.148	S	C	.	.	H	α-helix	trans	-58.4	-50.9	167.8	-176.2	-166.2	173.5	-65.4	0	110.5	G731 G733 L737 S738 D739 F871	G731-K735 VanDerWaalsContact O-CB 3.3Å; G731-K735 WeakPolarHBondContact O-CB 3.42Å; G731-K735 PolarHBondContact O-N 3.11Å; G733-K735 VanDerWaalsContact C-N 3.33Å; G733-K735 PolarHBondContact O-N 3.14Å; K735-L737 PolarHBondContact O-N 3.23Å; K735-S738 PolarHBondContact O-N 3.37Å; K735-D739 IonicContact NZ-OD1 3.19Å; K735-D739 IonicContact NZ-OD2 3.95Å; K735-D739 PolarHBondContact NZ-OD2 3.02Å; K735-D739 PolarHBondContact O-N 2.95Å; K735-F871 HydrophobicContact CB-CB 3.86Å; K735-F871 HydrophobicContact CG-CB 4.45Å
736	Y	95.7	Very high	92.4	Very high	46 Å²	46	26.3 Å²	26.3	18%	0.18	14%	0.137	C	C	.	.	H	α-helix	trans	-58.8	-47.2	179.2	170.9	-93.5	0	0	0	112	F677 D678 H679 I682 S732 G733 S738 D739 M740	F677-Y736 HydrophobicContact CB-CE1 3.96Å; F677-Y736 AromaticContact CD1-CE1 3.93Å; F677-Y736 HydrophobicContact CD1-CE1 3.93Å; F677-Y736 HydrophobicContact CG-CE1 4.2Å; D678-Y736 PolarHBondContact N-OH 3.17Å; H679-Y736 HydrophobicContact CB-CD1 3.71Å; H679-Y736 HydrophobicContact CB-CD2 3.89Å; H679-Y736 HydrophobicContact CB-CE1 3.95Å; H679-Y736 HydrophobicContact CB-CE2 4.12Å; H679-Y736 HydrophobicContact CB-CG 3.67Å; H679-Y736 AromaticContact CD2-CG 3.98Å; H679-Y736 AromaticContact CG-CG 3.78Å; I682-Y736 HydrophobicContact CG1-CD1 3.97Å; I682-Y736 HydrophobicContact CG1-CE1 4.44Å; S732-Y736 PolarHBondContact O-N 3.29Å; S732-Y736 VanDerWaalsContact O-N 3.11Å; G733-Y736 WeakPolarHBondContact O-CB 3.15Å; G733-Y736 PolarHBondContact O-N 2.72Å; G733-Y736 VanDerWaalsContact O-N 3.11Å; Y736-S738 VanDerWaalsContact C-N 3.35Å; Y736-S738 PolarHBondContact O-N 3.2Å; Y736-D739 PolarHBondContact O-N 2.88Å; Y736-M740 HydrophobicContact CD1-CG 4.3Å; Y736-M740 HydrophobicContact CD2-CG 4.49Å; Y736-M740 HydrophobicContact CE1-CG 3.91Å; Y736-M740 HydrophobicContact CE2-CG 4.14Å; Y736-M740 HydrophobicContact CE2-SD 4.22Å; Y736-M740 VanDerWaalsContact O-CG 3.28Å; Y736-M740 WeakPolarHBondContact O-CG 3.22Å; Y736-M740 PolarHBondContact O-N 2.89Å
737	L	91.2	Very high	92.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.7	-43.7	175.9	-66.9	176.7	0	0	0	112	F677 I682 G733 M734 K735 D739 M740 S741 Y742 V762 F765	F677-L737 HydrophobicContact CD1-CD2 4.05Å; F677-L737 HydrophobicContact CD2-CD2 3.74Å; F677-L737 HydrophobicContact CE1-CD2 3.88Å; F677-L737 HydrophobicContact CE2-CD2 3.53Å; F677-L737 HydrophobicContact CG-CD2 4Å; F677-L737 HydrophobicContact CZ-CD2 3.63Å; I682-L737 HydrophobicContact CD1-CD1 3.86Å; I682-L737 HydrophobicContact CD1-CD2 4.14Å; I682-L737 HydrophobicContact CD1-CG 3.79Å; G733-L737 PolarHBondContact O-N 2.71Å; M734-L737 HydrophobicContact CE-CD1 4.31Å; M734-L737 HydrophobicContact SD-CD1 3.92Å; K735-L737 PolarHBondContact O-N 3.23Å; L737-D739 VanDerWaalsContact C-N 3.34Å; L737-D739 PolarHBondContact O-N 3.25Å; L737-M740 CarbonylContact O-C 3.58Å; L737-M740 WeakPolarHBondContact O-CB 3.39Å; L737-M740 PolarHBondContact O-N 3.07Å; L737-S741 PolarHBondContact O-N 3.25Å; L737-Y742 HydrophobicContact CB-CD1 4.3Å; L737-Y742 HydrophobicContact CD1-CD1 4.23Å; L737-Y742 HydrophobicContact CD2-CD1 3.99Å; L737-Y742 HydrophobicContact CD2-CG 4.47Å; L737-Y742 HydrophobicContact CG-CD1 4.4Å; L737-Y742 PolarHBondContact O-N 3.43Å; L737-V762 HydrophobicContact CD1-CG1 4.24Å; L737-F765 HydrophobicContact CD1-CE1 4.11Å; L737-F765 HydrophobicContact CD2-CE1 4.4Å
738	S	88.9	Confident	92.2	Very high	33 Å²	33	26.1 Å²	26.1	23%	0.231	14%	0.136	C	C	.	.	H	α-helix	trans	-67.8	-30	177	-175.3	0	0	0	0	113.5	M734 K735 Y736 S741 S803	M734-S738 WeakPolarHBondContact O-CB 3.47Å; M734-S738 PolarHBondContact O-N 2.89Å; K735-S738 PolarHBondContact O-N 3.37Å; Y736-S738 VanDerWaalsContact C-N 3.35Å; Y736-S738 PolarHBondContact O-N 3.2Å; S738-S741 PolarHBondContact O-N 3.47Å; S738-S803 VanDerWaalsContact OG-CB 3.26Å; S738-S803 WeakPolarHBondContact OG-CB 3.13Å; S738-S803 PolarHBondContact OG-OG 3.12Å
739	D	87.8	Confident	92.1	Very high	89 Å²	89	22.8 Å²	22.8	48%	0.476	12%	0.123	S	C	.	.	H	α-helix	trans	-73.2	-34.8	173.9	-66.1	-26.5	0	0	0	110.9	K735 Y736 L737 S741	K735-D739 IonicContact NZ-OD1 3.19Å; K735-D739 IonicContact NZ-OD2 3.95Å; K735-D739 PolarHBondContact NZ-OD2 3.02Å; K735-D739 PolarHBondContact O-N 2.95Å; Y736-D739 PolarHBondContact O-N 2.88Å; L737-D739 VanDerWaalsContact C-N 3.34Å; L737-D739 PolarHBondContact O-N 3.25Å; D739-S741 PolarHBondContact O-N 2.99Å
740	M	84.2	Confident	92	Very high	24 Å²	24	26 Å²	26	12%	0.118	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-4.6	168.9	-64.2	-69.3	-66.4	0	0	113.1	R594 Y596 F677 Y736 L737 Y742	R594-M740 WeakPolarHBondContact O-CE 3.49Å; Y596-M740 WeakPolarHBondContact CB-O 3.47Å; Y596-M740 PolarHBondContact N-O 2.98Å; F677-M740 HydrophobicContact CD1-CE 4.37Å; F677-M740 HydrophobicContact CE1-CB 4.43Å; F677-M740 HydrophobicContact CE1-CE 4.46Å; Y736-M740 HydrophobicContact CD1-CG 4.3Å; Y736-M740 HydrophobicContact CD2-CG 4.49Å; Y736-M740 HydrophobicContact CE1-CG 3.91Å; Y736-M740 HydrophobicContact CE2-CG 4.14Å; Y736-M740 HydrophobicContact CE2-SD 4.22Å; Y736-M740 VanDerWaalsContact O-CG 3.28Å; Y736-M740 WeakPolarHBondContact O-CG 3.22Å; Y736-M740 PolarHBondContact O-N 2.89Å; L737-M740 CarbonylContact O-C 3.58Å; L737-M740 WeakPolarHBondContact O-CB 3.39Å; L737-M740 PolarHBondContact O-N 3.07Å; M740-Y742 VanDerWaalsContact C-N 3.28Å; M740-Y742 PolarHBondContact O-N 3.4Å
741	S	81.8	Confident	91.8	Very high	81 Å²	81	26.7 Å²	26.7	57%	0.566	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.8	25	-172.2	-54.9	0	0	0	0	115.1	L737 S738 D739	L737-S741 PolarHBondContact O-N 3.25Å; S738-S741 PolarHBondContact O-N 3.47Å; D739-S741 PolarHBondContact O-N 2.99Å
742	Y	85.6	Confident	91.8	Very high	6 Å²	6	26.7 Å²	26.7	2%	0.024	14%	0.137	C	C	.	.			trans	-89	149.9	172	-173	-96.8	0	0	0	111.7	Y596 I673 F677 L737 M740 H744 F765 S768	Y596-Y742 AromaticContact CD1-CD2 3.88Å; Y596-Y742 HydrophobicContact CD1-CD2 3.88Å; Y596-Y742 AromaticContact CD2-CD2 3.71Å; Y596-Y742 HydrophobicContact CD2-CD2 3.71Å; Y596-Y742 HydrophobicContact CD2-CE2 4.34Å; Y596-Y742 AromaticContact CE1-CD2 3.77Å; Y596-Y742 HydrophobicContact CE1-CD2 3.77Å; Y596-Y742 HydrophobicContact CE1-CE2 4.13Å; Y596-Y742 AromaticContact CE2-CD2 3.59Å; Y596-Y742 HydrophobicContact CE2-CD2 3.59Å; Y596-Y742 AromaticContact CE2-CE2 3.76Å; Y596-Y742 HydrophobicContact CE2-CE2 3.76Å; Y596-Y742 AromaticContact CG-CD2 3.84Å; Y596-Y742 HydrophobicContact CG-CD2 3.84Å; Y596-Y742 AromaticContact CZ-CD2 3.61Å; Y596-Y742 AromaticContact CZ-CE2 3.63Å; I673-Y742 HydrophobicContact CG2-CE2 3.9Å; F677-Y742 HydrophobicContact CE2-CD1 4.36Å; F677-Y742 HydrophobicContact CE2-CD2 4.49Å; F677-Y742 HydrophobicContact CE2-CE1 4.49Å; F677-Y742 HydrophobicContact CE2-CG 4.35Å; F677-Y742 HydrophobicContact CZ-CD1 4.07Å; F677-Y742 AromaticContact CZ-CD2 3.78Å; F677-Y742 HydrophobicContact CZ-CD2 3.78Å; F677-Y742 HydrophobicContact CZ-CE2 4.28Å; F677-Y742 AromaticContact CZ-CG 3.65Å; F677-Y742 HydrophobicContact CZ-CG 3.65Å; L737-Y742 HydrophobicContact CB-CD1 4.3Å; L737-Y742 HydrophobicContact CD1-CD1 4.23Å; L737-Y742 HydrophobicContact CD2-CD1 3.99Å; L737-Y742 HydrophobicContact CD2-CG 4.47Å; L737-Y742 HydrophobicContact CG-CD1 4.4Å; L737-Y742 PolarHBondContact O-N 3.43Å; M740-Y742 VanDerWaalsContact C-N 3.28Å; M740-Y742 PolarHBondContact O-N 3.4Å; Y742-H744 HydrophobicContact CE1-CB 4.42Å; Y742-F765 AromaticContact CE1-CD1 3.66Å; Y742-F765 HydrophobicContact CE1-CD1 3.66Å; Y742-F765 AromaticContact CE1-CE1 3.99Å; Y742-F765 HydrophobicContact CE1-CE1 3.99Å; Y742-F765 AromaticContact CZ-CD1 3.83Å; Y742-F765 WeakPolarHBondContact OH-CD1 3.44Å; Y742-S768 WeakPolarHBondContact OH-CB 3.25Å
743	V	85.8	Confident	91.7	Very high	28 Å²	28	28 Å²	28	17%	0.17	14%	0.142	C	C	.	.			trans	-130.3	123.7	177.6	-175.3	0	0	0	0	108.8	R745 F801 D806	V743-R745 HydrophobicContact CG1-CG 4.01Å; V743-F801 HydrophobicContact CG1-CB 4.19Å; V743-D806 WeakPolarHBondContact CA-OD2 3.25Å; V743-D806 WeakPolarHBondContact CG1-OD2 3.41Å
744	H	88.7	Confident	91.7	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.142	C	C	.	.			trans	-82.5	-35.4	-168.3	-173.3	-14.3	0	0	0	113.7	M734 Y742 D746 V762 S763 D764 D806	M734-H744 HydrophobicContact CE-CB 3.93Å; M734-H744 HydrophobicContact SD-CB 4.48Å; Y742-H744 HydrophobicContact CE1-CB 4.42Å; H744-D746 PolarHBondContact CE1-O 3.33Å; H744-D746 PolarHBondContact O-N 3.33Å; H744-V762 WeakPolarHBondContact CD2-CG1 3.15Å; H744-V762 WeakPolarHBondContact NE2-CG1 3.38Å; H744-S763 PolarHBondContact CE1-O 2.76Å; H744-S763 VanDerWaalsContact CE1-O 3.32Å; H744-S763 PolarHBondContact NE2-O 3.47Å; H744-D764 PolarHBondContact CE1-O 2.77Å; H744-D806 PolarHBondContact N-OD2 3.41Å
745	R	87.7	Confident	91.6	Very high	49 Å²	49	29.2 Å²	29.2	19%	0.185	15%	0.149	C	C	.	.	S	Bend	trans	66	-21	173	-42.4	-175.9	-170.6	-174	6.9	117.5	V743 R769 F801 D806	V743-R745 HydrophobicContact CG1-CG 4.01Å; R745-R769 PolarHBondContact NH1-O 3.12Å; R745-F801 HydrophobicContact CB-CD1 3.68Å; R745-F801 HydrophobicContact CB-CE1 3.94Å; R745-F801 HydrophobicContact CB-CG 4.29Å; R745-F801 HydrophobicContact CG-CB 3.98Å; R745-F801 HydrophobicContact CG-CD1 3.73Å; R745-F801 HydrophobicContact CG-CE1 4.42Å; R745-F801 HydrophobicContact CG-CG 3.87Å; R745-D806 PolarHBondContact N-OD1 3.06Å
746	D	88.3	Confident	91.4	Very high	23 Å²	23	28.7 Å²	28.7	12%	0.123	16%	0.155	C	C	.	.			trans	-130.4	54.9	172.4	-168.7	28.9	0	0	0	111.5	H744 A748 R750 N751 M767 P787	H744-D746 PolarHBondContact CE1-O 3.33Å; H744-D746 PolarHBondContact O-N 3.33Å; D746-A748 PolarHBondContact O-N 3.44Å; D746-R750 IonicContact OD1-CZ 3.61Å; D746-R750 IonicContact OD1-NE 4Å; D746-R750 IonicContact OD1-NH2 2.7Å; D746-R750 PolarHBondContact OD1-NH2 2.93Å; D746-R750 IonicContact OD2-NE 3.69Å; D746-R750 IonicContact OD2-NH2 2.97Å; D746-N751 VanDerWaalsContact CG-ND2 3.28Å; D746-N751 PolarHBondContact O-ND2 3.44Å; D746-N751 PolarHBondContact OD2-ND2 3.13Å; D746-M767 HydrophobicContact CB-CG 4.45Å; D746-P787 HydrophobicContact CB-CG 4.45Å; D746-P787 WeakPolarHBondContact OD1-CB 3.45Å; D746-P787 VanDerWaalsContact OD1-CG 3.28Å; D746-P787 WeakPolarHBondContact OD1-CG 3.44Å
747	L	94.8	Very high	91.3	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.			trans	-81	108.5	175	178.2	64.4	0	0	0	110.3	I730 M734 I752 S809 Y810 V813	I730-L747 HydrophobicContact CG2-CD1 4.39Å; M734-L747 HydrophobicContact CE-CD2 4.02Å; M734-L747 HydrophobicContact CG-CD1 4.24Å; M734-L747 HydrophobicContact CG-CD2 3.72Å; M734-L747 HydrophobicContact SD-CD1 3.87Å; M734-L747 HydrophobicContact SD-CD2 3.83Å; M734-L747 HydrophobicContact SD-CG 4.4Å; L747-I752 HydrophobicContact CD1-CD1 3.86Å; L747-S809 WeakPolarHBondContact O-CB 3.36Å; L747-Y810 HydrophobicContact CD2-CD2 4.31Å; L747-V813 HydrophobicContact CG-CG2 4.2Å
748	A	95.3	Very high	91.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.19	C	C	.	.			trans	-148.4	157.7	-179.1	0	0	0	0	0	110.5	D746 R750 N751 W790	D746-A748 PolarHBondContact O-N 3.44Å; A748-R750 HydrophobicContact CB-CG 3.72Å; A748-R750 PolarHBondContact O-N 2.64Å; A748-R750 VanDerWaalsContact O-N 3.12Å; A748-N751 PolarHBondContact O-N 2.65Å; A748-W790 VanDerWaalsContact CB-CD1 3.48Å; A748-W790 HydrophobicContact CB-CD2 4.07Å; A748-W790 HydrophobicContact CB-CG 3.91Å
749	A	96.5	Very high	91.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-59.3	-28.1	-177.8	0	0	0	0	0	113.9	L707 D708 N751 I752 E816	L707-A749 WeakPolarHBondContact CB-O 3.36Å; L707-A749 PolarHBondContact N-O 3.01Å; D708-A749 HydrophobicContact CB-CB 3.84Å; D708-A749 PolarHBondContact N-O 3.08Å; A749-N751 VanDerWaalsContact C-N 3.26Å; A749-N751 PolarHBondContact O-N 2.9Å; A749-I752 PolarHBondContact O-N 3.34Å; A749-E816 HydrophobicContact CB-CB 3.92Å; A749-E816 HydrophobicContact CB-CG 4.35Å; A749-E816 WeakPolarHBondContact CB-OE2 3.43Å; A749-E816 PolarHBondContact N-OE2 2.99Å
750	R	93.8	Very high	92.2	Very high	75 Å²	75	31.5 Å²	31.5	28%	0.283	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-59	-31.3	170.6	51.1	157	-179.2	-69.8	-5.4	114.5	S706 D708 D746 A748 W790	S706-R750 VanDerWaalsContact CB-O 3.29Å; S706-R750 WeakPolarHBondContact CB-O 3.49Å; D708-R750 WeakPolarHBondContact OD1-CA 3.29Å; D746-R750 IonicContact OD1-CZ 3.61Å; D746-R750 IonicContact OD1-NE 4Å; D746-R750 IonicContact OD1-NH2 2.7Å; D746-R750 PolarHBondContact OD1-NH2 2.93Å; D746-R750 IonicContact OD2-NE 3.69Å; D746-R750 IonicContact OD2-NH2 2.97Å; A748-R750 HydrophobicContact CB-CG 3.72Å; A748-R750 PolarHBondContact O-N 2.64Å; A748-R750 VanDerWaalsContact O-N 3.12Å; R750-W790 VanDerWaalsContact NH1-CZ3 3.3Å
751	N	94.4	Very high	92.9	Very high	13 Å²	13	31.3 Å²	31.3	7%	0.07	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-98.8	5.9	-174.4	-61.9	-1.4	0	0	0	111.5	D746 A748 A749 S763 D764	D746-N751 VanDerWaalsContact CG-ND2 3.28Å; D746-N751 PolarHBondContact O-ND2 3.44Å; D746-N751 PolarHBondContact OD2-ND2 3.13Å; A748-N751 PolarHBondContact O-N 2.65Å; A749-N751 VanDerWaalsContact C-N 3.26Å; A749-N751 PolarHBondContact O-N 2.9Å; N751-S763 CarbonylContact O-C 3.53Å; N751-S763 PolarHBondContact O-N 3.46Å; N751-S763 PolarHBondContact O-OG 3.38Å; N751-D764 HydrophobicContact CB-CB 4.39Å
752	I	97.8	Very high	93.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.5	168.5	-54.6	-54.8	0	0	0	108.6	S706 L707 I730 L747 A749 C760 K761 V762	S706-I752 CarbonylContact C-O 3.18Å; S706-I752 WeakPolarHBondContact CA-O 3.28Å; L707-I752 HydrophobicContact CB-CB 3.92Å; L707-I752 HydrophobicContact CB-CG2 4.06Å; L707-I752 HydrophobicContact CD2-CB 4.02Å; L707-I752 HydrophobicContact CD2-CG1 4.46Å; L707-I752 HydrophobicContact CD2-CG2 3.79Å; L707-I752 PolarHBondContact N-O 3.43Å; I730-I752 HydrophobicContact CD1-CG1 4.12Å; I730-I752 HydrophobicContact CD1-CG2 4Å; I730-I752 HydrophobicContact CG1-CD1 4.23Å; I730-I752 HydrophobicContact CG1-CG1 4.23Å; I730-I752 HydrophobicContact CG1-CG2 3.87Å; I730-I752 HydrophobicContact CG2-CD1 3.87Å; I730-I752 HydrophobicContact CG2-CG1 4.43Å; L747-I752 HydrophobicContact CD1-CD1 3.86Å; A749-I752 PolarHBondContact O-N 3.34Å; I752-C760 HydrophobicContact CG2-CB 3.65Å; I752-K761 CarbonylContact C-O 3.38Å; I752-K761 WeakPolarHBondContact CA-O 3.45Å; I752-V762 HydrophobicContact CD1-CB 4.25Å; I752-V762 HydrophobicContact CD1-CG1 4.39Å; I752-V762 HydrophobicContact CD1-CG2 3.93Å
753	L	96.6	Very high	93.9	Very high	45 Å²	45	27.7 Å²	27.7	24%	0.236	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	148.7	174.8	-65.5	172.6	0	0	0	111.3	I683 M702 G705 C760 K761	I683-L753 HydrophobicContact CD1-CD1 3.92Å; I683-L753 HydrophobicContact CG1-CD1 4.4Å; M702-L753 HydrophobicContact CB-CB 3.89Å; M702-L753 HydrophobicContact CB-CD1 4.49Å; M702-L753 VanDerWaalsContact CE-C 3.48Å; M702-L753 HydrophobicContact CE-CB 3.92Å; M702-L753 VanDerWaalsContact CE-O 3.27Å; M702-L753 WeakPolarHBondContact CE-O 3.37Å; M702-L753 HydrophobicContact CG-CB 3.78Å; M702-L753 HydrophobicContact CG-CD1 4.15Å; G705-L753 CarbonylContact O-C 3.59Å; G705-L753 WeakPolarHBondContact O-CA 3.13Å; L753-C760 CarbonylContact O-C 3.6Å; L753-C760 WeakPolarHBondContact O-CA 3.29Å; L753-K761 PolarHBondContact N-O 3.31Å; L753-K761 PolarHBondContact O-N 3.47Å
754	V	97.1	Very high	93.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.1	-176.5	-169.2	0	0	0	0	110.7	M702 N704 G705 L707 F710	M702-V754 CarbonylContact C-O 3.47Å; N704-V754 HydrophobicContact CB-CB 3.93Å; N704-V754 HydrophobicContact CB-CG1 4.13Å; N704-V754 WeakPolarHBondContact CB-O 3.28Å; N704-V754 PolarHBondContact N-O 3.06Å; G705-V754 PolarHBondContact O-N 2.98Å; L707-V754 HydrophobicContact CB-CG2 3.72Å; L707-V754 HydrophobicContact CD1-CG2 3.66Å; L707-V754 HydrophobicContact CG-CG2 4.25Å; F710-V754 HydrophobicContact CD1-CB 4.41Å; F710-V754 HydrophobicContact CD1-CG1 4.1Å; F710-V754 HydrophobicContact CD1-CG2 4.26Å; F710-V754 HydrophobicContact CE1-CG1 4.06Å
755	N	94.6	Very high	93.4	Very high	26 Å²	26	29.6 Å²	29.6	14%	0.139	16%	0.155	C	C	.	.			trans	-97.7	176.8	175.4	79.2	3.7	0	0	0	112.7	M702 E703 N704 N757 L758 V759	M702-N755 HydrophobicContact CE-CB 3.93Å; M702-N755 HydrophobicContact SD-CB 3.93Å; E703-N755 WeakPolarHBondContact OE2-CA 3.34Å; E703-N755 VanDerWaalsContact OE2-CB 3.29Å; E703-N755 WeakPolarHBondContact OE2-CB 3.41Å; N704-N755 PolarHBondContact ND2-O 2.96Å; N755-N757 PolarHBondContact O-N 3.16Å; N755-N757 VanDerWaalsContact O-N 3.13Å; N755-N757 WeakPolarHBondContact OD1-CA 3.42Å; N755-N757 PolarHBondContact OD1-N 3.36Å; N755-L758 PolarHBondContact O-N 3.05Å; N755-L758 PolarHBondContact OD1-N 3.14Å; N755-V759 PolarHBondContact N-O 2.93Å; N755-V759 WeakPolarHBondContact OD1-CB 3.5Å; N755-V759 PolarHBondContact OD1-N 3.06Å
756	S	92.6	Very high	92.1	Very high	64 Å²	64	28.3 Å²	28.3	45%	0.448	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-24.9	-179.6	54.4	0	0	0	0	114.2	E703	E703-S756 VanDerWaalsContact CD-CB 3.48Å; E703-S756 WeakPolarHBondContact OE1-CB 3.2Å; E703-S756 PolarHBondContact OE1-OG 3.36Å; E703-S756 PolarHBondContact OE2-N 3.32Å
757	N	93.7	Very high	90.3	Very high	126 Å²	126	30 Å²	30	67%	0.674	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	15.9	178.8	-61.7	-65.1	0	0	0	114	N755 V759	N755-N757 PolarHBondContact O-N 3.16Å; N755-N757 VanDerWaalsContact O-N 3.13Å; N755-N757 WeakPolarHBondContact OD1-CA 3.42Å; N755-N757 PolarHBondContact OD1-N 3.36Å; N757-V759 HydrophobicContact CB-CG2 4.24Å; N757-V759 PolarHBondContact O-N 3.02Å
758	L	93.9	Very high	88.3	Confident	48 Å²	48	30.3 Å²	30.3	25%	0.251	17%	0.168	S	C	.	.			trans	61.1	19.6	-175.9	-48.4	179.8	0	0	0	114.4	F710 F718 M726 N755 C760	F710-L758 HydrophobicContact CE1-CD2 3.78Å; F710-L758 HydrophobicContact CZ-CD2 3.53Å; F718-L758 HydrophobicContact CE1-CD1 4.32Å; F718-L758 HydrophobicContact CE1-CD2 4.25Å; M726-L758 HydrophobicContact CE-CB 4.11Å; M726-L758 HydrophobicContact CE-CD1 4.23Å; M726-L758 HydrophobicContact CE-CD2 4.12Å; M726-L758 HydrophobicContact CE-CG 4.39Å; N755-L758 PolarHBondContact O-N 3.05Å; N755-L758 PolarHBondContact OD1-N 3.14Å; L758-C760 PolarHBondContact O-N 3.36Å
759	V	96.5	Very high	86.2	Confident	52 Å²	52	34.1 Å²	34.1	32%	0.315	18%	0.182	S	C	.	.			trans	-78.9	114.6	174.9	-175.1	0	0	0	0	108.9	N755 N757	N755-V759 PolarHBondContact N-O 2.93Å; N755-V759 WeakPolarHBondContact OD1-CB 3.5Å; N755-V759 PolarHBondContact OD1-N 3.06Å; N757-V759 HydrophobicContact CB-CG2 4.24Å; N757-V759 PolarHBondContact O-N 3.02Å
760	C	97.7	Very high	83.3	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.007	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	136.1	172	-66.1	0	0	0	0	111.4	N681 M726 I730 I752 L753 L758	N681-C760 PolarHBondContact ND2-O 2.86Å; M726-C760 VanDerWaalsContact CB-SG 3.59Å; I730-C760 HydrophobicContact CD1-CB 4.2Å; I730-C760 HydrophobicContact CG1-CB 3.67Å; I752-C760 HydrophobicContact CG2-CB 3.65Å; L753-C760 CarbonylContact O-C 3.6Å; L753-C760 WeakPolarHBondContact O-CA 3.29Å; L758-C760 PolarHBondContact O-N 3.36Å
