G4LUC1_SCHMA Loading...

Translation initiation factor eIF2B subunit epsilon

AlphaFold DB , UniProt , Accession G4LUC1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 765 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.6	Very low	32.8	Very low	240 Å²	240	175 Å²	175	100%	1.182	91%	0.908	S	S	*	*				0	93.7	0	-80.2	166.9	156.7	0	0	108.3
2	N	32.3	Very low	32.4	Very low	168 Å²	168	181.3 Å²	181.3	90%	0.898	91%	0.911	S	S	*	*			trans	-163.3	114.9	170.9	-96.2	-18.7	0	0	0	107.3
3	K	35.7	Very low	32.2	Very low	209 Å²	209	171.8 Å²	171.8	91%	0.909	89%	0.887	S	S	*	*			trans	-132	117.2	165.6	-89	-170.8	177.5	-179.5	0	109.2
4	S	35.5	Very low	32.1	Very low	122 Å²	122	168.7 Å²	168.7	85%	0.853	88%	0.883	S	S	*	*	P	Polyproline II helix	trans	-65.9	132.6	175.5	39.4	0	0	0	0	112.7
5	K	34.7	Very low	32.2	Very low	211 Å²	211	166.2 Å²	166.2	92%	0.917	88%	0.878	S	S	*	*	P	Polyproline II helix	trans	-88.7	125.4	165.3	-80.4	179.9	174.3	177.4	0	109.5
6	A	35.1	Very low	32.1	Very low	101 Å²	101	164 Å²	164	84%	0.835	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-92	127.5	169.9	0	0	0	0	0	110.1
7	N	27.8	Very low	31.9	Very low	163 Å²	163	164 Å²	164	87%	0.872	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-74.1	124.4	171.1	-84.8	-21.6	0	0	0	110.3
8	R	31.6	Very low	32	Very low	245 Å²	245	161 Å²	161	93%	0.925	86%	0.856	S	S	*	*			trans	-108.4	107.3	160.1	-93.1	-177.1	168.6	178.3	-3.6	108.7	K10	R8-K10 PolarHBondContact O-N 3.3Å
9	T	27.5	Very low	31.9	Very low	141 Å²	141	160.5 Å²	160.5	87%	0.865	85%	0.852	S	S	*	*			trans	-67.2	112.8	165.4	41.9	0	0	0	0	109.5
10	K	32	Very low	31.7	Very low	206 Å²	206	161.3 Å²	161.3	90%	0.896	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-82.3	122.9	165.9	-83.4	-175.9	174.8	-177.2	0	109.1	R8	R8-K10 PolarHBondContact O-N 3.3Å
11	S	31.1	Very low	31.5	Very low	119 Å²	119	160 Å²	160	83%	0.832	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-62.6	135.3	168.2	43	0	0	0	0	110.6
12	R	28	Very low	31	Very low	250 Å²	250	154.3 Å²	154.3	94%	0.943	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77.9	118.1	168.6	-75.5	177.7	168.5	174.9	-4.7	108.4
13	G	29.6	Very low	30.8	Very low	58 Å²	58	150.2 Å²	150.2	60%	0.598	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-75.7	164.9	163.3	0	0	0	0	0	111.1	T15	G13-T15 PolarHBondContact O-N 3.31Å
14	P	31.2	Very low	30.3	Very low	129 Å²	129	147.3 Å²	147.3	84%	0.838	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-69.2	130.8	-176.4	31.2	-31.3	0	0	0	109	D16	P14-D16 PolarHBondContact O-N 3.04Å
15	T	33.5	Very low	30	Very low	131 Å²	131	148.5 Å²	148.5	80%	0.804	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-68.5	117.5	178.8	44.9	0	0	0	0	110.1	G13	G13-T15 PolarHBondContact O-N 3.31Å
16	D	30	Very low	29.8	Very low	131 Å²	131	141.3 Å²	141.3	70%	0.701	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-54.5	134.4	159.7	-68.8	-44.5	0	0	0	109.3	P14 V18	P14-D16 PolarHBondContact O-N 3.04Å; D16-V18 PolarHBondContact O-N 2.99Å
17	N	29.7	Very low	29.6	Very low	164 Å²	164	145.9 Å²	145.9	88%	0.877	78%	0.782	S	S	*	*			trans	-68.3	78.6	173.4	-81.6	-28.3	0	0	0	109.3	I19	N17-I19 PolarHBondContact O-N 3.43Å
18	V	32.4	Very low	30.6	Very low	110 Å²	110	140.5 Å²	140.5	67%	0.667	76%	0.755	S	S	*	*			trans	-68.3	120	168.4	175.7	0	0	0	0	108.1	D16 K20	D16-V18 PolarHBondContact O-N 2.99Å; V18-K20 PolarHBondContact O-N 3.07Å
19	I	31.1	Very low	31.6	Very low	152 Å²	152	133.5 Å²	133.5	78%	0.779	74%	0.736	S	S	*	*			trans	-46.1	109.6	172.8	-60.7	166.1	0	0	0	109.1	N17	N17-I19 PolarHBondContact O-N 3.43Å
20	K	27.7	Very low	33.6	Very low	176 Å²	176	136 Å²	136	77%	0.765	73%	0.734	S	S	*	*			trans	-130	92.3	167.3	-77.9	-170.7	177.7	-177.7	0	108.6	V18	V18-K20 PolarHBondContact O-N 3.07Å
21	N	27.7	Very low	36.1	Very low	135 Å²	135	130 Å²	130	72%	0.722	71%	0.71	S	S	*	*			trans	171.5	103.4	134.9	-86.5	-11.7	0	0	0	110.6	S23	N21-S23 VanDerWaalsContact C-N 3.35Å; N21-S23 PolarHBondContact O-N 3.32Å
22	P	27.7	Very low	39	Very low	120 Å²	120	124.6 Å²	124.6	78%	0.779	67%	0.671	S	S	*	*			trans	-90	76.6	162.8	34.8	-25.3	0	0	0	107.8
23	S	27.2	Very low	42.2	Very low	82 Å²	82	114.1 Å²	114.1	57%	0.573	63%	0.632	S	S	*	*			trans	-156.6	75	170.6	46.9	0	0	0	0	110.3	N21	N21-S23 VanDerWaalsContact C-N 3.35Å; N21-S23 PolarHBondContact O-N 3.32Å
24	N	26.3	Very low	45.3	Very low	147 Å²	147	111.3 Å²	111.3	79%	0.786	60%	0.603	S	S	*	*			trans	-173.5	61.1	153.7	-91.7	-14.4	0	0	0	109	G26	N24-G26 PolarHBondContact O-N 2.97Å
25	F	29.1	Very low	48.4	Very low	147 Å²	147	105.2 Å²	105.2	65%	0.645	56%	0.564	S	S	*	*			trans	-87.2	88.1	167.4	-83	-81.3	0	0	0	108.5	C134	F25-C134 HydrophobicContact CE1-CB 4.28Å; F25-C134 HydrophobicContact CZ-CB 4.12Å; F25-C134 VanDerWaalsContact CZ-SG 3.54Å
26	G	28.7	Very low	51.3	Low	61 Å²	61	99 Å²	99	63%	0.629	53%	0.525	S	S	*	.	S	Bend	trans	168.6	100.4	174.8	0	0	0	0	0	110.7	N24	N24-G26 PolarHBondContact O-N 2.97Å
27	Q	32.5	Very low	54.4	Low	197 Å²	197	93.4 Å²	93.4	92%	0.921	50%	0.496	S	S	*	.	S	Bend	trans	92.2	44.3	-179.3	-55.1	-178.4	-6.7	0	0	118.2
28	T	48	Very low	57.2	Low	50 Å²	50	86.1 Å²	86.1	31%	0.307	46%	0.458	S	S	.	.			trans	-95.8	-12.2	175.9	43.4	0	0	0	0	115.8	K30 E31	T28-K30 PolarHBondContact O-N 2.94Å; T28-E31 PolarHBondContact O-N 3.12Å
29	D	53.6	Low	59.6	Low	98 Å²	98	81.2 Å²	81.2	52%	0.524	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-8.6	-171.1	-79.5	-31.9	0	0	0	116.9	K160	D29-K160 PolarHBondContact O-NZ 3.32Å; D29-K160 VanDerWaalsContact O-NZ 3.12Å
30	K	68.9	Low	61.9	Low	192 Å²	192	76.5 Å²	76.5	84%	0.835	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.2	-179.6	-74.1	-174.5	177.5	178.3	0	113.5	T28	T28-K30 PolarHBondContact O-N 2.94Å
31	E	83.9	Confident	64.2	Low	81 Å²	81	69.5 Å²	69.5	38%	0.379	38%	0.375	S	S	.	.	S	Bend	trans	-85.9	141.5	-178.3	-62.7	-171.6	171.7	0	0	111	T28 Y33 N79	T28-E31 PolarHBondContact O-N 3.12Å; E31-Y33 HydrophobicContact CB-CE2 4.02Å; E31-Y33 WeakPolarHBondContact O-CD2 3.46Å; E31-N79 PolarHBondContact OE2-ND2 2.87Å
32	L	92.2	Very high	66.2	Low	5 Å²	5	64.1 Å²	64.1	3%	0.026	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	131.5	176.6	-67.4	174.4	0	0	0	109.9	F77 R78 N79 A153 V156 Y157	L32-F77 HydrophobicContact CB-CD1 3.63Å; L32-F77 HydrophobicContact CB-CE1 3.94Å; L32-F77 HydrophobicContact CB-CG 4.12Å; L32-R78 PolarHBondContact O-N 2.8Å; L32-N79 PolarHBondContact O-N 3.31Å; L32-A153 HydrophobicContact CD1-CB 3.61Å; L32-V156 HydrophobicContact CD2-CB 4.19Å; L32-V156 HydrophobicContact CD2-CG1 3.71Å; L32-Y157 HydrophobicContact CD1-CE2 4.24Å; L32-Y157 HydrophobicContact CD2-CE1 4.19Å
33	Y	94.7	Very high	68.7	Low	30 Å²	30	62.2 Å²	62.2	12%	0.118	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.3	-178.8	-72.3	-106	0	0	0	110.5	E31 N79 F132 V136 F139 L140	E31-Y33 HydrophobicContact CB-CE2 4.02Å; E31-Y33 WeakPolarHBondContact O-CD2 3.46Å; Y33-N79 WeakPolarHBondContact CA-O 3.02Å; Y33-N79 HydrophobicContact CD1-CB 3.48Å; Y33-N79 VanDerWaalsContact CD1-CB 3.48Å; Y33-N79 HydrophobicContact CE1-CB 3.5Å; Y33-N79 HydrophobicContact CG-CB 4.06Å; Y33-N79 VanDerWaalsContact CZ-ND2 3.31Å; Y33-F132 AromaticContact CD1-CE1 3.84Å; Y33-F132 HydrophobicContact CD1-CE1 3.84Å; Y33-F132 AromaticContact CD1-CZ 3.89Å; Y33-F132 HydrophobicContact CD1-CZ 3.89Å; Y33-F132 HydrophobicContact CE1-CE1 4.46Å; Y33-F132 HydrophobicContact CE1-CZ 4.24Å; Y33-V136 HydrophobicContact CD1-CG2 4.01Å; Y33-V136 HydrophobicContact CD2-CB 4.48Å; Y33-V136 HydrophobicContact CD2-CG1 3.69Å; Y33-V136 HydrophobicContact CD2-CG2 3.89Å; Y33-V136 HydrophobicContact CE1-CG2 3.73Å; Y33-V136 HydrophobicContact CE2-CG1 4.21Å; Y33-V136 HydrophobicContact CE2-CG2 3.62Å; Y33-V136 HydrophobicContact CG-CG1 3.89Å; Y33-V136 HydrophobicContact CG-CG2 4.09Å; Y33-F139 WeakPolarHBondContact O-CA 3.35Å; Y33-L140 PolarHBondContact O-N 3.17Å
34	A	95.5	Very high	71.3	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	142.9	173.5	0	0	0	0	0	111.1	L72 F77 N79 I80 L81 L140	A34-L72 HydrophobicContact CB-CD1 4.37Å; A34-F77 HydrophobicContact CB-CD1 3.78Å; A34-F77 HydrophobicContact CB-CE1 4.24Å; A34-F77 HydrophobicContact CB-CG 4.42Å; A34-N79 PolarHBondContact N-O 3.25Å; A34-I80 HydrophobicContact CB-CG1 4.38Å; A34-I80 HydrophobicContact CB-CG2 4.42Å; A34-I80 CarbonylContact O-C 3.54Å; A34-I80 WeakPolarHBondContact O-CA 3.39Å; A34-L81 PolarHBondContact O-N 3.17Å; A34-L140 CarbonylContact C-O 3.55Å; A34-L140 VanDerWaalsContact CA-O 3.29Å; A34-L140 WeakPolarHBondContact CA-O 3.45Å; A34-L140 HydrophobicContact CB-CB 4.16Å; A34-L140 HydrophobicContact CB-CD2 4.42Å
35	V	95.6	Very high	74.1	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.5	174.7	-178.4	0	0	0	0	107.2	L81 Y83 L127 F139 L140 L141 A142	V35-L81 CarbonylContact C-O 3.58Å; V35-L81 WeakPolarHBondContact CA-O 3.5Å; V35-Y83 HydrophobicContact CG1-CD2 3.76Å; V35-Y83 HydrophobicContact CG1-CE2 3.99Å; V35-L127 HydrophobicContact CB-CD1 4.44Å; V35-L127 HydrophobicContact CG1-CD1 3.95Å; V35-L127 HydrophobicContact CG2-CD1 3.72Å; V35-F139 HydrophobicContact CB-CD2 4.13Å; V35-F139 HydrophobicContact CB-CE2 4.32Å; V35-F139 HydrophobicContact CG2-CD2 3.55Å; V35-F139 HydrophobicContact CG2-CE2 3.9Å; V35-F139 HydrophobicContact CG2-CG 4.39Å; V35-L140 PolarHBondContact N-O 3.41Å; V35-L141 HydrophobicContact CB-CD1 4.1Å; V35-L141 HydrophobicContact CG1-CD1 4.04Å; V35-A142 PolarHBondContact O-N 3.21Å
36	L	95.6	Very high	76.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.7	179.8	-61	-175	0	0	0	110.6	L65 T68 L69 L72 I80 L81 I82 Y83 A142	L36-L65 HydrophobicContact CD1-CD1 4.23Å; L36-T68 HydrophobicContact CD1-CG2 4.03Å; L36-T68 HydrophobicContact CD2-CG2 4.11Å; L36-L69 HydrophobicContact CD1-CD2 3.79Å; L36-L72 HydrophobicContact CD1-CD1 4.18Å; L36-L72 HydrophobicContact CD2-CD1 3.84Å; L36-L72 HydrophobicContact CG-CD1 4.41Å; L36-I80 HydrophobicContact CD1-CG2 3.76Å; L36-I80 HydrophobicContact CG-CG2 3.88Å; L36-L81 PolarHBondContact N-O 2.64Å; L36-I82 HydrophobicContact CB-CG1 4.16Å; L36-I82 HydrophobicContact CD1-CG1 4.23Å; L36-I82 WeakPolarHBondContact O-CA 3.46Å; L36-Y83 PolarHBondContact O-N 3.16Å; L36-A142 VanDerWaalsContact CA-O 3.28Å; L36-A142 WeakPolarHBondContact CA-O 3.49Å; L36-A142 HydrophobicContact CD2-CB 3.74Å