761	K	97.6	Very high	80.4	Confident	20 Å²	20	39.8 Å²	39.8	9%	0.087	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.4	174	-62.4	-169.6	164.8	-148.2	0	111.3	P680 N681 I682 I683 E700 M702 I752 L753	P680-K761 WeakPolarHBondContact O-CE 3.41Å; N681-K761 WeakPolarHBondContact O-CA 3.38Å; I682-K761 WeakPolarHBondContact O-CD 3.19Å; I683-K761 HydrophobicContact CD1-CD 4.49Å; E700-K761 WeakPolarHBondContact OE1-CD 3.47Å; E700-K761 WeakPolarHBondContact OE1-CE 3.45Å; E700-K761 IonicContact OE1-NZ 2.74Å; E700-K761 PolarHBondContact OE1-NZ 2.9Å; E700-K761 VanDerWaalsContact OE2-CE 3.32Å; E700-K761 WeakPolarHBondContact OE2-CE 3.41Å; E700-K761 IonicContact OE2-NZ 2.87Å; E700-K761 PolarHBondContact OE2-NZ 2.86Å; M702-K761 HydrophobicContact CE-CB 3.87Å; M702-K761 HydrophobicContact CE-CD 3.79Å; M702-K761 HydrophobicContact CE-CG 3.68Å; M702-K761 HydrophobicContact SD-CD 3.92Å; M702-K761 HydrophobicContact SD-CG 4.47Å; I752-K761 CarbonylContact C-O 3.38Å; I752-K761 WeakPolarHBondContact CA-O 3.45Å; L753-K761 PolarHBondContact N-O 3.31Å; L753-K761 PolarHBondContact O-N 3.47Å
762	V	96.8	Very high	77.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137.3	174.6	-174.8	0	0	0	0	109.7	N681 I682 I683 I730 M734 L737 H744 I752	N681-V762 PolarHBondContact O-N 3.31Å; I682-V762 HydrophobicContact CD1-CB 3.81Å; I682-V762 HydrophobicContact CD1-CG2 4.13Å; I683-V762 WeakPolarHBondContact CG2-O 3.32Å; I683-V762 PolarHBondContact N-O 3.12Å; I730-V762 HydrophobicContact CG2-CG2 4.36Å; M734-V762 HydrophobicContact CG-CG2 4.37Å; M734-V762 HydrophobicContact SD-CG1 4.01Å; M734-V762 HydrophobicContact SD-CG2 4.15Å; L737-V762 HydrophobicContact CD1-CG1 4.24Å; H744-V762 WeakPolarHBondContact CD2-CG1 3.15Å; H744-V762 WeakPolarHBondContact NE2-CG1 3.38Å; I752-V762 HydrophobicContact CD1-CB 4.25Å; I752-V762 HydrophobicContact CD1-CG1 4.39Å; I752-V762 HydrophobicContact CD1-CG2 3.93Å
763	S	92.5	Very high	74.3	Confident	11 Å²	11	55.8 Å²	55.8	8%	0.077	30%	0.3	C	S	.	.			trans	-150.9	179.8	-176	71.1	0	0	0	0	112.2	H744 N751	H744-S763 PolarHBondContact CE1-O 2.76Å; H744-S763 VanDerWaalsContact CE1-O 3.32Å; H744-S763 PolarHBondContact NE2-O 3.47Å; N751-S763 CarbonylContact O-C 3.53Å; N751-S763 PolarHBondContact O-N 3.46Å; N751-S763 PolarHBondContact O-OG 3.38Å
764	D	83.2	Confident	71.2	Confident	67 Å²	67	58.7 Å²	58.7	36%	0.358	32%	0.316	S	S	.	.			trans	57.3	91.6	-173.2	-157.5	-15.6	0	0	0	115.1	H744 N751 G766	H744-D764 PolarHBondContact CE1-O 2.77Å; N751-D764 HydrophobicContact CB-CB 4.39Å; D764-G766 PolarHBondContact OD1-N 3.39Å; D764-G766 VanDerWaalsContact OD1-N 3.12Å
765	F	79.4	Confident	68	Low	1 Å²	1	64.9 Å²	64.9	0%	0.004	36%	0.356	C	S	.	.			trans	-98.2	8.5	-179.6	-60.3	-78.8	0	0	0	113.2	I673 M674 F677 I682 I683 L737 Y742 M767 S768	I673-F765 HydrophobicContact CB-CB 4.35Å; I673-F765 HydrophobicContact CD1-CB 4.31Å; I673-F765 HydrophobicContact CG2-CB 3.82Å; I673-F765 HydrophobicContact CG2-CD1 4.06Å; I673-F765 HydrophobicContact CG2-CG 3.88Å; M674-F765 HydrophobicContact CG-CD2 3.41Å; M674-F765 VanDerWaalsContact CG-CD2 3.41Å; M674-F765 HydrophobicContact CG-CE2 3.65Å; M674-F765 HydrophobicContact CG-CG 4.5Å; M674-F765 HydrophobicContact SD-CD2 4.13Å; M674-F765 HydrophobicContact SD-CE2 4.34Å; F677-F765 HydrophobicContact CD2-CE1 4.25Å; F677-F765 HydrophobicContact CD2-CZ 4.13Å; F677-F765 HydrophobicContact CE2-CD1 4.29Å; F677-F765 AromaticContact CE2-CE1 3.94Å; F677-F765 HydrophobicContact CE2-CE1 3.94Å; F677-F765 HydrophobicContact CE2-CZ 4.28Å; I682-F765 HydrophobicContact CG2-CZ 3.99Å; I683-F765 HydrophobicContact CG2-CE2 4Å; L737-F765 HydrophobicContact CD1-CE1 4.11Å; L737-F765 HydrophobicContact CD2-CE1 4.4Å; Y742-F765 AromaticContact CE1-CD1 3.66Å; Y742-F765 HydrophobicContact CE1-CD1 3.66Å; Y742-F765 AromaticContact CE1-CE1 3.99Å; Y742-F765 HydrophobicContact CE1-CE1 3.99Å; Y742-F765 AromaticContact CZ-CD1 3.83Å; Y742-F765 WeakPolarHBondContact OH-CD1 3.44Å; F765-M767 PolarHBondContact O-N 3.49Å; F765-S768 PolarHBondContact O-OG 2.94Å
766	G	60.1	Low	65	Low	23 Å²	23	72.3 Å²	72.3	24%	0.237	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8.4	-169	0	0	0	0	0	116.5	D764	D764-G766 PolarHBondContact OD1-N 3.39Å; D764-G766 VanDerWaalsContact OD1-N 3.12Å
767	M	51.9	Low	61.9	Low	59 Å²	59	72.1 Å²	72.1	29%	0.291	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	4	-174	-76.5	-67.4	-70.9	0	0	115.3	D746 F765 R769 K785	D746-M767 HydrophobicContact CB-CG 4.45Å; F765-M767 PolarHBondContact O-N 3.49Å; M767-R769 PolarHBondContact O-N 3.25Å; M767-K785 WeakPolarHBondContact CE-O 3.22Å
768	S	51.5	Low	58.9	Low	6 Å²	6	69.6 Å²	69.6	4%	0.042	39%	0.389	C	S	.	.			trans	-78	58.3	179.6	65.9	0	0	0	0	113.8	I673 Y742 F765	I673-S768 WeakPolarHBondContact CD1-OG 3.27Å; Y742-S768 WeakPolarHBondContact OH-CB 3.25Å; F765-S768 PolarHBondContact O-OG 2.94Å
769	R	51.2	Low	55.9	Low	79 Å²	79	78.4 Å²	78.4	30%	0.298	42%	0.42	S	S	.	.			trans	-84.7	142.4	176.2	-67.6	-174.3	174.3	120.8	-4.2	111.9	D666 R745 M767	D666-R769 IonicContact OD2-CZ 3.52Å; D666-R769 IonicContact OD2-NE 3.51Å; D666-R769 IonicContact OD2-NH2 3.58Å; D666-R769 PolarHBondContact OD2-NH2 3.23Å; R745-R769 PolarHBondContact NH1-O 3.12Å; M767-R769 PolarHBondContact O-N 3.25Å
770	V	36.7	Very low	52.7	Low	88 Å²	88	81.5 Å²	81.5	53%	0.533	44%	0.44	S	S	.	.			trans	-60.8	150.3	-176.7	177.2	0	0	0	0	111.8	F600	F600-V770 HydrophobicContact CB-CG2 4.19Å
771	L	33.8	Very low	49.6	Very low	106 Å²	106	86.2 Å²	86.2	56%	0.555	47%	0.469	S	S	*	.			trans	-85.6	115.7	167.7	-69.7	166.4	0	0	0	108.2
772	E	31	Very low	46.6	Very low	182 Å²	182	97.8 Å²	97.8	85%	0.85	51%	0.512	S	S	*	.			trans	-94.8	130.9	166.7	-68.1	179.5	157.2	0	0	108.5	D774	E772-D774 PolarHBondContact O-N 3.18Å
773	D	32.7	Very low	44	Very low	168 Å²	168	99.3 Å²	99.3	90%	0.898	53%	0.527	S	S	*	.			trans	-77.8	82	-178.5	-73.8	-53	0	0	0	111.5
774	D	30.1	Very low	42.1	Very low	105 Å²	105	100 Å²	100	56%	0.561	54%	0.536	S	S	*	.			trans	-109.8	105.1	166.7	-175.3	-16.2	0	0	0	110.3	E772 E776 A777	E772-D774 PolarHBondContact O-N 3.18Å; D774-E776 VanDerWaalsContact C-N 3.33Å; D774-E776 PolarHBondContact O-N 2.97Å; D774-E776 PolarHBondContact OD1-N 3.11Å; D774-A777 HydrophobicContact CB-CB 4.38Å
775	P	31	Very low	40.9	Very low	131 Å²	131	106 Å²	106	85%	0.851	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	-13.6	-179.4	-21.9	35.1	0	0	0	116.2
776	E	30.8	Very low	40.5	Very low	181 Å²	181	107.9 Å²	107.9	85%	0.846	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	-7.1	-171.9	-67.6	-161.3	116.3	0	0	114.5	D774 A778	D774-E776 VanDerWaalsContact C-N 3.33Å; D774-E776 PolarHBondContact O-N 2.97Å; D774-E776 PolarHBondContact OD1-N 3.11Å; E776-A778 PolarHBondContact O-N 3.41Å
777	A	28.1	Very low	41.8	Very low	61 Å²	61	107.9 Å²	107.9	50%	0.504	56%	0.564	S	S	.	*			trans	-74.8	53.8	-172.5	0	0	0	0	0	115.8	D774	D774-A777 HydrophobicContact CB-CB 4.38Å
778	A	29.5	Very low	43.5	Very low	72 Å²	72	106.4 Å²	106.4	60%	0.595	56%	0.558	S	S	*	*			trans	-69.3	131.8	175.2	0	0	0	0	0	112.4	E776 T780	E776-A778 PolarHBondContact O-N 3.41Å; A778-T780 PolarHBondContact O-N 2.88Å
779	Y	32.7	Very low	45.5	Very low	233 Å²	233	106.8 Å²	106.8	91%	0.914	56%	0.558	S	S	*	*	S	Bend	trans	64.9	7.6	166.2	-60.4	-72.8	0	0	0	120.7
780	T	28.6	Very low	47.5	Very low	118 Å²	118	104.7 Å²	104.7	72%	0.724	55%	0.55	S	S	*	*			trans	-128.1	127.9	163.2	58.8	0	0	0	0	113.1	A778 R782	A778-T780 PolarHBondContact O-N 2.88Å; T780-R782 PolarHBondContact O-N 2.81Å
781	T	32.5	Very low	50.2	Low	100 Å²	100	100.7 Å²	100.7	61%	0.613	53%	0.526	S	S	*	.			trans	-94.8	97.3	-162.2	55	0	0	0	0	114	G783	T781-G783 PolarHBondContact O-N 3.03Å
782	R	35.5	Very low	53	Low	262 Å²	262	95.7 Å²	95.7	99%	0.989	50%	0.5	S	S	*	.	S	Bend	trans	-73.3	-5.6	163.4	-73.1	-171.6	173.4	-168.4	0.8	114.3	T780	T780-R782 PolarHBondContact O-N 2.81Å
783	G	42.2	Very low	55.8	Low	32 Å²	32	88.1 Å²	88.1	33%	0.33	47%	0.466	S	S	.	.	S	Bend	trans	-132.6	69.2	-175.9	0	0	0	0	0	115	T781 R799	T781-G783 PolarHBondContact O-N 3.03Å; G783-R799 PolarHBondContact O-NH1 3.33Å
784	G	50.7	Low	58.4	Low	25 Å²	25	81.1 Å²	81.1	26%	0.258	43%	0.428	S	S	.	.			trans	71.9	170	164.3	0	0	0	0	0	117.7
785	K	59.3	Low	61.1	Low	195 Å²	195	76.1 Å²	76.1	85%	0.848	40%	0.402	S	S	*	.			trans	-84.4	136.6	169.5	-66.5	-178.6	178.5	179.6	0	109.2	M767	M767-K785 WeakPolarHBondContact CE-O 3.22Å
786	I	70.4	Confident	63.7	Low	39 Å²	39	71.5 Å²	71.5	20%	0.2	37%	0.369	C	S	.	.			trans	-97.6	132.8	177.2	-64.2	-179.8	0	0	0	109.8	I788 T791 R799	I786-I788 VanDerWaalsContact C-N 3.27Å; I786-I788 HydrophobicContact CB-CD1 4.24Å; I786-I788 HydrophobicContact CG2-CD1 4.01Å; I786-I788 PolarHBondContact O-N 3Å; I786-T791 HydrophobicContact CG2-CG2 3.76Å; I786-T791 WeakPolarHBondContact CG2-OG1 3.43Å; I786-R799 HydrophobicContact CD1-CG 4.33Å
787	P	86.9	Confident	66.1	Low	23 Å²	23	65.5 Å²	65.5	15%	0.149	35%	0.35	C	S	.	.			trans	-79.7	69.4	-179.3	34.9	-37.7	0	0	0	111.3	D746 R789 W790 T791	D746-P787 HydrophobicContact CB-CG 4.45Å; D746-P787 WeakPolarHBondContact OD1-CB 3.45Å; D746-P787 VanDerWaalsContact OD1-CG 3.28Å; D746-P787 WeakPolarHBondContact OD1-CG 3.44Å; P787-R789 VanDerWaalsContact C-N 3.33Å; P787-R789 PolarHBondContact O-N 2.89Å; P787-W790 HydrophobicContact CB-CE3 4.1Å; P787-W790 PolarHBondContact O-N 2.81Å; P787-T791 PolarHBondContact O-N 3.1Å; P787-T791 PolarHBondContact O-OG1 2.94Å
788	I	87.9	Confident	68.4	Low	29 Å²	29	70.3 Å²	70.3	15%	0.149	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-37.7	-52.5	-168	-59	-57.4	0	0	0	114.6	I786 W790 T791 I796 N830 V833 I834	I786-I788 VanDerWaalsContact C-N 3.27Å; I786-I788 HydrophobicContact CB-CD1 4.24Å; I786-I788 HydrophobicContact CG2-CD1 4.01Å; I786-I788 PolarHBondContact O-N 3Å; I788-W790 PolarHBondContact O-N 2.93Å; I788-W790 VanDerWaalsContact O-N 3.15Å; I788-T791 PolarHBondContact O-N 2.83Å; I788-I796 HydrophobicContact CG2-CD1 4.25Å; I788-N830 HydrophobicContact CB-CB 4.46Å; I788-N830 HydrophobicContact CG1-CB 4.35Å; I788-N830 HydrophobicContact CG2-CB 4.4Å; I788-V833 HydrophobicContact CG2-CG1 4.31Å; I788-I834 HydrophobicContact CD1-CD1 4.37Å; I788-I834 HydrophobicContact CG2-CD1 4.08Å; I788-I834 HydrophobicContact CG2-CG1 3.71Å
789	R	93.3	Very high	70.6	Confident	13 Å²	13	70.9 Å²	70.9	5%	0.049	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-62.1	-22.7	-175.8	-64.5	163.8	-170.4	-88.5	-8.1	115.2	P787 R823 P824 Y825 W826 M828 N830 V833	P787-R789 VanDerWaalsContact C-N 3.33Å; P787-R789 PolarHBondContact O-N 2.89Å; R789-R823 VanDerWaalsContact NH2-NH2 3.19Å; R789-P824 HydrophobicContact CB-CB 4.39Å; R789-P824 WeakPolarHBondContact CD-O 3.46Å; R789-P824 PolarHBondContact NH1-O 3.4Å; R789-Y825 HydrophobicContact CB-CD2 4.33Å; R789-Y825 HydrophobicContact CG-CD2 4.43Å; R789-Y825 PolarHBondContact NH1-O 2.83Å; R789-W826 PolarHBondContact NH1-O 2.87Å; R789-M828 PolarHBondContact NH2-O 3.11Å; R789-N830 PolarHBondContact NE-OD1 3.32Å; R789-N830 PolarHBondContact NH2-OD1 3.21Å; R789-V833 HydrophobicContact CG-CG1 4.32Å; R789-V833 HydrophobicContact CG-CG2 4.49Å
790	W	94.9	Very high	72.5	Confident	36 Å²	36	65.7 Å²	65.7	14%	0.136	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-102.4	-9.4	176.7	-62.6	-97.1	0	0	0	112.4	A748 R750 P787 I788 S809 I812 E816 P824	A748-W790 VanDerWaalsContact CB-CD1 3.48Å; A748-W790 HydrophobicContact CB-CD2 4.07Å; A748-W790 HydrophobicContact CB-CG 3.91Å; R750-W790 VanDerWaalsContact NH1-CZ3 3.3Å; P787-W790 HydrophobicContact CB-CE3 4.1Å; P787-W790 PolarHBondContact O-N 2.81Å; I788-W790 PolarHBondContact O-N 2.93Å; I788-W790 VanDerWaalsContact O-N 3.15Å; W790-S809 VanDerWaalsContact O-CA 3.32Å; W790-S809 WeakPolarHBondContact O-CA 3.4Å; W790-S809 WeakPolarHBondContact O-CB 3.41Å; W790-S809 PolarHBondContact O-OG 2.88Å; W790-I812 HydrophobicContact CG-CG2 4.07Å; W790-E816 WeakPolarHBondContact CZ2-OE1 3.05Å; W790-E816 PolarHBondContact NE1-OE1 3.5Å; W790-E816 PolarHBondContact NE1-OE2 2.86Å; W790-P824 HydrophobicContact CZ2-CG 4.03Å
791	T	91.8	Very high	75	Confident	3 Å²	3	62 Å²	62	2%	0.018	30%	0.299	C	S	.	.	S	Bend	trans	-89.5	138.8	-169.3	-52.4	0	0	0	0	111.1	I786 P787 I788 A795 I796 F801 W808	I786-T791 HydrophobicContact CG2-CG2 3.76Å; I786-T791 WeakPolarHBondContact CG2-OG1 3.43Å; P787-T791 PolarHBondContact O-N 3.1Å; P787-T791 PolarHBondContact O-OG1 2.94Å; I788-T791 PolarHBondContact O-N 2.83Å; T791-A795 HydrophobicContact CG2-CB 3.6Å; T791-I796 HydrophobicContact CG2-CG1 3.66Å; T791-F801 HydrophobicContact CG2-CE1 4.43Å; T791-W808 PolarHBondContact O-NE1 3.32Å
792	A	92.6	Very high	77.5	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.008	28%	0.281	C	S	.	.			trans	-70.2	152	177	0	0	0	0	0	112.6	E794 A795 I796 W808	A792-E794 VanDerWaalsContact C-N 3.3Å; A792-E794 WeakPolarHBondContact CB-OE1 3.33Å; A792-E794 WeakPolarHBondContact CB-OE2 3.27Å; A792-E794 PolarHBondContact O-N 3.42Å; A792-A795 WeakPolarHBondContact O-CA 3.38Å; A792-A795 PolarHBondContact O-N 2.89Å; A792-I796 PolarHBondContact O-N 3.07Å; A792-W808 HydrophobicContact CB-CB 3.74Å; A792-W808 HydrophobicContact CB-CD2 4.15Å; A792-W808 HydrophobicContact CB-CG 3.75Å
793	P	91.1	Very high	80	Confident	23 Å²	23	48.1 Å²	48.1	15%	0.149	25%	0.245	C	C	.	.	H	α-helix	trans	-53.7	-42.6	-177	-24.9	32.6	0	0	0	113.6	A795 I796 A797 W808 I837	P793-A795 VanDerWaalsContact C-N 3.28Å; P793-A795 PolarHBondContact O-N 3.08Å; P793-I796 PolarHBondContact O-N 3.41Å; P793-A797 WeakPolarHBondContact O-CB 3.23Å; P793-A797 PolarHBondContact O-N 2.79Å; P793-W808 HydrophobicContact CG-CE3 4.34Å; P793-W808 HydrophobicContact CG-CH2 3.6Å; P793-W808 HydrophobicContact CG-CZ2 4.09Å; P793-W808 HydrophobicContact CG-CZ3 3.73Å; P793-I837 HydrophobicContact CG-CG2 3.76Å
794	E	87.3	Confident	82.2	Confident	22 Å²	22	47.6 Å²	47.6	10%	0.103	24%	0.238	C	C	.	.	H	α-helix	trans	-70.9	-22.3	179.9	74.6	-75.5	-177	0	0	113.8	A792 Y798 R799 K800 R868	A792-E794 VanDerWaalsContact C-N 3.3Å; A792-E794 WeakPolarHBondContact CB-OE1 3.33Å; A792-E794 WeakPolarHBondContact CB-OE2 3.27Å; A792-E794 PolarHBondContact O-N 3.42Å; E794-Y798 HydrophobicContact CB-CD2 4.33Å; E794-Y798 CarbonylContact O-C 3.58Å; E794-Y798 WeakPolarHBondContact O-CA 3.09Å; E794-Y798 WeakPolarHBondContact O-CB 3.08Å; E794-Y798 PolarHBondContact O-N 3.08Å; E794-Y798 VanDerWaalsContact O-N 3.12Å; E794-R799 PolarHBondContact O-N 2.77Å; E794-K800 PolarHBondContact O-N 3.05Å; E794-R868 IonicContact OE1-CZ 2.69Å; E794-R868 IonicContact OE1-NH1 3.61Å; E794-R868 PolarHBondContact OE1-NH1 2.85Å; E794-R868 IonicContact OE1-NH2 2.69Å; E794-R868 IonicContact OE2-CZ 3.37Å; E794-R868 IonicContact OE2-NH1 2.69Å; E794-R868 PolarHBondContact OE2-NH1 2.89Å; E794-R868 IonicContact OE2-NH2 2.89Å; E794-R868 PolarHBondContact OE2-NH2 3.5Å
795	A	86.9	Confident	84.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-87.7	-26.5	174.6	0	0	0	0	0	112.2	T791 A792 P793 R799 F801	T791-A795 HydrophobicContact CG2-CB 3.6Å; A792-A795 WeakPolarHBondContact O-CA 3.38Å; A792-A795 PolarHBondContact O-N 2.89Å; P793-A795 VanDerWaalsContact C-N 3.28Å; P793-A795 PolarHBondContact O-N 3.08Å; A795-R799 VanDerWaalsContact O-CA 3.29Å; A795-R799 WeakPolarHBondContact O-CA 3.47Å; A795-R799 PolarHBondContact O-N 3.01Å; A795-F801 HydrophobicContact CB-CD1 3.92Å; A795-F801 HydrophobicContact CB-CE1 3.83Å; A795-F801 HydrophobicContact CB-CG 4.43Å; A795-F801 HydrophobicContact CB-CZ 4.23Å
796	I	84.8	Confident	85.7	Confident	34 Å²	34	37.2 Å²	37.2	17%	0.174	19%	0.186	C	C	.	.	H	α-helix	trans	-70.6	-57.7	167.5	-62.5	172.3	0	0	0	109.8	I788 T791 A792 P793 I834	I788-I796 HydrophobicContact CG2-CD1 4.25Å; T791-I796 HydrophobicContact CG2-CG1 3.66Å; A792-I796 PolarHBondContact O-N 3.07Å; P793-I796 PolarHBondContact O-N 3.41Å; I796-I834 HydrophobicContact CD1-CG1 4.36Å; I796-I834 HydrophobicContact CG2-CD1 4.06Å; I796-I834 HydrophobicContact CG2-CG1 4.16Å
797	A	81.1	Confident	87	Confident	54 Å²	54	35.6 Å²	35.6	45%	0.446	18%	0.178	S	C	.	.	H	α-helix	trans	-74	-35.9	-171.4	0	0	0	0	0	114	P793	P793-A797 WeakPolarHBondContact O-CB 3.23Å; P793-A797 PolarHBondContact O-N 2.79Å
798	Y	76.8	Confident	87.5	Confident	162 Å²	162	34.5 Å²	34.5	64%	0.635	17%	0.171	S	C	*	.	H	α-helix	trans	-126.8	5.1	-171.3	-46.3	-62.7	0	0	0	114.4	E794 K800	E794-Y798 HydrophobicContact CB-CD2 4.33Å; E794-Y798 CarbonylContact O-C 3.58Å; E794-Y798 WeakPolarHBondContact O-CA 3.09Å; E794-Y798 WeakPolarHBondContact O-CB 3.08Å; E794-Y798 PolarHBondContact O-N 3.08Å; E794-Y798 VanDerWaalsContact O-N 3.12Å; Y798-K800 PolarHBondContact O-N 3.41Å; Y798-K800 VanDerWaalsContact O-N 3.07Å
799	R	74.6	Confident	88	Confident	85 Å²	85	33.3 Å²	33.3	32%	0.321	17%	0.165	S	C	.	.			trans	53.4	23.2	-173.9	-66.8	-177.4	166.1	-112.7	-9.5	114.7	G783 I786 E794 A795 F801	G783-R799 PolarHBondContact O-NH1 3.33Å; I786-R799 HydrophobicContact CD1-CG 4.33Å; E794-R799 PolarHBondContact O-N 2.77Å; A795-R799 VanDerWaalsContact O-CA 3.29Å; A795-R799 WeakPolarHBondContact O-CA 3.47Å; A795-R799 PolarHBondContact O-N 3.01Å; R799-F801 HydrophobicContact CB-CE2 4.37Å; R799-F801 WeakPolarHBondContact O-CD2 3.3Å; R799-F801 PolarHBondContact O-N 2.78Å; R799-F801 VanDerWaalsContact O-N 3.11Å
800	K	73.2	Confident	88.2	Confident	124 Å²	124	32.7 Å²	32.7	54%	0.539	16%	0.163	S	C	.	.			trans	-86	78.2	-177	-74.3	174	-175.2	172.5	0	112.3	E794 Y798	E794-K800 PolarHBondContact O-N 3.05Å; Y798-K800 PolarHBondContact O-N 3.41Å; Y798-K800 VanDerWaalsContact O-N 3.07Å
801	F	81.9	Confident	88.4	Confident	39 Å²	39	31 Å²	31	17%	0.171	16%	0.156	C	C	.	.			trans	-71.6	133.1	175	-61.5	-84.6	0	0	0	112.1	V743 R745 T791 A795 R799	V743-F801 HydrophobicContact CG1-CB 4.19Å; R745-F801 HydrophobicContact CB-CD1 3.68Å; R745-F801 HydrophobicContact CB-CE1 3.94Å; R745-F801 HydrophobicContact CB-CG 4.29Å; R745-F801 HydrophobicContact CG-CB 3.98Å; R745-F801 HydrophobicContact CG-CD1 3.73Å; R745-F801 HydrophobicContact CG-CE1 4.42Å; R745-F801 HydrophobicContact CG-CG 3.87Å; T791-F801 HydrophobicContact CG2-CE1 4.43Å; A795-F801 HydrophobicContact CB-CD1 3.92Å; A795-F801 HydrophobicContact CB-CE1 3.83Å; A795-F801 HydrophobicContact CB-CG 4.43Å; A795-F801 HydrophobicContact CB-CZ 4.23Å; R799-F801 HydrophobicContact CB-CE2 4.37Å; R799-F801 WeakPolarHBondContact O-CD2 3.3Å; R799-F801 PolarHBondContact O-N 2.78Å; R799-F801 VanDerWaalsContact O-N 3.11Å
802	T	85	Confident	88.7	Confident	36 Å²	36	30.9 Å²	30.9	22%	0.221	16%	0.155	C	C	.	.			trans	-150.9	170.4	177	62.7	0	0	0	0	110.4	A804 S805 D806	T802-A804 PolarHBondContact O-N 2.89Å; T802-A804 PolarHBondContact OG1-N 2.84Å; T802-S805 PolarHBondContact N-OG 2.91Å; T802-S805 PolarHBondContact O-N 2.9Å; T802-S805 PolarHBondContact O-OG 3.03Å; T802-S805 PolarHBondContact OG1-N 2.91Å; T802-D806 PolarHBondContact O-N 3.32Å; T802-D806 VanDerWaalsContact O-N 3.12Å