37	I	93.9	Very high	79.3	Confident	15 Å²	15	45.2 Å²	45.2	8%	0.077	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.8	177.1	-58	166.9	0	0	0	110	L40 L120 I123 L141 A142 A144	I37-L40 HydrophobicContact CB-CD1 4.4Å; I37-L40 HydrophobicContact CD1-CD1 4.25Å; I37-L40 HydrophobicContact CG2-CB 4.43Å; I37-L40 HydrophobicContact CG2-CD1 3.57Å; I37-L40 HydrophobicContact CG2-CG 3.57Å; I37-L120 HydrophobicContact CD1-CD1 3.17Å; I37-I123 HydrophobicContact CD1-CD1 4.47Å; I37-I123 HydrophobicContact CG1-CD1 4.38Å; I37-I123 HydrophobicContact CG2-CD1 3.74Å; I37-L141 HydrophobicContact CD1-CD1 3.71Å; I37-L141 HydrophobicContact CD1-CG 4.45Å; I37-L141 HydrophobicContact CG1-CD1 4.2Å; I37-A142 PolarHBondContact N-O 3.17Å; I37-A144 WeakPolarHBondContact O-CB 3.47Å; I37-A144 PolarHBondContact O-N 3.41Å
38	A	89.6	Confident	81.8	Confident	10 Å²	10	35.9 Å²	35.9	8%	0.083	17%	0.174	C	C	.	.			trans	-98.6	-28.9	-172.2	0	0	0	0	0	115.6	C55 I82 Y83 T84 A144	A38-C55 HydrophobicContact CB-CB 4.06Å; A38-I82 HydrophobicContact CB-CG2 4.45Å; A38-Y83 WeakPolarHBondContact CB-O 3.25Å; A38-Y83 PolarHBondContact N-O 3.48Å; A38-Y83 VanDerWaalsContact N-O 3.08Å; A38-T84 HydrophobicContact CB-CG2 4.17Å; A38-A144 HydrophobicContact CB-CB 3.84Å
39	D	82.6	Confident	83.6	Confident	8 Å²	8	33.5 Å²	33.5	4%	0.043	16%	0.16	C	C	.	.	S	Bend	trans	-114.2	1.5	-160.5	-80.9	-7.9	0	0	0	115.9	L41 Y42 I85 K86 S87	D39-L41 PolarHBondContact O-N 3.1Å; D39-L41 VanDerWaalsContact O-N 3.15Å; D39-Y42 WeakPolarHBondContact O-CB 3.15Å; D39-Y42 PolarHBondContact O-N 3.01Å; D39-I85 HydrophobicContact CB-CB 3.95Å; D39-I85 HydrophobicContact CB-CD1 3.91Å; D39-I85 HydrophobicContact CB-CG1 4.03Å; D39-I85 WeakPolarHBondContact OD2-CA 3.44Å; D39-I85 PolarHBondContact OD2-N 3.08Å; D39-K86 PolarHBondContact OD2-N 3.37Å; D39-S87 WeakPolarHBondContact OD1-CB 3.23Å; D39-S87 PolarHBondContact OD1-OG 3.43Å; D39-S87 PolarHBondContact OD2-N 3.26Å; D39-S87 PolarHBondContact OD2-OG 3.14Å
40	L	78.4	Confident	84.9	Confident	53 Å²	53	32.6 Å²	32.6	28%	0.277	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.1	-179	-72.5	171.9	0	0	0	113.7	I37 I123	I37-L40 HydrophobicContact CB-CD1 4.4Å; I37-L40 HydrophobicContact CD1-CD1 4.25Å; I37-L40 HydrophobicContact CG2-CB 4.43Å; I37-L40 HydrophobicContact CG2-CD1 3.57Å; I37-L40 HydrophobicContact CG2-CG 3.57Å; L40-I123 HydrophobicContact CD2-CD1 4.47Å
41	L	75.6	Confident	85.6	Confident	29 Å²	29	26.5 Å²	26.5	15%	0.152	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	14.6	178.8	-58.4	177.1	0	0	0	113.1	D39 D43 R44	D39-L41 PolarHBondContact O-N 3.1Å; D39-L41 VanDerWaalsContact O-N 3.15Å; L41-D43 VanDerWaalsContact C-N 3.26Å; L41-D43 PolarHBondContact O-N 3.49Å; L41-R44 WeakPolarHBondContact O-CB 3.48Å; L41-R44 PolarHBondContact O-N 2.97Å; L41-R44 VanDerWaalsContact O-N 3.16Å
42	Y	70.9	Confident	85.8	Confident	22 Å²	22	24.4 Å²	24.4	9%	0.086	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-54.2	-41.9	-173.5	-169.6	-82.8	0	0	0	112.9	D39 R44 F45 S49 D50 P53 K86	D39-Y42 WeakPolarHBondContact O-CB 3.15Å; D39-Y42 PolarHBondContact O-N 3.01Å; Y42-R44 VanDerWaalsContact C-N 3.29Å; Y42-R44 PolarHBondContact O-N 3.14Å; Y42-F45 PolarHBondContact O-N 3.41Å; Y42-S49 VanDerWaalsContact O-CB 3.25Å; Y42-S49 WeakPolarHBondContact O-CB 3.09Å; Y42-S49 PolarHBondContact O-OG 3.07Å; Y42-S49 PolarHBondContact OH-O 2.97Å; Y42-D50 WeakPolarHBondContact OH-CA 3.48Å; Y42-P53 HydrophobicContact CE2-CB 4.35Å; Y42-K86 HydrophobicContact CD1-CD 3.75Å; Y42-K86 HydrophobicContact CD2-CB 4.32Å; Y42-K86 HydrophobicContact CE1-CB 4.42Å; Y42-K86 HydrophobicContact CE1-CD 3.66Å; Y42-K86 HydrophobicContact CE2-CB 3.91Å; Y42-K86 HydrophobicContact CG-CD 4.25Å
43	D	79.7	Confident	85.7	Confident	79 Å²	79	24.4 Å²	24.4	42%	0.422	12%	0.118	S	C	.	.	G	3₁₀ helix	trans	-73.2	-19.7	-173.3	-72.2	-19.2	0	0	0	113.9	L41 F45 N46 K86	L41-D43 VanDerWaalsContact C-N 3.26Å; L41-D43 PolarHBondContact O-N 3.49Å; D43-F45 PolarHBondContact O-N 2.77Å; D43-N46 WeakPolarHBondContact CA-ND2 3.37Å; D43-N46 PolarHBondContact O-N 3.21Å; D43-N46 PolarHBondContact O-ND2 3.07Å; D43-N46 PolarHBondContact OD1-ND2 3.36Å; D43-K86 IonicContact OD1-NZ 3.29Å; D43-K86 PolarHBondContact OD1-NZ 3.29Å
44	R	82.4	Confident	85.4	Confident	71 Å²	71	23.2 Å²	23.2	27%	0.268	11%	0.114	S	C	.	.	G	3₁₀ helix	trans	-66.8	-25.3	177.6	-62.9	-168.6	-179.6	-160.7	0.2	112.5	L41 Y42 E189 P294 R516	L41-R44 WeakPolarHBondContact O-CB 3.48Å; L41-R44 PolarHBondContact O-N 2.97Å; L41-R44 VanDerWaalsContact O-N 3.16Å; Y42-R44 VanDerWaalsContact C-N 3.29Å; Y42-R44 PolarHBondContact O-N 3.14Å; R44-E189 IonicContact CZ-OE1 3.17Å; R44-E189 IonicContact NH1-OE1 2.79Å; R44-E189 PolarHBondContact NH1-OE1 2.78Å; R44-E189 IonicContact NH2-OE1 3.37Å; R44-E189 PolarHBondContact NH2-OE1 3.46Å; R44-E189 VanDerWaalsContact NH2-OE1 3.11Å; R44-P294 WeakPolarHBondContact CD-O 3.31Å; R44-R516 VanDerWaalsContact NH1-CZ 3.31Å
45	F	84.7	Confident	85.2	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-101.1	12.6	-178.6	-69.5	-88.2	0	0	0	113.5	Y42 D43 P47 L48 S49 P54 L57 A293 L296 L509	Y42-F45 PolarHBondContact O-N 3.41Å; D43-F45 PolarHBondContact O-N 2.77Å; F45-P47 CarbonylContact O-C 3.57Å; F45-L48 HydrophobicContact CB-CB 4.48Å; F45-L48 HydrophobicContact CD1-CD2 4.34Å; F45-L48 VanDerWaalsContact O-CA 3.31Å; F45-L48 WeakPolarHBondContact O-CA 3.2Å; F45-L48 WeakPolarHBondContact O-CB 3.45Å; F45-L48 PolarHBondContact O-N 3.21Å; F45-S49 PolarHBondContact O-N 3.04Å; F45-S49 PolarHBondContact O-OG 3.3Å; F45-P54 HydrophobicContact CB-CG 4.41Å; F45-P54 HydrophobicContact CD2-CB 4Å; F45-P54 HydrophobicContact CD2-CG 3.82Å; F45-P54 HydrophobicContact CE2-CB 4.29Å; F45-P54 HydrophobicContact CG-CG 4.37Å; F45-L57 HydrophobicContact CD1-CD1 3.78Å; F45-L57 HydrophobicContact CE1-CD1 3.77Å; F45-L57 HydrophobicContact CG-CD1 4.25Å; F45-L57 HydrophobicContact CZ-CD1 4.27Å; F45-A293 HydrophobicContact CE2-CB 4.21Å; F45-A293 WeakPolarHBondContact CE2-O 3.39Å; F45-A293 HydrophobicContact CZ-CB 3.73Å; F45-A293 WeakPolarHBondContact CZ-O 3.5Å; F45-L296 HydrophobicContact CE1-CB 4.29Å; F45-L509 HydrophobicContact CB-CD1 4.45Å; F45-L509 HydrophobicContact CD1-CD1 4.41Å; F45-L509 WeakPolarHBondContact O-CD1 3.37Å
46	N	82.8	Confident	84.9	Confident	10 Å²	10	24.3 Å²	24.3	5%	0.053	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	127.6	176.3	-77.6	-38.2	0	0	0	110.9	D43 S49	D43-N46 WeakPolarHBondContact CA-ND2 3.37Å; D43-N46 PolarHBondContact O-N 3.21Å; D43-N46 PolarHBondContact O-ND2 3.07Å; D43-N46 PolarHBondContact OD1-ND2 3.36Å; N46-S49 WeakPolarHBondContact CA-OG 3.38Å; N46-S49 PolarHBondContact N-OG 3.24Å; N46-S49 PolarHBondContact OD1-OG 2.93Å
47	P	83.9	Confident	84.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	cis	-97.1	2.1	10.2	35.9	-36	0	0	0	116.9	F45 S49 D50 F424 V447 V449 Y472	F45-P47 CarbonylContact O-C 3.57Å; P47-S49 VanDerWaalsContact C-N 3.28Å; P47-S49 PolarHBondContact O-N 3.47Å; P47-D50 PolarHBondContact O-N 3.5Å; P47-F424 HydrophobicContact CG-CE1 3.95Å; P47-V447 HydrophobicContact CG-CG1 3.94Å; P47-V449 HydrophobicContact CB-CG2 4.5Å; P47-V449 HydrophobicContact CG-CG2 3.87Å; P47-Y472 HydrophobicContact CB-CD2 3.7Å; P47-Y472 HydrophobicContact CB-CE1 4.35Å; P47-Y472 HydrophobicContact CB-CE2 3.46Å; P47-Y472 VanDerWaalsContact CB-CE2 3.46Å; P47-Y472 HydrophobicContact CB-CG 4.24Å; P47-Y472 HydrophobicContact CG-CD1 4.28Å; P47-Y472 HydrophobicContact CG-CD2 3.79Å; P47-Y472 HydrophobicContact CG-CE1 4.49Å; P47-Y472 HydrophobicContact CG-CE2 4.06Å; P47-Y472 HydrophobicContact CG-CG 3.9Å
48	L	86.4	Confident	84.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-40.9	178.6	-178.9	58.8	0	0	0	112	F45 D50 Y51 I52 L57 L296 W406 F424 P427 L509	F45-L48 HydrophobicContact CB-CB 4.48Å; F45-L48 HydrophobicContact CD1-CD2 4.34Å; F45-L48 VanDerWaalsContact O-CA 3.31Å; F45-L48 WeakPolarHBondContact O-CA 3.2Å; F45-L48 WeakPolarHBondContact O-CB 3.45Å; F45-L48 PolarHBondContact O-N 3.21Å; L48-D50 VanDerWaalsContact C-N 3.28Å; L48-D50 PolarHBondContact O-N 3.23Å; L48-Y51 PolarHBondContact O-N 3.13Å; L48-Y51 VanDerWaalsContact O-N 3.16Å; L48-I52 HydrophobicContact CD1-CD1 4.48Å; L48-I52 PolarHBondContact O-N 2.87Å; L48-I52 VanDerWaalsContact O-O 3.11Å; L48-L57 HydrophobicContact CD1-CD2 4.25Å; L48-L57 HydrophobicContact CD2-CD1 4.31Å; L48-L57 HydrophobicContact CD2-CD2 3.4Å; L48-L57 HydrophobicContact CG-CD2 3.73Å; L48-L296 HydrophobicContact CD2-CD1 4.19Å; L48-W406 HydrophobicContact CD2-CZ2 4.4Å; L48-F424 HydrophobicContact CB-CE2 3.92Å; L48-F424 HydrophobicContact CB-CZ 3.74Å; L48-F424 HydrophobicContact CD1-CE2 3.92Å; L48-F424 HydrophobicContact CD1-CZ 3.96Å; L48-F424 HydrophobicContact CD2-CE2 4.09Å; L48-F424 HydrophobicContact CG-CE2 4.2Å; L48-F424 HydrophobicContact CG-CZ 4.33Å; L48-P427 HydrophobicContact CD1-CG 4.37Å; L48-L509 HydrophobicContact CB-CD1 4.21Å
49	S	84.1	Confident	84.3	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.007	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-36	179.1	45.6	0	0	0	0	113.9	Y42 F45 N46 P47 Y51 I52	Y42-S49 VanDerWaalsContact O-CB 3.25Å; Y42-S49 WeakPolarHBondContact O-CB 3.09Å; Y42-S49 PolarHBondContact O-OG 3.07Å; Y42-S49 PolarHBondContact OH-O 2.97Å; F45-S49 PolarHBondContact O-N 3.04Å; F45-S49 PolarHBondContact O-OG 3.3Å; N46-S49 WeakPolarHBondContact CA-OG 3.38Å; N46-S49 PolarHBondContact N-OG 3.24Å; N46-S49 PolarHBondContact OD1-OG 2.93Å; P47-S49 VanDerWaalsContact C-N 3.28Å; P47-S49 PolarHBondContact O-N 3.47Å; S49-Y51 PolarHBondContact O-N 3.13Å; S49-Y51 VanDerWaalsContact O-N 3.13Å; S49-I52 VanDerWaalsContact CA-O 3.31Å; S49-I52 WeakPolarHBondContact CA-O 3.3Å; S49-I52 CarbonylContact O-C 3.59Å
50	D	82.6	Confident	84.3	Confident	79 Å²	79	24 Å²	24	42%	0.422	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.5	179.1	-74.4	-18	0	0	0	113.8	Y42 P47 L48	Y42-D50 WeakPolarHBondContact OH-CA 3.48Å; P47-D50 PolarHBondContact O-N 3.5Å; L48-D50 VanDerWaalsContact C-N 3.28Å; L48-D50 PolarHBondContact O-N 3.23Å
51	Y	83.5	Confident	84.5	Confident	64 Å²	64	23.6 Å²	23.6	25%	0.251	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-45	-179.1	-60.6	-88.5	0	0	0	111.6	L48 S49 P427 R452	L48-Y51 PolarHBondContact O-N 3.13Å; L48-Y51 VanDerWaalsContact O-N 3.16Å; S49-Y51 PolarHBondContact O-N 3.13Å; S49-Y51 VanDerWaalsContact O-N 3.13Å; Y51-P427 HydrophobicContact CD1-CB 3.94Å; Y51-P427 HydrophobicContact CD1-CG 4.43Å; Y51-P427 HydrophobicContact CD2-CB 3.89Å; Y51-P427 HydrophobicContact CD2-CG 3.57Å; Y51-P427 HydrophobicContact CE1-CB 4.37Å; Y51-P427 HydrophobicContact CE2-CB 4.31Å; Y51-P427 HydrophobicContact CE2-CG 4.26Å; Y51-P427 HydrophobicContact CG-CB 3.67Å; Y51-P427 HydrophobicContact CG-CG 3.66Å; Y51-P427 PolarHBondContact OH-O 3.28Å; Y51-R452 PolarHBondContact OH-NH2 3.5Å
52	I	87.8	Confident	84.9	Confident	37 Å²	37	22.4 Å²	22.4	19%	0.19	11%	0.11	C	C	.	.	S	Bend	trans	-125.5	108.9	-179.2	-54.5	175.1	0	0	0	106.9	L48 S49 L56 L57 L391	L48-I52 HydrophobicContact CD1-CD1 4.48Å; L48-I52 PolarHBondContact O-N 2.87Å; L48-I52 VanDerWaalsContact O-O 3.11Å; S49-I52 VanDerWaalsContact CA-O 3.31Å; S49-I52 WeakPolarHBondContact CA-O 3.3Å; S49-I52 CarbonylContact O-C 3.59Å; I52-L56 HydrophobicContact CG2-CB 4.16Å; I52-L57 HydrophobicContact CB-CD2 4.28Å; I52-L57 HydrophobicContact CG2-CD2 3.89Å; I52-L391 HydrophobicContact CD1-CD1 3.78Å
53	P	89.3	Confident	85.8	Confident	4 Å²	4	22.4 Å²	22.4	3%	0.026	11%	0.113	C	C	.	.			trans	-64	152.8	179.8	29.2	-35.9	0	0	0	110.4	Y42 C55 L56 L57 V91	Y42-P53 HydrophobicContact CE2-CB 4.35Å; P53-C55 PolarHBondContact O-N 3.03Å; P53-C55 VanDerWaalsContact O-N 3.13Å; P53-L56 HydrophobicContact CG-CB 3.91Å; P53-L56 HydrophobicContact CG-CD1 3.68Å; P53-L56 HydrophobicContact CG-CG 3.81Å; P53-L56 PolarHBondContact O-N 3.23Å; P53-L57 PolarHBondContact O-N 2.84Å; P53-V91 HydrophobicContact CG-CG2 4.45Å
54	P	88.8	Confident	86.3	Confident	5 Å²	5	18.7 Å²	18.7	3%	0.032	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-52.3	-41	-175.1	-27.1	33.6	0	0	0	113.6	F45 L56 L57	F45-P54 HydrophobicContact CB-CG 4.41Å; F45-P54 HydrophobicContact CD2-CB 4Å; F45-P54 HydrophobicContact CD2-CG 3.82Å; F45-P54 HydrophobicContact CE2-CB 4.29Å; F45-P54 HydrophobicContact CG-CG 4.37Å; P54-L56 PolarHBondContact O-N 2.65Å; P54-L57 HydrophobicContact CB-CD1 4.45Å; P54-L57 WeakPolarHBondContact O-CB 3.19Å; P54-L57 WeakPolarHBondContact O-CG 3.4Å; P54-L57 PolarHBondContact O-N 3.45Å; P54-L57 VanDerWaalsContact O-N 3.13Å
55	C	90.2	Very high	86.7	Confident	2 Å²	2	15.3 Å²	15.3	1%	0.014	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-64.2	-22.7	177.9	64	0	0	0	0	114	A38 P53 L64 L65 A144	A38-C55 HydrophobicContact CB-CB 4.06Å; P53-C55 PolarHBondContact O-N 3.03Å; P53-C55 VanDerWaalsContact O-N 3.13Å; C55-L64 PolarHBondContact O-N 3.3Å; C55-L65 HydrophobicContact CB-CB 4.42Å; C55-L65 VanDerWaalsContact O-CB 3.23Å; C55-L65 WeakPolarHBondContact O-CB 3.49Å; C55-L65 PolarHBondContact O-N 3.1Å; C55-A144 HydrophobicContact CB-CB 3.8Å
56	L	91.2	Very high	86.9	Confident	22 Å²	22	16 Å²	16	12%	0.115	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-101.6	6.9	177.3	-63.3	-179.4	0	0	0	113	I52 P53 P54 P63 L65 V91 Y94	I52-L56 HydrophobicContact CG2-CB 4.16Å; P53-L56 HydrophobicContact CG-CB 3.91Å; P53-L56 HydrophobicContact CG-CD1 3.68Å; P53-L56 HydrophobicContact CG-CG 3.81Å; P53-L56 PolarHBondContact O-N 3.23Å; P54-L56 PolarHBondContact O-N 2.65Å; L56-P63 HydrophobicContact CD2-CB 4.19Å; L56-L65 HydrophobicContact CD2-CB 4.17Å; L56-L65 HydrophobicContact CD2-CD2 4.03Å; L56-V91 HydrophobicContact CD1-CG2 4.26Å; L56-V91 HydrophobicContact CG-CG2 4.46Å; L56-Y94 HydrophobicContact CD2-CD1 3.75Å; L56-Y94 HydrophobicContact CD2-CD2 4.24Å; L56-Y94 HydrophobicContact CD2-CE1 4.28Å; L56-Y94 HydrophobicContact CD2-CG 3.73Å
57	L	90.5	Very high	87.1	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.084	C	C	.	.			trans	-59.4	135.8	175.1	-69.8	174.3	0	0	0	110	F45 L48 I52 P53 P54 P63 L64 L299 W406	F45-L57 HydrophobicContact CD1-CD1 3.78Å; F45-L57 HydrophobicContact CE1-CD1 3.77Å; F45-L57 HydrophobicContact CG-CD1 4.25Å; F45-L57 HydrophobicContact CZ-CD1 4.27Å; L48-L57 HydrophobicContact CD1-CD2 4.25Å; L48-L57 HydrophobicContact CD2-CD1 4.31Å; L48-L57 HydrophobicContact CD2-CD2 3.4Å; L48-L57 HydrophobicContact CG-CD2 3.73Å; I52-L57 HydrophobicContact CB-CD2 4.28Å; I52-L57 HydrophobicContact CG2-CD2 3.89Å; P53-L57 PolarHBondContact O-N 2.84Å; P54-L57 HydrophobicContact CB-CD1 4.45Å; P54-L57 WeakPolarHBondContact O-CB 3.19Å; P54-L57 WeakPolarHBondContact O-CG 3.4Å; P54-L57 PolarHBondContact O-N 3.45Å; P54-L57 VanDerWaalsContact O-N 3.13Å; L57-P63 WeakPolarHBondContact O-CA 3.41Å; L57-L64 HydrophobicContact CB-CD1 4.08Å; L57-L64 WeakPolarHBondContact O-CG 3.49Å; L57-L64 PolarHBondContact O-N 3.1Å; L57-L299 HydrophobicContact CB-CD2 4.05Å; L57-L299 HydrophobicContact CD1-CD2 3.72Å; L57-L299 HydrophobicContact CG-CD2 4.45Å; L57-W406 HydrophobicContact CD2-CZ2 4.35Å
58	P	88.3	Confident	87.4	Confident	19 Å²	19	16.1 Å²	16.1	12%	0.123	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	126.9	-178.1	28.8	-31.2	0	0	0	110.7	V62 L391 W406	P58-V62 CarbonylContact C-O 3.48Å; P58-V62 WeakPolarHBondContact CA-O 3.49Å; P58-L391 HydrophobicContact CB-CD2 4.47Å; P58-L391 HydrophobicContact CG-CD1 4.47Å; P58-L391 HydrophobicContact CG-CD2 3.35Å; P58-W406 HydrophobicContact CG-CZ2 4.32Å
59	L	87.1	Confident	87.6	Confident	7 Å²	7	16.1 Å²	16.1	4%	0.037	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	111.4	166.3	-167.4	76.1	0	0	0	107.9	N61 V62 L64 I147 L299 L302 N303 L306	L59-N61 PolarHBondContact O-N 3.43Å; L59-V62 PolarHBondContact N-O 2.7Å; L59-V62 PolarHBondContact O-N 2.77Å; L59-L64 HydrophobicContact CB-CD2 3.79Å; L59-L64 HydrophobicContact CD2-CD2 4.02Å; L59-L64 HydrophobicContact CG-CD2 4.39Å; L59-I147 HydrophobicContact CD2-CD1 3.58Å; L59-L299 HydrophobicContact CD1-CD1 3.87Å; L59-L302 HydrophobicContact CD1-CD2 3.61Å; L59-L302 HydrophobicContact CD2-CD2 3.51Å; L59-L302 HydrophobicContact CG-CD2 4.18Å; L59-N303 HydrophobicContact CD1-CB 3.81Å; L59-L306 HydrophobicContact CD2-CD1 3.85Å
60	S	82.2	Confident	87.7	Confident	1 Å²	1	16.2 Å²	16.2	1%	0.007	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	44.9	-171.6	-64.5	0	0	0	0	112.5	V62 N303 L307	S60-V62 PolarHBondContact O-N 3.46Å; S60-N303 WeakPolarHBondContact CA-OD1 3.44Å; S60-N303 PolarHBondContact N-OD1 3.33Å; S60-N303 PolarHBondContact OG-OD1 3.36Å; S60-L307 WeakPolarHBondContact OG-CD2 3.31Å; S60-L307 WeakPolarHBondContact OG-CG 3.31Å
61	N	82.5	Confident	88	Confident	43 Å²	43	13.5 Å²	13.5	23%	0.23	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	11.5	-176.2	-59.5	-5.6	0	0	0	116.1	L59 F355 L373 G374	L59-N61 PolarHBondContact O-N 3.43Å; N61-F355 HydrophobicContact CB-CE1 4Å; N61-F355 HydrophobicContact CB-CZ 4.41Å; N61-F355 WeakPolarHBondContact ND2-CE1 3.26Å; N61-L373 PolarHBondContact ND2-O 3.16Å; N61-G374 VanDerWaalsContact ND2-CA 3.27Å; N61-G374 WeakPolarHBondContact ND2-CA 3.32Å
62	V	84.4	Confident	88.3	Confident	5 Å²	5	10.5 Å²	10.5	3%	0.03	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	126.7	173	-179.3	0	0	0	0	109.2	P58 L59 S60 H66 M67 Y321 A322 L324	P58-V62 CarbonylContact C-O 3.48Å; P58-V62 WeakPolarHBondContact CA-O 3.49Å; L59-V62 PolarHBondContact N-O 2.7Å; L59-V62 PolarHBondContact O-N 2.77Å; S60-V62 PolarHBondContact O-N 3.46Å; V62-H66 HydrophobicContact CG1-CB 3.77Å; V62-M67 HydrophobicContact CB-SD 4.5Å; V62-M67 HydrophobicContact CG1-CG 4.23Å; V62-M67 HydrophobicContact CG1-SD 3.84Å; V62-Y321 WeakPolarHBondContact CG2-O 3.49Å; V62-A322 HydrophobicContact CG2-CB 4.16Å; V62-L324 HydrophobicContact CG1-CD1 4.16Å
63	P	89.5	Confident	88.4	Confident	22 Å²	22	9 Å²	9	14%	0.143	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	138.8	176.3	-25.3	35.7	0	0	0	111.9	L56 L57 L65 H66 Y94 L324	L56-P63 HydrophobicContact CD2-CB 4.19Å; L57-P63 WeakPolarHBondContact O-CA 3.41Å; P63-L65 VanDerWaalsContact C-N 3.28Å; P63-L65 PolarHBondContact O-N 2.9Å; P63-H66 WeakPolarHBondContact O-CA 3.38Å; P63-H66 WeakPolarHBondContact O-CB 3.41Å; P63-H66 PolarHBondContact O-N 2.97Å; P63-Y94 HydrophobicContact CB-CE2 4.32Å; P63-Y94 HydrophobicContact CG-CE2 3.79Å; P63-L324 HydrophobicContact CG-CD1 4.47Å
64	L	90.2	Very high	88.3	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-54.6	-42.7	-179.4	-71.4	172	0	0	0	112.8	C55 L57 L59 H66 M67 T68 D145 I147 A292 A293 L299	C55-L64 PolarHBondContact O-N 3.3Å; L57-L64 HydrophobicContact CB-CD1 4.08Å; L57-L64 WeakPolarHBondContact O-CG 3.49Å; L57-L64 PolarHBondContact O-N 3.1Å; L59-L64 HydrophobicContact CB-CD2 3.79Å; L59-L64 HydrophobicContact CD2-CD2 4.02Å; L59-L64 HydrophobicContact CG-CD2 4.39Å; L64-H66 PolarHBondContact O-N 3.31Å; L64-M67 WeakPolarHBondContact O-CB 3.49Å; L64-M67 PolarHBondContact O-N 3.27Å; L64-T68 PolarHBondContact O-N 3.04Å; L64-T68 PolarHBondContact O-OG1 3.05Å; L64-D145 HydrophobicContact CB-CB 4.27Å; L64-D145 HydrophobicContact CD1-CB 4.09Å; L64-I147 HydrophobicContact CD2-CD1 4.33Å; L64-A292 HydrophobicContact CD1-CB 4.1Å; L64-A292 HydrophobicContact CD2-CB 3.49Å; L64-A292 VanDerWaalsContact CD2-CB 3.49Å; L64-A292 HydrophobicContact CG-CB 4.39Å; L64-A293 HydrophobicContact CD1-CB 3.63Å; L64-L299 HydrophobicContact CD1-CD1 4.08Å; L64-L299 HydrophobicContact CD2-CD1 4.44Å
65	L	91.3	Very high	88.3	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-57.1	-32.9	176.5	179.9	63	0	0	0	112.2	L36 C55 L56 P63 M67 T68 L69 I82 V91 Y94 A144	L36-L65 HydrophobicContact CD1-CD1 4.23Å; C55-L65 HydrophobicContact CB-CB 4.42Å; C55-L65 VanDerWaalsContact O-CB 3.23Å; C55-L65 WeakPolarHBondContact O-CB 3.49Å; C55-L65 PolarHBondContact O-N 3.1Å; L56-L65 HydrophobicContact CD2-CB 4.17Å; L56-L65 HydrophobicContact CD2-CD2 4.03Å; P63-L65 VanDerWaalsContact C-N 3.28Å; P63-L65 PolarHBondContact O-N 2.9Å; L65-M67 VanDerWaalsContact C-N 3.31Å; L65-M67 PolarHBondContact O-N 2.84Å; L65-T68 PolarHBondContact O-N 3.17Å; L65-L69 HydrophobicContact CD1-CD1 4.11Å; L65-L69 HydrophobicContact CD1-CD2 4.48Å; L65-L69 HydrophobicContact CD1-CG 3.97Å; L65-L69 HydrophobicContact CD2-CD1 4.39Å; L65-L69 HydrophobicContact CG-CD1 3.85Å; L65-L69 HydrophobicContact CG-CG 4.15Å; L65-L69 WeakPolarHBondContact O-CB 3.32Å; L65-L69 VanDerWaalsContact O-CG 3.25Å; L65-L69 WeakPolarHBondContact O-CG 3.33Å; L65-L69 PolarHBondContact O-N 2.99Å; L65-I82 HydrophobicContact CD1-CD1 4.34Å; L65-V91 HydrophobicContact CD2-CG1 4.09Å; L65-Y94 HydrophobicContact CD2-CD1 4.1Å; L65-Y94 HydrophobicContact CD2-CE1 4.35Å; L65-A144 HydrophobicContact CD1-CB 4.14Å