803	S	87.4	Confident	89	Confident	35 Å²	35	30.8 Å²	30.8	25%	0.245	16%	0.155	C	C	.	.	H	α-helix	trans	-55	-25.9	170.6	-41	0	0	0	0	113.2	S738 V807	S738-S803 VanDerWaalsContact OG-CB 3.26Å; S738-S803 WeakPolarHBondContact OG-CB 3.13Å; S738-S803 PolarHBondContact OG-OG 3.12Å; S803-V807 WeakPolarHBondContact O-CG2 3.33Å; S803-V807 PolarHBondContact O-N 2.9Å
804	A	88.7	Confident	89.3	Confident	21 Å²	21	29.7 Å²	29.7	17%	0.174	15%	0.148	C	C	.	.	H	α-helix	trans	-78.5	-22.9	175.7	0	0	0	0	0	113.6	T802 W808 R865 R868	T802-A804 PolarHBondContact O-N 2.89Å; T802-A804 PolarHBondContact OG1-N 2.84Å; A804-W808 PolarHBondContact O-N 3.38Å; A804-R865 HydrophobicContact CB-CB 4.04Å; A804-R865 WeakPolarHBondContact CB-O 3.3Å; A804-R868 WeakPolarHBondContact O-CD 3.44Å; A804-R868 PolarHBondContact O-NH1 2.59Å
805	S	89.8	Confident	89.8	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.014	14%	0.144	C	C	.	.	H	α-helix	trans	-76.6	-36.8	168.1	65.9	0	0	0	0	110.8	T802 V807 W808 S809	T802-S805 PolarHBondContact N-OG 2.91Å; T802-S805 PolarHBondContact O-N 2.9Å; T802-S805 PolarHBondContact O-OG 3.03Å; T802-S805 PolarHBondContact OG1-N 2.91Å; S805-V807 VanDerWaalsContact C-N 3.28Å; S805-V807 PolarHBondContact O-N 3.35Å; S805-W808 WeakPolarHBondContact O-CB 3.45Å; S805-W808 PolarHBondContact O-N 2.81Å; S805-S809 PolarHBondContact O-N 3.11Å; S805-S809 VanDerWaalsContact O-N 3.13Å; S805-S809 PolarHBondContact O-OG 3.41Å
806	D	93.6	Very high	90.3	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	15%	0.145	C	C	.	.	H	α-helix	trans	-64	-31.8	171.7	-73.6	-5.9	0	0	0	112.1	M734 V743 H744 R745 T802 S809 Y810 F871	M734-D806 HydrophobicContact CE-CB 3.89Å; M734-D806 WeakPolarHBondContact CE-OD2 3.16Å; V743-D806 WeakPolarHBondContact CA-OD2 3.25Å; V743-D806 WeakPolarHBondContact CG1-OD2 3.41Å; H744-D806 PolarHBondContact N-OD2 3.41Å; R745-D806 PolarHBondContact N-OD1 3.06Å; T802-D806 PolarHBondContact O-N 3.32Å; T802-D806 VanDerWaalsContact O-N 3.12Å; D806-S809 WeakPolarHBondContact O-CB 3.42Å; D806-S809 PolarHBondContact O-N 3.2Å; D806-Y810 WeakPolarHBondContact O-CB 3.27Å; D806-Y810 PolarHBondContact O-N 3Å; D806-F871 HydrophobicContact CB-CE2 4.01Å; D806-F871 HydrophobicContact CB-CZ 4.04Å
807	V	97.8	Very high	90.8	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.024	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-40.4	172.2	163.3	0	0	0	0	112	S803 S805 Y810 G811 C860 R868 P869 F871 I874	S803-V807 WeakPolarHBondContact O-CG2 3.33Å; S803-V807 PolarHBondContact O-N 2.9Å; S805-V807 VanDerWaalsContact C-N 3.28Å; S805-V807 PolarHBondContact O-N 3.35Å; V807-Y810 WeakPolarHBondContact O-CB 3.4Å; V807-Y810 PolarHBondContact O-N 3.12Å; V807-G811 PolarHBondContact O-N 2.94Å; V807-C860 HydrophobicContact CG1-CB 3.94Å; V807-R868 HydrophobicContact CG1-CB 3.92Å; V807-P869 WeakPolarHBondContact CG1-O 3.33Å; V807-P869 WeakPolarHBondContact CG2-O 3.15Å; V807-F871 HydrophobicContact CB-CZ 4.38Å; V807-F871 HydrophobicContact CG2-CD1 4.27Å; V807-F871 HydrophobicContact CG2-CD2 3.91Å; V807-F871 HydrophobicContact CG2-CE1 4.01Å; V807-F871 HydrophobicContact CG2-CE2 3.63Å; V807-F871 HydrophobicContact CG2-CG 4.22Å; V807-F871 HydrophobicContact CG2-CZ 3.68Å; V807-I874 HydrophobicContact CG1-CD1 4.02Å; V807-I874 HydrophobicContact CG2-CD1 4.1Å
808	W	97.9	Very high	91.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.5	-47	173.8	175.3	-72.7	0	0	0	111	T791 A792 P793 A804 S805 Y810 G811 I812 I837 C860 W861	T791-W808 PolarHBondContact O-NE1 3.32Å; A792-W808 HydrophobicContact CB-CB 3.74Å; A792-W808 HydrophobicContact CB-CD2 4.15Å; A792-W808 HydrophobicContact CB-CG 3.75Å; P793-W808 HydrophobicContact CG-CE3 4.34Å; P793-W808 HydrophobicContact CG-CH2 3.6Å; P793-W808 HydrophobicContact CG-CZ2 4.09Å; P793-W808 HydrophobicContact CG-CZ3 3.73Å; A804-W808 PolarHBondContact O-N 3.38Å; S805-W808 WeakPolarHBondContact O-CB 3.45Å; S805-W808 PolarHBondContact O-N 2.81Å; W808-Y810 VanDerWaalsContact C-N 3.29Å; W808-Y810 PolarHBondContact O-N 2.81Å; W808-G811 WeakPolarHBondContact O-CA 3.34Å; W808-G811 PolarHBondContact O-N 3.29Å; W808-I812 PolarHBondContact O-N 3.39Å; W808-I812 VanDerWaalsContact O-N 3.15Å; W808-I837 HydrophobicContact CH2-CG2 3.82Å; W808-I837 HydrophobicContact CZ2-CD1 4.26Å; W808-I837 HydrophobicContact CZ2-CG1 4.38Å; W808-I837 HydrophobicContact CZ2-CG2 3.81Å; W808-C860 WeakPolarHBondContact CA-O 3.38Å; W808-W861 AromaticContact CD2-CD1 3.86Å; W808-W861 HydrophobicContact CE3-CB 4.12Å; W808-W861 HydrophobicContact CH2-CB 4.26Å; W808-W861 HydrophobicContact CZ3-CB 3.99Å; W808-W861 WeakPolarHBondContact CZ3-O 3.46Å; W808-W861 PolarHBondContact O-NE1 3.47Å
809	S	97.5	Very high	92.2	Very high	5 Å²	5	18.5 Å²	18.5	4%	0.035	9%	0.093	C	C	.	.	H	α-helix	trans	-59.2	-40.6	175.4	-51.4	0	0	0	0	111.7	L747 W790 S805 D806 G811 I812 V813	L747-S809 WeakPolarHBondContact O-CB 3.36Å; W790-S809 VanDerWaalsContact O-CA 3.32Å; W790-S809 WeakPolarHBondContact O-CA 3.4Å; W790-S809 WeakPolarHBondContact O-CB 3.41Å; W790-S809 PolarHBondContact O-OG 2.88Å; S805-S809 PolarHBondContact O-N 3.11Å; S805-S809 VanDerWaalsContact O-N 3.13Å; S805-S809 PolarHBondContact O-OG 3.41Å; D806-S809 WeakPolarHBondContact O-CB 3.42Å; D806-S809 PolarHBondContact O-N 3.2Å; S809-G811 VanDerWaalsContact C-N 3.33Å; S809-G811 PolarHBondContact O-N 3.04Å; S809-I812 WeakPolarHBondContact O-CA 3.45Å; S809-I812 WeakPolarHBondContact O-CB 3.34Å; S809-I812 PolarHBondContact O-N 2.9Å; S809-I812 VanDerWaalsContact O-N 3.08Å; S809-V813 PolarHBondContact O-N 2.73Å
810	Y	98.5	Very high	93	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-62.5	-36.9	173.3	-179.3	-94.3	0	0	0	112.6	L727 I730 L747 D806 V807 W808 I812 V813 M814 F871 I874 L878	L727-Y810 PolarHBondContact O-OH 2.78Å; I730-Y810 HydrophobicContact CB-CE2 4.03Å; I730-Y810 HydrophobicContact CG2-CD2 3.93Å; I730-Y810 HydrophobicContact CG2-CE2 3.75Å; L747-Y810 HydrophobicContact CD2-CD2 4.31Å; D806-Y810 WeakPolarHBondContact O-CB 3.27Å; D806-Y810 PolarHBondContact O-N 3Å; V807-Y810 WeakPolarHBondContact O-CB 3.4Å; V807-Y810 PolarHBondContact O-N 3.12Å; W808-Y810 VanDerWaalsContact C-N 3.29Å; W808-Y810 PolarHBondContact O-N 2.81Å; Y810-I812 VanDerWaalsContact C-N 3.29Å; Y810-I812 PolarHBondContact O-N 2.84Å; Y810-V813 CarbonylContact O-C 3.53Å; Y810-V813 PolarHBondContact O-N 3.34Å; Y810-V813 VanDerWaalsContact O-N 3.16Å; Y810-M814 HydrophobicContact CD1-CG 3.98Å; Y810-M814 HydrophobicContact CD1-SD 4.02Å; Y810-M814 HydrophobicContact CE1-CG 3.52Å; Y810-M814 HydrophobicContact CE1-SD 3.49Å; Y810-M814 WeakPolarHBondContact CE1-SD 3.41Å; Y810-M814 WeakPolarHBondContact O-CG 3.4Å; Y810-M814 PolarHBondContact O-N 2.59Å; Y810-F871 HydrophobicContact CD1-CE1 4.32Å; Y810-F871 HydrophobicContact CD2-CE1 4.07Å; Y810-F871 AromaticContact CG-CE1 3.76Å; Y810-F871 HydrophobicContact CG-CE1 3.76Å; Y810-I874 HydrophobicContact CD1-CD1 4.13Å; Y810-I874 HydrophobicContact CD1-CG2 4.18Å; Y810-I874 HydrophobicContact CE1-CD1 4.43Å; Y810-I874 HydrophobicContact CE1-CG2 3.45Å; Y810-I874 VanDerWaalsContact CE1-CG2 3.45Å; Y810-L878 VanDerWaalsContact OH-CD1 3.23Å; Y810-L878 WeakPolarHBondContact OH-CD1 3.22Å
811	G	98.1	Very high	93.9	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-59.8	-38.4	170.8	0	0	0	0	0	112.5	V807 W808 S809 M814 W815 W861	V807-G811 PolarHBondContact O-N 2.94Å; W808-G811 WeakPolarHBondContact O-CA 3.34Å; W808-G811 PolarHBondContact O-N 3.29Å; S809-G811 VanDerWaalsContact C-N 3.33Å; S809-G811 PolarHBondContact O-N 3.04Å; G811-M814 WeakPolarHBondContact O-CB 3.39Å; G811-M814 PolarHBondContact O-N 3.44Å; G811-W815 PolarHBondContact O-N 3.4Å; G811-W815 VanDerWaalsContact O-N 3.1Å; G811-W861 WeakPolarHBondContact O-CZ2 3.42Å
812	I	98.1	Very high	94.3	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-67.3	-41.3	172.7	-56.8	-69.4	0	0	0	110.8	W790 W808 S809 Y810 M814 W815 E816 P824 Y825 L843 W861	W790-I812 HydrophobicContact CG-CG2 4.07Å; W808-I812 PolarHBondContact O-N 3.39Å; W808-I812 VanDerWaalsContact O-N 3.15Å; S809-I812 WeakPolarHBondContact O-CA 3.45Å; S809-I812 WeakPolarHBondContact O-CB 3.34Å; S809-I812 PolarHBondContact O-N 2.9Å; S809-I812 VanDerWaalsContact O-N 3.08Å; Y810-I812 VanDerWaalsContact C-N 3.29Å; Y810-I812 PolarHBondContact O-N 2.84Å; I812-M814 VanDerWaalsContact C-N 3.32Å; I812-M814 PolarHBondContact O-N 3.32Å; I812-W815 CarbonylContact O-C 3.55Å; I812-W815 WeakPolarHBondContact O-CA 3.34Å; I812-W815 WeakPolarHBondContact O-CB 3.38Å; I812-W815 PolarHBondContact O-N 2.04Å; I812-W815 VanDerWaalsContact O-N 3.07Å; I812-E816 HydrophobicContact CG2-CG 4.48Å; I812-E816 WeakPolarHBondContact O-CG 3.07Å; I812-E816 PolarHBondContact O-N 3.11Å; I812-P824 HydrophobicContact CG2-CB 3.81Å; I812-P824 HydrophobicContact CG2-CG 3.58Å; I812-Y825 HydrophobicContact CD1-CE2 4.02Å; I812-L843 HydrophobicContact CD1-CD1 3.91Å; I812-W861 HydrophobicContact CD1-CZ2 3.77Å; I812-W861 HydrophobicContact CG1-CZ2 4.5Å
813	V	98.3	Very high	94.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.7	-37.1	173.3	177.1	0	0	0	0	112	I730 L747 S809 Y810 W815 E816 V817	I730-V813 HydrophobicContact CD1-CG1 4.02Å; L747-V813 HydrophobicContact CG-CG2 4.2Å; S809-V813 PolarHBondContact O-N 2.73Å; Y810-V813 CarbonylContact O-C 3.53Å; Y810-V813 PolarHBondContact O-N 3.34Å; Y810-V813 VanDerWaalsContact O-N 3.16Å; V813-W815 VanDerWaalsContact C-N 3.28Å; V813-W815 PolarHBondContact O-N 3.26Å; V813-E816 PolarHBondContact O-N 3.24Å; V813-V817 HydrophobicContact CG1-CG2 4.3Å; V813-V817 VanDerWaalsContact O-CG2 3.31Å; V813-V817 WeakPolarHBondContact O-CG2 3.05Å; V813-V817 PolarHBondContact O-N 3.4Å
814	M	98.1	Very high	94.6	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-59	-41.1	171.3	-74.8	-174	64.7	0	0	111.7	L727 Y810 G811 I812 M818 L853 L856 M857	L727-M814 HydrophobicContact CD1-CB 4.39Å; L727-M814 HydrophobicContact CD1-CG 4.12Å; L727-M814 HydrophobicContact CD2-CB 4.36Å; L727-M814 HydrophobicContact CD2-CG 3.96Å; Y810-M814 HydrophobicContact CD1-CG 3.98Å; Y810-M814 HydrophobicContact CD1-SD 4.02Å; Y810-M814 HydrophobicContact CE1-CG 3.52Å; Y810-M814 HydrophobicContact CE1-SD 3.49Å; Y810-M814 WeakPolarHBondContact CE1-SD 3.41Å; Y810-M814 WeakPolarHBondContact O-CG 3.4Å; Y810-M814 PolarHBondContact O-N 2.59Å; G811-M814 WeakPolarHBondContact O-CB 3.39Å; G811-M814 PolarHBondContact O-N 3.44Å; I812-M814 VanDerWaalsContact C-N 3.32Å; I812-M814 PolarHBondContact O-N 3.32Å; M814-M818 WeakPolarHBondContact O-CG 3.46Å; M814-M818 PolarHBondContact O-N 3.37Å; M814-L853 HydrophobicContact CE-CB 4.42Å; M814-L853 HydrophobicContact CE-CD2 4.22Å; M814-L853 WeakPolarHBondContact CE-O 3.34Å; M814-L856 HydrophobicContact CE-CB 4.03Å; M814-L856 HydrophobicContact CE-CD2 3.96Å; M814-L856 HydrophobicContact CE-CG 3.91Å; M814-L856 HydrophobicContact SD-CD2 4.31Å; M814-L856 HydrophobicContact SD-CG 4.03Å; M814-M857 HydrophobicContact CB-CE 4.09Å; M814-M857 HydrophobicContact CB-CG 3.76Å; M814-M857 HydrophobicContact CB-SD 4.49Å; M814-M857 HydrophobicContact CE-CE 4.49Å; M814-M857 HydrophobicContact CE-CG 4.03Å; M814-M857 WeakPolarHBondContact O-CE 3.28Å; M814-M857 HydrophobicContact SD-CG 4.38Å
815	W	97.2	Very high	94.6	Very high	3 Å²	3	13.7 Å²	13.7	1%	0.011	6%	0.061	C	C	.	.	H	α-helix	trans	-66	-50.5	174.5	-169.7	92.8	0	0	0	111.2	G811 I812 V813 V817 M818 S819 E822 P824 W826 L843 P844 P846 M857 W861	G811-W815 PolarHBondContact O-N 3.4Å; G811-W815 VanDerWaalsContact O-N 3.1Å; I812-W815 CarbonylContact O-C 3.55Å; I812-W815 WeakPolarHBondContact O-CA 3.34Å; I812-W815 WeakPolarHBondContact O-CB 3.38Å; I812-W815 PolarHBondContact O-N 2.04Å; I812-W815 VanDerWaalsContact O-N 3.07Å; V813-W815 VanDerWaalsContact C-N 3.28Å; V813-W815 PolarHBondContact O-N 3.26Å; W815-V817 VanDerWaalsContact C-N 3.29Å; W815-V817 PolarHBondContact O-N 2.74Å; W815-M818 CarbonylContact O-C 3.6Å; W815-M818 PolarHBondContact O-N 2.62Å; W815-M818 VanDerWaalsContact O-N 3.08Å; W815-S819 VanDerWaalsContact CE3-OG 3.31Å; W815-S819 VanDerWaalsContact CZ3-OG 3.25Å; W815-S819 WeakPolarHBondContact CZ3-OG 3.26Å; W815-S819 WeakPolarHBondContact O-CB 3.47Å; W815-S819 PolarHBondContact O-N 3.11Å; W815-S819 PolarHBondContact O-OG 3.2Å; W815-E822 HydrophobicContact CH2-CB 3.73Å; W815-E822 WeakPolarHBondContact CH2-OE2 3.43Å; W815-E822 HydrophobicContact CZ3-CB 3.81Å; W815-P824 HydrophobicContact CE3-CG 4.36Å; W815-P824 HydrophobicContact CZ3-CG 4.42Å; W815-W826 AromaticContact CH2-NE1 3.92Å; W815-W826 HydrophobicContact CZ2-CZ2 4.18Å; W815-L843 HydrophobicContact CB-CD1 4.44Å; W815-L843 HydrophobicContact CD2-CB 4.49Å; W815-L843 HydrophobicContact CD2-CD1 3.83Å; W815-L843 HydrophobicContact CE3-CD1 4.22Å; W815-L843 HydrophobicContact CG-CB 4.26Å; W815-L843 HydrophobicContact CG-CD1 3.91Å; W815-P844 PolarHBondContact NE1-O 2.75Å; W815-P846 HydrophobicContact CD2-CG 4.35Å; W815-P846 HydrophobicContact CG-CG 4.11Å; W815-M857 HydrophobicContact CB-SD 4.14Å; W815-W861 HydrophobicContact CB-CH2 4.08Å; W815-W861 HydrophobicContact CB-CZ2 4.09Å; W815-W861 HydrophobicContact CG-CH2 4.34Å
816	E	97.4	Very high	94.6	Very high	8 Å²	8	17.4 Å²	17.4	4%	0.037	8%	0.075	C	C	.	.	H	α-helix	trans	-54.2	-41.1	177.5	-70.4	179.7	119.1	0	0	112.5	A749 W790 I812 V813 S819 Y820 G821 P824	A749-E816 HydrophobicContact CB-CB 3.92Å; A749-E816 HydrophobicContact CB-CG 4.35Å; A749-E816 WeakPolarHBondContact CB-OE2 3.43Å; A749-E816 PolarHBondContact N-OE2 2.99Å; W790-E816 WeakPolarHBondContact CZ2-OE1 3.05Å; W790-E816 PolarHBondContact NE1-OE1 3.5Å; W790-E816 PolarHBondContact NE1-OE2 2.86Å; I812-E816 HydrophobicContact CG2-CG 4.48Å; I812-E816 WeakPolarHBondContact O-CG 3.07Å; I812-E816 PolarHBondContact O-N 3.11Å; V813-E816 PolarHBondContact O-N 3.24Å; E816-S819 PolarHBondContact O-OG 3.27Å; E816-Y820 PolarHBondContact O-N 3.11Å; E816-G821 PolarHBondContact O-N 3.24Å; E816-P824 HydrophobicContact CG-CG 3.7Å
817	V	96.5	Very high	94.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-69.8	-38.6	178.1	174.4	0	0	0	0	112.1	L707 L711 L723 L727 V813 W815	L707-V817 HydrophobicContact CD2-CG2 3.76Å; L707-V817 HydrophobicContact CG-CG2 4.43Å; L711-V817 HydrophobicContact CD1-CB 4.36Å; L711-V817 HydrophobicContact CD1-CG2 4.11Å; L723-V817 HydrophobicContact CB-CG1 4.04Å; L723-V817 HydrophobicContact CD2-CG1 3.92Å; L727-V817 HydrophobicContact CD1-CB 4.47Å; L727-V817 HydrophobicContact CD1-CG1 4.35Å; L727-V817 HydrophobicContact CD2-CB 3.81Å; L727-V817 HydrophobicContact CD2-CG1 4.16Å; L727-V817 HydrophobicContact CD2-CG2 3.69Å; L727-V817 HydrophobicContact CG-CB 4.18Å; L727-V817 HydrophobicContact CG-CG1 4Å; L727-V817 HydrophobicContact CG-CG2 4.41Å; V813-V817 HydrophobicContact CG1-CG2 4.3Å; V813-V817 VanDerWaalsContact O-CG2 3.31Å; V813-V817 WeakPolarHBondContact O-CG2 3.05Å; V813-V817 PolarHBondContact O-N 3.4Å; W815-V817 VanDerWaalsContact C-N 3.29Å; W815-V817 PolarHBondContact O-N 2.74Å
818	M	94	Very high	93.3	Very high	9 Å²	9	26.4 Å²	26.4	4%	0.044	12%	0.122	C	C	.	.	H	α-helix	trans	-80.6	-17.3	179.5	-66.2	-57	-53.5	0	0	113.3	L723 M814 W815 P846 C849 L853 M857	L723-M818 HydrophobicContact CB-SD 4.02Å; L723-M818 HydrophobicContact CD1-CE 4.27Å; L723-M818 HydrophobicContact CD1-SD 3.99Å; M814-M818 WeakPolarHBondContact O-CG 3.46Å; M814-M818 PolarHBondContact O-N 3.37Å; W815-M818 CarbonylContact O-C 3.6Å; W815-M818 PolarHBondContact O-N 2.62Å; W815-M818 VanDerWaalsContact O-N 3.08Å; M818-P846 HydrophobicContact CB-CB 4.13Å; M818-P846 HydrophobicContact CB-CG 3.91Å; M818-P846 WeakPolarHBondContact O-CB 3.46Å; M818-C849 HydrophobicContact CE-CB 4.19Å; M818-L853 HydrophobicContact CE-CD1 4.24Å; M818-L853 HydrophobicContact CG-CD1 4.48Å; M818-L853 HydrophobicContact SD-CD1 3.86Å; M818-M857 HydrophobicContact CB-CE 4.1Å; M818-M857 HydrophobicContact CG-CE 3.81Å
819	S	92.3	Very high	92.4	Very high	16 Å²	16	28.7 Å²	28.7	11%	0.112	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	16	171.4	66.3	0	0	0	0	113.5	W815 E816 G821 E822	W815-S819 VanDerWaalsContact CE3-OG 3.31Å; W815-S819 VanDerWaalsContact CZ3-OG 3.25Å; W815-S819 WeakPolarHBondContact CZ3-OG 3.26Å; W815-S819 WeakPolarHBondContact O-CB 3.47Å; W815-S819 PolarHBondContact O-N 3.11Å; W815-S819 PolarHBondContact O-OG 3.2Å; E816-S819 PolarHBondContact O-OG 3.27Å; S819-G821 PolarHBondContact O-N 2.92Å; S819-G821 VanDerWaalsContact O-N 3.07Å; S819-E822 PolarHBondContact O-N 3.13Å; S819-E822 VanDerWaalsContact O-N 3.15Å
820	Y	92.9	Very high	91.7	Very high	28 Å²	28	32.4 Å²	32.4	11%	0.11	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	30.3	179.7	-78.8	-93.4	0	0	0	115.1	L711 R712 N714 R717 F718 L723 E816	L711-Y820 CarbonylContact C-O 3.52Å; L711-Y820 HydrophobicContact CB-CD1 4.4Å; L711-Y820 WeakPolarHBondContact CB-O 3.47Å; L711-Y820 HydrophobicContact CD2-CD1 4.01Å; L711-Y820 HydrophobicContact CD2-CE1 4.42Å; R712-Y820 WeakPolarHBondContact CA-O 3.34Å; R712-Y820 WeakPolarHBondContact CG-O 3.32Å; R712-Y820 PolarHBondContact N-O 2.97Å; R712-Y820 VanDerWaalsContact N-O 3.12Å; N714-Y820 VanDerWaalsContact O-CE1 3.26Å; N714-Y820 WeakPolarHBondContact O-CE1 3.42Å; R717-Y820 PolarHBondContact N-OH 3.28Å; F718-Y820 WeakPolarHBondContact CA-OH 3.32Å; F718-Y820 HydrophobicContact CB-CE1 4.43Å; F718-Y820 AromaticContact CD2-CE1 3.71Å; F718-Y820 HydrophobicContact CD2-CE1 3.71Å; F718-Y820 HydrophobicContact CE2-CE1 4.45Å; F718-Y820 HydrophobicContact CG-CE1 4.48Å; F718-Y820 PolarHBondContact N-OH 2.58Å; F718-Y820 PolarHBondContact O-OH 2.91Å; L723-Y820 HydrophobicContact CD1-CE2 4.05Å; E816-Y820 PolarHBondContact O-N 3.11Å
821	G	90.9	Very high	91	Very high	2 Å²	2	40 Å²	40	2%	0.021	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.1	24.7	177.7	0	0	0	0	0	114.8	R712 E816 S819	R712-G821 WeakPolarHBondContact CD-O 3.41Å; R712-G821 PolarHBondContact NH1-O 3.18Å; E816-G821 PolarHBondContact O-N 3.24Å; S819-G821 PolarHBondContact O-N 2.92Å; S819-G821 VanDerWaalsContact O-N 3.07Å
822	E	89.6	Confident	90.3	Very high	76 Å²	76	43.6 Å²	43.6	36%	0.355	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-53.3	153.8	160.5	-80	-165.2	-178.2	0	0	111.2	W815 S819 P824 W826	W815-E822 HydrophobicContact CH2-CB 3.73Å; W815-E822 WeakPolarHBondContact CH2-OE2 3.43Å; W815-E822 HydrophobicContact CZ3-CB 3.81Å; S819-E822 PolarHBondContact O-N 3.13Å; S819-E822 VanDerWaalsContact O-N 3.15Å; E822-P824 WeakPolarHBondContact O-CD 3.22Å; E822-W826 PolarHBondContact OE2-NE1 3.01Å
823	R	87.8	Confident	89.6	Confident	132 Å²	132	43.6 Å²	43.6	50%	0.498	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-73.5	120.6	176.8	174.7	172.4	166.1	148.7	-10.5	110.7	R789 Y825 W826	R789-R823 VanDerWaalsContact NH2-NH2 3.19Å; R823-Y825 PolarHBondContact O-N 3.32Å; R823-W826 WeakPolarHBondContact CD-O 3.35Å; R823-W826 PolarHBondContact NE-O 3.47Å; R823-W826 WeakPolarHBondContact O-CA 3.32Å; R823-W826 PolarHBondContact O-N 2.81Å