66	H	88.9	Confident	88.2	Confident	16 Å²	16	14.6 Å²	14.6	7%	0.074	9%	0.093	C	C	.	.	H	α-helix	trans	-63	-40.9	176.2	-165	72.2	0	0	0	111.8	V62 P63 L64 L69 S70 Y94	V62-H66 HydrophobicContact CG1-CB 3.77Å; P63-H66 WeakPolarHBondContact O-CA 3.38Å; P63-H66 WeakPolarHBondContact O-CB 3.41Å; P63-H66 PolarHBondContact O-N 2.97Å; L64-H66 PolarHBondContact O-N 3.31Å; H66-L69 PolarHBondContact O-N 2.89Å; H66-S70 WeakPolarHBondContact O-CB 3.36Å; H66-S70 PolarHBondContact O-N 3.1Å; H66-S70 PolarHBondContact O-OG 2.56Å; H66-Y94 WeakPolarHBondContact CB-OH 3.48Å; H66-Y94 VanDerWaalsContact CG-OH 3.31Å; H66-Y94 PolarHBondContact ND1-OH 2.91Å
67	M	86.2	Confident	88.3	Confident	12 Å²	12	13.6 Å²	13.6	6%	0.059	9%	0.088	C	C	.	.	H	α-helix	trans	-65.6	-44.1	179.6	-58.9	-61.3	-68.4	0	0	110.1	V62 L64 L65 S70 T71 Y321	V62-M67 HydrophobicContact CB-SD 4.5Å; V62-M67 HydrophobicContact CG1-CG 4.23Å; V62-M67 HydrophobicContact CG1-SD 3.84Å; L64-M67 WeakPolarHBondContact O-CB 3.49Å; L64-M67 PolarHBondContact O-N 3.27Å; L65-M67 VanDerWaalsContact C-N 3.31Å; L65-M67 PolarHBondContact O-N 2.84Å; M67-S70 PolarHBondContact O-OG 3.01Å; M67-T71 WeakPolarHBondContact O-CB 3.42Å; M67-T71 VanDerWaalsContact O-CG2 3.22Å; M67-T71 WeakPolarHBondContact O-CG2 3.25Å; M67-T71 PolarHBondContact O-N 3.32Å; M67-T71 PolarHBondContact O-OG1 3.28Å; M67-Y321 HydrophobicContact CE-CD2 3.89Å; M67-Y321 HydrophobicContact CE-CE2 4.28Å; M67-Y321 HydrophobicContact CE-CG 4.13Å; M67-Y321 HydrophobicContact SD-CD1 4.3Å; M67-Y321 HydrophobicContact SD-CD2 4.22Å; M67-Y321 HydrophobicContact SD-CG 3.84Å
68	T	90.2	Very high	88.3	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.2	-49.6	175.6	-45.5	0	0	0	0	111.8	L36 L64 L65 S70 T71 L72 A144 L146	L36-T68 HydrophobicContact CD1-CG2 4.03Å; L36-T68 HydrophobicContact CD2-CG2 4.11Å; L64-T68 PolarHBondContact O-N 3.04Å; L64-T68 PolarHBondContact O-OG1 3.05Å; L65-T68 PolarHBondContact O-N 3.17Å; T68-S70 PolarHBondContact O-N 3.22Å; T68-T71 PolarHBondContact O-N 3.16Å; T68-T71 PolarHBondContact O-OG1 3.2Å; T68-L72 HydrophobicContact CG2-CD1 4.04Å; T68-L72 WeakPolarHBondContact O-CB 3.15Å; T68-L72 VanDerWaalsContact O-CG 3.3Å; T68-L72 WeakPolarHBondContact O-CG 3.44Å; T68-L72 PolarHBondContact O-N 3.21Å; T68-A144 WeakPolarHBondContact CB-O 3.24Å; T68-A144 PolarHBondContact OG1-O 3.25Å; T68-L146 HydrophobicContact CG2-CB 3.95Å; T68-L146 PolarHBondContact OG1-N 3.12Å; T68-L146 PolarHBondContact OG1-O 3.25Å
69	L	90.9	Very high	88.6	Confident	0 Å²	0	17 Å²	17	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66	-41.1	-177.7	-71.4	177.1	0	0	0	112.6	L36 L65 H66 A73 I80 I82 L100 L109	L36-L69 HydrophobicContact CD1-CD2 3.79Å; L65-L69 HydrophobicContact CD1-CD1 4.11Å; L65-L69 HydrophobicContact CD1-CD2 4.48Å; L65-L69 HydrophobicContact CD1-CG 3.97Å; L65-L69 HydrophobicContact CD2-CD1 4.39Å; L65-L69 HydrophobicContact CG-CD1 3.85Å; L65-L69 HydrophobicContact CG-CG 4.15Å; L65-L69 WeakPolarHBondContact O-CB 3.32Å; L65-L69 VanDerWaalsContact O-CG 3.25Å; L65-L69 WeakPolarHBondContact O-CG 3.33Å; L65-L69 PolarHBondContact O-N 2.99Å; H66-L69 PolarHBondContact O-N 2.89Å; L69-A73 WeakPolarHBondContact O-CB 3.48Å; L69-A73 PolarHBondContact O-N 3.35Å; L69-I80 HydrophobicContact CD2-CD1 3.91Å; L69-I80 HydrophobicContact CD2-CG2 3.98Å; L69-I82 HydrophobicContact CD1-CD1 4.44Å; L69-I82 HydrophobicContact CD2-CD1 4.21Å; L69-L100 HydrophobicContact CB-CD1 3.84Å; L69-L100 HydrophobicContact CD1-CD1 4.1Å; L69-L109 HydrophobicContact CD1-CD1 4.27Å; L69-L109 HydrophobicContact CD2-CD2 3.95Å
70	S	87.1	Confident	88.9	Confident	3 Å²	3	16.6 Å²	16.6	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-68.8	-38.8	-179.6	60.1	0	0	0	0	112.2	H66 M67 T68 S74 Y321	H66-S70 WeakPolarHBondContact O-CB 3.36Å; H66-S70 PolarHBondContact O-N 3.1Å; H66-S70 PolarHBondContact O-OG 2.56Å; M67-S70 PolarHBondContact O-OG 3.01Å; T68-S70 PolarHBondContact O-N 3.22Å; S70-S74 VanDerWaalsContact O-CB 3.24Å; S70-S74 WeakPolarHBondContact O-CB 3.38Å; S70-S74 PolarHBondContact O-N 3.11Å; S70-S74 PolarHBondContact O-OG 3.34Å; S70-Y321 VanDerWaalsContact CB-CE1 3.5Å; S70-Y321 VanDerWaalsContact OG-CD1 3.31Å; S70-Y321 WeakPolarHBondContact OG-CD1 3.5Å; S70-Y321 WeakPolarHBondContact OG-CE1 3.24Å
71	T	87.3	Confident	89.6	Confident	21 Å²	21	16.9 Å²	16.9	13%	0.129	10%	0.098	C	C	.	.	H	α-helix	trans	-63.8	-49.6	173.9	51.7	0	0	0	0	111	M67 T68 A73 S74 D75 C148	M67-T71 WeakPolarHBondContact O-CB 3.42Å; M67-T71 VanDerWaalsContact O-CG2 3.22Å; M67-T71 WeakPolarHBondContact O-CG2 3.25Å; M67-T71 PolarHBondContact O-N 3.32Å; M67-T71 PolarHBondContact O-OG1 3.28Å; T68-T71 PolarHBondContact O-N 3.16Å; T68-T71 PolarHBondContact O-OG1 3.2Å; T71-A73 PolarHBondContact O-N 3.28Å; T71-S74 PolarHBondContact O-N 3.06Å; T71-S74 PolarHBondContact O-OG 2.89Å; T71-D75 VanDerWaalsContact O-CB 3.32Å; T71-D75 WeakPolarHBondContact O-CB 3.45Å; T71-D75 PolarHBondContact O-N 2.99Å; T71-C148 VanDerWaalsContact CG2-O 3.31Å; T71-C148 WeakPolarHBondContact CG2-O 3.32Å
72	L	91.1	Very high	90.2	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.01	9%	0.087	C	C	.	.	H	α-helix	trans	-61.8	-43.5	176.9	-68.3	175	0	0	0	112.9	A34 L36 T68 S74 D75 G76 F77 I80 L140 L152	A34-L72 HydrophobicContact CB-CD1 4.37Å; L36-L72 HydrophobicContact CD1-CD1 4.18Å; L36-L72 HydrophobicContact CD2-CD1 3.84Å; L36-L72 HydrophobicContact CG-CD1 4.41Å; T68-L72 HydrophobicContact CG2-CD1 4.04Å; T68-L72 WeakPolarHBondContact O-CB 3.15Å; T68-L72 VanDerWaalsContact O-CG 3.3Å; T68-L72 WeakPolarHBondContact O-CG 3.44Å; T68-L72 PolarHBondContact O-N 3.21Å; L72-S74 VanDerWaalsContact C-N 3.35Å; L72-S74 PolarHBondContact O-N 2.96Å; L72-D75 PolarHBondContact O-N 3.44Å; L72-G76 PolarHBondContact O-N 2.97Å; L72-F77 HydrophobicContact CB-CB 4.16Å; L72-F77 HydrophobicContact CB-CD2 4.14Å; L72-F77 HydrophobicContact CB-CG 4.36Å; L72-F77 HydrophobicContact CD2-CD2 3.76Å; L72-F77 HydrophobicContact CD2-CE2 3.87Å; L72-F77 HydrophobicContact CD2-CG 4.29Å; L72-F77 HydrophobicContact CD2-CZ 4.49Å; L72-F77 WeakPolarHBondContact O-CB 3.44Å; L72-F77 WeakPolarHBondContact O-CD2 3.38Å; L72-F77 PolarHBondContact O-N 3.43Å; L72-I80 HydrophobicContact CB-CD1 4.02Å; L72-I80 HydrophobicContact CD1-CD1 4.4Å; L72-L140 HydrophobicContact CD2-CD2 3.57Å; L72-L152 HydrophobicContact CD2-CD1 3.92Å
73	A	89.2	Confident	90.6	Very high	4 Å²	4	14.8 Å²	14.8	3%	0.033	9%	0.086	C	C	.	.	H	α-helix	trans	-64.8	-40	177.9	0	0	0	0	0	111.8	L69 T71 D75 G76 F104 L107	L69-A73 WeakPolarHBondContact O-CB 3.48Å; L69-A73 PolarHBondContact O-N 3.35Å; T71-A73 PolarHBondContact O-N 3.28Å; A73-D75 PolarHBondContact O-N 3.35Å; A73-G76 PolarHBondContact O-N 2.66Å; A73-F104 HydrophobicContact CB-CB 4.29Å; A73-F104 HydrophobicContact CB-CD1 4.14Å; A73-F104 HydrophobicContact CB-CD2 3.61Å; A73-F104 HydrophobicContact CB-CE1 4.38Å; A73-F104 HydrophobicContact CB-CE2 3.87Å; A73-F104 HydrophobicContact CB-CG 3.75Å; A73-F104 HydrophobicContact CB-CZ 4.25Å; A73-L107 HydrophobicContact CB-CD1 4.23Å; A73-L107 HydrophobicContact CB-CD2 4.08Å
74	S	86.5	Confident	90.7	Very high	75 Å²	75	13.8 Å²	13.8	52%	0.524	8%	0.08	S	C	.	.	H	α-helix	trans	-65.1	-30.2	175.5	75.6	0	0	0	0	112.8	S70 T71 L72 G76	S70-S74 VanDerWaalsContact O-CB 3.24Å; S70-S74 WeakPolarHBondContact O-CB 3.38Å; S70-S74 PolarHBondContact O-N 3.11Å; S70-S74 PolarHBondContact O-OG 3.34Å; T71-S74 PolarHBondContact O-N 3.06Å; T71-S74 PolarHBondContact O-OG 2.89Å; L72-S74 VanDerWaalsContact C-N 3.35Å; L72-S74 PolarHBondContact O-N 2.96Å; S74-G76 VanDerWaalsContact C-N 3.29Å
75	D	88.6	Confident	90.5	Very high	30 Å²	30	15.1 Å²	15.1	16%	0.16	9%	0.087	C	C	.	.	H	α-helix	trans	-82.3	-9.6	180	-162.5	34	0	0	0	113.2	T71 L72 A73 F77 S151 L152 A153	T71-D75 VanDerWaalsContact O-CB 3.32Å; T71-D75 WeakPolarHBondContact O-CB 3.45Å; T71-D75 PolarHBondContact O-N 2.99Å; L72-D75 PolarHBondContact O-N 3.44Å; A73-D75 PolarHBondContact O-N 3.35Å; D75-F77 HydrophobicContact CB-CD2 4.24Å; D75-F77 HydrophobicContact CB-CE2 4.41Å; D75-S151 WeakPolarHBondContact OD1-CA 3.39Å; D75-S151 WeakPolarHBondContact OD1-CB 3.5Å; D75-S151 PolarHBondContact OD1-OG 3.41Å; D75-L152 VanDerWaalsContact OD2-CA 3.32Å; D75-L152 WeakPolarHBondContact OD2-CA 3.12Å; D75-L152 PolarHBondContact OD2-N 3.02Å; D75-A153 WeakPolarHBondContact O-CB 3.25Å; D75-A153 PolarHBondContact OD2-N 2.95Å
76	G	89.3	Confident	90.2	Very high	25 Å²	25	21 Å²	21	26%	0.258	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	107.2	5.2	172.7	0	0	0	0	0	115.2	L72 A73 S74 R78	L72-G76 PolarHBondContact O-N 2.97Å; A73-G76 PolarHBondContact O-N 2.66Å; S74-G76 VanDerWaalsContact C-N 3.29Å; G76-R78 PolarHBondContact O-N 3.32Å
77	F	93.1	Very high	90	Very high	1 Å²	1	20.5 Å²	20.5	0%	0.004	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	124.2	171.8	-68.5	-92.8	0	0	0	110.1	L32 A34 L72 D75 I80 L140 L152 A153 V156	L32-F77 HydrophobicContact CB-CD1 3.63Å; L32-F77 HydrophobicContact CB-CE1 3.94Å; L32-F77 HydrophobicContact CB-CG 4.12Å; A34-F77 HydrophobicContact CB-CD1 3.78Å; A34-F77 HydrophobicContact CB-CE1 4.24Å; A34-F77 HydrophobicContact CB-CG 4.42Å; L72-F77 HydrophobicContact CB-CB 4.16Å; L72-F77 HydrophobicContact CB-CD2 4.14Å; L72-F77 HydrophobicContact CB-CG 4.36Å; L72-F77 HydrophobicContact CD2-CD2 3.76Å; L72-F77 HydrophobicContact CD2-CE2 3.87Å; L72-F77 HydrophobicContact CD2-CG 4.29Å; L72-F77 HydrophobicContact CD2-CZ 4.49Å; L72-F77 WeakPolarHBondContact O-CB 3.44Å; L72-F77 WeakPolarHBondContact O-CD2 3.38Å; L72-F77 PolarHBondContact O-N 3.43Å; D75-F77 HydrophobicContact CB-CD2 4.24Å; D75-F77 HydrophobicContact CB-CE2 4.41Å; F77-I80 HydrophobicContact CB-CD1 4.38Å; F77-I80 HydrophobicContact CB-CG1 4.38Å; F77-L140 HydrophobicContact CE1-CB 3.74Å; F77-L140 HydrophobicContact CE1-CD2 4.03Å; F77-L140 HydrophobicContact CE2-CD2 4.29Å; F77-L140 HydrophobicContact CZ-CB 4.09Å; F77-L140 HydrophobicContact CZ-CD2 3.75Å; F77-L140 HydrophobicContact CZ-CG 4.46Å; F77-L152 HydrophobicContact CE2-CB 4.18Å; F77-L152 HydrophobicContact CZ-CB 4.41Å; F77-A153 HydrophobicContact CE2-CB 4.33Å; F77-V156 HydrophobicContact CE1-CG2 4.33Å; F77-V156 HydrophobicContact CZ-CG2 3.95Å