824	P	92.8	Very high	88.9	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.013	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	132.4	176.8	-26	35.7	0	0	0	112	R789 W790 I812 W815 E816 E822 W826 L843	R789-P824 HydrophobicContact CB-CB 4.39Å; R789-P824 WeakPolarHBondContact CD-O 3.46Å; R789-P824 PolarHBondContact NH1-O 3.4Å; W790-P824 HydrophobicContact CZ2-CG 4.03Å; I812-P824 HydrophobicContact CG2-CB 3.81Å; I812-P824 HydrophobicContact CG2-CG 3.58Å; W815-P824 HydrophobicContact CE3-CG 4.36Å; W815-P824 HydrophobicContact CZ3-CG 4.42Å; E816-P824 HydrophobicContact CG-CG 3.7Å; E822-P824 WeakPolarHBondContact O-CD 3.22Å; P824-W826 PolarHBondContact O-N 3.37Å; P824-L843 HydrophobicContact CB-CD1 4.2Å
825	Y	88.7	Confident	88.2	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	22.1	-172.6	-52	-92.6	0	0	0	114.5	R789 I812 R823 D827 M828 V833 I837 Y841 L843	R789-Y825 HydrophobicContact CB-CD2 4.33Å; R789-Y825 HydrophobicContact CG-CD2 4.43Å; R789-Y825 PolarHBondContact NH1-O 2.83Å; I812-Y825 HydrophobicContact CD1-CE2 4.02Å; R823-Y825 PolarHBondContact O-N 3.32Å; Y825-D827 PolarHBondContact O-N 3.09Å; Y825-M828 HydrophobicContact CD1-SD 4.35Å; Y825-M828 WeakPolarHBondContact O-CB 3.25Å; Y825-M828 WeakPolarHBondContact O-CG 3.42Å; Y825-M828 PolarHBondContact O-N 2.73Å; Y825-V833 HydrophobicContact CD1-CG1 4.39Å; Y825-V833 HydrophobicContact CD1-CG2 4.44Å; Y825-V833 HydrophobicContact CD2-CG1 3.9Å; Y825-V833 HydrophobicContact CD2-CG2 4.41Å; Y825-V833 HydrophobicContact CE2-CG1 4.17Å; Y825-V833 HydrophobicContact CG-CG1 4.03Å; Y825-V833 HydrophobicContact CG-CG2 3.92Å; Y825-I837 HydrophobicContact CE1-CD1 4.41Å; Y825-I837 HydrophobicContact CE1-CG1 4.13Å; Y825-I837 HydrophobicContact CE2-CD1 4.23Å; Y825-I837 WeakPolarHBondContact OH-CG1 3.42Å; Y825-Y841 HydrophobicContact CD1-CD1 4.3Å; Y825-Y841 HydrophobicContact CD1-CE1 4.15Å; Y825-Y841 HydrophobicContact CE1-CD1 4.03Å; Y825-Y841 HydrophobicContact CE1-CE1 4.19Å; Y825-L843 HydrophobicContact CD1-CD2 3.64Å; Y825-L843 HydrophobicContact CD1-CG 4.28Å; Y825-L843 HydrophobicContact CD2-CD1 4.32Å; Y825-L843 HydrophobicContact CD2-CD2 4.17Å; Y825-L843 HydrophobicContact CD2-CG 4.48Å; Y825-L843 HydrophobicContact CE1-CD2 3.85Å; Y825-L843 HydrophobicContact CE1-CG 3.99Å; Y825-L843 HydrophobicContact CE2-CD1 4.05Å; Y825-L843 HydrophobicContact CE2-CD2 4.35Å; Y825-L843 HydrophobicContact CE2-CG 4.19Å; Y825-L843 HydrophobicContact CG-CD2 3.8Å
826	W	89.8	Confident	87.6	Confident	79 Å²	79	51.9 Å²	51.9	30%	0.299	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.4	-125.9	174.9	-46.3	-71.6	0	0	0	112.4	R789 W815 E822 R823 P824 P844	R789-W826 PolarHBondContact NH1-O 2.87Å; W815-W826 AromaticContact CH2-NE1 3.92Å; W815-W826 HydrophobicContact CZ2-CZ2 4.18Å; E822-W826 PolarHBondContact OE2-NE1 3.01Å; R823-W826 WeakPolarHBondContact CD-O 3.35Å; R823-W826 PolarHBondContact NE-O 3.47Å; R823-W826 WeakPolarHBondContact O-CA 3.32Å; R823-W826 PolarHBondContact O-N 2.81Å; P824-W826 PolarHBondContact O-N 3.37Å; W826-P844 HydrophobicContact CH2-CG 3.77Å; W826-P844 HydrophobicContact CZ2-CG 4.3Å
827	D	82	Confident	87.3	Confident	137 Å²	137	51.6 Å²	51.6	73%	0.733	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	2.3	-170	-53.7	-60.8	0	0	0	114.6	Y825	Y825-D827 PolarHBondContact O-N 3.09Å
828	M	80.3	Confident	86.8	Confident	58 Å²	58	56.8 Å²	56.8	29%	0.286	28%	0.275	S	S	.	.			trans	-47.3	141.4	169	-64.5	177	66.1	0	0	110.8	R789 Y825 D832 V833 A836	R789-M828 PolarHBondContact NH2-O 3.11Å; Y825-M828 HydrophobicContact CD1-SD 4.35Å; Y825-M828 WeakPolarHBondContact O-CB 3.25Å; Y825-M828 WeakPolarHBondContact O-CG 3.42Å; Y825-M828 PolarHBondContact O-N 2.73Å; M828-D832 HydrophobicContact CB-CB 4.19Å; M828-D832 HydrophobicContact CE-CB 3.9Å; M828-V833 HydrophobicContact CB-CG2 3.88Å; M828-V833 HydrophobicContact CE-CG2 4.46Å; M828-A836 HydrophobicContact CE-CB 3.79Å
829	S	80.1	Confident	86.5	Confident	48 Å²	48	63.1 Å²	63.1	34%	0.336	30%	0.304	S	S	.	.			trans	-67.9	163.5	176.8	83.4	0	0	0	0	111.3	Q831 D832 V833	S829-Q831 PolarHBondContact O-N 3.33Å; S829-Q831 PolarHBondContact OG-N 3.44Å; S829-D832 WeakPolarHBondContact CA-OD2 3.39Å; S829-D832 WeakPolarHBondContact CB-OD2 3.32Å; S829-D832 PolarHBondContact N-OD2 3.49Å; S829-D832 PolarHBondContact O-N 2.98Å; S829-D832 VanDerWaalsContact OG-CG 3.22Å; S829-D832 PolarHBondContact OG-N 3.34Å; S829-D832 PolarHBondContact OG-OD2 3.11Å; S829-V833 WeakPolarHBondContact O-CG2 3.23Å; S829-V833 PolarHBondContact O-N 3.01Å
830	N	82.4	Confident	86.2	Confident	82 Å²	82	64.4 Å²	64.4	44%	0.439	32%	0.32	S	S	.	.	H	α-helix	trans	-64	-20.4	175.3	-73.2	-4.1	0	0	0	112.6	I788 R789 I834	I788-N830 HydrophobicContact CB-CB 4.46Å; I788-N830 HydrophobicContact CG1-CB 4.35Å; I788-N830 HydrophobicContact CG2-CB 4.4Å; R789-N830 PolarHBondContact NE-OD1 3.32Å; R789-N830 PolarHBondContact NH2-OD1 3.21Å; N830-I834 WeakPolarHBondContact O-CD1 3.49Å; N830-I834 VanDerWaalsContact O-CG1 3.29Å; N830-I834 WeakPolarHBondContact O-CG1 3.32Å; N830-I834 PolarHBondContact O-N 3.38Å
831	Q	84.1	Confident	86.1	Confident	160 Å²	160	67.7 Å²	67.7	75%	0.748	33%	0.333	S	S	*	.	H	α-helix	trans	-77.5	-43.9	173.4	-68.7	178.3	-16.7	0	0	110.9	S829 V833 I834 K835	S829-Q831 PolarHBondContact O-N 3.33Å; S829-Q831 PolarHBondContact OG-N 3.44Å; Q831-V833 VanDerWaalsContact C-N 3.29Å; Q831-V833 PolarHBondContact O-N 3.32Å; Q831-I834 PolarHBondContact O-N 3.36Å; Q831-K835 PolarHBondContact O-N 2.93Å
832	D	83	Confident	86.2	Confident	76 Å²	76	69.8 Å²	69.8	41%	0.406	34%	0.34	S	S	.	.	H	α-helix	trans	-62.4	-37.8	176.6	-53.8	-53.5	0	0	0	111.8	M828 S829 K835 A836	M828-D832 HydrophobicContact CB-CB 4.19Å; M828-D832 HydrophobicContact CE-CB 3.9Å; S829-D832 WeakPolarHBondContact CA-OD2 3.39Å; S829-D832 WeakPolarHBondContact CB-OD2 3.32Å; S829-D832 PolarHBondContact N-OD2 3.49Å; S829-D832 PolarHBondContact O-N 2.98Å; S829-D832 VanDerWaalsContact OG-CG 3.22Å; S829-D832 PolarHBondContact OG-N 3.34Å; S829-D832 PolarHBondContact OG-OD2 3.11Å; D832-K835 PolarHBondContact O-N 3.06Å; D832-A836 WeakPolarHBondContact O-CB 3.07Å; D832-A836 PolarHBondContact O-N 2.94Å
833	V	82.8	Confident	86.2	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-62.5	-42.3	175.5	171.6	0	0	0	0	111.4	I788 R789 Y825 M828 S829 Q831 I837	I788-V833 HydrophobicContact CG2-CG1 4.31Å; R789-V833 HydrophobicContact CG-CG1 4.32Å; R789-V833 HydrophobicContact CG-CG2 4.49Å; Y825-V833 HydrophobicContact CD1-CG1 4.39Å; Y825-V833 HydrophobicContact CD1-CG2 4.44Å; Y825-V833 HydrophobicContact CD2-CG1 3.9Å; Y825-V833 HydrophobicContact CD2-CG2 4.41Å; Y825-V833 HydrophobicContact CE2-CG1 4.17Å; Y825-V833 HydrophobicContact CG-CG1 4.03Å; Y825-V833 HydrophobicContact CG-CG2 3.92Å; M828-V833 HydrophobicContact CB-CG2 3.88Å; M828-V833 HydrophobicContact CE-CG2 4.46Å; S829-V833 WeakPolarHBondContact O-CG2 3.23Å; S829-V833 PolarHBondContact O-N 3.01Å; Q831-V833 VanDerWaalsContact C-N 3.29Å; Q831-V833 PolarHBondContact O-N 3.32Å; V833-I837 HydrophobicContact CG1-CD1 3.7Å; V833-I837 WeakPolarHBondContact O-CB 3.32Å; V833-I837 WeakPolarHBondContact O-CD1 3.49Å; V833-I837 WeakPolarHBondContact O-CG1 3.35Å; V833-I837 PolarHBondContact O-N 3.24Å
834	I	83.9	Confident	86.2	Confident	45 Å²	45	62.5 Å²	62.5	23%	0.231	32%	0.316	C	S	.	.	H	α-helix	trans	-62.9	-53.1	176	-67.7	165.9	0	0	0	109.7	I788 I796 N830 Q831 A836 I837 E838	I788-I834 HydrophobicContact CD1-CD1 4.37Å; I788-I834 HydrophobicContact CG2-CD1 4.08Å; I788-I834 HydrophobicContact CG2-CG1 3.71Å; I796-I834 HydrophobicContact CD1-CG1 4.36Å; I796-I834 HydrophobicContact CG2-CD1 4.06Å; I796-I834 HydrophobicContact CG2-CG1 4.16Å; N830-I834 WeakPolarHBondContact O-CD1 3.49Å; N830-I834 VanDerWaalsContact O-CG1 3.29Å; N830-I834 WeakPolarHBondContact O-CG1 3.32Å; N830-I834 PolarHBondContact O-N 3.38Å; Q831-I834 PolarHBondContact O-N 3.36Å; I834-A836 PolarHBondContact O-N 3.45Å; I834-I837 PolarHBondContact O-N 2.97Å; I834-E838 WeakPolarHBondContact O-CG 3.3Å; I834-E838 PolarHBondContact O-N 3.28Å
835	K	84.7	Confident	85.8	Confident	119 Å²	119	65.8 Å²	65.8	52%	0.517	34%	0.338	S	S	.	.	H	α-helix	trans	-54.9	-51.2	179.8	-179.5	-176.4	170.9	-174.1	0	111.8	Q831 D832 I837 E838 E839	Q831-K835 PolarHBondContact O-N 2.93Å; D832-K835 PolarHBondContact O-N 3.06Å; K835-I837 VanDerWaalsContact C-N 3.34Å; K835-I837 PolarHBondContact O-N 3.29Å; K835-E838 PolarHBondContact O-N 3.02Å; K835-E838 VanDerWaalsContact O-N 3.17Å; K835-E839 WeakPolarHBondContact CE-OE1 3.38Å; K835-E839 HydrophobicContact CG-CG 4.42Å; K835-E839 IonicContact NZ-OE1 2.64Å; K835-E839 WeakPolarHBondContact O-CB 3.49Å; K835-E839 WeakPolarHBondContact O-CG 3.48Å; K835-E839 PolarHBondContact O-N 3.48Å
836	A	84.3	Confident	85.7	Confident	12 Å²	12	66.5 Å²	66.5	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-62.3	-40.1	-179.7	0	0	0	0	0	112	M828 D832 I834 E838 E839 G840 Y841	M828-A836 HydrophobicContact CE-CB 3.79Å; D832-A836 WeakPolarHBondContact O-CB 3.07Å; D832-A836 PolarHBondContact O-N 2.94Å; I834-A836 PolarHBondContact O-N 3.45Å; A836-E838 VanDerWaalsContact C-N 3.34Å; A836-E838 PolarHBondContact O-N 2.93Å; A836-E839 PolarHBondContact O-N 3.18Å; A836-G840 PolarHBondContact O-N 3.42Å; A836-G840 VanDerWaalsContact O-N 3.1Å; A836-Y841 HydrophobicContact CB-CD1 4.33Å; A836-Y841 HydrophobicContact CB-CG 4.36Å; A836-Y841 VanDerWaalsContact O-CB 3.23Å; A836-Y841 WeakPolarHBondContact O-CB 3.43Å; A836-Y841 PolarHBondContact O-N 2.88Å
837	I	89.7	Confident	84.8	Confident	3 Å²	3	65.4 Å²	65.4	2%	0.015	34%	0.342	C	S	.	.	H	α-helix	trans	-62.7	-40.2	175.8	-75.3	168.8	0	0	0	111.6	P793 W808 Y825 V833 I834 K835 G840 R842	P793-I837 HydrophobicContact CG-CG2 3.76Å; W808-I837 HydrophobicContact CH2-CG2 3.82Å; W808-I837 HydrophobicContact CZ2-CD1 4.26Å; W808-I837 HydrophobicContact CZ2-CG1 4.38Å; W808-I837 HydrophobicContact CZ2-CG2 3.81Å; Y825-I837 HydrophobicContact CE1-CD1 4.41Å; Y825-I837 HydrophobicContact CE1-CG1 4.13Å; Y825-I837 HydrophobicContact CE2-CD1 4.23Å; Y825-I837 WeakPolarHBondContact OH-CG1 3.42Å; V833-I837 HydrophobicContact CG1-CD1 3.7Å; V833-I837 WeakPolarHBondContact O-CB 3.32Å; V833-I837 WeakPolarHBondContact O-CD1 3.49Å; V833-I837 WeakPolarHBondContact O-CG1 3.35Å; V833-I837 PolarHBondContact O-N 3.24Å; I834-I837 PolarHBondContact O-N 2.97Å; K835-I837 VanDerWaalsContact C-N 3.34Å; K835-I837 PolarHBondContact O-N 3.29Å; I837-G840 PolarHBondContact O-N 3.41Å; I837-R842 PolarHBondContact O-NH1 3.46Å
838	E	86.7	Confident	84.4	Confident	108 Å²	108	62.7 Å²	62.7	51%	0.505	33%	0.327	S	S	.	.	H	α-helix	trans	-68	-42.9	177.6	-72.6	-178.5	165.1	0	0	112.7	I834 K835 A836 G840 K863	I834-E838 WeakPolarHBondContact O-CG 3.3Å; I834-E838 PolarHBondContact O-N 3.28Å; K835-E838 PolarHBondContact O-N 3.02Å; K835-E838 VanDerWaalsContact O-N 3.17Å; A836-E838 VanDerWaalsContact C-N 3.34Å; A836-E838 PolarHBondContact O-N 2.93Å; E838-G840 PolarHBondContact O-N 2.77Å; E838-K863 PolarHBondContact O-NZ 3.13Å; E838-K863 VanDerWaalsContact O-NZ 3.14Å
839	E	88.4	Confident	84.7	Confident	143 Å²	143	60.6 Å²	60.6	67%	0.668	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-8.9	172.4	-70.9	174.8	161.7	0	0	113.1	K835 A836	K835-E839 WeakPolarHBondContact CE-OE1 3.38Å; K835-E839 HydrophobicContact CG-CG 4.42Å; K835-E839 IonicContact NZ-OE1 2.64Å; K835-E839 WeakPolarHBondContact O-CB 3.49Å; K835-E839 WeakPolarHBondContact O-CG 3.48Å; K835-E839 PolarHBondContact O-N 3.48Å; A836-E839 PolarHBondContact O-N 3.18Å
840	G	86.4	Confident	85.1	Confident	43 Å²	43	58.5 Å²	58.5	44%	0.443	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	2.1	172.2	0	0	0	0	0	115.4	A836 I837 E838	A836-G840 PolarHBondContact O-N 3.42Å; A836-G840 VanDerWaalsContact O-N 3.1Å; I837-G840 PolarHBondContact O-N 3.41Å; E838-G840 PolarHBondContact O-N 2.77Å
841	Y	90.3	Very high	85.4	Confident	97 Å²	97	59.9 Å²	59.9	38%	0.38	31%	0.309	S	S	.	.			trans	-60.3	141.1	174.4	-176.7	-94.6	0	0	0	111.5	Y825 A836	Y825-Y841 HydrophobicContact CD1-CD1 4.3Å; Y825-Y841 HydrophobicContact CD1-CE1 4.15Å; Y825-Y841 HydrophobicContact CE1-CD1 4.03Å; Y825-Y841 HydrophobicContact CE1-CE1 4.19Å; A836-Y841 HydrophobicContact CB-CD1 4.33Å; A836-Y841 HydrophobicContact CB-CG 4.36Å; A836-Y841 VanDerWaalsContact O-CB 3.23Å; A836-Y841 WeakPolarHBondContact O-CB 3.43Å; A836-Y841 PolarHBondContact O-N 2.88Å
842	R	92.6	Very high	85.6	Confident	45 Å²	45	54.3 Å²	54.3	17%	0.17	29%	0.29	C	S	.	.			trans	-138.2	152.1	178.1	-62.3	-61.2	-179	-94.2	1.6	109.3	I837 L858 W861	I837-R842 PolarHBondContact O-NH1 3.46Å; R842-L858 HydrophobicContact CB-CD2 4.03Å; R842-L858 HydrophobicContact CG-CD2 4.43Å; R842-W861 HydrophobicContact CB-CE3 4.1Å; R842-W861 PolarHBondContact NE-O 3.03Å; R842-W861 PolarHBondContact NH2-O 2.98Å; R842-W861 VanDerWaalsContact NH2-O 3.14Å
843	L	90.5	Very high	86.1	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.005	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-64.8	134.5	-175.6	-65.3	170	0	0	0	111.2	I812 W815 P824 Y825 H854 W861	I812-L843 HydrophobicContact CD1-CD1 3.91Å; W815-L843 HydrophobicContact CB-CD1 4.44Å; W815-L843 HydrophobicContact CD2-CB 4.49Å; W815-L843 HydrophobicContact CD2-CD1 3.83Å; W815-L843 HydrophobicContact CE3-CD1 4.22Å; W815-L843 HydrophobicContact CG-CB 4.26Å; W815-L843 HydrophobicContact CG-CD1 3.91Å; P824-L843 HydrophobicContact CB-CD1 4.2Å; Y825-L843 HydrophobicContact CD1-CD2 3.64Å; Y825-L843 HydrophobicContact CD1-CG 4.28Å; Y825-L843 HydrophobicContact CD2-CD1 4.32Å; Y825-L843 HydrophobicContact CD2-CD2 4.17Å; Y825-L843 HydrophobicContact CD2-CG 4.48Å; Y825-L843 HydrophobicContact CE1-CD2 3.85Å; Y825-L843 HydrophobicContact CE1-CG 3.99Å; Y825-L843 HydrophobicContact CE2-CD1 4.05Å; Y825-L843 HydrophobicContact CE2-CD2 4.35Å; Y825-L843 HydrophobicContact CE2-CG 4.19Å; Y825-L843 HydrophobicContact CG-CD2 3.8Å; L843-H854 PolarHBondContact O-NE2 3.25Å; L843-W861 HydrophobicContact CB-CH2 3.8Å; L843-W861 HydrophobicContact CB-CZ3 4.1Å; L843-W861 HydrophobicContact CD1-CH2 4.31Å; L843-W861 HydrophobicContact CD1-CZ2 4.36Å; L843-W861 HydrophobicContact CG-CH2 4.48Å
844	P	87.7	Confident	86.7	Confident	54 Å²	54	52 Å²	52	35%	0.351	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-67.2	159.8	177.1	28.9	-34.7	0	0	0	111.1	W815 W826 P846	W815-P844 PolarHBondContact NE1-O 2.75Å; W826-P844 HydrophobicContact CH2-CG 3.77Å; W826-P844 HydrophobicContact CZ2-CG 4.3Å; P844-P846 WeakPolarHBondContact O-CD 3.48Å
845	P	83.8	Confident	87.2	Confident	72 Å²	72	54.3 Å²	54.3	47%	0.468	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-60.4	129.6	176.9	24.3	-32.4	0	0	0	110.4	C849 H854	P845-C849 HydrophobicContact CB-CB 4.49Å; P845-H854 HydrophobicContact CB-CB 3.96Å
846	P	86.3	Confident	87.7	Confident	15 Å²	15	48.9 Å²	48.9	10%	0.097	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-56.4	160.2	170	-27.8	37.3	0	0	0	112.4	W815 M818 P844 D848 C849	W815-P846 HydrophobicContact CD2-CG 4.35Å; W815-P846 HydrophobicContact CG-CG 4.11Å; M818-P846 HydrophobicContact CB-CB 4.13Å; M818-P846 HydrophobicContact CB-CG 3.91Å; M818-P846 WeakPolarHBondContact O-CB 3.46Å; P844-P846 WeakPolarHBondContact O-CD 3.48Å; P846-D848 PolarHBondContact O-N 3.37Å; P846-C849 HydrophobicContact CB-CB 4.26Å; P846-C849 WeakPolarHBondContact O-CB 3.11Å; P846-C849 PolarHBondContact O-N 2.92Å; P846-C849 VanDerWaalsContact O-N 3.1Å
847	M	71.8	Confident	88.4	Confident	56 Å²	56	48.3 Å²	48.3	28%	0.276	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	131.8	178.2	-85.1	-76.6	-63.1	0	0	111.6	C849 M925 H961 K964	M847-C849 PolarHBondContact O-N 2.03Å; M847-M925 HydrophobicContact SD-CE 4.27Å; M847-H961 WeakPolarHBondContact CG-NE2 3.23Å; M847-K964 HydrophobicContact CE-CD 3.61Å; M847-K964 HydrophobicContact SD-CD 4.06Å
848	D	73.6	Confident	88.7	Confident	80 Å²	80	50.6 Å²	50.6	43%	0.428	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	18.5	-179	-52.8	-32	0	0	0	115.6	P846 R890	P846-D848 PolarHBondContact O-N 3.37Å; D848-R890 IonicContact OD1-CZ 2.59Å; D848-R890 IonicContact OD1-NH1 2.67Å; D848-R890 PolarHBondContact OD1-NH1 3.46Å; D848-R890 IonicContact OD1-NH2 3.98Å; D848-R890 PolarHBondContact OD1-NH2 2.89Å
849	C	85.1	Confident	89.2	Confident	14 Å²	14	47.6 Å²	47.6	10%	0.095	26%	0.259	C	S	.	.			trans	-63.9	127.9	170.7	-174.1	0	0	0	0	111.3	M818 P845 P846 M847	M818-C849 HydrophobicContact CE-CB 4.19Å; P845-C849 HydrophobicContact CB-CB 4.49Å; P846-C849 HydrophobicContact CB-CB 4.26Å; P846-C849 WeakPolarHBondContact O-CB 3.11Å; P846-C849 PolarHBondContact O-N 2.92Å; P846-C849 VanDerWaalsContact O-N 3.1Å; M847-C849 PolarHBondContact O-N 2.03Å
850	P	89.4	Confident	89.7	Confident	4 Å²	4	40.8 Å²	40.8	3%	0.026	23%	0.227	C	C	.	.			trans	-58.8	137.8	171.6	-22.9	31	0	0	0	112.6	V720 A852 L853 H854 L888	V720-P850 HydrophobicContact CG1-CG 3.55Å; P850-A852 PolarHBondContact O-N 3.03Å; P850-A852 VanDerWaalsContact O-N 3.17Å; P850-L853 HydrophobicContact CB-CD1 4.46Å; P850-L853 HydrophobicContact CB-CG 4.35Å; P850-L853 HydrophobicContact CG-CD1 4.02Å; P850-L853 HydrophobicContact CG-CG 4.44Å; P850-L853 PolarHBondContact O-N 3.34Å; P850-H854 PolarHBondContact O-N 3.17Å; P850-L888 HydrophobicContact CB-CD2 4.16Å; P850-L888 HydrophobicContact CG-CB 4.26Å; P850-L888 HydrophobicContact CG-CD2 3.93Å
851	I	87.4	Confident	90.2	Very high	110 Å²	110	38.9 Å²	38.9	56%	0.564	21%	0.206	S	C	*	.	H	α-helix	trans	-54.9	-39.6	-179.5	-57.7	172.6	0	0	0	111.2	L853 H854 Q855	I851-L853 VanDerWaalsContact C-N 3.29Å; I851-L853 PolarHBondContact O-N 3.08Å; I851-H854 PolarHBondContact O-N 3.18Å; I851-Q855 WeakPolarHBondContact O-CB 3.45Å; I851-Q855 PolarHBondContact O-N 3.44Å
852	A	89.4	Confident	90.5	Very high	43 Å²	43	38 Å²	38	36%	0.355	21%	0.205	S	C	.	.	H	α-helix	trans	-65.3	-25.6	178.2	0	0	0	0	0	114.3	P850 L856 L881	P850-A852 PolarHBondContact O-N 3.03Å; P850-A852 VanDerWaalsContact O-N 3.17Å; A852-L856 PolarHBondContact O-N 3.45Å; A852-L881 HydrophobicContact CB-CD1 4.45Å; A852-L881 HydrophobicContact CB-CD2 3.93Å
853	L	93.4	Very high	90.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-82.3	-41.5	174.2	-66.9	179.8	0	0	0	111.4	V724 M814 M818 P850 I851 L856 M857 L878 L881 L888	V724-L853 HydrophobicContact CG2-CD1 3.53Å; V724-L853 HydrophobicContact CG2-CD2 4.1Å; V724-L853 HydrophobicContact CG2-CG 4.37Å; M814-L853 HydrophobicContact CE-CB 4.42Å; M814-L853 HydrophobicContact CE-CD2 4.22Å; M814-L853 WeakPolarHBondContact CE-O 3.34Å; M818-L853 HydrophobicContact CE-CD1 4.24Å; M818-L853 HydrophobicContact CG-CD1 4.48Å; M818-L853 HydrophobicContact SD-CD1 3.86Å; P850-L853 HydrophobicContact CB-CD1 4.46Å; P850-L853 HydrophobicContact CB-CG 4.35Å; P850-L853 HydrophobicContact CG-CD1 4.02Å; P850-L853 HydrophobicContact CG-CG 4.44Å; P850-L853 PolarHBondContact O-N 3.34Å; I851-L853 VanDerWaalsContact C-N 3.29Å; I851-L853 PolarHBondContact O-N 3.08Å; L853-L856 PolarHBondContact O-N 3.06Å; L853-M857 HydrophobicContact CB-CE 4.45Å; L853-M857 WeakPolarHBondContact O-CG 3.42Å; L853-M857 PolarHBondContact O-N 3.23Å; L853-L878 HydrophobicContact CD2-CD2 3.84Å; L853-L881 HydrophobicContact CD2-CD1 3.45Å; L853-L881 VanDerWaalsContact CD2-CD1 3.45Å; L853-L881 HydrophobicContact CG-CD1 4.23Å; L853-L888 HydrophobicContact CD1-CD2 4.3Å; L853-L888 HydrophobicContact CG-CD2 4.36Å