78	R	91.3	Very high	90.2	Very high	84 Å²	84	23 Å²	23	32%	0.317	12%	0.119	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-31.3	-175.5	-59.9	-54	-177.9	142.3	3.6	113	L32 G76 P105 K108	L32-R78 PolarHBondContact O-N 2.8Å; G76-R78 PolarHBondContact O-N 3.32Å; R78-P105 PolarHBondContact NH1-O 3Å; R78-K108 PolarHBondContact O-N 2.99Å
79	N	93.3	Very high	90.3	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.027	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	108.9	179	-59.4	-63.8	0	0	0	108.5	E31 L32 Y33 A34 K108 F132	E31-N79 PolarHBondContact OE2-ND2 2.87Å; L32-N79 PolarHBondContact O-N 3.31Å; Y33-N79 WeakPolarHBondContact CA-O 3.02Å; Y33-N79 HydrophobicContact CD1-CB 3.48Å; Y33-N79 VanDerWaalsContact CD1-CB 3.48Å; Y33-N79 HydrophobicContact CE1-CB 3.5Å; Y33-N79 HydrophobicContact CG-CB 4.06Å; Y33-N79 VanDerWaalsContact CZ-ND2 3.31Å; A34-N79 PolarHBondContact N-O 3.25Å; N79-K108 WeakPolarHBondContact OD1-CD 3.47Å; N79-F132 HydrophobicContact CB-CZ 4.31Å
80	I	94.8	Very high	90.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	122.1	-178.9	-51.6	-179.8	0	0	0	108.9	A34 L36 L69 L72 F77 I82 L107 K108 L109 F110	A34-I80 HydrophobicContact CB-CG1 4.38Å; A34-I80 HydrophobicContact CB-CG2 4.42Å; A34-I80 CarbonylContact O-C 3.54Å; A34-I80 WeakPolarHBondContact O-CA 3.39Å; L36-I80 HydrophobicContact CD1-CG2 3.76Å; L36-I80 HydrophobicContact CG-CG2 3.88Å; L69-I80 HydrophobicContact CD2-CD1 3.91Å; L69-I80 HydrophobicContact CD2-CG2 3.98Å; L72-I80 HydrophobicContact CB-CD1 4.02Å; L72-I80 HydrophobicContact CD1-CD1 4.4Å; F77-I80 HydrophobicContact CB-CD1 4.38Å; F77-I80 HydrophobicContact CB-CG1 4.38Å; I80-I82 HydrophobicContact CG2-CG1 4.28Å; I80-L107 HydrophobicContact CD1-CD1 4Å; I80-L107 HydrophobicContact CG1-CD1 4.34Å; I80-K108 PolarHBondContact N-O 3.24Å; I80-L109 HydrophobicContact CB-CD2 3.83Å; I80-L109 HydrophobicContact CD1-CD2 4.09Å; I80-L109 HydrophobicContact CG1-CD2 4.27Å; I80-F110 PolarHBondContact O-N 3.35Å
81	L	95	Very high	90.5	Very high	7 Å²	7	33.8 Å²	33.8	4%	0.037	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	128.8	174.3	178.4	62	0	0	0	109.5	A34 V35 L36 Y83 F110 R112 F132	A34-L81 PolarHBondContact O-N 3.17Å; V35-L81 CarbonylContact C-O 3.58Å; V35-L81 WeakPolarHBondContact CA-O 3.5Å; L36-L81 PolarHBondContact N-O 2.64Å; L81-Y83 HydrophobicContact CD2-CD2 4.24Å; L81-Y83 HydrophobicContact CD2-CE2 3.42Å; L81-Y83 VanDerWaalsContact CD2-CE2 3.42Å; L81-Y83 HydrophobicContact CG-CD2 4.15Å; L81-Y83 HydrophobicContact CG-CE2 3.82Å; L81-F110 CarbonylContact C-O 3.57Å; L81-F110 WeakPolarHBondContact CA-O 3.42Å; L81-F110 HydrophobicContact CD1-CB 3.64Å; L81-R112 HydrophobicContact CD1-CB 4.13Å; L81-F132 HydrophobicContact CB-CD1 4.06Å; L81-F132 HydrophobicContact CB-CE1 3.63Å; L81-F132 HydrophobicContact CB-CE2 4.33Å; L81-F132 HydrophobicContact CB-CZ 3.78Å; L81-F132 HydrophobicContact CD2-CB 4.13Å; L81-F132 HydrophobicContact CD2-CD1 3.59Å; L81-F132 HydrophobicContact CD2-CD2 4.37Å; L81-F132 HydrophobicContact CD2-CE1 4.07Å; L81-F132 HydrophobicContact CD2-CG 3.76Å; L81-F132 HydrophobicContact CG-CD1 4.44Å; L81-F132 HydrophobicContact CG-CE1 4.48Å
82	I	95	Very high	90.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	118.4	-178.3	-55.7	164.1	0	0	0	108.5	L36 A38 L65 L69 I80 T84 V91 I95 F110 V111 R112	L36-I82 HydrophobicContact CB-CG1 4.16Å; L36-I82 HydrophobicContact CD1-CG1 4.23Å; L36-I82 WeakPolarHBondContact O-CA 3.46Å; A38-I82 HydrophobicContact CB-CG2 4.45Å; L65-I82 HydrophobicContact CD1-CD1 4.34Å; L69-I82 HydrophobicContact CD1-CD1 4.44Å; L69-I82 HydrophobicContact CD2-CD1 4.21Å; I80-I82 HydrophobicContact CG2-CG1 4.28Å; I82-T84 HydrophobicContact CG2-CG2 4.25Å; I82-V91 HydrophobicContact CG2-CG1 4.23Å; I82-I95 HydrophobicContact CD1-CD1 3.46Å; I82-I95 VanDerWaalsContact CD1-CD1 3.46Å; I82-I95 HydrophobicContact CD1-CG1 4.5Å; I82-F110 PolarHBondContact N-O 3.41Å; I82-V111 WeakPolarHBondContact O-CA 3.44Å; I82-R112 PolarHBondContact O-N 3.15Å
83	Y	93.8	Very high	90.7	Very high	3 Å²	3	37.1 Å²	37.1	1%	0.012	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	126.6	175.3	-87.9	-88.5	0	0	0	111.2	V35 L36 A38 L81 R112 V114 I123 D126 L127	V35-Y83 HydrophobicContact CG1-CD2 3.76Å; V35-Y83 HydrophobicContact CG1-CE2 3.99Å; L36-Y83 PolarHBondContact O-N 3.16Å; A38-Y83 WeakPolarHBondContact CB-O 3.25Å; A38-Y83 PolarHBondContact N-O 3.48Å; A38-Y83 VanDerWaalsContact N-O 3.08Å; L81-Y83 HydrophobicContact CD2-CD2 4.24Å; L81-Y83 HydrophobicContact CD2-CE2 3.42Å; L81-Y83 VanDerWaalsContact CD2-CE2 3.42Å; L81-Y83 HydrophobicContact CG-CD2 4.15Å; L81-Y83 HydrophobicContact CG-CE2 3.82Å; Y83-R112 HydrophobicContact CD1-CB 4.44Å; Y83-R112 HydrophobicContact CE1-CB 4.29Å; Y83-R112 HydrophobicContact CE1-CG 4.22Å; Y83-V114 HydrophobicContact CD1-CG2 3.53Å; Y83-V114 HydrophobicContact CE1-CG2 3.58Å; Y83-I123 HydrophobicContact CD1-CG1 4.41Å; Y83-I123 HydrophobicContact CD1-CG2 3.67Å; Y83-I123 HydrophobicContact CD2-CG2 3.87Å; Y83-I123 HydrophobicContact CE1-CG2 3.94Å; Y83-I123 HydrophobicContact CE2-CG2 4.14Å; Y83-I123 HydrophobicContact CG-CG2 3.62Å; Y83-D126 VanDerWaalsContact CE1-OD2 3.24Å; Y83-D126 WeakPolarHBondContact CE1-OD2 3.35Å; Y83-D126 PolarHBondContact OH-OD2 2.83Å; Y83-L127 HydrophobicContact CE2-CB 4.35Å; Y83-L127 HydrophobicContact CE2-CD1 4.12Å; Y83-L127 WeakPolarHBondContact OH-CA 3.35Å; Y83-L127 WeakPolarHBondContact OH-CB 3.47Å; Y83-L127 PolarHBondContact OH-N 3.08Å
84	T	91.9	Very high	90.8	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	141.2	177.3	57.8	0	0	0	0	109.5	A38 I82 Y88 V91 V111 R112 N113 V114	A38-T84 HydrophobicContact CB-CG2 4.17Å; I82-T84 HydrophobicContact CG2-CG2 4.25Å; T84-Y88 WeakPolarHBondContact OG1-CA 3.23Å; T84-Y88 WeakPolarHBondContact OG1-CB 3.28Å; T84-V91 HydrophobicContact CG2-CB 3.92Å; T84-V91 HydrophobicContact CG2-CG1 3.95Å; T84-V91 HydrophobicContact CG2-CG2 3.88Å; T84-V111 HydrophobicContact CG2-CG1 4.05Å; T84-R112 PolarHBondContact N-O 3.02Å; T84-R112 PolarHBondContact OG1-O 3.27Å; T84-N113 WeakPolarHBondContact O-CA 3.31Å; T84-V114 PolarHBondContact O-N 3.43Å
85	I	86.4	Confident	90.9	Very high	29 Å²	29	35.4 Å²	35.4	15%	0.149	18%	0.176	C	C	.	.	S	Bend	trans	-107.1	-64.4	-179.8	-58.9	164.1	0	0	0	108.9	D39 N113 V114 C117	D39-I85 HydrophobicContact CB-CB 3.95Å; D39-I85 HydrophobicContact CB-CD1 3.91Å; D39-I85 HydrophobicContact CB-CG1 4.03Å; D39-I85 WeakPolarHBondContact OD2-CA 3.44Å; D39-I85 PolarHBondContact OD2-N 3.08Å; I85-N113 PolarHBondContact O-OD1 3.49Å; I85-V114 WeakPolarHBondContact CA-O 3.3Å; I85-C117 WeakPolarHBondContact CD1-O 3.39Å; I85-C117 WeakPolarHBondContact CG2-O 3.36Å
86	K	85.3	Confident	90.9	Very high	124 Å²	124	39.7 Å²	39.7	54%	0.539	20%	0.199	S	C	.	.	S	Bend	trans	-99	-27.3	-179.6	-64.2	177.8	-174.4	170.1	0	111.6	D39 Y42 D43	D39-K86 PolarHBondContact OD2-N 3.37Å; Y42-K86 HydrophobicContact CD1-CD 3.75Å; Y42-K86 HydrophobicContact CD2-CB 4.32Å; Y42-K86 HydrophobicContact CE1-CB 4.42Å; Y42-K86 HydrophobicContact CE1-CD 3.66Å; Y42-K86 HydrophobicContact CE2-CB 3.91Å; Y42-K86 HydrophobicContact CG-CD 4.25Å; D43-K86 IonicContact OD1-NZ 3.29Å; D43-K86 PolarHBondContact OD1-NZ 3.29Å
87	S	84.6	Confident	90.7	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.028	22%	0.221	C	C	.	.			trans	-92.8	9.1	-167.1	66.5	0	0	0	0	115.8	D39 K89 S90 V91	D39-S87 WeakPolarHBondContact OD1-CB 3.23Å; D39-S87 PolarHBondContact OD1-OG 3.43Å; D39-S87 PolarHBondContact OD2-N 3.26Å; D39-S87 PolarHBondContact OD2-OG 3.14Å; S87-K89 PolarHBondContact O-N 3.25Å; S87-S90 PolarHBondContact O-N 3.14Å; S87-S90 VanDerWaalsContact O-N 3.16Å; S87-V91 WeakPolarHBondContact O-CG2 3.46Å; S87-V91 PolarHBondContact O-N 3.46Å
88	Y	89.8	Confident	90.1	Very high	65 Å²	65	46.7 Å²	46.7	26%	0.255	23%	0.227	S	C	.	.	H	α-helix	trans	-49.7	-51.4	-172.3	173.8	-113.3	0	0	0	114	T84 S90 V91 Q92 V111 N113	T84-Y88 WeakPolarHBondContact OG1-CA 3.23Å; T84-Y88 WeakPolarHBondContact OG1-CB 3.28Å; Y88-S90 VanDerWaalsContact C-N 3.33Å; Y88-S90 PolarHBondContact O-N 3.36Å; Y88-V91 PolarHBondContact O-N 2.87Å; Y88-Q92 HydrophobicContact CE2-CB 4.27Å; Y88-Q92 HydrophobicContact CE2-CG 4.5Å; Y88-Q92 WeakPolarHBondContact O-CB 3.36Å; Y88-Q92 PolarHBondContact O-N 3.13Å; Y88-V111 HydrophobicContact CD2-CG1 3.74Å; Y88-V111 HydrophobicContact CE2-CB 4.21Å; Y88-V111 HydrophobicContact CE2-CG1 3.92Å; Y88-N113 WeakPolarHBondContact CB-OD1 3.41Å; Y88-N113 HydrophobicContact CD1-CB 3.96Å; Y88-N113 HydrophobicContact CD2-CB 3.6Å; Y88-N113 HydrophobicContact CE1-CB 4.38Å; Y88-N113 HydrophobicContact CE2-CB 4.06Å; Y88-N113 HydrophobicContact CG-CB 3.54Å
89	K	91.3	Very high	89.4	Confident	177 Å²	177	46.5 Å²	46.5	77%	0.77	23%	0.231	S	C	*	.	H	α-helix	trans	-60.2	-43.1	-175.6	-67.6	179	-177.6	170.4	0	112.1	S87 A93	S87-K89 PolarHBondContact O-N 3.25Å; K89-A93 VanDerWaalsContact O-CB 3.24Å; K89-A93 WeakPolarHBondContact O-CB 3.44Å; K89-A93 PolarHBondContact O-N 3.28Å
90	S	90.9	Very high	88.7	Confident	52 Å²	52	46.6 Å²	46.6	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-71.4	-43.1	-178	-57.2	0	0	0	0	111.4	S87 Y88 A93 Y94	S87-S90 PolarHBondContact O-N 3.14Å; S87-S90 VanDerWaalsContact O-N 3.16Å; Y88-S90 VanDerWaalsContact C-N 3.33Å; Y88-S90 PolarHBondContact O-N 3.36Å; S90-A93 PolarHBondContact O-N 3.06Å; S90-Y94 WeakPolarHBondContact O-CB 3.28Å; S90-Y94 PolarHBondContact O-N 3.14Å
91	V	91.9	Very high	87.7	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67.7	-42.9	178.6	175.2	0	0	0	0	111.3	P53 L56 L65 I82 T84 S87 Y88 Y94 I95 V111	P53-V91 HydrophobicContact CG-CG2 4.45Å; L56-V91 HydrophobicContact CD1-CG2 4.26Å; L56-V91 HydrophobicContact CG-CG2 4.46Å; L65-V91 HydrophobicContact CD2-CG1 4.09Å; I82-V91 HydrophobicContact CG2-CG1 4.23Å; T84-V91 HydrophobicContact CG2-CB 3.92Å; T84-V91 HydrophobicContact CG2-CG1 3.95Å; T84-V91 HydrophobicContact CG2-CG2 3.88Å; S87-V91 WeakPolarHBondContact O-CG2 3.46Å; S87-V91 PolarHBondContact O-N 3.46Å; Y88-V91 PolarHBondContact O-N 2.87Å; V91-Y94 WeakPolarHBondContact O-CB 3.11Å; V91-Y94 PolarHBondContact O-N 3.42Å; V91-I95 HydrophobicContact CG1-CD1 3.72Å; V91-I95 WeakPolarHBondContact O-CG1 3.29Å; V91-I95 PolarHBondContact O-N 2.93Å; V91-V111 HydrophobicContact CG1-CG1 4.1Å; V91-V111 HydrophobicContact CG1-CG2 4.43Å
92	Q	92	Very high	86.8	Confident	51 Å²	51	54.6 Å²	54.6	24%	0.238	28%	0.283	C	S	.	.	H	α-helix	trans	-62.5	-44.2	175.4	-172.9	65.5	14.7	0	0	111.6	Y88 Y94 I95 N96	Y88-Q92 HydrophobicContact CE2-CB 4.27Å; Y88-Q92 HydrophobicContact CE2-CG 4.5Å; Y88-Q92 WeakPolarHBondContact O-CB 3.36Å; Y88-Q92 PolarHBondContact O-N 3.13Å; Q92-Y94 VanDerWaalsContact C-N 3.32Å; Q92-Y94 PolarHBondContact O-N 2.95Å; Q92-I95 PolarHBondContact O-N 3.23Å; Q92-N96 WeakPolarHBondContact O-CB 3.41Å; Q92-N96 PolarHBondContact O-N 3.37Å; Q92-N96 PolarHBondContact O-ND2 3.21Å
93	A	91.7	Very high	85.9	Confident	42 Å²	42	58.6 Å²	58.6	35%	0.347	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-42.6	176.1	0	0	0	0	0	111.6	K89 S90 Q97	K89-A93 VanDerWaalsContact O-CB 3.24Å; K89-A93 WeakPolarHBondContact O-CB 3.44Å; K89-A93 PolarHBondContact O-N 3.28Å; S90-A93 PolarHBondContact O-N 3.06Å; A93-Q97 VanDerWaalsContact O-CG 3.31Å; A93-Q97 WeakPolarHBondContact O-CG 3.46Å; A93-Q97 PolarHBondContact O-N 3.31Å
94	Y	90	Very high	85.4	Confident	26 Å²	26	61 Å²	61	10%	0.102	32%	0.32	C	S	.	.	H	α-helix	trans	-59.8	-52.4	175.4	177.2	-105.2	0	0	0	111.2	L56 P63 L65 H66 S90 V91 Q92 N96 Q97 T98 L324	L56-Y94 HydrophobicContact CD2-CD1 3.75Å; L56-Y94 HydrophobicContact CD2-CD2 4.24Å; L56-Y94 HydrophobicContact CD2-CE1 4.28Å; L56-Y94 HydrophobicContact CD2-CG 3.73Å; P63-Y94 HydrophobicContact CB-CE2 4.32Å; P63-Y94 HydrophobicContact CG-CE2 3.79Å; L65-Y94 HydrophobicContact CD2-CD1 4.1Å; L65-Y94 HydrophobicContact CD2-CE1 4.35Å; H66-Y94 WeakPolarHBondContact CB-OH 3.48Å; H66-Y94 VanDerWaalsContact CG-OH 3.31Å; H66-Y94 PolarHBondContact ND1-OH 2.91Å; S90-Y94 WeakPolarHBondContact O-CB 3.28Å; S90-Y94 PolarHBondContact O-N 3.14Å; V91-Y94 WeakPolarHBondContact O-CB 3.11Å; V91-Y94 PolarHBondContact O-N 3.42Å; Q92-Y94 VanDerWaalsContact C-N 3.32Å; Q92-Y94 PolarHBondContact O-N 2.95Å; Y94-N96 VanDerWaalsContact C-N 3.3Å; Y94-N96 PolarHBondContact O-N 3.46Å; Y94-Q97 CarbonylContact O-C 3.58Å; Y94-Q97 WeakPolarHBondContact O-CA 3.5Å; Y94-Q97 WeakPolarHBondContact O-CB 3.41Å; Y94-Q97 PolarHBondContact O-N 2.71Å; Y94-T98 HydrophobicContact CD1-CG2 3.7Å; Y94-T98 HydrophobicContact CD2-CG2 4.36Å; Y94-T98 HydrophobicContact CE1-CG2 3.32Å; Y94-T98 HydrophobicContact CE2-CG2 4.04Å; Y94-T98 HydrophobicContact CG-CG2 4.19Å; Y94-T98 VanDerWaalsContact CZ-CG2 3.5Å; Y94-T98 WeakPolarHBondContact O-CG2 3.02Å; Y94-T98 PolarHBondContact O-N 3.31Å; Y94-L324 HydrophobicContact CE2-CD2 4.3Å
95	I	89.8	Confident	84.8	Confident	18 Å²	18	66 Å²	66	9%	0.092	35%	0.353	C	S	.	.	H	α-helix	trans	-58.1	-42	-177.7	-74.4	161.4	0	0	0	112.2	I82 V91 Q92 Q97 T98 L109 V111	I82-I95 HydrophobicContact CD1-CD1 3.46Å; I82-I95 VanDerWaalsContact CD1-CD1 3.46Å; I82-I95 HydrophobicContact CD1-CG1 4.5Å; V91-I95 HydrophobicContact CG1-CD1 3.72Å; V91-I95 WeakPolarHBondContact O-CG1 3.29Å; V91-I95 PolarHBondContact O-N 2.93Å; Q92-I95 PolarHBondContact O-N 3.23Å; I95-Q97 PolarHBondContact O-N 3.37Å; I95-T98 PolarHBondContact O-N 2.92Å; I95-T98 PolarHBondContact O-OG1 3.24Å; I95-L109 HydrophobicContact CG2-CB 4.05Å; I95-L109 HydrophobicContact CG2-CD1 4.12Å; I95-V111 HydrophobicContact CD1-CG2 3.14Å; I95-V111 HydrophobicContact CG1-CG2 4.4Å
96	N	87.7	Confident	84.7	Confident	119 Å²	119	67.1 Å²	67.1	64%	0.636	37%	0.372	S	S	*	.	H	α-helix	trans	-62	-28.3	175.2	-69.2	-22.8	0	0	0	113.4	Q92 Y94	Q92-N96 WeakPolarHBondContact O-CB 3.41Å; Q92-N96 PolarHBondContact O-N 3.37Å; Q92-N96 PolarHBondContact O-ND2 3.21Å; Y94-N96 VanDerWaalsContact C-N 3.3Å; Y94-N96 PolarHBondContact O-N 3.46Å
97	Q	85	Confident	84.8	Confident	154 Å²	154	62.2 Å²	62.2	72%	0.72	35%	0.352	S	S	*	.	H	α-helix	trans	-90.6	-18	178.7	-67.6	172.4	11.4	0	0	112.8	A93 Y94 I95	A93-Q97 VanDerWaalsContact O-CG 3.31Å; A93-Q97 WeakPolarHBondContact O-CG 3.46Å; A93-Q97 PolarHBondContact O-N 3.31Å; Y94-Q97 CarbonylContact O-C 3.58Å; Y94-Q97 WeakPolarHBondContact O-CA 3.5Å; Y94-Q97 WeakPolarHBondContact O-CB 3.41Å; Y94-Q97 PolarHBondContact O-N 2.71Å; I95-Q97 PolarHBondContact O-N 3.37Å
98	T	81.1	Confident	85.1	Confident	20 Å²	20	66.9 Å²	66.9	12%	0.123	37%	0.371	C	S	.	.			trans	-65.6	144.2	-175.2	69.9	0	0	0	0	112.7	Y94 I95 L100	Y94-T98 HydrophobicContact CD1-CG2 3.7Å; Y94-T98 HydrophobicContact CD2-CG2 4.36Å; Y94-T98 HydrophobicContact CE1-CG2 3.32Å; Y94-T98 HydrophobicContact CE2-CG2 4.04Å; Y94-T98 HydrophobicContact CG-CG2 4.19Å; Y94-T98 VanDerWaalsContact CZ-CG2 3.5Å; Y94-T98 WeakPolarHBondContact O-CG2 3.02Å; Y94-T98 PolarHBondContact O-N 3.31Å; I95-T98 PolarHBondContact O-N 2.92Å; I95-T98 PolarHBondContact O-OG1 3.24Å; T98-L100 VanDerWaalsContact C-N 3.31Å; T98-L100 HydrophobicContact CG2-CD1 4.46Å
99	I	77.2	Confident	85.2	Confident	79 Å²	79	65.6 Å²	65.6	41%	0.405	37%	0.368	S	S	.	.	S	Bend	trans	-88.9	-3.4	176.5	-51.3	166.2	0	0	0	110.8	G101 N102 C103	I99-G101 VanDerWaalsContact C-N 3.3Å; I99-G101 PolarHBondContact O-N 3.21Å; I99-N102 HydrophobicContact CG2-CB 4.1Å; I99-N102 WeakPolarHBondContact O-CA 3.39Å; I99-N102 WeakPolarHBondContact O-CB 3.49Å; I99-N102 PolarHBondContact O-N 3.13Å; I99-C103 PolarHBondContact O-N 2.95Å
100	L	78	Confident	85.3	Confident	7 Å²	7	61.3 Å²	61.3	4%	0.037	35%	0.35	C	S	.	.	H	α-helix	trans	-56.5	-39.8	-173.9	-78.2	161.7	0	0	0	113.2	L69 T98 N102 C103 F104 L107	L69-L100 HydrophobicContact CB-CD1 3.84Å; L69-L100 HydrophobicContact CD1-CD1 4.1Å; T98-L100 VanDerWaalsContact C-N 3.31Å; T98-L100 HydrophobicContact CG2-CD1 4.46Å; L100-N102 PolarHBondContact O-N 3.45Å; L100-C103 PolarHBondContact O-N 3.16Å; L100-C103 VanDerWaalsContact O-N 3.1Å; L100-F104 HydrophobicContact CD2-CD2 4.19Å; L100-F104 HydrophobicContact CD2-CE2 3.93Å; L100-F104 WeakPolarHBondContact O-CD2 3.45Å; L100-F104 PolarHBondContact O-N 3.02Å; L100-L107 HydrophobicContact CB-CD2 4.25Å
101	G	73	Confident	85.4	Confident	36 Å²	36	59.9 Å²	59.9	37%	0.371	34%	0.339	S	S	.	.	H	α-helix	trans	-61.5	-28.4	176.6	0	0	0	0	0	113.5	I99	I99-G101 VanDerWaalsContact C-N 3.3Å; I99-G101 PolarHBondContact O-N 3.21Å
102	N	76.2	Confident	85.3	Confident	140 Å²	140	63.2 Å²	63.2	75%	0.749	35%	0.352	S	S	*	.	H	α-helix	trans	-78.7	-34.2	175.5	-62.3	-16.5	0	0	0	111.6	I99 L100	I99-N102 HydrophobicContact CG2-CB 4.1Å; I99-N102 WeakPolarHBondContact O-CA 3.39Å; I99-N102 WeakPolarHBondContact O-CB 3.49Å; I99-N102 PolarHBondContact O-N 3.13Å; L100-N102 PolarHBondContact O-N 3.45Å
103	C	77.4	Confident	85.3	Confident	83 Å²	83	63.4 Å²	63.4	56%	0.561	35%	0.354	S	S	*	.	H	α-helix	trans	-72.3	-33.6	177.7	-62.8	0	0	0	0	112.2	I99 L100	I99-C103 PolarHBondContact O-N 2.95Å; L100-C103 PolarHBondContact O-N 3.16Å; L100-C103 VanDerWaalsContact O-N 3.1Å
104	F	81.5	Confident	85	Confident	54 Å²	54	62.1 Å²	62.1	24%	0.237	34%	0.342	C	S	.	.	S	Bend	trans	-122.1	91.3	-175.2	-60.7	-75.7	0	0	0	110.9	A73 L100 G106 L107	A73-F104 HydrophobicContact CB-CB 4.29Å; A73-F104 HydrophobicContact CB-CD1 4.14Å; A73-F104 HydrophobicContact CB-CD2 3.61Å; A73-F104 HydrophobicContact CB-CE1 4.38Å; A73-F104 HydrophobicContact CB-CE2 3.87Å; A73-F104 HydrophobicContact CB-CG 3.75Å; A73-F104 HydrophobicContact CB-CZ 4.25Å; L100-F104 HydrophobicContact CD2-CD2 4.19Å; L100-F104 HydrophobicContact CD2-CE2 3.93Å; L100-F104 WeakPolarHBondContact O-CD2 3.45Å; L100-F104 PolarHBondContact O-N 3.02Å; F104-G106 PolarHBondContact O-N 3.06Å; F104-L107 HydrophobicContact CB-CB 4.13Å; F104-L107 HydrophobicContact CB-CD2 4.35Å; F104-L107 VanDerWaalsContact O-CB 3.31Å; F104-L107 WeakPolarHBondContact O-CB 3.39Å; F104-L107 PolarHBondContact O-N 3.21Å; F104-L107 VanDerWaalsContact O-N 3.13Å
105	P	79.7	Confident	84.6	Confident	105 Å²	105	67.7 Å²	67.7	68%	0.682	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	123.4	-175.1	24.2	-32.9	0	0	0	111	R78	R78-P105 PolarHBondContact NH1-O 3Å
106	G	83.9	Confident	84.1	Confident	54 Å²	54	73.3 Å²	73.3	56%	0.557	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.3	1.9	-178.1	0	0	0	0	0	115	F104 K108	F104-G106 PolarHBondContact O-N 3.06Å; G106-K108 PolarHBondContact O-N 3.39Å
107	L	88.9	Confident	83.9	Confident	21 Å²	21	68.1 Å²	68.1	11%	0.11	37%	0.372	C	S	.	.			trans	-69	122.4	170.6	-178.2	66.7	0	0	0	110.4	A73 I80 L100 F104 L109	A73-L107 HydrophobicContact CB-CD1 4.23Å; A73-L107 HydrophobicContact CB-CD2 4.08Å; I80-L107 HydrophobicContact CD1-CD1 4Å; I80-L107 HydrophobicContact CG1-CD1 4.34Å; L100-L107 HydrophobicContact CB-CD2 4.25Å; F104-L107 HydrophobicContact CB-CB 4.13Å; F104-L107 HydrophobicContact CB-CD2 4.35Å; F104-L107 VanDerWaalsContact O-CB 3.31Å; F104-L107 WeakPolarHBondContact O-CB 3.39Å; F104-L107 PolarHBondContact O-N 3.21Å; F104-L107 VanDerWaalsContact O-N 3.13Å; L107-L109 HydrophobicContact CD1-CD2 4.01Å; L107-L109 HydrophobicContact CD2-CD1 4.39Å; L107-L109 HydrophobicContact CD2-CD2 4.14Å; L107-L109 HydrophobicContact CD2-CG 4.27Å; L107-L109 HydrophobicContact CG-CD2 3.98Å; L107-L109 HydrophobicContact CG-CG 4.15Å
108	K	90.8	Very high	83.9	Confident	102 Å²	102	67.8 Å²	67.8	44%	0.443	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	116.9	173.8	-58.9	-178.9	-161.7	147.4	0	109	R78 N79 I80 G106 F110	R78-K108 PolarHBondContact O-N 2.99Å; N79-K108 WeakPolarHBondContact OD1-CD 3.47Å; I80-K108 PolarHBondContact N-O 3.24Å; G106-K108 PolarHBondContact O-N 3.39Å; K108-F110 HydrophobicContact CB-CD2 4.5Å; K108-F110 HydrophobicContact CB-CE2 3.65Å; K108-F110 HydrophobicContact CB-CZ 3.98Å; K108-F110 HydrophobicContact CD-CE2 4.49Å; K108-F110 HydrophobicContact CD-CZ 4.28Å