854	H	94.4	Very high	90.4	Very high	28 Å²	28	46.7 Å²	46.7	13%	0.13	25%	0.246	C	C	.	.	H	α-helix	trans	-66.7	-37.4	176.2	-175.2	-114.4	0	0	0	112.3	L843 P845 P850 I851 L856 M857 L858	L843-H854 PolarHBondContact O-NE2 3.25Å; P845-H854 HydrophobicContact CB-CB 3.96Å; P850-H854 PolarHBondContact O-N 3.17Å; I851-H854 PolarHBondContact O-N 3.18Å; H854-L856 VanDerWaalsContact C-N 3.3Å; H854-L856 PolarHBondContact O-N 2.86Å; H854-M857 WeakPolarHBondContact O-CB 3.23Å; H854-M857 PolarHBondContact O-N 2.79Å; H854-M857 VanDerWaalsContact O-N 3.08Å; H854-L858 WeakPolarHBondContact O-CG 3.46Å; H854-L858 PolarHBondContact O-N 3.18Å
855	Q	94.5	Very high	90.5	Very high	94 Å²	94	51 Å²	51	44%	0.439	26%	0.255	S	S	.	.	H	α-helix	trans	-57.5	-44.5	170.9	-175.3	60.3	57.9	0	0	111.3	I851 M857 L858 D859	I851-Q855 WeakPolarHBondContact O-CB 3.45Å; I851-Q855 PolarHBondContact O-N 3.44Å; Q855-M857 VanDerWaalsContact C-N 3.29Å; Q855-M857 PolarHBondContact O-N 2.87Å; Q855-L858 WeakPolarHBondContact O-CB 3.43Å; Q855-L858 PolarHBondContact O-N 3.44Å; Q855-L858 VanDerWaalsContact O-N 3.11Å; Q855-D859 PolarHBondContact NE2-OD1 3.12Å; Q855-D859 PolarHBondContact O-N 2.95Å
856	L	96.3	Very high	90.8	Very high	5 Å²	5	52 Å²	52	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-29.6	176.7	-178.1	54.9	0	0	0	112.8	M814 A852 L853 H854 C860 P869 I874 M877 L878	M814-L856 HydrophobicContact CE-CB 4.03Å; M814-L856 HydrophobicContact CE-CD2 3.96Å; M814-L856 HydrophobicContact CE-CG 3.91Å; M814-L856 HydrophobicContact SD-CD2 4.31Å; M814-L856 HydrophobicContact SD-CG 4.03Å; A852-L856 PolarHBondContact O-N 3.45Å; L853-L856 PolarHBondContact O-N 3.06Å; H854-L856 VanDerWaalsContact C-N 3.3Å; H854-L856 PolarHBondContact O-N 2.86Å; L856-C860 PolarHBondContact O-N 3.01Å; L856-C860 VanDerWaalsContact O-N 3.08Å; L856-C860 PolarHBondContact O-SG 3.11Å; L856-P869 HydrophobicContact CD1-CG 4.22Å; L856-I874 HydrophobicContact CD1-CG1 4.4Å; L856-I874 HydrophobicContact CD2-CG2 4.36Å; L856-M877 HydrophobicContact CD1-SD 3.59Å; L856-M877 VanDerWaalsContact CD1-SD 3.59Å; L856-M877 HydrophobicContact CD2-CB 4.18Å; L856-M877 HydrophobicContact CD2-SD 4.42Å; L856-L878 HydrophobicContact CD2-CD2 4.2Å; L856-L878 HydrophobicContact CD2-CG 4.33Å
857	M	97.7	Very high	91.1	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.4	-46.9	169	-60.2	168.3	-160.5	0	0	111.3	M814 W815 M818 L853 H854 Q855 D859 C860 W861	M814-M857 HydrophobicContact CB-CE 4.09Å; M814-M857 HydrophobicContact CB-CG 3.76Å; M814-M857 HydrophobicContact CB-SD 4.49Å; M814-M857 HydrophobicContact CE-CE 4.49Å; M814-M857 HydrophobicContact CE-CG 4.03Å; M814-M857 WeakPolarHBondContact O-CE 3.28Å; M814-M857 HydrophobicContact SD-CG 4.38Å; W815-M857 HydrophobicContact CB-SD 4.14Å; M818-M857 HydrophobicContact CB-CE 4.1Å; M818-M857 HydrophobicContact CG-CE 3.81Å; L853-M857 HydrophobicContact CB-CE 4.45Å; L853-M857 WeakPolarHBondContact O-CG 3.42Å; L853-M857 PolarHBondContact O-N 3.23Å; H854-M857 WeakPolarHBondContact O-CB 3.23Å; H854-M857 PolarHBondContact O-N 2.79Å; H854-M857 VanDerWaalsContact O-N 3.08Å; Q855-M857 VanDerWaalsContact C-N 3.29Å; Q855-M857 PolarHBondContact O-N 2.87Å; M857-D859 VanDerWaalsContact C-N 3.32Å; M857-D859 PolarHBondContact O-N 2.84Å; M857-C860 CarbonylContact O-C 3.57Å; M857-C860 WeakPolarHBondContact O-CA 3.39Å; M857-C860 WeakPolarHBondContact O-CB 3.22Å; M857-C860 PolarHBondContact O-N 2.76Å; M857-C860 VanDerWaalsContact O-N 3.09Å; M857-W861 HydrophobicContact CB-CD2 4.46Å; M857-W861 HydrophobicContact CB-CE3 4.12Å; M857-W861 HydrophobicContact CB-CH2 3.69Å; M857-W861 HydrophobicContact CB-CZ2 4.06Å; M857-W861 HydrophobicContact CB-CZ3 3.72Å; M857-W861 HydrophobicContact CG-CH2 4.32Å; M857-W861 VanDerWaalsContact O-CD2 3.23Å; M857-W861 VanDerWaalsContact O-CG 3.31Å; M857-W861 PolarHBondContact O-N 2.82Å; M857-W861 HydrophobicContact SD-CH2 4.21Å
858	L	96.9	Very high	92.3	Very high	51 Å²	51	54.1 Å²	54.1	27%	0.267	28%	0.275	S	S	.	.	H	α-helix	trans	-60.5	-40.7	176.5	-64.8	173.7	0	0	0	111.9	R842 H854 Q855 C860 W861 Q862	R842-L858 HydrophobicContact CB-CD2 4.03Å; R842-L858 HydrophobicContact CG-CD2 4.43Å; H854-L858 WeakPolarHBondContact O-CG 3.46Å; H854-L858 PolarHBondContact O-N 3.18Å; Q855-L858 WeakPolarHBondContact O-CB 3.43Å; Q855-L858 PolarHBondContact O-N 3.44Å; Q855-L858 VanDerWaalsContact O-N 3.11Å; L858-C860 VanDerWaalsContact C-N 3.29Å; L858-C860 PolarHBondContact O-N 2.82Å; L858-W861 HydrophobicContact CD2-CE3 4.21Å; L858-W861 HydrophobicContact CD2-CZ3 4.47Å; L858-W861 CarbonylContact O-C 3.57Å; L858-W861 PolarHBondContact O-N 2.66Å; L858-Q862 PolarHBondContact O-N 2.95Å
859	D	97.6	Very high	93.5	Very high	45 Å²	45	51 Å²	51	24%	0.241	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-35.7	174.7	-60.2	-16.5	0	0	0	111.4	Q855 M857 W861 Q862 R868 P869	Q855-D859 PolarHBondContact NE2-OD1 3.12Å; Q855-D859 PolarHBondContact O-N 2.95Å; M857-D859 VanDerWaalsContact C-N 3.32Å; M857-D859 PolarHBondContact O-N 2.84Å; D859-W861 VanDerWaalsContact C-N 3.33Å; D859-Q862 WeakPolarHBondContact O-CG 3.26Å; D859-R868 WeakPolarHBondContact O-CA 3.41Å; D859-P869 HydrophobicContact CB-CG 4.25Å; D859-P869 WeakPolarHBondContact O-CD 3.42Å
860	C	98	Very high	93.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-71.8	-23.9	172.4	-65.9	0	0	0	0	113.4	V807 W808 L856 M857 L858 R868	V807-C860 HydrophobicContact CG1-CB 3.94Å; W808-C860 WeakPolarHBondContact CA-O 3.38Å; L856-C860 PolarHBondContact O-N 3.01Å; L856-C860 VanDerWaalsContact O-N 3.08Å; L856-C860 PolarHBondContact O-SG 3.11Å; M857-C860 CarbonylContact O-C 3.57Å; M857-C860 WeakPolarHBondContact O-CA 3.39Å; M857-C860 WeakPolarHBondContact O-CB 3.22Å; M857-C860 PolarHBondContact O-N 2.76Å; M857-C860 VanDerWaalsContact O-N 3.09Å; L858-C860 VanDerWaalsContact C-N 3.29Å; L858-C860 PolarHBondContact O-N 2.82Å; C860-R868 WeakPolarHBondContact O-CD 3.29Å
861	W	97.8	Very high	94.2	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.008	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	22	-179.3	-54.9	-40.9	0	0	0	114.8	W808 G811 I812 W815 R842 L843 M857 L858 D859	W808-W861 AromaticContact CD2-CD1 3.86Å; W808-W861 HydrophobicContact CE3-CB 4.12Å; W808-W861 HydrophobicContact CH2-CB 4.26Å; W808-W861 HydrophobicContact CZ3-CB 3.99Å; W808-W861 WeakPolarHBondContact CZ3-O 3.46Å; W808-W861 PolarHBondContact O-NE1 3.47Å; G811-W861 WeakPolarHBondContact O-CZ2 3.42Å; I812-W861 HydrophobicContact CD1-CZ2 3.77Å; I812-W861 HydrophobicContact CG1-CZ2 4.5Å; W815-W861 HydrophobicContact CB-CH2 4.08Å; W815-W861 HydrophobicContact CB-CZ2 4.09Å; W815-W861 HydrophobicContact CG-CH2 4.34Å; R842-W861 HydrophobicContact CB-CE3 4.1Å; R842-W861 PolarHBondContact NE-O 3.03Å; R842-W861 PolarHBondContact NH2-O 2.98Å; R842-W861 VanDerWaalsContact NH2-O 3.14Å; L843-W861 HydrophobicContact CB-CH2 3.8Å; L843-W861 HydrophobicContact CB-CZ3 4.1Å; L843-W861 HydrophobicContact CD1-CH2 4.31Å; L843-W861 HydrophobicContact CD1-CZ2 4.36Å; L843-W861 HydrophobicContact CG-CH2 4.48Å; M857-W861 HydrophobicContact CB-CD2 4.46Å; M857-W861 HydrophobicContact CB-CE3 4.12Å; M857-W861 HydrophobicContact CB-CH2 3.69Å; M857-W861 HydrophobicContact CB-CZ2 4.06Å; M857-W861 HydrophobicContact CB-CZ3 3.72Å; M857-W861 HydrophobicContact CG-CH2 4.32Å; M857-W861 VanDerWaalsContact O-CD2 3.23Å; M857-W861 VanDerWaalsContact O-CG 3.31Å; M857-W861 PolarHBondContact O-N 2.82Å; M857-W861 HydrophobicContact SD-CH2 4.21Å; L858-W861 HydrophobicContact CD2-CE3 4.21Å; L858-W861 HydrophobicContact CD2-CZ3 4.47Å; L858-W861 CarbonylContact O-C 3.57Å; L858-W861 PolarHBondContact O-N 2.66Å; D859-W861 VanDerWaalsContact C-N 3.33Å
862	Q	96.8	Very high	94.6	Very high	79 Å²	79	53.8 Å²	53.8	37%	0.369	27%	0.272	S	S	.	.			trans	-58.2	139.6	169.5	-66.3	-61.3	-14.1	0	0	110.7	L858 D859 D867 R868	L858-Q862 PolarHBondContact O-N 2.95Å; D859-Q862 WeakPolarHBondContact O-CG 3.26Å; Q862-D867 HydrophobicContact CB-CB 4.11Å; Q862-D867 HydrophobicContact CG-CB 4.34Å; Q862-R868 HydrophobicContact CB-CG 4Å; Q862-R868 PolarHBondContact O-NE 3.03Å; Q862-R868 PolarHBondContact O-NH2 3.03Å
863	K	89.9	Confident	95	Very high	114 Å²	114	56.5 Å²	56.5	50%	0.496	28%	0.277	S	S	.	.	S	Bend	trans	-61.8	-51.1	-176.4	-170	165.2	-176.1	163.2	0	109.9	E838 R868	E838-K863 PolarHBondContact O-NZ 3.13Å; E838-K863 VanDerWaalsContact O-NZ 3.14Å; K863-R868 PolarHBondContact O-NH2 3.05Å
864	E	89.6	Confident	95.2	Very high	114 Å²	114	56.5 Å²	56.5	53%	0.533	28%	0.277	S	S	.	.	S	Bend	trans	-75.7	131.5	175.9	-63.7	-48.9	130.5	0	0	112.8	S866 D867	E864-S866 PolarHBondContact O-N 3.24Å; E864-D867 PolarHBondContact O-N 3Å
865	R	90.4	Very high	95.3	Very high	144 Å²	144	55.5 Å²	55.5	54%	0.543	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-18.7	-176.9	68.9	176.2	-172.7	157.5	5.1	114.2	A804 D867	A804-R865 HydrophobicContact CB-CB 4.04Å; A804-R865 WeakPolarHBondContact CB-O 3.3Å; R865-D867 VanDerWaalsContact C-N 3.33Å
866	S	89.5	Confident	95.4	Very high	94 Å²	94	55.8 Å²	55.8	66%	0.657	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-27.1	178	41.2	0	0	0	0	113	E864	E864-S866 PolarHBondContact O-N 3.24Å
867	D	94.4	Very high	95.3	Very high	104 Å²	104	59 Å²	59	56%	0.556	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-11.6	-164.6	-55.9	3.9	0	0	0	111	Q862 E864 R865	Q862-D867 HydrophobicContact CB-CB 4.11Å; Q862-D867 HydrophobicContact CG-CB 4.34Å; E864-D867 PolarHBondContact O-N 3Å; R865-D867 VanDerWaalsContact C-N 3.33Å
868	R	96.8	Very high	95.2	Very high	12 Å²	12	59 Å²	59	5%	0.045	29%	0.293	C	S	.	.	S	Bend	trans	-72.8	137.9	173.9	-57.4	176.9	-163.1	153.7	9.9	110.7	E794 A804 V807 D859 C860 Q862 K863	E794-R868 IonicContact OE1-CZ 2.69Å; E794-R868 IonicContact OE1-NH1 3.61Å; E794-R868 PolarHBondContact OE1-NH1 2.85Å; E794-R868 IonicContact OE1-NH2 2.69Å; E794-R868 IonicContact OE2-CZ 3.37Å; E794-R868 IonicContact OE2-NH1 2.69Å; E794-R868 PolarHBondContact OE2-NH1 2.89Å; E794-R868 IonicContact OE2-NH2 2.89Å; E794-R868 PolarHBondContact OE2-NH2 3.5Å; A804-R868 WeakPolarHBondContact O-CD 3.44Å; A804-R868 PolarHBondContact O-NH1 2.59Å; V807-R868 HydrophobicContact CG1-CB 3.92Å; D859-R868 WeakPolarHBondContact O-CA 3.41Å; C860-R868 WeakPolarHBondContact O-CD 3.29Å; Q862-R868 HydrophobicContact CB-CG 4Å; Q862-R868 PolarHBondContact O-NE 3.03Å; Q862-R868 PolarHBondContact O-NH2 3.03Å; K863-R868 PolarHBondContact O-NH2 3.05Å
869	P	97.2	Very high	95	Very high	14 Å²	14	57.9 Å²	57.9	9%	0.091	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-68.4	137.8	-179.9	28.3	-34.2	0	0	0	111.7	V807 L856 D859 Q873 I874	V807-P869 WeakPolarHBondContact CG1-O 3.33Å; V807-P869 WeakPolarHBondContact CG2-O 3.15Å; L856-P869 HydrophobicContact CD1-CG 4.22Å; D859-P869 HydrophobicContact CB-CG 4.25Å; D859-P869 WeakPolarHBondContact O-CD 3.42Å; P869-Q873 HydrophobicContact CB-CB 4.26Å; P869-I874 HydrophobicContact CB-CG1 4.01Å; P869-I874 HydrophobicContact CG-CD1 4.17Å; P869-I874 HydrophobicContact CG-CG1 3.86Å
870	K	93.8	Very high	94.8	Very high	159 Å²	159	62.8 Å²	62.8	69%	0.691	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-67.2	150.3	172.6	-61.1	-176	179.5	-175.9	0	110.2	G872 Q873 I874	K870-G872 PolarHBondContact O-N 2.83Å; K870-Q873 WeakPolarHBondContact O-CA 3.34Å; K870-Q873 WeakPolarHBondContact O-CB 3.49Å; K870-Q873 PolarHBondContact O-N 2.83Å; K870-I874 PolarHBondContact O-N 3.04Å; K870-I874 VanDerWaalsContact O-N 3.13Å
871	F	97.1	Very high	94.5	Very high	4 Å²	4	63.7 Å²	63.7	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-51.3	-34.8	179.5	-75	-66.3	0	0	0	114.7	M734 K735 D806 V807 Y810 Q873 I874 V875	M734-F871 HydrophobicContact CB-CD1 3.6Å; M734-F871 HydrophobicContact CB-CD2 4.03Å; M734-F871 HydrophobicContact CB-CE1 3.41Å; M734-F871 VanDerWaalsContact CB-CE1 3.41Å; M734-F871 HydrophobicContact CB-CE2 3.85Å; M734-F871 HydrophobicContact CB-CG 3.91Å; M734-F871 HydrophobicContact CB-CZ 3.54Å; M734-F871 HydrophobicContact CE-CE2 4.12Å; M734-F871 HydrophobicContact CE-CZ 4.05Å; M734-F871 HydrophobicContact CG-CE1 4.04Å; M734-F871 HydrophobicContact CG-CZ 4.07Å; K735-F871 HydrophobicContact CB-CB 3.86Å; K735-F871 HydrophobicContact CG-CB 4.45Å; D806-F871 HydrophobicContact CB-CE2 4.01Å; D806-F871 HydrophobicContact CB-CZ 4.04Å; V807-F871 HydrophobicContact CB-CZ 4.38Å; V807-F871 HydrophobicContact CG2-CD1 4.27Å; V807-F871 HydrophobicContact CG2-CD2 3.91Å; V807-F871 HydrophobicContact CG2-CE1 4.01Å; V807-F871 HydrophobicContact CG2-CE2 3.63Å; V807-F871 HydrophobicContact CG2-CG 4.22Å; V807-F871 HydrophobicContact CG2-CZ 3.68Å; Y810-F871 HydrophobicContact CD1-CE1 4.32Å; Y810-F871 HydrophobicContact CD2-CE1 4.07Å; Y810-F871 AromaticContact CG-CE1 3.76Å; Y810-F871 HydrophobicContact CG-CE1 3.76Å; F871-Q873 VanDerWaalsContact C-N 3.32Å; F871-Q873 PolarHBondContact O-N 2.91Å; F871-I874 HydrophobicContact CD1-CD1 4.02Å; F871-I874 HydrophobicContact CE1-CD1 4.38Å; F871-I874 PolarHBondContact O-N 2.93Å; F871-V875 WeakPolarHBondContact O-CG2 3.45Å; F871-V875 PolarHBondContact O-N 2.98Å
872	G	94.9	Very high	94.1	Very high	23 Å²	23	66.2 Å²	66.2	24%	0.237	33%	0.325	C	S	.	.	H	α-helix	trans	-62.7	-32.4	172.7	0	0	0	0	0	114.5	K870 N876	K870-G872 PolarHBondContact O-N 2.83Å; G872-N876 WeakPolarHBondContact O-CB 3.46Å; G872-N876 VanDerWaalsContact O-CG 3.22Å; G872-N876 PolarHBondContact O-N 3.27Å; G872-N876 PolarHBondContact O-ND2 2.82Å
873	Q	97	Very high	93.8	Very high	100 Å²	100	72.4 Å²	72.4	47%	0.467	34%	0.344	S	S	.	.	H	α-helix	trans	-74.1	-43.3	173	-64.3	165.3	-73.7	0	0	110.6	P869 K870 F871 N876 M877	P869-Q873 HydrophobicContact CB-CB 4.26Å; K870-Q873 WeakPolarHBondContact O-CA 3.34Å; K870-Q873 WeakPolarHBondContact O-CB 3.49Å; K870-Q873 PolarHBondContact O-N 2.83Å; F871-Q873 VanDerWaalsContact C-N 3.32Å; F871-Q873 PolarHBondContact O-N 2.91Å; Q873-N876 CarbonylContact O-C 3.56Å; Q873-N876 PolarHBondContact O-N 2.86Å; Q873-M877 WeakPolarHBondContact O-CG 3.34Å; Q873-M877 PolarHBondContact O-N 2.8Å
874	I	97.8	Very high	93.7	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-56.8	-51.7	176.9	-61	177.2	0	0	0	111.1	V807 Y810 L856 P869 K870 F871 N876 M877 L878	V807-I874 HydrophobicContact CG1-CD1 4.02Å; V807-I874 HydrophobicContact CG2-CD1 4.1Å; Y810-I874 HydrophobicContact CD1-CD1 4.13Å; Y810-I874 HydrophobicContact CD1-CG2 4.18Å; Y810-I874 HydrophobicContact CE1-CD1 4.43Å; Y810-I874 HydrophobicContact CE1-CG2 3.45Å; Y810-I874 VanDerWaalsContact CE1-CG2 3.45Å; L856-I874 HydrophobicContact CD1-CG1 4.4Å; L856-I874 HydrophobicContact CD2-CG2 4.36Å; P869-I874 HydrophobicContact CB-CG1 4.01Å; P869-I874 HydrophobicContact CG-CD1 4.17Å; P869-I874 HydrophobicContact CG-CG1 3.86Å; K870-I874 PolarHBondContact O-N 3.04Å; K870-I874 VanDerWaalsContact O-N 3.13Å; F871-I874 HydrophobicContact CD1-CD1 4.02Å; F871-I874 HydrophobicContact CE1-CD1 4.38Å; F871-I874 PolarHBondContact O-N 2.93Å; I874-N876 VanDerWaalsContact C-N 3.31Å; I874-N876 PolarHBondContact O-N 3.1Å; I874-M877 WeakPolarHBondContact O-CB 3.07Å; I874-M877 PolarHBondContact O-N 3.47Å; I874-L878 HydrophobicContact CG2-CD1 3.98Å; I874-L878 WeakPolarHBondContact O-CG 3.33Å; I874-L878 PolarHBondContact O-N 2.96Å
875	V	97.6	Very high	93.2	Very high	8 Å²	8	68.8 Å²	68.8	5%	0.048	34%	0.338	C	S	.	.	H	α-helix	trans	-60.8	-40.9	177.8	174.1	0	0	0	0	111.3	G731 F871 M877 L878 D879	G731-V875 WeakPolarHBondContact O-CG2 3.48Å; F871-V875 WeakPolarHBondContact O-CG2 3.45Å; F871-V875 PolarHBondContact O-N 2.98Å; V875-M877 VanDerWaalsContact C-N 3.28Å; V875-M877 PolarHBondContact O-N 3.23Å; V875-L878 PolarHBondContact O-N 2.96Å; V875-D879 WeakPolarHBondContact O-CB 3.5Å; V875-D879 PolarHBondContact O-N 3.08Å
876	N	95.9	Very high	92.5	Very high	99 Å²	99	66.6 Å²	66.6	53%	0.529	34%	0.337	S	S	.	.	H	α-helix	trans	-66.3	-25.2	175.7	-78.9	-31.6	0	0	0	113.7	G872 Q873 I874 K880	G872-N876 WeakPolarHBondContact O-CB 3.46Å; G872-N876 VanDerWaalsContact O-CG 3.22Å; G872-N876 PolarHBondContact O-N 3.27Å; G872-N876 PolarHBondContact O-ND2 2.82Å; Q873-N876 CarbonylContact O-C 3.56Å; Q873-N876 PolarHBondContact O-N 2.86Å; I874-N876 VanDerWaalsContact C-N 3.31Å; I874-N876 PolarHBondContact O-N 3.1Å; N876-K880 WeakPolarHBondContact O-CD 3.43Å; N876-K880 VanDerWaalsContact O-CG 3.27Å; N876-K880 WeakPolarHBondContact O-CG 3.43Å; N876-K880 PolarHBondContact O-N 2.74Å
877	M	94.6	Very high	91.8	Very high	72 Å²	72	64.2 Å²	64.2	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-77	-46.3	172.5	-70	165.2	174.9	0	0	110.8	L856 Q873 I874 V875 D879 K880 L881	L856-M877 HydrophobicContact CD1-SD 3.59Å; L856-M877 VanDerWaalsContact CD1-SD 3.59Å; L856-M877 HydrophobicContact CD2-CB 4.18Å; L856-M877 HydrophobicContact CD2-SD 4.42Å; Q873-M877 WeakPolarHBondContact O-CG 3.34Å; Q873-M877 PolarHBondContact O-N 2.8Å; I874-M877 WeakPolarHBondContact O-CB 3.07Å; I874-M877 PolarHBondContact O-N 3.47Å; V875-M877 VanDerWaalsContact C-N 3.28Å; V875-M877 PolarHBondContact O-N 3.23Å; M877-D879 PolarHBondContact O-N 3.34Å; M877-K880 WeakPolarHBondContact O-CB 3.16Å; M877-K880 PolarHBondContact O-N 2.93Å; M877-K880 VanDerWaalsContact O-N 3.11Å; M877-L881 PolarHBondContact O-N 2.82Å; M877-L881 VanDerWaalsContact O-N 3.09Å
878	L	95.5	Very high	90.9	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-41.3	177.6	-63.6	167	0	0	0	111.7	V724 L727 R728 Y810 L853 L856 I874 V875 K880 L881 I882	V724-L878 HydrophobicContact CG1-CD2 4.19Å; L727-L878 HydrophobicContact CB-CD1 4.41Å; R728-L878 HydrophobicContact CB-CB 4.1Å; R728-L878 HydrophobicContact CB-CD1 4.36Å; R728-L878 HydrophobicContact CG-CB 4.18Å; Y810-L878 VanDerWaalsContact OH-CD1 3.23Å; Y810-L878 WeakPolarHBondContact OH-CD1 3.22Å; L853-L878 HydrophobicContact CD2-CD2 3.84Å; L856-L878 HydrophobicContact CD2-CD2 4.2Å; L856-L878 HydrophobicContact CD2-CG 4.33Å; I874-L878 HydrophobicContact CG2-CD1 3.98Å; I874-L878 WeakPolarHBondContact O-CG 3.33Å; I874-L878 PolarHBondContact O-N 2.96Å; V875-L878 PolarHBondContact O-N 2.96Å; L878-K880 VanDerWaalsContact C-N 3.26Å; L878-K880 PolarHBondContact O-N 2.94Å; L878-L881 PolarHBondContact O-N 2.64Å; L878-L881 VanDerWaalsContact O-N 3.13Å; L878-I882 WeakPolarHBondContact O-CG1 3.25Å; L878-I882 PolarHBondContact O-N 2.99Å
879	D	93.7	Very high	89.6	Confident	29 Å²	29	65.9 Å²	65.9	16%	0.155	32%	0.324	C	S	.	.	H	α-helix	trans	-63	-28.7	174.3	-84.7	-11.2	0	0	0	112.8	R728 V875 M877 R883	R728-D879 WeakPolarHBondContact CG-OD1 3.34Å; R728-D879 IonicContact CZ-OD1 2.81Å; R728-D879 IonicContact CZ-OD2 3.13Å; R728-D879 IonicContact NE-OD1 3.38Å; R728-D879 PolarHBondContact NE-OD1 3.27Å; R728-D879 IonicContact NE-OD2 2.87Å; R728-D879 IonicContact NH2-OD1 3.18Å; R728-D879 PolarHBondContact NH2-OD1 3Å; R728-D879 IonicContact NH2-OD2 3.49Å; R728-D879 PolarHBondContact NH2-OD2 2.86Å; V875-D879 WeakPolarHBondContact O-CB 3.5Å; V875-D879 PolarHBondContact O-N 3.08Å; M877-D879 PolarHBondContact O-N 3.34Å; D879-R883 WeakPolarHBondContact O-CB 3.42Å; D879-R883 WeakPolarHBondContact O-CD 3.47Å; D879-R883 WeakPolarHBondContact O-CG 3.18Å; D879-R883 PolarHBondContact O-N 3.42Å; D879-R883 VanDerWaalsContact O-N 3.13Å