109	L	92.2	Very high	84.3	Confident	37 Å²	37	68.2 Å²	68.2	19%	0.194	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.1	176.6	-58.5	179.3	0	0	0	108.8	L69 I80 I95 L107	L69-L109 HydrophobicContact CD1-CD1 4.27Å; L69-L109 HydrophobicContact CD2-CD2 3.95Å; I80-L109 HydrophobicContact CB-CD2 3.83Å; I80-L109 HydrophobicContact CD1-CD2 4.09Å; I80-L109 HydrophobicContact CG1-CD2 4.27Å; I95-L109 HydrophobicContact CG2-CB 4.05Å; I95-L109 HydrophobicContact CG2-CD1 4.12Å; L107-L109 HydrophobicContact CD1-CD2 4.01Å; L107-L109 HydrophobicContact CD2-CD1 4.39Å; L107-L109 HydrophobicContact CD2-CD2 4.14Å; L107-L109 HydrophobicContact CD2-CG 4.27Å; L107-L109 HydrophobicContact CG-CD2 3.98Å; L107-L109 HydrophobicContact CG-CG 4.15Å
110	F	92	Very high	85	Confident	87 Å²	87	65 Å²	65	38%	0.382	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	138.7	175.7	-58.4	-83.4	0	0	0	109	I80 L81 I82 K108 F132	I80-F110 PolarHBondContact O-N 3.35Å; L81-F110 CarbonylContact C-O 3.57Å; L81-F110 WeakPolarHBondContact CA-O 3.42Å; L81-F110 HydrophobicContact CD1-CB 3.64Å; I82-F110 PolarHBondContact N-O 3.41Å; K108-F110 HydrophobicContact CB-CD2 4.5Å; K108-F110 HydrophobicContact CB-CE2 3.65Å; K108-F110 HydrophobicContact CB-CZ 3.98Å; K108-F110 HydrophobicContact CD-CE2 4.49Å; K108-F110 HydrophobicContact CD-CZ 4.28Å; F110-F132 AromaticContact CD2-CE2 3.55Å; F110-F132 HydrophobicContact CD2-CE2 3.55Å; F110-F132 HydrophobicContact CD2-CZ 4.13Å; F110-F132 AromaticContact CE2-CE2 3.8Å; F110-F132 HydrophobicContact CE2-CE2 3.8Å; F110-F132 HydrophobicContact CE2-CZ 4.49Å; F110-F132 HydrophobicContact CG-CE2 4.21Å
111	V	92.8	Very high	85.6	Confident	23 Å²	23	64.7 Å²	64.7	14%	0.139	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130.9	173.8	-168.2	0	0	0	0	107.8	I82 T84 Y88 V91 I95	I82-V111 WeakPolarHBondContact O-CA 3.44Å; T84-V111 HydrophobicContact CG2-CG1 4.05Å; Y88-V111 HydrophobicContact CD2-CG1 3.74Å; Y88-V111 HydrophobicContact CE2-CB 4.21Å; Y88-V111 HydrophobicContact CE2-CG1 3.92Å; V91-V111 HydrophobicContact CG1-CG1 4.1Å; V91-V111 HydrophobicContact CG1-CG2 4.43Å; I95-V111 HydrophobicContact CD1-CG2 3.14Å; I95-V111 HydrophobicContact CG1-CG2 4.4Å
112	R	91.4	Very high	86.5	Confident	69 Å²	69	64.7 Å²	64.7	26%	0.26	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129	177.3	-165.5	163	170.2	132.3	-13.6	109.5	L81 I82 Y83 T84 V114 D126 S129	L81-R112 HydrophobicContact CD1-CB 4.13Å; I82-R112 PolarHBondContact O-N 3.15Å; Y83-R112 HydrophobicContact CD1-CB 4.44Å; Y83-R112 HydrophobicContact CE1-CB 4.29Å; Y83-R112 HydrophobicContact CE1-CG 4.22Å; T84-R112 PolarHBondContact N-O 3.02Å; T84-R112 PolarHBondContact OG1-O 3.27Å; R112-V114 HydrophobicContact CG-CG2 4.15Å; R112-D126 WeakPolarHBondContact CD-OD2 3.27Å; R112-D126 IonicContact CZ-OD1 3.91Å; R112-D126 IonicContact CZ-OD2 3.54Å; R112-D126 VanDerWaalsContact CZ-OD2 3.26Å; R112-D126 IonicContact NE-OD1 3.93Å; R112-D126 IonicContact NE-OD2 3.6Å; R112-D126 PolarHBondContact NE-OD2 3.43Å; R112-D126 VanDerWaalsContact NH2-CG 3.28Å; R112-D126 PolarHBondContact NH2-O 2.59Å; R112-D126 IonicContact NH2-OD1 3.05Å; R112-D126 PolarHBondContact NH2-OD1 2.71Å; R112-D126 IonicContact NH2-OD2 3.46Å; R112-D126 PolarHBondContact NH2-OD2 3.21Å; R112-D126 VanDerWaalsContact NH2-OD2 3.17Å; R112-S129 PolarHBondContact NH2-OG 2.89Å
113	N	91.4	Very high	87.3	Confident	55 Å²	55	58.1 Å²	58.1	29%	0.294	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	126.6	172.1	-171.5	25.3	0	0	0	108.5	T84 I85 Y88 E115	T84-N113 WeakPolarHBondContact O-CA 3.31Å; I85-N113 PolarHBondContact O-OD1 3.49Å; Y88-N113 WeakPolarHBondContact CB-OD1 3.41Å; Y88-N113 HydrophobicContact CD1-CB 3.96Å; Y88-N113 HydrophobicContact CD2-CB 3.6Å; Y88-N113 HydrophobicContact CE1-CB 4.38Å; Y88-N113 HydrophobicContact CE2-CB 4.06Å; Y88-N113 HydrophobicContact CG-CB 3.54Å; N113-E115 PolarHBondContact ND2-OE1 3.45Å
114	V	85.3	Confident	88	Confident	16 Å²	16	54.1 Å²	54.1	10%	0.097	28%	0.283	C	S	.	.			trans	-133.5	97.3	174.7	-147.2	0	0	0	0	109.8	Y83 T84 I85 R112 N116 C117 D126	Y83-V114 HydrophobicContact CD1-CG2 3.53Å; Y83-V114 HydrophobicContact CE1-CG2 3.58Å; T84-V114 PolarHBondContact O-N 3.43Å; I85-V114 WeakPolarHBondContact CA-O 3.3Å; R112-V114 HydrophobicContact CG-CG2 4.15Å; V114-N116 VanDerWaalsContact C-N 3.32Å; V114-N116 PolarHBondContact O-N 3.34Å; V114-C117 HydrophobicContact CB-CB 4.18Å; V114-C117 HydrophobicContact CG1-CB 4.16Å; V114-C117 WeakPolarHBondContact CG1-SG 3.43Å; V114-D126 HydrophobicContact CG1-CB 4.26Å
115	E	80.7	Confident	88.5	Confident	143 Å²	143	53.4 Å²	53.4	67%	0.668	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-24.3	-171	-61.6	-175.9	171.2	0	0	113	N113	N113-E115 PolarHBondContact ND2-OE1 3.45Å
116	N	80.9	Confident	89.1	Confident	136 Å²	136	49.8 Å²	49.8	73%	0.727	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-0.8	-174.3	-65.1	-16.4	0	0	0	114.1	V114 H118	V114-N116 VanDerWaalsContact C-N 3.32Å; V114-N116 PolarHBondContact O-N 3.34Å; N116-H118 PolarHBondContact O-CE1 3.03Å; N116-H118 PolarHBondContact O-ND1 3.43Å
117	C	83	Confident	89.5	Confident	9 Å²	9	47.3 Å²	47.3	6%	0.061	23%	0.228	C	C	.	.			trans	-87.9	134	179.1	-65.2	0	0	0	0	110.6	I85 V114 D122 I123	I85-C117 WeakPolarHBondContact CD1-O 3.39Å; I85-C117 WeakPolarHBondContact CG2-O 3.36Å; V114-C117 HydrophobicContact CB-CB 4.18Å; V114-C117 HydrophobicContact CG1-CB 4.16Å; V114-C117 WeakPolarHBondContact CG1-SG 3.43Å; C117-D122 HydrophobicContact CB-CB 3.68Å; C117-D122 VanDerWaalsContact SG-CB 3.59Å; C117-I123 HydrophobicContact CB-CG1 4.15Å
118	H	84	Confident	89.6	Confident	148 Å²	148	49.8 Å²	49.8	69%	0.685	24%	0.239	S	C	*	.			trans	-118.8	-26	-180	-61.6	74.1	0	0	0	112.4	N116 D122	N116-H118 PolarHBondContact O-CE1 3.03Å; N116-H118 PolarHBondContact O-ND1 3.43Å; H118-D122 PolarHBondContact N-OD2 3.22Å
119	N	89.4	Confident	89.4	Confident	28 Å²	28	48.6 Å²	48.6	15%	0.15	24%	0.243	C	C	.	.	S	Bend	trans	-128.8	180	-176	62.3	41	0	0	0	111.4	G121 D122 I123 E258	N119-G121 PolarHBondContact OD1-N 2.88Å; N119-G121 VanDerWaalsContact OD1-N 3.09Å; N119-D122 PolarHBondContact OD1-N 3.3Å; N119-D122 PolarHBondContact OD1-OD1 2.93Å; N119-D122 PolarHBondContact OD1-OD2 3.27Å; N119-I123 WeakPolarHBondContact O-CG1 3.49Å; N119-I123 PolarHBondContact O-N 3.06Å; N119-E258 HydrophobicContact CB-CB 4.23Å; N119-E258 WeakPolarHBondContact CB-O 3.47Å
120	L	91.8	Very high	89.1	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-40	179.3	177.5	66.1	0	0	0	111.4	I37 D122 I123 M124 L141 E258 M260	I37-L120 HydrophobicContact CD1-CD1 3.17Å; L120-D122 VanDerWaalsContact C-N 3.32Å; L120-D122 PolarHBondContact O-N 3.14Å; L120-I123 WeakPolarHBondContact O-CB 3.29Å; L120-I123 PolarHBondContact O-N 3.19Å; L120-I123 VanDerWaalsContact O-N 3.12Å; L120-M124 HydrophobicContact CD1-CG 4.32Å; L120-M124 HydrophobicContact CG-CG 4.32Å; L120-M124 WeakPolarHBondContact O-CG 3.49Å; L120-M124 PolarHBondContact O-N 2.95Å; L120-L141 HydrophobicContact CD1-CD2 4.24Å; L120-E258 PolarHBondContact N-O 2.74Å; L120-E258 VanDerWaalsContact N-O 3.16Å; L120-M260 HydrophobicContact CD2-CB 3.72Å; L120-M260 HydrophobicContact CD2-CE 4.1Å
121	G	92.3	Very high	88.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.1	-42.9	-179.9	0	0	0	0	0	112.9	N119 I123 M124 R125 F251 E258	N119-G121 PolarHBondContact OD1-N 2.88Å; N119-G121 VanDerWaalsContact OD1-N 3.09Å; G121-I123 VanDerWaalsContact C-N 3.32Å; G121-I123 PolarHBondContact O-N 2.92Å; G121-M124 PolarHBondContact O-N 3.23Å; G121-R125 VanDerWaalsContact O-CG 3.31Å; G121-R125 WeakPolarHBondContact O-CG 3.48Å; G121-R125 PolarHBondContact O-N 3.36Å; G121-F251 VanDerWaalsContact CA-CD1 3.42Å; G121-E258 PolarHBondContact N-O 3.22Å
122	D	91.8	Very high	88	Confident	36 Å²	36	51.6 Å²	51.6	19%	0.193	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-40.4	176.1	-60.7	-28.8	0	0	0	112	C117 H118 N119 L120 M124 R125 D126	C117-D122 HydrophobicContact CB-CB 3.68Å; C117-D122 VanDerWaalsContact SG-CB 3.59Å; H118-D122 PolarHBondContact N-OD2 3.22Å; N119-D122 PolarHBondContact OD1-N 3.3Å; N119-D122 PolarHBondContact OD1-OD1 2.93Å; N119-D122 PolarHBondContact OD1-OD2 3.27Å; L120-D122 VanDerWaalsContact C-N 3.32Å; L120-D122 PolarHBondContact O-N 3.14Å; D122-M124 VanDerWaalsContact C-N 3.32Å; D122-M124 PolarHBondContact O-N 3.01Å; D122-R125 PolarHBondContact O-N 3.22Å; D122-R125 IonicContact OD1-NH1 2.81Å; D122-R125 PolarHBondContact OD1-NH1 3.38Å; D122-D126 PolarHBondContact O-N 3Å
123	I	92.2	Very high	87.6	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-62.9	-41.7	176.4	-68.4	170	0	0	0	110.4	I37 L40 Y83 C117 N119 L120 G121 D126 L127	I37-I123 HydrophobicContact CD1-CD1 4.47Å; I37-I123 HydrophobicContact CG1-CD1 4.38Å; I37-I123 HydrophobicContact CG2-CD1 3.74Å; L40-I123 HydrophobicContact CD2-CD1 4.47Å; Y83-I123 HydrophobicContact CD1-CG1 4.41Å; Y83-I123 HydrophobicContact CD1-CG2 3.67Å; Y83-I123 HydrophobicContact CD2-CG2 3.87Å; Y83-I123 HydrophobicContact CE1-CG2 3.94Å; Y83-I123 HydrophobicContact CE2-CG2 4.14Å; Y83-I123 HydrophobicContact CG-CG2 3.62Å; C117-I123 HydrophobicContact CB-CG1 4.15Å; N119-I123 WeakPolarHBondContact O-CG1 3.49Å; N119-I123 PolarHBondContact O-N 3.06Å; L120-I123 WeakPolarHBondContact O-CB 3.29Å; L120-I123 PolarHBondContact O-N 3.19Å; L120-I123 VanDerWaalsContact O-N 3.12Å; G121-I123 VanDerWaalsContact C-N 3.32Å; G121-I123 PolarHBondContact O-N 2.92Å; I123-D126 PolarHBondContact O-N 2.66Å; I123-L127 VanDerWaalsContact O-CB 3.27Å; I123-L127 WeakPolarHBondContact O-CB 3.32Å; I123-L127 PolarHBondContact O-N 2.99Å