880	K	92.6	Very high	87.5	Confident	148 Å²	148	73.1 Å²	73.1	64%	0.643	35%	0.349	S	S	*	.	H	α-helix	trans	-71.7	-42.1	171.6	-72.8	167.6	-175.6	-179.8	0	111.8	N876 M877 L878 R883 N884	N876-K880 WeakPolarHBondContact O-CD 3.43Å; N876-K880 VanDerWaalsContact O-CG 3.27Å; N876-K880 WeakPolarHBondContact O-CG 3.43Å; N876-K880 PolarHBondContact O-N 2.74Å; M877-K880 WeakPolarHBondContact O-CB 3.16Å; M877-K880 PolarHBondContact O-N 2.93Å; M877-K880 VanDerWaalsContact O-N 3.11Å; L878-K880 VanDerWaalsContact C-N 3.26Å; L878-K880 PolarHBondContact O-N 2.94Å; K880-R883 PolarHBondContact O-N 3.47Å; K880-N884 PolarHBondContact O-N 2.66Å
881	L	90.8	Very high	85	Confident	19 Å²	19	70.8 Å²	70.8	10%	0.099	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-39.9	177.1	-63.8	177.1	0	0	0	111.5	A852 L853 M877 L878 N884 S887 L888	A852-L881 HydrophobicContact CB-CD1 4.45Å; A852-L881 HydrophobicContact CB-CD2 3.93Å; L853-L881 HydrophobicContact CD2-CD1 3.45Å; L853-L881 VanDerWaalsContact CD2-CD1 3.45Å; L853-L881 HydrophobicContact CG-CD1 4.23Å; M877-L881 PolarHBondContact O-N 2.82Å; M877-L881 VanDerWaalsContact O-N 3.09Å; L878-L881 PolarHBondContact O-N 2.64Å; L878-L881 VanDerWaalsContact O-N 3.13Å; L881-N884 CarbonylContact O-C 3.52Å; L881-N884 PolarHBondContact O-N 3.47Å; L881-S887 VanDerWaalsContact CD2-OG 3.25Å; L881-S887 WeakPolarHBondContact CD2-OG 3.38Å; L881-L888 HydrophobicContact CB-CD2 4.08Å; L881-L888 HydrophobicContact CB-CG 4.41Å; L881-L888 HydrophobicContact CD1-CD2 4.21Å; L881-L888 HydrophobicContact CD2-CD2 4.42Å; L881-L888 HydrophobicContact CG-CD2 4.47Å
882	I	91.1	Very high	82.1	Confident	55 Å²	55	73.9 Å²	73.9	28%	0.282	38%	0.382	S	S	.	.	H	α-helix	trans	-63.5	-42.9	174.4	-67.6	168.1	0	0	0	111.3	I721 V724 R728 L878 N884 P885	I721-I882 HydrophobicContact CD1-CB 4.2Å; I721-I882 HydrophobicContact CD1-CG1 3.97Å; I721-I882 HydrophobicContact CD1-CG2 4.26Å; V724-I882 HydrophobicContact CG1-CD1 4.08Å; V724-I882 HydrophobicContact CG1-CG1 3.61Å; R728-I882 HydrophobicContact CB-CD1 3.86Å; R728-I882 HydrophobicContact CG-CD1 3.83Å; L878-I882 WeakPolarHBondContact O-CG1 3.25Å; L878-I882 PolarHBondContact O-N 2.99Å; I882-N884 VanDerWaalsContact C-N 3.3Å; I882-N884 PolarHBondContact O-N 3.14Å; I882-P885 WeakPolarHBondContact O-CD 3.47Å
883	R	89.4	Confident	78.9	Confident	208 Å²	208	79.3 Å²	79.3	79%	0.785	41%	0.41	S	S	*	.	H	α-helix	trans	-71.7	-20.3	178.4	-71	171.2	-163.8	-152.4	6.4	113.8	D879 K880	D879-R883 WeakPolarHBondContact O-CB 3.42Å; D879-R883 WeakPolarHBondContact O-CD 3.47Å; D879-R883 WeakPolarHBondContact O-CG 3.18Å; D879-R883 PolarHBondContact O-N 3.42Å; D879-R883 VanDerWaalsContact O-N 3.13Å; K880-R883 PolarHBondContact O-N 3.47Å
884	N	87	Confident	76.2	Confident	83 Å²	83	83.4 Å²	83.4	44%	0.444	43%	0.43	S	S	.	.			trans	-131	77.3	174.7	-176.4	10.6	0	0	0	111.8	K880 L881 I882 N886 S887	K880-N884 PolarHBondContact O-N 2.66Å; L881-N884 CarbonylContact O-C 3.52Å; L881-N884 PolarHBondContact O-N 3.47Å; I882-N884 VanDerWaalsContact C-N 3.3Å; I882-N884 PolarHBondContact O-N 3.14Å; N884-N886 PolarHBondContact O-N 3.08Å; N884-N886 PolarHBondContact OD1-N 3.07Å; N884-S887 WeakPolarHBondContact O-CB 3.41Å; N884-S887 PolarHBondContact O-N 2.62Å; N884-S887 PolarHBondContact O-OG 3.29Å
885	P	79.8	Confident	73.1	Confident	69 Å²	69	88.9 Å²	88.9	45%	0.448	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-60.9	-14.3	-178.5	-25.4	36	0	0	0	115	I882 S887 L888	I882-P885 WeakPolarHBondContact O-CD 3.47Å; P885-S887 PolarHBondContact O-N 3.05Å; P885-L888 WeakPolarHBondContact O-CB 3.48Å; P885-L888 PolarHBondContact O-N 2.91Å; P885-L888 VanDerWaalsContact O-N 3.11Å
886	N	76.2	Confident	69.8	Low	98 Å²	98	94 Å²	94	52%	0.524	50%	0.504	S	S	.	.	G	3₁₀ helix	trans	-65	-26.7	171.6	-66.9	-59.4	0	0	0	112.4	N884 L888 K889	N884-N886 PolarHBondContact O-N 3.08Å; N884-N886 PolarHBondContact OD1-N 3.07Å; N886-L888 PolarHBondContact O-N 2.9Å; N886-K889 WeakPolarHBondContact O-CB 3.48Å; N886-K889 PolarHBondContact O-N 2.81Å; N886-K889 WeakPolarHBondContact OD1-CE 3.46Å; N886-K889 PolarHBondContact OD1-NZ 3.11Å
887	S	75.6	Confident	66.5	Low	44 Å²	44	100.9 Å²	100.9	31%	0.308	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-71.2	-11.8	173.4	66.1	0	0	0	0	114.1	L881 N884 P885	L881-S887 VanDerWaalsContact CD2-OG 3.25Å; L881-S887 WeakPolarHBondContact CD2-OG 3.38Å; N884-S887 WeakPolarHBondContact O-CB 3.41Å; N884-S887 PolarHBondContact O-N 2.62Å; N884-S887 PolarHBondContact O-OG 3.29Å; P885-S887 PolarHBondContact O-N 3.05Å
888	L	75.3	Confident	63.4	Low	19 Å²	19	103.5 Å²	103.5	10%	0.099	55%	0.545	C	S	.	.	G	3₁₀ helix	trans	-91.6	0.9	173.1	-62.1	170.9	0	0	0	112.5	V720 I721 V724 P850 L853 L881 P885 N886	V720-L888 HydrophobicContact CG1-CB 4.22Å; V720-L888 HydrophobicContact CG1-CD1 4.36Å; V720-L888 HydrophobicContact CG1-CD2 4.23Å; I721-L888 HydrophobicContact CD1-CD1 3.97Å; V724-L888 HydrophobicContact CG2-CD1 4.21Å; V724-L888 HydrophobicContact CG2-CD2 3.99Å; P850-L888 HydrophobicContact CB-CD2 4.16Å; P850-L888 HydrophobicContact CG-CB 4.26Å; P850-L888 HydrophobicContact CG-CD2 3.93Å; L853-L888 HydrophobicContact CD1-CD2 4.3Å; L853-L888 HydrophobicContact CG-CD2 4.36Å; L881-L888 HydrophobicContact CB-CD2 4.08Å; L881-L888 HydrophobicContact CB-CG 4.41Å; L881-L888 HydrophobicContact CD1-CD2 4.21Å; L881-L888 HydrophobicContact CD2-CD2 4.42Å; L881-L888 HydrophobicContact CG-CD2 4.47Å; P885-L888 WeakPolarHBondContact O-CB 3.48Å; P885-L888 PolarHBondContact O-N 2.91Å; P885-L888 VanDerWaalsContact O-N 3.11Å; N886-L888 PolarHBondContact O-N 2.9Å
889	K	67.8	Low	60.1	Low	132 Å²	132	111 Å²	111	57%	0.574	59%	0.585	S	S	*	*	S	Bend	trans	-79.2	144.7	173	-67.8	174.3	174.1	169.4	0	110.3	N886 T891	N886-K889 WeakPolarHBondContact O-CB 3.48Å; N886-K889 PolarHBondContact O-N 2.81Å; N886-K889 WeakPolarHBondContact OD1-CE 3.46Å; N886-K889 PolarHBondContact OD1-NZ 3.11Å; K889-T891 VanDerWaalsContact C-N 3.34Å; K889-T891 PolarHBondContact O-N 3.25Å
890	R	53.5	Low	57.1	Low	166 Å²	166	116.2 Å²	116.2	63%	0.626	62%	0.619	S	S	*	*			trans	-71.5	83.2	176.8	-167.8	-167.1	-145.1	142.6	16.8	110.7	D848 G892	D848-R890 IonicContact OD1-CZ 2.59Å; D848-R890 IonicContact OD1-NH1 2.67Å; D848-R890 PolarHBondContact OD1-NH1 3.46Å; D848-R890 IonicContact OD1-NH2 3.98Å; D848-R890 PolarHBondContact OD1-NH2 2.89Å; R890-G892 VanDerWaalsContact C-N 3.28Å; R890-G892 PolarHBondContact O-N 2.83Å
891	T	41.2	Very low	53.9	Low	110 Å²	110	113 Å²	113	68%	0.675	62%	0.62	S	S	*	*			trans	-67.9	86.5	171.7	46.8	0	0	0	0	110.2	K889	K889-T891 VanDerWaalsContact C-N 3.34Å; K889-T891 PolarHBondContact O-N 3.25Å
892	G	37	Very low	50.9	Low	70 Å²	70	119.6 Å²	119.6	72%	0.722	65%	0.654	S	S	*	*			trans	-134	31.5	179.5	0	0	0	0	0	112.1	R890	R890-G892 VanDerWaalsContact C-N 3.28Å; R890-G892 PolarHBondContact O-N 2.83Å
893	T	28.4	Very low	48	Very low	136 Å²	136	124.3 Å²	124.3	83%	0.834	68%	0.679	S	S	*	*	S	Bend	trans	-121.5	134.1	171	50	0	0	0	0	108.8
894	E	39.6	Very low	45	Very low	187 Å²	187	121.6 Å²	121.6	87%	0.874	68%	0.68	S	S	*	*			trans	-28.7	162.7	-173	-58.4	175.2	141.2	0	0	121.2
895	S	32.5	Very low	42.7	Very low	114 Å²	114	122.1 Å²	122.1	80%	0.797	69%	0.688	S	S	*	*			trans	90.1	142.2	162.7	80.4	0	0	0	0	119.7
896	S	27.7	Very low	40.1	Very low	117 Å²	117	124.7 Å²	124.7	82%	0.818	71%	0.708	S	S	*	*			trans	71.7	84.9	171.2	68.3	0	0	0	0	120
897	R	27	Very low	38.1	Very low	242 Å²	242	125.2 Å²	125.2	91%	0.913	72%	0.719	S	S	*	*			trans	-124.3	132.6	144.6	-96.6	-171.4	174.3	-176	-1.3	109.3
898	P	29.8	Very low	36.2	Very low	128 Å²	128	127.9 Å²	127.9	83%	0.831	74%	0.735	S	S	*	*			trans	-75.8	147.9	163	-13.7	30	0	0	0	111.6
899	N	26.9	Very low	34.3	Very low	157 Å²	157	134.1 Å²	134.1	84%	0.84	76%	0.764	S	S	*	*			trans	-48.2	144.7	-175.5	-55.7	-25.5	0	0	0	115.9
900	T	29.4	Very low	33.2	Very low	139 Å²	139	132.9 Å²	132.9	85%	0.853	76%	0.759	S	S	*	*				-155.1	145.2	110.1	-69.7	0	0	0	0	109.9
901	A	26.2	Very low	32.8	Very low	81 Å²	81	129.7 Å²	129.7	67%	0.669	76%	0.762	S	S	*	*			trans	-40.5	157.7	173.4	0	0	0	0	0	116.4
902	L	28.6	Very low	33	Very low	157 Å²	157	127.2 Å²	127.2	82%	0.822	75%	0.752	S	S	*	*			cis	-160.1	170.7	8.7	-123.9	163.5	0	0	0	110.7
903	L	29.9	Very low	33.9	Very low	154 Å²	154	125.3 Å²	125.3	81%	0.806	73%	0.727	S	S	*	*			trans	76.8	63.6	171.7	-52.9	178.5	0	0	0	118.7
904	D	26.1	Very low	35.4	Very low	150 Å²	150	125 Å²	125	80%	0.802	72%	0.724	S	S	*	*				28.1	153.3	100.9	-131.1	48.1	0	0	0	120.7
905	P	37.8	Very low	37.3	Very low	95 Å²	95	118.1 Å²	118.1	62%	0.617	70%	0.697	S	S	*	*				-136.2	164.3	-56.7	39.8	-26.9	0	0	0	114.2
906	S	26.8	Very low	39.6	Very low	123 Å²	123	112.9 Å²	112.9	86%	0.86	66%	0.66	S	S	*	*			trans	178	122.8	130.7	36.1	0	0	0	0	112.9
907	S	33.6	Very low	42.1	Very low	108 Å²	108	107.7 Å²	107.7	76%	0.755	63%	0.625	S	S	*	*			trans	-140	120.6	159.9	57	0	0	0	0	107.3	E909	S907-E909 PolarHBondContact O-N 2.87Å
908	P	34.5	Very low	44.5	Very low	100 Å²	100	99.3 Å²	99.3	65%	0.649	60%	0.598	S	S	*	*			trans	-64.5	135.1	-176.2	-21.9	33.1	0	0	0	112	A912	P908-A912 HydrophobicContact CB-CB 4.34Å
909	E	35.5	Very low	47.2	Very low	150 Å²	150	93.2 Å²	93.2	70%	0.701	56%	0.558	S	S	*	*			trans	-62.1	152.3	153.9	-66.6	-176	157	0	0	109.3	S907 S911 A912	S907-E909 PolarHBondContact O-N 2.87Å; E909-S911 WeakPolarHBondContact CB-OG 3.48Å; E909-S911 PolarHBondContact O-N 2.67Å; E909-S911 PolarHBondContact OE2-OG 2.71Å; E909-S911 VanDerWaalsContact OE2-OG 3.06Å; E909-A912 PolarHBondContact O-N 3.18Å
910	F	44.7	Very low	49.8	Very low	107 Å²	107	85.7 Å²	85.7	47%	0.469	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-65.5	-6.3	178.4	-108.9	-95.8	0	0	0	114.1	A912 V913	F910-A912 PolarHBondContact O-N 3.29Å; F910-V913 HydrophobicContact CD1-CG2 4.11Å; F910-V913 HydrophobicContact CE1-CG2 4.37Å; F910-V913 HydrophobicContact CG-CG2 4.44Å
911	S	45.4	Very low	52.2	Low	99 Å²	99	85 Å²	85	69%	0.692	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-69.6	-11	167.6	46.1	0	0	0	0	114.1	E909	E909-S911 WeakPolarHBondContact CB-OG 3.48Å; E909-S911 PolarHBondContact O-N 2.67Å; E909-S911 PolarHBondContact OE2-OG 2.71Å; E909-S911 VanDerWaalsContact OE2-OG 3.06Å
912	A	46.8	Very low	54.4	Low	57 Å²	57	83.8 Å²	83.8	47%	0.471	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-120.2	21.6	-172.4	0	0	0	0	0	114.9	P908 E909 F910 V914	P908-A912 HydrophobicContact CB-CB 4.34Å; E909-A912 PolarHBondContact O-N 3.18Å; F910-A912 PolarHBondContact O-N 3.29Å; A912-V914 PolarHBondContact O-N 2.94Å
913	V	53.9	Low	56.7	Low	30 Å²	30	77.5 Å²	77.5	18%	0.182	46%	0.462	C	S	.	.			trans	-88.6	101.6	177.4	-171.8	0	0	0	0	109.8	F910 D918 W919 L940	F910-V913 HydrophobicContact CD1-CG2 4.11Å; F910-V913 HydrophobicContact CE1-CG2 4.37Å; F910-V913 HydrophobicContact CG-CG2 4.44Å; V913-D918 HydrophobicContact CG1-CB 4.47Å; V913-W919 HydrophobicContact CG1-CB 3.75Å; V913-L940 HydrophobicContact CG1-CD1 4.09Å; V913-L940 HydrophobicContact CG1-CD2 4.37Å
914	V	61.5	Low	58.6	Low	130 Å²	130	77.9 Å²	77.9	79%	0.788	46%	0.457	S	S	*	.			trans	-94.3	-31.2	-173.2	-175.6	0	0	0	0	112.8	A912	A912-V914 PolarHBondContact O-N 2.94Å
915	S	78.3	Confident	61.4	Low	42 Å²	42	71.1 Å²	71.1	29%	0.294	42%	0.421	S	S	.	.	S	Bend	trans	-130.4	164.3	179.2	79.8	0	0	0	0	114	G917 D918 W919	S915-G917 PolarHBondContact O-N 2.8Å; S915-G917 PolarHBondContact OG-N 2.68Å; S915-D918 WeakPolarHBondContact CA-OD2 3.4Å; S915-D918 VanDerWaalsContact CB-OD2 3.27Å; S915-D918 WeakPolarHBondContact CB-OD2 3.39Å; S915-D918 PolarHBondContact N-OD2 2.78Å; S915-D918 PolarHBondContact O-N 2.89Å; S915-D918 PolarHBondContact OG-N 2.91Å; S915-D918 PolarHBondContact OG-OD2 3.13Å; S915-W919 PolarHBondContact O-N 3.24Å; S915-W919 VanDerWaalsContact O-N 3.09Å
916	V	81.8	Confident	63.4	Low	5 Å²	5	70.9 Å²	70.9	3%	0.03	42%	0.415	C	S	.	.	H	α-helix	trans	-60.9	-30.4	171.3	175	0	0	0	0	111.8	W919 L920 F932 Y937 T938 T939 L940 V943	V916-W919 HydrophobicContact CG1-CE3 3.99Å; V916-W919 HydrophobicContact CG1-CZ3 4.27Å; V916-L920 HydrophobicContact CG1-CD1 4.06Å; V916-L920 HydrophobicContact CG1-CG 4.41Å; V916-L920 WeakPolarHBondContact O-CB 3.42Å; V916-L920 VanDerWaalsContact O-CG 3.32Å; V916-L920 WeakPolarHBondContact O-CG 3.35Å; V916-L920 PolarHBondContact O-N 2.9Å; V916-F932 HydrophobicContact CG1-CB 4.11Å; V916-F932 HydrophobicContact CG1-CD1 3.98Å; V916-F932 HydrophobicContact CG1-CG 4.27Å; V916-Y937 WeakPolarHBondContact CG1-O 3.43Å; V916-Y937 WeakPolarHBondContact CG2-O 3.16Å; V916-T938 WeakPolarHBondContact CG2-O 3.11Å; V916-T939 WeakPolarHBondContact CG2-O 3.36Å; V916-L940 HydrophobicContact CG2-CD2 4.24Å; V916-V943 HydrophobicContact CB-CG2 4.33Å; V916-V943 HydrophobicContact CG1-CG2 3.75Å; V916-V943 HydrophobicContact CG2-CG2 3.58Å
917	G	80	Confident	66	Low	7 Å²	7	71.6 Å²	71.6	7%	0.072	40%	0.398	C	S	.	.	H	α-helix	trans	-64.9	-43.7	174.4	0	0	0	0	0	112.5	S915 L920 Q921	S915-G917 PolarHBondContact O-N 2.8Å; S915-G917 PolarHBondContact OG-N 2.68Å; G917-L920 PolarHBondContact O-N 3.39Å; G917-Q921 WeakPolarHBondContact O-CB 3.48Å; G917-Q921 PolarHBondContact O-N 2.8Å
918	D	78.3	Confident	68.5	Low	66 Å²	66	67.3 Å²	67.3	35%	0.353	37%	0.366	S	S	.	.	H	α-helix	trans	-68.7	-37.7	179.3	-46.3	-50.8	0	0	0	110.9	V913 S915 Q921 A922	V913-D918 HydrophobicContact CG1-CB 4.47Å; S915-D918 WeakPolarHBondContact CA-OD2 3.4Å; S915-D918 VanDerWaalsContact CB-OD2 3.27Å; S915-D918 WeakPolarHBondContact CB-OD2 3.39Å; S915-D918 PolarHBondContact N-OD2 2.78Å; S915-D918 PolarHBondContact O-N 2.89Å; S915-D918 PolarHBondContact OG-N 2.91Å; S915-D918 PolarHBondContact OG-OD2 3.13Å; D918-Q921 PolarHBondContact O-N 2.89Å; D918-A922 WeakPolarHBondContact O-CB 3.49Å; D918-A922 PolarHBondContact O-N 2.83Å
919	W	85	Confident	70.8	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-61.4	-49.7	172.1	168	67.3	0	0	0	112.1	V913 S915 V916 Q921 A922 I923 F932 L940 V943 I965 S968 V969 M972	V913-W919 HydrophobicContact CG1-CB 3.75Å; S915-W919 PolarHBondContact O-N 3.24Å; S915-W919 VanDerWaalsContact O-N 3.09Å; V916-W919 HydrophobicContact CG1-CE3 3.99Å; V916-W919 HydrophobicContact CG1-CZ3 4.27Å; W919-Q921 VanDerWaalsContact C-N 3.28Å; W919-Q921 PolarHBondContact O-N 3.37Å; W919-A922 PolarHBondContact O-N 2.95Å; W919-A922 VanDerWaalsContact O-N 3.15Å; W919-I923 HydrophobicContact CH2-CD1 4.39Å; W919-I923 HydrophobicContact CZ2-CD1 3.9Å; W919-I923 WeakPolarHBondContact O-CG1 3.09Å; W919-I923 PolarHBondContact O-N 3.19Å; W919-F932 HydrophobicContact CH2-CE1 4.11Å; W919-F932 HydrophobicContact CH2-CZ 4.1Å; W919-F932 HydrophobicContact CZ3-CD1 4.24Å; W919-F932 AromaticContact CZ3-CE1 3.72Å; W919-F932 HydrophobicContact CZ3-CE1 3.72Å; W919-F932 AromaticContact CZ3-CZ 3.94Å; W919-F932 HydrophobicContact CZ3-CZ 3.94Å; W919-L940 HydrophobicContact CB-CD2 3.78Å; W919-L940 HydrophobicContact CG-CD2 4.12Å; W919-V943 HydrophobicContact CD2-CG1 4.42Å; W919-V943 HydrophobicContact CE3-CG1 3.96Å; W919-V943 HydrophobicContact CH2-CG1 3.31Å; W919-V943 HydrophobicContact CZ2-CG1 3.86Å; W919-V943 HydrophobicContact CZ3-CB 4.42Å; W919-V943 HydrophobicContact CZ3-CG1 3.4Å; W919-V943 VanDerWaalsContact CZ3-CG1 3.4Å; W919-V943 HydrophobicContact CZ3-CG2 4.11Å; W919-I965 HydrophobicContact CH2-CG2 3.83Å; W919-I965 HydrophobicContact CZ2-CG2 4.39Å; W919-S968 PolarHBondContact NE1-OG 2.98Å; W919-V969 HydrophobicContact CH2-CG2 4.17Å; W919-V969 HydrophobicContact CZ2-CG2 4.04Å; W919-M972 HydrophobicContact CD2-CE 4.19Å; W919-M972 VanDerWaalsContact CE2-CE 3.45Å; W919-M972 HydrophobicContact CG-SD 4.44Å; W919-M972 HydrophobicContact CH2-CE 4.43Å; W919-M972 HydrophobicContact CZ2-CE 3.6Å
920	L	81.3	Confident	72.9	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-59.1	-40.8	177	-75.6	169.7	0	0	0	111.3	V916 G917 I923 K924 M925 D926 K929 F932	V916-L920 HydrophobicContact CG1-CD1 4.06Å; V916-L920 HydrophobicContact CG1-CG 4.41Å; V916-L920 WeakPolarHBondContact O-CB 3.42Å; V916-L920 VanDerWaalsContact O-CG 3.32Å; V916-L920 WeakPolarHBondContact O-CG 3.35Å; V916-L920 PolarHBondContact O-N 2.9Å; G917-L920 PolarHBondContact O-N 3.39Å; L920-I923 HydrophobicContact CD2-CD1 4.37Å; L920-I923 WeakPolarHBondContact O-CG1 3.21Å; L920-I923 PolarHBondContact O-N 2.84Å; L920-K924 PolarHBondContact O-N 2.88Å; L920-K924 VanDerWaalsContact O-N 3.09Å; L920-M925 HydrophobicContact CD2-CB 4.02Å; L920-M925 CarbonylContact O-C 3.6Å; L920-M925 PolarHBondContact O-N 2.89Å; L920-D926 PolarHBondContact O-N 2.85Å; L920-K929 HydrophobicContact CD1-CB 4.36Å; L920-F932 HydrophobicContact CD1-CB 4.01Å; L920-F932 HydrophobicContact CD1-CD2 3.81Å; L920-F932 HydrophobicContact CD1-CE2 4.47Å; L920-F932 HydrophobicContact CD1-CG 3.91Å; L920-F932 HydrophobicContact CD2-CD2 4.08Å; L920-F932 HydrophobicContact CD2-CE2 3.91Å; L920-F932 HydrophobicContact CD2-CZ 4.39Å
921	Q	79.6	Confident	75	Confident	125 Å²	125	63.1 Å²	63.1	58%	0.584	34%	0.343	S	S	*	.	H	α-helix	trans	-64.9	-43.5	174.2	-172.3	173.8	-7.3	0	0	112.3	G917 D918 W919 I923 K924 D926	G917-Q921 WeakPolarHBondContact O-CB 3.48Å; G917-Q921 PolarHBondContact O-N 2.8Å; D918-Q921 PolarHBondContact O-N 2.89Å; W919-Q921 VanDerWaalsContact C-N 3.28Å; W919-Q921 PolarHBondContact O-N 3.37Å; Q921-I923 VanDerWaalsContact C-N 3.34Å; Q921-I923 PolarHBondContact O-N 2.93Å; Q921-K924 PolarHBondContact O-N 3.11Å; Q921-D926 HydrophobicContact CB-CB 4.38Å
922	A	72.5	Confident	77.1	Confident	55 Å²	55	58.4 Å²	58.4	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-40	177	0	0	0	0	0	112.4	D918 W919 K924	D918-A922 WeakPolarHBondContact O-CB 3.49Å; D918-A922 PolarHBondContact O-N 2.83Å; W919-A922 PolarHBondContact O-N 2.95Å; W919-A922 VanDerWaalsContact O-N 3.15Å; A922-K924 VanDerWaalsContact C-N 3.26Å; A922-K924 PolarHBondContact O-N 2.96Å
923	I	77.7	Confident	78.8	Confident	25 Å²	25	59.3 Å²	59.3	13%	0.128	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	2.8	173.4	71.1	168.8	0	0	0	113.5	W919 L920 Q921 M925 K964 I965	W919-I923 HydrophobicContact CH2-CD1 4.39Å; W919-I923 HydrophobicContact CZ2-CD1 3.9Å; W919-I923 WeakPolarHBondContact O-CG1 3.09Å; W919-I923 PolarHBondContact O-N 3.19Å; L920-I923 HydrophobicContact CD2-CD1 4.37Å; L920-I923 WeakPolarHBondContact O-CG1 3.21Å; L920-I923 PolarHBondContact O-N 2.84Å; Q921-I923 VanDerWaalsContact C-N 3.34Å; Q921-I923 PolarHBondContact O-N 2.93Å; I923-M925 HydrophobicContact CD1-CB 4.13Å; I923-M925 HydrophobicContact CD1-CG 3.82Å; I923-M925 HydrophobicContact CG1-CB 3.95Å; I923-M925 HydrophobicContact CG1-CG 3.79Å; I923-K964 WeakPolarHBondContact O-CE 3.22Å; I923-K964 PolarHBondContact O-NZ 2.64Å; I923-I965 HydrophobicContact CD1-CG1 4.02Å
924	K	70.3	Confident	80	Confident	161 Å²	161	62.4 Å²	62.4	70%	0.7	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	56.7	-176.5	-51.6	-171.7	-179.1	-167.6	0	112.3	L920 Q921 A922 K964	L920-K924 PolarHBondContact O-N 2.88Å; L920-K924 VanDerWaalsContact O-N 3.09Å; Q921-K924 PolarHBondContact O-N 3.11Å; A922-K924 VanDerWaalsContact C-N 3.26Å; A922-K924 PolarHBondContact O-N 2.96Å; K924-K964 PolarHBondContact O-NZ 2.77Å
925	M	83.9	Confident	81	Confident	8 Å²	8	58.3 Å²	58.3	4%	0.039	32%	0.318	C	S	.	.			trans	-138	23.8	174.9	-60	-87	69.8	0	0	110.2	M847 L920 I923 R927 Y928 H961 K964 I965	M847-M925 HydrophobicContact SD-CE 4.27Å; L920-M925 HydrophobicContact CD2-CB 4.02Å; L920-M925 CarbonylContact O-C 3.6Å; L920-M925 PolarHBondContact O-N 2.89Å; I923-M925 HydrophobicContact CD1-CB 4.13Å; I923-M925 HydrophobicContact CD1-CG 3.82Å; I923-M925 HydrophobicContact CG1-CB 3.95Å; I923-M925 HydrophobicContact CG1-CG 3.79Å; M925-R927 PolarHBondContact O-N 2.9Å; M925-Y928 HydrophobicContact CB-CD2 4.31Å; M925-Y928 HydrophobicContact CE-CE2 4.33Å; M925-Y928 PolarHBondContact O-N 3.39Å; M925-Y928 HydrophobicContact SD-CE2 4.47Å; M925-H961 HydrophobicContact CE-CB 4.43Å; M925-H961 HydrophobicContact SD-CB 3.91Å; M925-K964 HydrophobicContact CG-CD 4.36Å; M925-K964 HydrophobicContact SD-CD 3.96Å; M925-I965 HydrophobicContact CG-CD1 4.46Å; M925-I965 HydrophobicContact CG-CG1 4.09Å; M925-I965 HydrophobicContact SD-CD1 4.27Å; M925-I965 HydrophobicContact SD-CG1 4.19Å
926	D	81.1	Confident	81.1	Confident	90 Å²	90	58.5 Å²	58.5	48%	0.481	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-49.6	-35.6	178.7	47.2	-76.9	0	0	0	113.7	L920 Q921 Y928 K929	L920-D926 PolarHBondContact O-N 2.85Å; Q921-D926 HydrophobicContact CB-CB 4.38Å; D926-Y928 PolarHBondContact O-N 2.79Å; D926-K929 WeakPolarHBondContact O-CB 3.43Å; D926-K929 PolarHBondContact O-N 3.39Å
927	R	79.7	Confident	81.3	Confident	138 Å²	138	60.2 Å²	60.2	52%	0.521	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-55.6	-7.7	172.1	73.1	173.6	-66.2	-178.7	3	116.1	M925	M925-R927 PolarHBondContact O-N 2.9Å
928	Y	86.2	Confident	81.3	Confident	18 Å²	18	64 Å²	64	7%	0.071	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-112.8	9.4	177	-61.6	-56.7	0	0	0	113.4	M925 D926 D930 N931 F932 I956 H961	M925-Y928 HydrophobicContact CB-CD2 4.31Å; M925-Y928 HydrophobicContact CE-CE2 4.33Å; M925-Y928 PolarHBondContact O-N 3.39Å; M925-Y928 HydrophobicContact SD-CE2 4.47Å; D926-Y928 PolarHBondContact O-N 2.79Å; Y928-D930 PolarHBondContact O-N 3.2Å; Y928-N931 HydrophobicContact CD1-CB 4.48Å; Y928-N931 WeakPolarHBondContact O-CB 3.5Å; Y928-N931 PolarHBondContact O-N 3.34Å; Y928-F932 WeakPolarHBondContact O-CD2 3.41Å; Y928-F932 PolarHBondContact O-N 2.64Å; Y928-I956 HydrophobicContact CD1-CD1 3.98Å; Y928-I956 HydrophobicContact CD1-CG1 3.68Å; Y928-I956 HydrophobicContact CD2-CD1 3.95Å; Y928-I956 HydrophobicContact CD2-CG1 4.3Å; Y928-I956 HydrophobicContact CE1-CG1 3.9Å; Y928-I956 HydrophobicContact CE1-CG2 4.49Å; Y928-I956 HydrophobicContact CE2-CG1 4.5Å; Y928-I956 HydrophobicContact CE2-CG2 4.13Å; Y928-I956 HydrophobicContact CG-CD1 3.65Å; Y928-I956 HydrophobicContact CG-CG1 3.89Å; Y928-H961 HydrophobicContact CE2-CB 4.07Å; Y928-H961 AromaticContact CE2-CG 3.96Å; Y928-H961 AromaticContact CE2-ND1 3.45Å; Y928-H961 WeakPolarHBondContact CE2-ND1 2.74Å; Y928-H961 AromaticContact CZ-ND1 3.57Å; Y928-H961 PolarHBondContact OH-ND1 3.12Å
929	K	83.9	Confident	81.4	Confident	98 Å²	98	63.8 Å²	63.8	43%	0.426	36%	0.357	S	S	.	.	H	α-helix	trans	-54.4	-42.8	176.7	-177.7	173.8	179.1	175.5	0	111.9	L920 D926 T933	L920-K929 HydrophobicContact CD1-CB 4.36Å; D926-K929 WeakPolarHBondContact O-CB 3.43Å; D926-K929 PolarHBondContact O-N 3.39Å; K929-T933 WeakPolarHBondContact O-CB 3.44Å; K929-T933 PolarHBondContact O-N 2.72Å; K929-T933 PolarHBondContact O-OG1 3.23Å
930	D	80.4	Confident	81.1	Confident	119 Å²	119	66 Å²	66	64%	0.636	37%	0.368	S	S	*	.	H	α-helix	trans	-75.4	-37	-179.1	-51	-46.9	0	0	0	111.3	Y928 F932 T933 A934	Y928-D930 PolarHBondContact O-N 3.2Å; D930-F932 PolarHBondContact O-N 2.74Å; D930-T933 PolarHBondContact O-N 3.49Å; D930-A934 VanDerWaalsContact O-CB 3.22Å; D930-A934 WeakPolarHBondContact O-CB 3.38Å; D930-A934 PolarHBondContact O-N 2.87Å
931	N	88.4	Confident	80.9	Confident	53 Å²	53	72.2 Å²	72.2	28%	0.283	40%	0.397	S	S	.	.	H	α-helix	trans	-58.1	-45.6	171.8	-63.9	79.2	0	0	0	112.7	Y928 A935 I954	Y928-N931 HydrophobicContact CD1-CB 4.48Å; Y928-N931 WeakPolarHBondContact O-CB 3.5Å; Y928-N931 PolarHBondContact O-N 3.34Å; N931-A935 VanDerWaalsContact O-CB 3.27Å; N931-A935 WeakPolarHBondContact O-CB 3.3Å; N931-A935 PolarHBondContact O-N 2.81Å; N931-I954 WeakPolarHBondContact CB-O 3.15Å; N931-I954 PolarHBondContact ND2-O 3.01Å
932	F	88.3	Confident	80.9	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-66.8	-42.8	176.3	-90.8	-101.8	0	0	0	111.8	V916 W919 L920 Y928 D930 A935 G936 Y937 V943 L951 I954 I956 I965	V916-F932 HydrophobicContact CG1-CB 4.11Å; V916-F932 HydrophobicContact CG1-CD1 3.98Å; V916-F932 HydrophobicContact CG1-CG 4.27Å; W919-F932 HydrophobicContact CH2-CE1 4.11Å; W919-F932 HydrophobicContact CH2-CZ 4.1Å; W919-F932 HydrophobicContact CZ3-CD1 4.24Å; W919-F932 AromaticContact CZ3-CE1 3.72Å; W919-F932 HydrophobicContact CZ3-CE1 3.72Å; W919-F932 AromaticContact CZ3-CZ 3.94Å; W919-F932 HydrophobicContact CZ3-CZ 3.94Å; L920-F932 HydrophobicContact CD1-CB 4.01Å; L920-F932 HydrophobicContact CD1-CD2 3.81Å; L920-F932 HydrophobicContact CD1-CE2 4.47Å; L920-F932 HydrophobicContact CD1-CG 3.91Å; L920-F932 HydrophobicContact CD2-CD2 4.08Å; L920-F932 HydrophobicContact CD2-CE2 3.91Å; L920-F932 HydrophobicContact CD2-CZ 4.39Å; Y928-F932 WeakPolarHBondContact O-CD2 3.41Å; Y928-F932 PolarHBondContact O-N 2.64Å; D930-F932 PolarHBondContact O-N 2.74Å; F932-A935 PolarHBondContact O-N 2.85Å; F932-G936 PolarHBondContact O-N 2.7Å; F932-Y937 HydrophobicContact CD1-CD2 4.34Å; F932-Y937 HydrophobicContact CD1-CG 4.23Å; F932-Y937 PolarHBondContact O-N 2.82Å; F932-V943 HydrophobicContact CD1-CG2 3.9Å; F932-V943 HydrophobicContact CE1-CG1 4.49Å; F932-V943 HydrophobicContact CE1-CG2 3.96Å; F932-L951 HydrophobicContact CE2-CD2 4.18Å; F932-L951 HydrophobicContact CZ-CD2 3.67Å; F932-I954 HydrophobicContact CD2-CD1 3.76Å; F932-I954 HydrophobicContact CE1-CD1 4.42Å; F932-I954 HydrophobicContact CE2-CD1 3.69Å; F932-I954 HydrophobicContact CG-CD1 4.19Å; F932-I954 HydrophobicContact CZ-CD1 4.02Å; F932-I956 HydrophobicContact CD2-CD1 4.25Å; F932-I956 HydrophobicContact CE2-CD1 3.63Å; F932-I965 HydrophobicContact CE2-CD1 4.25Å; F932-I965 HydrophobicContact CZ-CG2 3.87Å
933	T	82.1	Confident	81.5	Confident	75 Å²	75	65.2 Å²	65.2	46%	0.46	36%	0.36	S	S	.	.	H	α-helix	trans	-65.7	-47.2	-179.2	-56	0	0	0	0	111.6	K929 D930 A935 G936 T938	K929-T933 WeakPolarHBondContact O-CB 3.44Å; K929-T933 PolarHBondContact O-N 2.72Å; K929-T933 PolarHBondContact O-OG1 3.23Å; D930-T933 PolarHBondContact O-N 3.49Å; T933-A935 PolarHBondContact O-N 2.83Å; T933-G936 PolarHBondContact O-N 2.9Å; T933-T938 HydrophobicContact CG2-CG2 4.37Å
934	A	79.1	Confident	81.8	Confident	95 Å²	95	64.6 Å²	64.6	79%	0.785	36%	0.358	S	S	*	.	H	α-helix	trans	-64.3	-26.8	177.9	0	0	0	0	0	113.1	D930 G936	D930-A934 VanDerWaalsContact O-CB 3.22Å; D930-A934 WeakPolarHBondContact O-CB 3.38Å; D930-A934 PolarHBondContact O-N 2.87Å; A934-G936 VanDerWaalsContact C-N 3.32Å
935	A	82.8	Confident	82.3	Confident	44 Å²	44	64 Å²	64	36%	0.364	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	3.1	174.5	0	0	0	0	0	114.4	N931 F932 T933 Y937 I954	N931-A935 VanDerWaalsContact O-CB 3.27Å; N931-A935 WeakPolarHBondContact O-CB 3.3Å; N931-A935 PolarHBondContact O-N 2.81Å; F932-A935 PolarHBondContact O-N 2.85Å; T933-A935 PolarHBondContact O-N 2.83Å; A935-Y937 VanDerWaalsContact C-N 3.31Å; A935-Y937 HydrophobicContact CB-CD2 3.77Å; A935-Y937 HydrophobicContact CB-CE2 4.07Å; A935-Y937 PolarHBondContact O-N 2.85Å; A935-I954 HydrophobicContact CB-CB 4.04Å; A935-I954 HydrophobicContact CB-CG2 3.22Å
936	G	80.7	Confident	82.4	Confident	47 Å²	47	63.7 Å²	63.7	49%	0.485	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	5	179.4	0	0	0	0	0	115.1	F932 T933 A934 T938	F932-G936 PolarHBondContact O-N 2.7Å; T933-G936 PolarHBondContact O-N 2.9Å; A934-G936 VanDerWaalsContact C-N 3.32Å; G936-T938 PolarHBondContact O-N 3.03Å
937	Y	86.1	Confident	82.5	Confident	41 Å²	41	62.7 Å²	62.7	16%	0.161	35%	0.35	C	S	.	.			trans	-80.5	65.8	173.9	-64.3	-67.7	0	0	0	110.6	V916 F932 A935 A942 V946 I954	V916-Y937 WeakPolarHBondContact CG1-O 3.43Å; V916-Y937 WeakPolarHBondContact CG2-O 3.16Å; F932-Y937 HydrophobicContact CD1-CD2 4.34Å; F932-Y937 HydrophobicContact CD1-CG 4.23Å; F932-Y937 PolarHBondContact O-N 2.82Å; A935-Y937 VanDerWaalsContact C-N 3.31Å; A935-Y937 HydrophobicContact CB-CD2 3.77Å; A935-Y937 HydrophobicContact CB-CE2 4.07Å; A935-Y937 PolarHBondContact O-N 2.85Å; Y937-A942 HydrophobicContact CD1-CB 4Å; Y937-V946 HydrophobicContact CD1-CG2 3.69Å; Y937-V946 HydrophobicContact CD2-CG2 4.42Å; Y937-V946 HydrophobicContact CE1-CG2 3.39Å; Y937-V946 HydrophobicContact CE2-CG2 4.17Å; Y937-V946 HydrophobicContact CG-CG2 4.22Å; Y937-I954 HydrophobicContact CD2-CG2 4.45Å; Y937-I954 HydrophobicContact CE2-CG2 4.07Å
938	T	79.3	Confident	82.6	Confident	86 Å²	86	60.2 Å²	60.2	53%	0.528	35%	0.345	S	S	.	.			trans	-91.5	-19.5	-176.9	55.2	0	0	0	0	113.8	V916 T933 G936	V916-T938 WeakPolarHBondContact CG2-O 3.11Å; T933-T938 HydrophobicContact CG2-CG2 4.37Å; G936-T938 PolarHBondContact O-N 3.03Å
939	T	81.3	Confident	82.4	Confident	62 Å²	62	66 Å²	66	38%	0.38	37%	0.373	S	S	.	.	S	Bend	trans	-110.9	151.4	174.5	75.3	0	0	0	0	112.2	V916 E941 A942 V943	V916-T939 WeakPolarHBondContact CG2-O 3.36Å; T939-E941 PolarHBondContact O-N 2.79Å; T939-A942 PolarHBondContact O-N 2.84Å; T939-A942 PolarHBondContact OG1-N 2.95Å; T939-V943 PolarHBondContact O-N 3.3Å; T939-V943 VanDerWaalsContact O-N 3.13Å
940	L	78.4	Confident	82.4	Confident	47 Å²	47	62.2 Å²	62.2	25%	0.246	36%	0.357	C	S	.	.	H	α-helix	trans	-62	-29	176.3	-66.7	170.8	0	0	0	112.1	V913 V916 W919 V943 V944 M972	V913-L940 HydrophobicContact CG1-CD1 4.09Å; V913-L940 HydrophobicContact CG1-CD2 4.37Å; V916-L940 HydrophobicContact CG2-CD2 4.24Å; W919-L940 HydrophobicContact CB-CD2 3.78Å; W919-L940 HydrophobicContact CG-CD2 4.12Å; L940-V943 WeakPolarHBondContact O-CB 3.1Å; L940-V943 PolarHBondContact O-N 2.95Å; L940-V944 WeakPolarHBondContact O-CB 3.37Å; L940-V944 VanDerWaalsContact O-CG2 3.28Å; L940-V944 WeakPolarHBondContact O-CG2 3.32Å; L940-V944 PolarHBondContact O-N 3.44Å; L940-M972 HydrophobicContact CD2-SD 4.36Å
941	E	77.6	Confident	82.7	Confident	129 Å²	129	56.6 Å²	56.6	60%	0.603	33%	0.327	S	S	*	.	H	α-helix	trans	-66.6	-43.7	176.9	-61.7	153.4	145.9	0	0	111.2	T939 V944 H945	T939-E941 PolarHBondContact O-N 2.79Å; E941-V944 PolarHBondContact O-N 3.08Å; E941-H945 PolarHBondContact O-CD2 3.35Å; E941-H945 VanDerWaalsContact O-CD2 3.32Å
942	A	79.4	Confident	82.3	Confident	33 Å²	33	56.4 Å²	56.4	27%	0.273	33%	0.333	S	S	.	.	H	α-helix	trans	-64	-43.4	173.9	0	0	0	0	0	111.3	Y937 T939 V944 H945	Y937-A942 HydrophobicContact CD1-CB 4Å; T939-A942 PolarHBondContact O-N 2.84Å; T939-A942 PolarHBondContact OG1-N 2.95Å; A942-V944 VanDerWaalsContact C-N 3.26Å; A942-V944 PolarHBondContact O-N 2.77Å; A942-H945 PolarHBondContact O-N 3.24Å
943	V	85.1	Confident	82	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-58.1	-37.4	174.6	165.8	0	0	0	0	112.1	V916 W919 F932 T939 L940 H945 V946 V969 M972	V916-V943 HydrophobicContact CB-CG2 4.33Å; V916-V943 HydrophobicContact CG1-CG2 3.75Å; V916-V943 HydrophobicContact CG2-CG2 3.58Å; W919-V943 HydrophobicContact CD2-CG1 4.42Å; W919-V943 HydrophobicContact CE3-CG1 3.96Å; W919-V943 HydrophobicContact CH2-CG1 3.31Å; W919-V943 HydrophobicContact CZ2-CG1 3.86Å; W919-V943 HydrophobicContact CZ3-CB 4.42Å; W919-V943 HydrophobicContact CZ3-CG1 3.4Å; W919-V943 VanDerWaalsContact CZ3-CG1 3.4Å; W919-V943 HydrophobicContact CZ3-CG2 4.11Å; F932-V943 HydrophobicContact CD1-CG2 3.9Å; F932-V943 HydrophobicContact CE1-CG1 4.49Å; F932-V943 HydrophobicContact CE1-CG2 3.96Å; T939-V943 PolarHBondContact O-N 3.3Å; T939-V943 VanDerWaalsContact O-N 3.13Å; L940-V943 WeakPolarHBondContact O-CB 3.1Å; L940-V943 PolarHBondContact O-N 2.95Å; V943-H945 PolarHBondContact O-N 3.28Å; V943-H945 VanDerWaalsContact O-N 3.14Å; V943-V946 VanDerWaalsContact O-CB 3.3Å; V943-V946 WeakPolarHBondContact O-CB 3.47Å; V943-V946 VanDerWaalsContact O-CG2 3.3Å; V943-V946 WeakPolarHBondContact O-CG2 3.36Å; V943-V946 PolarHBondContact O-N 3.17Å; V943-V946 VanDerWaalsContact O-N 3.12Å; V943-V969 HydrophobicContact CG1-CG2 3.98Å; V943-M972 HydrophobicContact CG1-CE 3.77Å
944	V	83.7	Confident	82.2	Confident	13 Å²	13	61.7 Å²	61.7	8%	0.079	35%	0.345	C	S	.	.	H	α-helix	trans	-62.9	-19.6	-179.7	155.8	0	0	0	0	112.8	L940 E941 A942 M972 R973 M976	L940-V944 WeakPolarHBondContact O-CB 3.37Å; L940-V944 VanDerWaalsContact O-CG2 3.28Å; L940-V944 WeakPolarHBondContact O-CG2 3.32Å; L940-V944 PolarHBondContact O-N 3.44Å; E941-V944 PolarHBondContact O-N 3.08Å; A942-V944 VanDerWaalsContact C-N 3.26Å; A942-V944 PolarHBondContact O-N 2.77Å; V944-M972 HydrophobicContact CG2-CB 3.84Å; V944-M972 HydrophobicContact CG2-CE 4.35Å; V944-R973 HydrophobicContact CG1-CG 3.84Å; V944-R973 PolarHBondContact O-NE 2.87Å; V944-R973 PolarHBondContact O-NH2 3.5Å; V944-M976 HydrophobicContact CB-SD 4.41Å; V944-M976 HydrophobicContact CG1-SD 4.12Å; V944-M976 HydrophobicContact CG2-SD 3.84Å
945	H	80	Confident	82	Confident	149 Å²	149	59 Å²	59	69%	0.69	33%	0.327	S	S	*	.	H	α-helix	trans	-92.6	-10.4	176.1	-71.7	-73.3	0	0	0	115.4	E941 A942 V943	E941-H945 PolarHBondContact O-CD2 3.35Å; E941-H945 VanDerWaalsContact O-CD2 3.32Å; A942-H945 PolarHBondContact O-N 3.24Å; V943-H945 PolarHBondContact O-N 3.28Å; V943-H945 VanDerWaalsContact O-N 3.14Å
946	V	86.4	Confident	82.1	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.006	31%	0.31	C	S	.	.			trans	-53.8	138.6	-177.6	172.3	0	0	0	0	112.9	Y937 V943 D950 L951 R973	Y937-V946 HydrophobicContact CD1-CG2 3.69Å; Y937-V946 HydrophobicContact CD2-CG2 4.42Å; Y937-V946 HydrophobicContact CE1-CG2 3.39Å; Y937-V946 HydrophobicContact CE2-CG2 4.17Å; Y937-V946 HydrophobicContact CG-CG2 4.22Å; V943-V946 VanDerWaalsContact O-CB 3.3Å; V943-V946 WeakPolarHBondContact O-CB 3.47Å; V943-V946 VanDerWaalsContact O-CG2 3.3Å; V943-V946 WeakPolarHBondContact O-CG2 3.36Å; V943-V946 PolarHBondContact O-N 3.17Å; V943-V946 VanDerWaalsContact O-N 3.12Å; V946-D950 HydrophobicContact CG1-CB 4.25Å; V946-L951 HydrophobicContact CG1-CD1 4.26Å; V946-L951 HydrophobicContact CG1-CD2 3.51Å; V946-L951 HydrophobicContact CG1-CG 3.6Å; V946-R973 PolarHBondContact O-NH2 3.2Å; V946-R973 VanDerWaalsContact O-NH2 3.07Å
947	N	84.5	Confident	81.8	Confident	68 Å²	68	60.1 Å²	60.1	36%	0.364	32%	0.32	S	S	.	.			trans	-119.1	178.9	171.9	77.3	65	0	0	0	112.3	E949 D950 L951	N947-E949 WeakPolarHBondContact OD1-CA 3.3Å; N947-E949 WeakPolarHBondContact OD1-CB 3.32Å; N947-E949 PolarHBondContact OD1-N 2.92Å; N947-D950 VanDerWaalsContact CG-OD2 3.24Å; N947-D950 PolarHBondContact N-OD2 3.11Å; N947-D950 VanDerWaalsContact ND2-CG 3.26Å; N947-D950 PolarHBondContact ND2-OD1 2.59Å; N947-D950 PolarHBondContact ND2-OD2 3.32Å; N947-D950 PolarHBondContact O-N 2.77Å; N947-D950 PolarHBondContact OD1-N 3.1Å; N947-L951 PolarHBondContact O-N 2.91Å; N947-L951 VanDerWaalsContact O-N 3.17Å
948	Q	82	Confident	81	Confident	87 Å²	87	59.3 Å²	59.3	41%	0.407	32%	0.322	S	S	.	.	H	α-helix	trans	-69.2	-32.9	-174.3	-167.6	165.4	5.5	0	0	114	L951 A952 Q962 L966	Q948-L951 PolarHBondContact O-N 2.8Å; Q948-A952 PolarHBondContact O-N 2.95Å; Q948-A952 VanDerWaalsContact O-N 3.13Å; Q948-Q962 HydrophobicContact CG-CB 4.49Å; Q948-L966 HydrophobicContact CB-CD1 3.77Å; Q948-L966 HydrophobicContact CG-CD1 4.03Å
949	E	81.1	Confident	80.6	Confident	140 Å²	140	60.2 Å²	60.2	65%	0.654	32%	0.322	S	S	*	.	H	α-helix	trans	-69.3	-36.2	174.8	-58	-176	177.9	0	0	111.2	N947 A952 R953	N947-E949 WeakPolarHBondContact OD1-CA 3.3Å; N947-E949 WeakPolarHBondContact OD1-CB 3.32Å; N947-E949 PolarHBondContact OD1-N 2.92Å; E949-A952 PolarHBondContact O-N 3.33Å; E949-R953 WeakPolarHBondContact O-CB 3.48Å; E949-R953 PolarHBondContact O-N 2.83Å
950	D	84.6	Confident	79.3	Confident	18 Å²	18	59.6 Å²	59.6	10%	0.096	32%	0.319	C	S	.	.	H	α-helix	trans	-62.9	-44.5	174.4	-54.6	-31.2	0	0	0	110.8	V946 N947 A952 R953 I954	V946-D950 HydrophobicContact CG1-CB 4.25Å; N947-D950 VanDerWaalsContact CG-OD2 3.24Å; N947-D950 PolarHBondContact N-OD2 3.11Å; N947-D950 VanDerWaalsContact ND2-CG 3.26Å; N947-D950 PolarHBondContact ND2-OD1 2.59Å; N947-D950 PolarHBondContact ND2-OD2 3.32Å; N947-D950 PolarHBondContact O-N 2.77Å; N947-D950 PolarHBondContact OD1-N 3.1Å; D950-A952 VanDerWaalsContact C-N 3.32Å; D950-A952 PolarHBondContact O-N 3.42Å; D950-R953 WeakPolarHBondContact O-CA 3.46Å; D950-R953 WeakPolarHBondContact O-CB 3.41Å; D950-R953 PolarHBondContact O-N 3.03Å; D950-R953 IonicContact OD1-CZ 3.66Å; D950-R953 IonicContact OD1-NH1 3.51Å; D950-R953 PolarHBondContact OD1-NH1 3.07Å; D950-R953 IonicContact OD1-NH2 2.94Å; D950-R953 PolarHBondContact OD1-NH2 2.9Å; D950-I954 WeakPolarHBondContact O-CG2 3.41Å; D950-I954 PolarHBondContact O-N 2.98Å
951	L	86.1	Confident	79.4	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-38.5	177.1	-66.3	-179.2	0	0	0	112.6	F932 V946 N947 Q948 I954 I956 Q962 I965 L966	F932-L951 HydrophobicContact CE2-CD2 4.18Å; F932-L951 HydrophobicContact CZ-CD2 3.67Å; V946-L951 HydrophobicContact CG1-CD1 4.26Å; V946-L951 HydrophobicContact CG1-CD2 3.51Å; V946-L951 HydrophobicContact CG1-CG 3.6Å; N947-L951 PolarHBondContact O-N 2.91Å; N947-L951 VanDerWaalsContact O-N 3.17Å; Q948-L951 PolarHBondContact O-N 2.8Å; L951-I954 HydrophobicContact CD2-CD1 3.93Å; L951-I954 WeakPolarHBondContact O-CG1 3.33Å; L951-I956 HydrophobicContact CD2-CD1 4.33Å; L951-I956 WeakPolarHBondContact O-CA 3.49Å; L951-I956 WeakPolarHBondContact O-CB 3.32Å; L951-I956 PolarHBondContact O-N 2.93Å; L951-Q962 HydrophobicContact CB-CG 4.01Å; L951-Q962 HydrophobicContact CD1-CB 4.19Å; L951-I965 HydrophobicContact CD1-CB 3.97Å; L951-I965 HydrophobicContact CD1-CG2 3.69Å; L951-I965 HydrophobicContact CD2-CG2 3.82Å; L951-I965 HydrophobicContact CG-CG2 4.44Å; L951-L966 HydrophobicContact CD1-CD1 4.2Å; L951-L966 HydrophobicContact CD1-CD2 3.95Å; L951-L966 HydrophobicContact CD1-CG 3.66Å
952	A	80.4	Confident	79.5	Confident	49 Å²	49	52.6 Å²	52.6	41%	0.405	29%	0.285	S	S	.	.	H	α-helix	trans	-63.9	-41.9	171.1	0	0	0	0	0	111.8	Q948 E949 D950 I954 G955	Q948-A952 PolarHBondContact O-N 2.95Å; Q948-A952 VanDerWaalsContact O-N 3.13Å; E949-A952 PolarHBondContact O-N 3.33Å; D950-A952 VanDerWaalsContact C-N 3.32Å; D950-A952 PolarHBondContact O-N 3.42Å; A952-I954 VanDerWaalsContact C-N 3.34Å; A952-I954 PolarHBondContact O-N 2.78Å; A952-G955 PolarHBondContact O-N 3.29Å; A952-G955 VanDerWaalsContact O-N 3.12Å
953	R	81.6	Confident	79.1	Confident	165 Å²	165	55 Å²	55	62%	0.623	29%	0.293	S	S	*	.	H	α-helix	trans	-65.3	-32.2	-179.2	-159.7	-177.4	-53.4	113.9	9.5	113.3	E949 D950 G955	E949-R953 WeakPolarHBondContact O-CB 3.48Å; E949-R953 PolarHBondContact O-N 2.83Å; D950-R953 WeakPolarHBondContact O-CA 3.46Å; D950-R953 WeakPolarHBondContact O-CB 3.41Å; D950-R953 PolarHBondContact O-N 3.03Å; D950-R953 IonicContact OD1-CZ 3.66Å; D950-R953 IonicContact OD1-NH1 3.51Å; D950-R953 PolarHBondContact OD1-NH1 3.07Å; D950-R953 IonicContact OD1-NH2 2.94Å; D950-R953 PolarHBondContact OD1-NH2 2.9Å; R953-G955 PolarHBondContact O-N 2.87Å
954	I	86.4	Confident	78.6	Confident	21 Å²	21	57.2 Å²	57.2	11%	0.108	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	11.7	175.2	73.2	177.3	0	0	0	113.4	N931 F932 A935 Y937 D950 L951 A952 I956	N931-I954 WeakPolarHBondContact CB-O 3.15Å; N931-I954 PolarHBondContact ND2-O 3.01Å; F932-I954 HydrophobicContact CD2-CD1 3.76Å; F932-I954 HydrophobicContact CE1-CD1 4.42Å; F932-I954 HydrophobicContact CE2-CD1 3.69Å; F932-I954 HydrophobicContact CG-CD1 4.19Å; F932-I954 HydrophobicContact CZ-CD1 4.02Å; A935-I954 HydrophobicContact CB-CB 4.04Å; A935-I954 HydrophobicContact CB-CG2 3.22Å; Y937-I954 HydrophobicContact CD2-CG2 4.45Å; Y937-I954 HydrophobicContact CE2-CG2 4.07Å; D950-I954 WeakPolarHBondContact O-CG2 3.41Å; D950-I954 PolarHBondContact O-N 2.98Å; L951-I954 HydrophobicContact CD2-CD1 3.93Å; L951-I954 WeakPolarHBondContact O-CG1 3.33Å; A952-I954 VanDerWaalsContact C-N 3.34Å; A952-I954 PolarHBondContact O-N 2.78Å; I954-I956 HydrophobicContact CD1-CD1 3.95Å; I954-I956 HydrophobicContact CD1-CG1 4.45Å; I954-I956 HydrophobicContact CG1-CD1 4.15Å; I954-I956 HydrophobicContact CG1-CG1 4.1Å
955	G	74.7	Confident	78.6	Confident	39 Å²	39	56.6 Å²	56.6	40%	0.402	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.9	7	174.6	0	0	0	0	0	115.5	A952 R953 T957	A952-G955 PolarHBondContact O-N 3.29Å; A952-G955 VanDerWaalsContact O-N 3.12Å; R953-G955 PolarHBondContact O-N 2.87Å; G955-T957 VanDerWaalsContact C-N 3.31Å; G955-T957 PolarHBondContact O-N 2.86Å
956	I	84.6	Confident	78.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.273	C	S	.	.			trans	-86.5	78.4	175.5	-53.5	179.2	0	0	0	108.3	Y928 F932 L951 I954 H961 Q962 I965	Y928-I956 HydrophobicContact CD1-CD1 3.98Å; Y928-I956 HydrophobicContact CD1-CG1 3.68Å; Y928-I956 HydrophobicContact CD2-CD1 3.95Å; Y928-I956 HydrophobicContact CD2-CG1 4.3Å; Y928-I956 HydrophobicContact CE1-CG1 3.9Å; Y928-I956 HydrophobicContact CE1-CG2 4.49Å; Y928-I956 HydrophobicContact CE2-CG1 4.5Å; Y928-I956 HydrophobicContact CE2-CG2 4.13Å; Y928-I956 HydrophobicContact CG-CD1 3.65Å; Y928-I956 HydrophobicContact CG-CG1 3.89Å; F932-I956 HydrophobicContact CD2-CD1 4.25Å; F932-I956 HydrophobicContact CE2-CD1 3.63Å; L951-I956 HydrophobicContact CD2-CD1 4.33Å; L951-I956 WeakPolarHBondContact O-CA 3.49Å; L951-I956 WeakPolarHBondContact O-CB 3.32Å; L951-I956 PolarHBondContact O-N 2.93Å; I954-I956 HydrophobicContact CD1-CD1 3.95Å; I954-I956 HydrophobicContact CD1-CG1 4.45Å; I954-I956 HydrophobicContact CG1-CD1 4.15Å; I954-I956 HydrophobicContact CG1-CG1 4.1Å; I956-H961 HydrophobicContact CG2-CB 3.72Å; I956-Q962 HydrophobicContact CG2-CG 4.28Å; I956-Q962 VanDerWaalsContact O-CG 3.3Å; I956-Q962 WeakPolarHBondContact O-CG 3.34Å; I956-Q962 PolarHBondContact O-NE2 3.24Å; I956-I965 HydrophobicContact CD1-CD1 3.68Å; I956-I965 HydrophobicContact CG2-CD1 4.34Å
957	T	73.9	Confident	78.2	Confident	115 Å²	115	54 Å²	54	71%	0.706	30%	0.295	S	S	*	.			trans	-74	-24.6	-177.7	53.8	0	0	0	0	113.8	G955 I959	G955-T957 VanDerWaalsContact C-N 3.31Å; G955-T957 PolarHBondContact O-N 2.86Å; T957-I959 PolarHBondContact O-N 2.61Å
958	A	70.3	Confident	78	Confident	24 Å²	24	51.4 Å²	51.4	20%	0.198	28%	0.283	C	S	.	.			trans	-72	111.3	-179.8	0	0	0	0	0	111.6	T960 H961 Q962	A958-T960 PolarHBondContact O-N 3.19Å; A958-H961 HydrophobicContact CB-CB 4.17Å; A958-H961 WeakPolarHBondContact O-CA 3.21Å; A958-H961 WeakPolarHBondContact O-CB 3.48Å; A958-H961 PolarHBondContact O-N 3.12Å; A958-Q962 PolarHBondContact O-N 2.72Å
959	I	70	Confident	78.1	Confident	104 Å²	104	47.3 Å²	47.3	53%	0.533	26%	0.264	S	S	.	.	H	α-helix	trans	-58.6	-33.9	-176.7	-65.2	167.3	0	0	0	112.1	T957 Q962 N963	T957-I959 PolarHBondContact O-N 2.61Å; I959-Q962 PolarHBondContact O-N 3.47Å; I959-N963 WeakPolarHBondContact O-CB 3.31Å; I959-N963 PolarHBondContact O-N 2.69Å; I959-N963 PolarHBondContact O-ND2 3.03Å
960	T	55	Low	77.9	Confident	50 Å²	50	46.4 Å²	46.4	31%	0.307	26%	0.259	S	S	.	.	H	α-helix	trans	-62.9	-39.8	174.2	50.9	0	0	0	0	112.3	A958 K964	A958-T960 PolarHBondContact O-N 3.19Å; T960-K964 WeakPolarHBondContact O-CB 3.05Å; T960-K964 PolarHBondContact O-N 2.99Å; T960-K964 VanDerWaalsContact O-N 3.15Å
961	H	80	Confident	77.3	Confident	16 Å²	16	48.1 Å²	48.1	7%	0.074	28%	0.276	C	S	.	.	H	α-helix	trans	-71.6	-43.4	175.5	-59.2	166.3	0	0	0	110.9	M847 M925 Y928 I956 A958 N963 K964 I965	M847-H961 WeakPolarHBondContact CG-NE2 3.23Å; M925-H961 HydrophobicContact CE-CB 4.43Å; M925-H961 HydrophobicContact SD-CB 3.91Å; Y928-H961 HydrophobicContact CE2-CB 4.07Å; Y928-H961 AromaticContact CE2-CG 3.96Å; Y928-H961 AromaticContact CE2-ND1 3.45Å; Y928-H961 WeakPolarHBondContact CE2-ND1 2.74Å; Y928-H961 AromaticContact CZ-ND1 3.57Å; Y928-H961 PolarHBondContact OH-ND1 3.12Å; I956-H961 HydrophobicContact CG2-CB 3.72Å; A958-H961 HydrophobicContact CB-CB 4.17Å; A958-H961 WeakPolarHBondContact O-CA 3.21Å; A958-H961 WeakPolarHBondContact O-CB 3.48Å; A958-H961 PolarHBondContact O-N 3.12Å; H961-N963 PolarHBondContact O-N 3.47Å; H961-K964 PolarHBondContact O-N 3.34Å; H961-I965 WeakPolarHBondContact O-CB 3.23Å; H961-I965 WeakPolarHBondContact O-CD1 3.35Å; H961-I965 VanDerWaalsContact O-CG1 3.23Å; H961-I965 WeakPolarHBondContact O-CG1 3.46Å; H961-I965 PolarHBondContact O-N 3.32Å
962	Q	79.3	Confident	76.8	Confident	13 Å²	13	48.9 Å²	48.9	6%	0.061	28%	0.28	C	S	.	.	H	α-helix	trans	-53.5	-53.7	173.6	-64.9	177.5	-4.2	0	0	111.3	Q948 L951 I956 A958 I959 K964 I965 L966	Q948-Q962 HydrophobicContact CG-CB 4.49Å; L951-Q962 HydrophobicContact CB-CG 4.01Å; L951-Q962 HydrophobicContact CD1-CB 4.19Å; I956-Q962 HydrophobicContact CG2-CG 4.28Å; I956-Q962 VanDerWaalsContact O-CG 3.3Å; I956-Q962 WeakPolarHBondContact O-CG 3.34Å; I956-Q962 PolarHBondContact O-NE2 3.24Å; A958-Q962 PolarHBondContact O-N 2.72Å; I959-Q962 PolarHBondContact O-N 3.47Å; Q962-K964 VanDerWaalsContact C-N 3.34Å; Q962-K964 PolarHBondContact O-N 2.91Å; Q962-I965 PolarHBondContact O-N 3.14Å; Q962-L966 WeakPolarHBondContact O-CB 3.17Å; Q962-L966 VanDerWaalsContact O-CG 3.24Å; Q962-L966 WeakPolarHBondContact O-CG 3.39Å; Q962-L966 PolarHBondContact O-N 3.21Å
963	N	72.4	Confident	76.7	Confident	84 Å²	84	50.9 Å²	50.9	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-41.1	-178.7	-71	-20.2	0	0	0	112.6	I959 H961 L966 S967	I959-N963 WeakPolarHBondContact O-CB 3.31Å; I959-N963 PolarHBondContact O-N 2.69Å; I959-N963 PolarHBondContact O-ND2 3.03Å; H961-N963 PolarHBondContact O-N 3.47Å; N963-L966 PolarHBondContact O-N 3.13Å; N963-S967 WeakPolarHBondContact O-CB 3.34Å; N963-S967 PolarHBondContact O-N 2.96Å; N963-S967 PolarHBondContact O-OG 3.06Å
964	K	73.8	Confident	76.1	Confident	45 Å²	45	46.4 Å²	46.4	20%	0.196	27%	0.268	C	S	.	.	H	α-helix	trans	-65.2	-44	178.6	-178.4	176.9	167.8	-151.3	0	111.8	M847 I923 K924 M925 T960 H961 Q962 S967 S968	M847-K964 HydrophobicContact CE-CD 3.61Å; M847-K964 HydrophobicContact SD-CD 4.06Å; I923-K964 WeakPolarHBondContact O-CE 3.22Å; I923-K964 PolarHBondContact O-NZ 2.64Å; K924-K964 PolarHBondContact O-NZ 2.77Å; M925-K964 HydrophobicContact CG-CD 4.36Å; M925-K964 HydrophobicContact SD-CD 3.96Å; T960-K964 WeakPolarHBondContact O-CB 3.05Å; T960-K964 PolarHBondContact O-N 2.99Å; T960-K964 VanDerWaalsContact O-N 3.15Å; H961-K964 PolarHBondContact O-N 3.34Å; Q962-K964 VanDerWaalsContact C-N 3.34Å; Q962-K964 PolarHBondContact O-N 2.91Å; K964-S967 PolarHBondContact O-N 2.87Å; K964-S967 PolarHBondContact O-OG 2.91Å; K964-S968 PolarHBondContact O-N 2.74Å
965	I	82.8	Confident	75.1	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-48.2	176	-69.9	167.6	0	0	0	110.4	W919 I923 M925 F932 L951 I956 H961 Q962 S967 S968 V969	W919-I965 HydrophobicContact CH2-CG2 3.83Å; W919-I965 HydrophobicContact CZ2-CG2 4.39Å; I923-I965 HydrophobicContact CD1-CG1 4.02Å; M925-I965 HydrophobicContact CG-CD1 4.46Å; M925-I965 HydrophobicContact CG-CG1 4.09Å; M925-I965 HydrophobicContact SD-CD1 4.27Å; M925-I965 HydrophobicContact SD-CG1 4.19Å; F932-I965 HydrophobicContact CE2-CD1 4.25Å; F932-I965 HydrophobicContact CZ-CG2 3.87Å; L951-I965 HydrophobicContact CD1-CB 3.97Å; L951-I965 HydrophobicContact CD1-CG2 3.69Å; L951-I965 HydrophobicContact CD2-CG2 3.82Å; L951-I965 HydrophobicContact CG-CG2 4.44Å; I956-I965 HydrophobicContact CD1-CD1 3.68Å; I956-I965 HydrophobicContact CG2-CD1 4.34Å; H961-I965 WeakPolarHBondContact O-CB 3.23Å; H961-I965 WeakPolarHBondContact O-CD1 3.35Å; H961-I965 VanDerWaalsContact O-CG1 3.23Å; H961-I965 WeakPolarHBondContact O-CG1 3.46Å; H961-I965 PolarHBondContact O-N 3.32Å; Q962-I965 PolarHBondContact O-N 3.14Å; I965-S967 VanDerWaalsContact C-N 3.32Å; I965-S967 PolarHBondContact O-N 3.45Å; I965-S968 PolarHBondContact O-N 3.1Å; I965-S968 VanDerWaalsContact O-N 3.16Å; I965-V969 WeakPolarHBondContact O-CG2 3.2Å; I965-V969 PolarHBondContact O-N 2.61Å
966	L	83.2	Confident	74.6	Confident	28 Å²	28	51.7 Å²	51.7	15%	0.147	28%	0.283	C	S	.	.	H	α-helix	trans	-61.7	-37.1	178	-69.3	166.3	0	0	0	112.7	Q948 L951 Q962 N963 S968 V969 Q970	Q948-L966 HydrophobicContact CB-CD1 3.77Å; Q948-L966 HydrophobicContact CG-CD1 4.03Å; L951-L966 HydrophobicContact CD1-CD1 4.2Å; L951-L966 HydrophobicContact CD1-CD2 3.95Å; L951-L966 HydrophobicContact CD1-CG 3.66Å; Q962-L966 WeakPolarHBondContact O-CB 3.17Å; Q962-L966 VanDerWaalsContact O-CG 3.24Å; Q962-L966 WeakPolarHBondContact O-CG 3.39Å; Q962-L966 PolarHBondContact O-N 3.21Å; N963-L966 PolarHBondContact O-N 3.13Å; L966-S968 VanDerWaalsContact C-N 3.34Å; L966-S968 PolarHBondContact O-N 2.91Å; L966-V969 PolarHBondContact O-N 2.79Å; L966-Q970 WeakPolarHBondContact O-CG 3.31Å; L966-Q970 PolarHBondContact O-N 2.72Å
967	S	75.3	Confident	73.4	Confident	67 Å²	67	58.3 Å²	58.3	47%	0.469	31%	0.314	S	S	.	.	H	α-helix	trans	-67	-34.8	176.7	72.9	0	0	0	0	112.6	N963 K964 I965 Q970 A971	N963-S967 WeakPolarHBondContact O-CB 3.34Å; N963-S967 PolarHBondContact O-N 2.96Å; N963-S967 PolarHBondContact O-OG 3.06Å; K964-S967 PolarHBondContact O-N 2.87Å; K964-S967 PolarHBondContact O-OG 2.91Å; I965-S967 VanDerWaalsContact C-N 3.32Å; I965-S967 PolarHBondContact O-N 3.45Å; S967-Q970 PolarHBondContact O-N 3.31Å; S967-A971 PolarHBondContact O-N 3.39Å; S967-A971 VanDerWaalsContact O-N 3.07Å
968	S	81.5	Confident	72.4	Confident	15 Å²	15	59.5 Å²	59.5	11%	0.105	31%	0.311	C	S	.	.	H	α-helix	trans	-70.8	-39.4	171.2	-172.2	0	0	0	0	112.4	W919 K964 I965 L966 Q970 A971 M972	W919-S968 PolarHBondContact NE1-OG 2.98Å; K964-S968 PolarHBondContact O-N 2.74Å; I965-S968 PolarHBondContact O-N 3.1Å; I965-S968 VanDerWaalsContact O-N 3.16Å; L966-S968 VanDerWaalsContact C-N 3.34Å; L966-S968 PolarHBondContact O-N 2.91Å; S968-Q970 VanDerWaalsContact C-N 3.28Å; S968-Q970 PolarHBondContact O-N 3.48Å; S968-A971 WeakPolarHBondContact O-CB 3.41Å; S968-A971 PolarHBondContact O-N 3.47Å; S968-A971 VanDerWaalsContact O-N 3.13Å; S968-M972 WeakPolarHBondContact O-CG 3.42Å; S968-M972 PolarHBondContact O-N 3.12Å
969	V	83.6	Confident	71.4	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	34%	0.336	C	S	.	.	H	α-helix	trans	-58.3	-40	171.7	167.4	0	0	0	0	111.4	W919 V943 I965 L966 M972 R973	W919-V969 HydrophobicContact CH2-CG2 4.17Å; W919-V969 HydrophobicContact CZ2-CG2 4.04Å; V943-V969 HydrophobicContact CG1-CG2 3.98Å; I965-V969 WeakPolarHBondContact O-CG2 3.2Å; I965-V969 PolarHBondContact O-N 2.61Å; L966-V969 PolarHBondContact O-N 2.79Å; V969-M972 HydrophobicContact CG2-CE 4.12Å; V969-M972 PolarHBondContact O-N 3.07Å; V969-R973 WeakPolarHBondContact O-CG 3.2Å; V969-R973 PolarHBondContact O-N 2.87Å
970	Q	76.1	Confident	70.5	Confident	120 Å²	120	67.7 Å²	67.7	56%	0.561	35%	0.345	S	S	*	.	H	α-helix	trans	-65.6	-39.4	173.5	-74.1	175.8	-8.6	0	0	112.9	L966 S967 S968 R973 T974	L966-Q970 WeakPolarHBondContact O-CG 3.31Å; L966-Q970 PolarHBondContact O-N 2.72Å; S967-Q970 PolarHBondContact O-N 3.31Å; S968-Q970 VanDerWaalsContact C-N 3.28Å; S968-Q970 PolarHBondContact O-N 3.48Å; Q970-R973 PolarHBondContact O-N 3.38Å; Q970-T974 PolarHBondContact O-N 3.44Å; Q970-T974 PolarHBondContact O-OG1 3.35Å
971	A	72.9	Confident	70	Confident	54 Å²	54	68.5 Å²	68.5	45%	0.446	36%	0.362	S	S	.	.	H	α-helix	trans	-62.4	-45.2	173.8	0	0	0	0	0	111.8	S967 S968 T974 Q975	S967-A971 PolarHBondContact O-N 3.39Å; S967-A971 VanDerWaalsContact O-N 3.07Å; S968-A971 WeakPolarHBondContact O-CB 3.41Å; S968-A971 PolarHBondContact O-N 3.47Å; S968-A971 VanDerWaalsContact O-N 3.13Å; A971-T974 WeakPolarHBondContact O-CB 3.48Å; A971-T974 PolarHBondContact O-N 3.05Å; A971-T974 VanDerWaalsContact O-N 3.17Å; A971-Q975 PolarHBondContact O-N 3.49Å
972	M	75.4	Confident	68.3	Low	17 Å²	17	78.5 Å²	78.5	8%	0.084	40%	0.399	C	S	.	.	H	α-helix	trans	-62.6	-44.9	176.2	-68.4	-172.1	-65	0	0	112.3	W919 L940 V943 V944 S968 V969 T974 Q975 M976	W919-M972 HydrophobicContact CD2-CE 4.19Å; W919-M972 VanDerWaalsContact CE2-CE 3.45Å; W919-M972 HydrophobicContact CG-SD 4.44Å; W919-M972 HydrophobicContact CH2-CE 4.43Å; W919-M972 HydrophobicContact CZ2-CE 3.6Å; L940-M972 HydrophobicContact CD2-SD 4.36Å; V943-M972 HydrophobicContact CG1-CE 3.77Å; V944-M972 HydrophobicContact CG2-CB 3.84Å; V944-M972 HydrophobicContact CG2-CE 4.35Å; S968-M972 WeakPolarHBondContact O-CG 3.42Å; S968-M972 PolarHBondContact O-N 3.12Å; V969-M972 HydrophobicContact CG2-CE 4.12Å; V969-M972 PolarHBondContact O-N 3.07Å; M972-T974 PolarHBondContact O-N 2.98Å; M972-Q975 PolarHBondContact O-N 3.44Å; M972-M976 WeakPolarHBondContact O-CG 3.49Å; M972-M976 PolarHBondContact O-N 3.32Å
973	R	78.6	Confident	66.3	Low	90 Å²	90	86.5 Å²	86.5	34%	0.34	44%	0.439	S	S	.	.	H	α-helix	trans	-52	-44.4	171.7	-76.2	174.5	-172.3	169.4	11.5	111.6	V944 V946 V969 Q970 Q977	V944-R973 HydrophobicContact CG1-CG 3.84Å; V944-R973 PolarHBondContact O-NE 2.87Å; V944-R973 PolarHBondContact O-NH2 3.5Å; V946-R973 PolarHBondContact O-NH2 3.2Å; V946-R973 VanDerWaalsContact O-NH2 3.07Å; V969-R973 WeakPolarHBondContact O-CG 3.2Å; V969-R973 PolarHBondContact O-N 2.87Å; Q970-R973 PolarHBondContact O-N 3.38Å; R973-Q977 VanDerWaalsContact O-CG 3.28Å; R973-Q977 WeakPolarHBondContact O-CG 3.11Å; R973-Q977 PolarHBondContact O-N 3.03Å; R973-Q977 VanDerWaalsContact O-N 3.15Å
974	T	69.2	Low	64.5	Low	71 Å²	71	88.9 Å²	88.9	44%	0.436	46%	0.456	S	S	.	.	H	α-helix	trans	-68.2	-41.3	-177.6	-51.1	0	0	0	0	111.9	Q970 A971 M972 Q978	Q970-T974 PolarHBondContact O-N 3.44Å; Q970-T974 PolarHBondContact O-OG1 3.35Å; A971-T974 WeakPolarHBondContact O-CB 3.48Å; A971-T974 PolarHBondContact O-N 3.05Å; A971-T974 VanDerWaalsContact O-N 3.17Å; M972-T974 PolarHBondContact O-N 2.98Å; T974-Q978 WeakPolarHBondContact O-CG 3.49Å; T974-Q978 PolarHBondContact O-N 3.36Å; T974-Q978 VanDerWaalsContact O-N 3.12Å
975	Q	64.5	Low	63	Low	98 Å²	98	92.5 Å²	92.5	46%	0.458	49%	0.485	S	S	.	.	H	α-helix	trans	-68.2	-42.4	175.6	-77.1	-175.3	-43.7	0	0	112.8	A971 M972 Q977 Q978 M979	A971-Q975 PolarHBondContact O-N 3.49Å; M972-Q975 PolarHBondContact O-N 3.44Å; Q975-Q977 VanDerWaalsContact C-N 3.26Å; Q975-Q977 PolarHBondContact O-N 3.05Å; Q975-Q978 PolarHBondContact O-N 3.43Å; Q975-Q978 VanDerWaalsContact O-N 3.1Å; Q975-M979 PolarHBondContact O-N 3.37Å
976	M	63.9	Low	60.7	Low	73 Å²	73	103 Å²	103	36%	0.36	55%	0.548	S	S	.	.	H	α-helix	trans	-61.9	-34.5	177.3	-70.1	-178.8	80.2	0	0	112.5	V944 M972 M979 H980	V944-M976 HydrophobicContact CB-SD 4.41Å; V944-M976 HydrophobicContact CG1-SD 4.12Å; V944-M976 HydrophobicContact CG2-SD 3.84Å; M972-M976 WeakPolarHBondContact O-CG 3.49Å; M972-M976 PolarHBondContact O-N 3.32Å; M976-M979 PolarHBondContact O-N 3.06Å; M976-H980 PolarHBondContact O-N 3.31Å; M976-H980 VanDerWaalsContact O-N 3.11Å; M976-H980 PolarHBondContact O-ND1 3.25Å
977	Q	59.2	Low	59.6	Low	140 Å²	140	106.7 Å²	106.7	65%	0.654	57%	0.568	S	S	*	*	H	α-helix	trans	-68.5	-40.6	172.7	-72.9	172.5	-5.3	0	0	112.2	R973 Q975 M979 H980 G981	R973-Q977 VanDerWaalsContact O-CG 3.28Å; R973-Q977 WeakPolarHBondContact O-CG 3.11Å; R973-Q977 PolarHBondContact O-N 3.03Å; R973-Q977 VanDerWaalsContact O-N 3.15Å; Q975-Q977 VanDerWaalsContact C-N 3.26Å; Q975-Q977 PolarHBondContact O-N 3.05Å; Q977-M979 VanDerWaalsContact C-N 3.3Å; Q977-M979 PolarHBondContact O-N 3.16Å; Q977-H980 PolarHBondContact O-N 3.43Å; Q977-G981 PolarHBondContact O-N 2.98Å; Q977-G981 VanDerWaalsContact O-N 3.07Å
978	Q	53.7	Low	58.8	Low	140 Å²	140	108.8 Å²	108.8	65%	0.654	57%	0.573	S	S	*	*	H	α-helix	trans	-65	-31.3	174.3	-73	179.5	-1	0	0	113.1	T974 Q975	T974-Q978 WeakPolarHBondContact O-CG 3.49Å; T974-Q978 PolarHBondContact O-N 3.36Å; T974-Q978 VanDerWaalsContact O-N 3.12Å; Q975-Q978 PolarHBondContact O-N 3.43Å; Q975-Q978 VanDerWaalsContact O-N 3.1Å
979	M	49.8	Very low	57.5	Low	147 Å²	147	114 Å²	114	72%	0.724	60%	0.599	S	S	*	*	H	α-helix	trans	-71.4	-45.6	173.5	-71.7	-179.9	64.2	0	0	112.4	Q975 M976 Q977 G981 R982	Q975-M979 PolarHBondContact O-N 3.37Å; M976-M979 PolarHBondContact O-N 3.06Å; Q977-M979 VanDerWaalsContact C-N 3.3Å; Q977-M979 PolarHBondContact O-N 3.16Å; M979-G981 VanDerWaalsContact C-N 3.25Å; M979-G981 PolarHBondContact O-N 3.48Å; M979-R982 PolarHBondContact O-N 3.38Å
980	H	49.5	Very low	56	Low	153 Å²	153	120.6 Å²	120.6	71%	0.708	63%	0.634	S	S	*	*	H	α-helix	trans	-65.5	-27.3	178	-80.2	81.6	0	0	0	113.2	M976 Q977 R982	M976-H980 PolarHBondContact O-N 3.31Å; M976-H980 VanDerWaalsContact O-N 3.11Å; M976-H980 PolarHBondContact O-ND1 3.25Å; Q977-H980 PolarHBondContact O-N 3.43Å; H980-R982 PolarHBondContact O-N 3.32Å
981	G	45.3	Very low	54.7	Low	66 Å²	66	120.7 Å²	120.7	68%	0.68	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	3.8	173.4	0	0	0	0	0	115.7	Q977 M979	Q977-G981 PolarHBondContact O-N 2.98Å; Q977-G981 VanDerWaalsContact O-N 3.07Å; M979-G981 VanDerWaalsContact C-N 3.25Å; M979-G981 PolarHBondContact O-N 3.48Å
982	R	43.9	Very low	53.5	Low	226 Å²	226	125.1 Å²	125.1	85%	0.853	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	4.1	-174.3	-117.3	179.2	-177.3	-177.3	1	116.1	M979 H980	M979-R982 PolarHBondContact O-N 3.38Å; H980-R982 PolarHBondContact O-N 3.32Å
983	M	37.8	Very low	51.9	Low	182 Å²	182	132.9 Å²	132.9	90%	0.897	69%	0.692	S	S	*	*			trans	-103.4	109.8	169.3	-83.8	-177.2	154.9	0	0	111.2
984	V	34.3	Very low	49.9	Very low	133 Å²	133	136.2 Å²	136.2	81%	0.806	72%	0.719	S	S	*	*			trans	-112.3	135.6	166.5	176.2	0	0	0	0	106.4
985	P	42.6	Very low	48.3	Very low	122 Å²	122	141.6 Å²	141.6	79%	0.792	74%	0.743	S	S	*	*			trans	-77.2	131.2	-162.8	28.6	-36.1	0	0	0	114.5
986	V	34.8	Very low	46.8	Very low	219 Å²	219	145.5 Å²	145.5	100%	1.327	77%	0.769	S	S	*	*			trans	-139.2	0	140.7	-178.1	0	0	0	0	106.9

Retrieved 986 of 986 residues in 828.9 ms (Link to these results)

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