124	M	92.9	Very high	87	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.4	-37.5	-180	-65	-63	-80.5	0	0	112.1	L120 G121 D122 L127 E128 F139 I247 P248 F251	L120-M124 HydrophobicContact CD1-CG 4.32Å; L120-M124 HydrophobicContact CG-CG 4.32Å; L120-M124 WeakPolarHBondContact O-CG 3.49Å; L120-M124 PolarHBondContact O-N 2.95Å; G121-M124 PolarHBondContact O-N 3.23Å; D122-M124 VanDerWaalsContact C-N 3.32Å; D122-M124 PolarHBondContact O-N 3.01Å; M124-L127 WeakPolarHBondContact O-CB 3.33Å; M124-L127 PolarHBondContact O-N 3.13Å; M124-E128 PolarHBondContact O-N 2.95Å; M124-F139 HydrophobicContact CE-CZ 4.04Å; M124-I247 HydrophobicContact CE-CB 4.12Å; M124-I247 HydrophobicContact CE-CG2 3.37Å; M124-P248 HydrophobicContact CE-CG 4.05Å; M124-F251 HydrophobicContact CB-CB 3.89Å; M124-F251 HydrophobicContact CB-CD2 3.58Å; M124-F251 HydrophobicContact CB-CE2 4.2Å; M124-F251 HydrophobicContact CB-CG 3.77Å; M124-F251 HydrophobicContact CE-CD2 4.27Å; M124-F251 HydrophobicContact CE-CE2 4.28Å; M124-F251 HydrophobicContact CG-CD2 3.78Å; M124-F251 HydrophobicContact CG-CE2 3.87Å; M124-F251 HydrophobicContact CG-CG 4.31Å; M124-F251 HydrophobicContact CG-CZ 4.49Å
125	R	91.8	Very high	86.7	Confident	38 Å²	38	50.9 Å²	50.9	14%	0.143	27%	0.273	C	S	.	.	H	α-helix	trans	-64.2	-44.1	173.1	-66.8	167.9	-167.6	136.5	8.7	111.9	G121 D122 L127 E128 S129 F251 N254 F255 Y257	G121-R125 VanDerWaalsContact O-CG 3.31Å; G121-R125 WeakPolarHBondContact O-CG 3.48Å; G121-R125 PolarHBondContact O-N 3.36Å; D122-R125 PolarHBondContact O-N 3.22Å; D122-R125 IonicContact OD1-NH1 2.81Å; D122-R125 PolarHBondContact OD1-NH1 3.38Å; R125-L127 VanDerWaalsContact C-N 3.29Å; R125-L127 PolarHBondContact O-N 2.76Å; R125-E128 PolarHBondContact O-N 2.97Å; R125-S129 PolarHBondContact O-N 2.83Å; R125-S129 VanDerWaalsContact O-N 3.16Å; R125-F251 HydrophobicContact CG-CB 4.3Å; R125-F251 PolarHBondContact NE-O 3.02Å; R125-F251 PolarHBondContact NH2-O 2.84Å; R125-N254 PolarHBondContact NH2-O 3Å; R125-F255 VanDerWaalsContact NH2-CA 3.25Å; R125-F255 PolarHBondContact NH2-O 3.41Å; R125-Y257 PolarHBondContact NH2-O 2.78Å
126	D	91.7	Very high	87	Confident	30 Å²	30	44.6 Å²	44.6	16%	0.16	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-34.9	175.4	178.4	72.8	0	0	0	111.5	Y83 R112 V114 D122 I123 S129 S130	Y83-D126 VanDerWaalsContact CE1-OD2 3.24Å; Y83-D126 WeakPolarHBondContact CE1-OD2 3.35Å; Y83-D126 PolarHBondContact OH-OD2 2.83Å; R112-D126 WeakPolarHBondContact CD-OD2 3.27Å; R112-D126 IonicContact CZ-OD1 3.91Å; R112-D126 IonicContact CZ-OD2 3.54Å; R112-D126 VanDerWaalsContact CZ-OD2 3.26Å; R112-D126 IonicContact NE-OD1 3.93Å; R112-D126 IonicContact NE-OD2 3.6Å; R112-D126 PolarHBondContact NE-OD2 3.43Å; R112-D126 VanDerWaalsContact NH2-CG 3.28Å; R112-D126 PolarHBondContact NH2-O 2.59Å; R112-D126 IonicContact NH2-OD1 3.05Å; R112-D126 PolarHBondContact NH2-OD1 2.71Å; R112-D126 IonicContact NH2-OD2 3.46Å; R112-D126 PolarHBondContact NH2-OD2 3.21Å; R112-D126 VanDerWaalsContact NH2-OD2 3.17Å; V114-D126 HydrophobicContact CG1-CB 4.26Å; D122-D126 PolarHBondContact O-N 3Å; I123-D126 PolarHBondContact O-N 2.66Å; D126-S129 PolarHBondContact O-N 2.92Å; D126-S129 PolarHBondContact O-OG 2.87Å; D126-S130 PolarHBondContact O-N 2.88Å
127	L	91.7	Very high	87.2	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-62.7	-40.4	174.1	-177	153.8	0	0	0	112.2	V35 Y83 I123 M124 R125 S129 S130 L133 P248	V35-L127 HydrophobicContact CB-CD1 4.44Å; V35-L127 HydrophobicContact CG1-CD1 3.95Å; V35-L127 HydrophobicContact CG2-CD1 3.72Å; Y83-L127 HydrophobicContact CE2-CB 4.35Å; Y83-L127 HydrophobicContact CE2-CD1 4.12Å; Y83-L127 WeakPolarHBondContact OH-CA 3.35Å; Y83-L127 WeakPolarHBondContact OH-CB 3.47Å; Y83-L127 PolarHBondContact OH-N 3.08Å; I123-L127 VanDerWaalsContact O-CB 3.27Å; I123-L127 WeakPolarHBondContact O-CB 3.32Å; I123-L127 PolarHBondContact O-N 2.99Å; M124-L127 WeakPolarHBondContact O-CB 3.33Å; M124-L127 PolarHBondContact O-N 3.13Å; R125-L127 VanDerWaalsContact C-N 3.29Å; R125-L127 PolarHBondContact O-N 2.76Å; L127-S129 VanDerWaalsContact C-N 3.35Å; L127-S130 WeakPolarHBondContact O-CB 3.49Å; L127-S130 PolarHBondContact O-N 2.97Å; L127-S130 VanDerWaalsContact O-N 3.16Å; L127-S130 PolarHBondContact O-OG 3.46Å; L127-L133 HydrophobicContact CD1-CD1 4.21Å; L127-L133 HydrophobicContact CD2-CD1 3.27Å; L127-L133 HydrophobicContact CD2-CG 3.8Å; L127-L133 HydrophobicContact CG-CD1 4.24Å; L127-P248 HydrophobicContact CD2-CB 3.85Å; L127-P248 HydrophobicContact CD2-CG 3.51Å
128	E	90.5	Very high	87.7	Confident	73 Å²	73	39.4 Å²	39.4	34%	0.341	22%	0.218	S	C	.	.	H	α-helix	trans	-63.2	-44	174.1	-173.6	56	-161.4	0	0	110.9	M124 R125 S130 E131 P248 P249	M124-E128 PolarHBondContact O-N 2.95Å; R125-E128 PolarHBondContact O-N 2.97Å; E128-S130 PolarHBondContact O-N 2.89Å; E128-S130 VanDerWaalsContact O-N 3.14Å; E128-E131 PolarHBondContact O-N 2.89Å; E128-P248 HydrophobicContact CB-CB 3.9Å; E128-P249 HydrophobicContact CG-CG 4.47Å
129	S	88.6	Confident	88.2	Confident	77 Å²	77	32.4 Å²	32.4	54%	0.538	19%	0.186	S	C	.	.	H	α-helix	trans	-63.9	-20.6	176	82.3	0	0	0	0	114.1	R112 R125 D126 L127 E131	R112-S129 PolarHBondContact NH2-OG 2.89Å; R125-S129 PolarHBondContact O-N 2.83Å; R125-S129 VanDerWaalsContact O-N 3.16Å; D126-S129 PolarHBondContact O-N 2.92Å; D126-S129 PolarHBondContact O-OG 2.87Å; L127-S129 VanDerWaalsContact C-N 3.35Å; S129-E131 VanDerWaalsContact C-N 3.31Å; S129-E131 PolarHBondContact O-N 3.43Å
130	S	84.4	Confident	88.5	Confident	19 Å²	19	31.1 Å²	31.1	13%	0.133	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-20.4	-176.3	78	0	0	0	0	114.3	D126 L127 E128 F132	D126-S130 PolarHBondContact O-N 2.88Å; L127-S130 WeakPolarHBondContact O-CB 3.49Å; L127-S130 PolarHBondContact O-N 2.97Å; L127-S130 VanDerWaalsContact O-N 3.16Å; L127-S130 PolarHBondContact O-OG 3.46Å; E128-S130 PolarHBondContact O-N 2.89Å; E128-S130 VanDerWaalsContact O-N 3.14Å; S130-F132 PolarHBondContact O-N 3.13Å; S130-F132 VanDerWaalsContact OG-CB 3.25Å; S130-F132 WeakPolarHBondContact OG-CB 3.47Å; S130-F132 PolarHBondContact OG-N 3.07Å; S130-F132 VanDerWaalsContact OG-N 3.07Å
131	E	79.1	Confident	88.8	Confident	151 Å²	151	30.7 Å²	30.7	71%	0.706	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	15.5	-167.2	-60.6	-178.7	179.6	0	0	114	E128 S129 L133 C134	E128-E131 PolarHBondContact O-N 2.89Å; S129-E131 VanDerWaalsContact C-N 3.31Å; S129-E131 PolarHBondContact O-N 3.43Å; E131-L133 PolarHBondContact O-N 2.9Å; E131-C134 HydrophobicContact CB-CB 4.28Å; E131-C134 WeakPolarHBondContact O-CB 3.4Å; E131-C134 PolarHBondContact O-N 2.79Å
132	F	84.1	Confident	88.9	Confident	41 Å²	41	30.8 Å²	30.8	18%	0.18	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-33.4	-179.3	175.3	-102.9	0	0	0	112.1	Y33 N79 L81 F110 S130 C134	Y33-F132 AromaticContact CD1-CE1 3.84Å; Y33-F132 HydrophobicContact CD1-CE1 3.84Å; Y33-F132 AromaticContact CD1-CZ 3.89Å; Y33-F132 HydrophobicContact CD1-CZ 3.89Å; Y33-F132 HydrophobicContact CE1-CE1 4.46Å; Y33-F132 HydrophobicContact CE1-CZ 4.24Å; N79-F132 HydrophobicContact CB-CZ 4.31Å; L81-F132 HydrophobicContact CB-CD1 4.06Å; L81-F132 HydrophobicContact CB-CE1 3.63Å; L81-F132 HydrophobicContact CB-CE2 4.33Å; L81-F132 HydrophobicContact CB-CZ 3.78Å; L81-F132 HydrophobicContact CD2-CB 4.13Å; L81-F132 HydrophobicContact CD2-CD1 3.59Å; L81-F132 HydrophobicContact CD2-CD2 4.37Å; L81-F132 HydrophobicContact CD2-CE1 4.07Å; L81-F132 HydrophobicContact CD2-CG 3.76Å; L81-F132 HydrophobicContact CG-CD1 4.44Å; L81-F132 HydrophobicContact CG-CE1 4.48Å; F110-F132 AromaticContact CD2-CE2 3.55Å; F110-F132 HydrophobicContact CD2-CE2 3.55Å; F110-F132 HydrophobicContact CD2-CZ 4.13Å; F110-F132 AromaticContact CE2-CE2 3.8Å; F110-F132 HydrophobicContact CE2-CE2 3.8Å; F110-F132 HydrophobicContact CE2-CZ 4.49Å; F110-F132 HydrophobicContact CG-CE2 4.21Å; S130-F132 PolarHBondContact O-N 3.13Å; S130-F132 VanDerWaalsContact OG-CB 3.25Å; S130-F132 WeakPolarHBondContact OG-CB 3.47Å; S130-F132 PolarHBondContact OG-N 3.07Å; S130-F132 VanDerWaalsContact OG-N 3.07Å; F132-C134 VanDerWaalsContact C-N 3.31Å
133	L	81.6	Confident	89	Confident	19 Å²	19	29.3 Å²	29.3	10%	0.099	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	12.6	177.3	-60.7	-175.4	0	0	0	113.1	L127 E131 G135 V136 F139 P248	L127-L133 HydrophobicContact CD1-CD1 4.21Å; L127-L133 HydrophobicContact CD2-CD1 3.27Å; L127-L133 HydrophobicContact CD2-CG 3.8Å; L127-L133 HydrophobicContact CG-CD1 4.24Å; E131-L133 PolarHBondContact O-N 2.9Å; L133-G135 PolarHBondContact O-N 3.26Å; L133-G135 VanDerWaalsContact O-N 3.1Å; L133-V136 HydrophobicContact CB-CB 4.39Å; L133-V136 HydrophobicContact CD2-CB 4.42Å; L133-V136 HydrophobicContact CD2-CG1 4.4Å; L133-V136 WeakPolarHBondContact O-CB 3.37Å; L133-V136 PolarHBondContact O-N 3.35Å; L133-F139 HydrophobicContact CD1-CD1 3.35Å; L133-F139 HydrophobicContact CD1-CD2 4.41Å; L133-F139 HydrophobicContact CD1-CE1 3.27Å; L133-F139 HydrophobicContact CD1-CE2 4.34Å; L133-F139 HydrophobicContact CD1-CG 3.94Å; L133-F139 HydrophobicContact CD1-CZ 3.78Å; L133-F139 HydrophobicContact CD2-CB 4.13Å; L133-F139 HydrophobicContact CD2-CD1 4.17Å; L133-F139 HydrophobicContact CD2-CG 4.14Å; L133-F139 HydrophobicContact CG-CD1 4.42Å; L133-P248 HydrophobicContact CD1-CG 4.33Å
134	C	79.4	Confident	89	Confident	65 Å²	65	29.3 Å²	29.3	44%	0.439	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	118.4	179.8	-165.6	0	0	0	0	110.5	F25 E131 F132 V136	F25-C134 HydrophobicContact CE1-CB 4.28Å; F25-C134 HydrophobicContact CZ-CB 4.12Å; F25-C134 VanDerWaalsContact CZ-SG 3.54Å; E131-C134 HydrophobicContact CB-CB 4.28Å; E131-C134 WeakPolarHBondContact O-CB 3.4Å; E131-C134 PolarHBondContact O-N 2.79Å; F132-C134 VanDerWaalsContact C-N 3.31Å; C134-V136 VanDerWaalsContact C-N 3.34Å
135	G	79.3	Confident	88.9	Confident	41 Å²	41	29.9 Å²	29.9	42%	0.423	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	15.9	-175.9	0	0	0	0	0	114.8	L133	L133-G135 PolarHBondContact O-N 3.26Å; L133-G135 VanDerWaalsContact O-N 3.1Å
136	V	86.1	Confident	88.9	Confident	10 Å²	10	28 Å²	28	6%	0.061	17%	0.166	C	C	.	.			trans	-106.1	125.1	172.6	-177.9	0	0	0	0	108.6	Y33 L133 C134 D138 N245	Y33-V136 HydrophobicContact CD1-CG2 4.01Å; Y33-V136 HydrophobicContact CD2-CB 4.48Å; Y33-V136 HydrophobicContact CD2-CG1 3.69Å; Y33-V136 HydrophobicContact CD2-CG2 3.89Å; Y33-V136 HydrophobicContact CE1-CG2 3.73Å; Y33-V136 HydrophobicContact CE2-CG1 4.21Å; Y33-V136 HydrophobicContact CE2-CG2 3.62Å; Y33-V136 HydrophobicContact CG-CG1 3.89Å; Y33-V136 HydrophobicContact CG-CG2 4.09Å; L133-V136 HydrophobicContact CB-CB 4.39Å; L133-V136 HydrophobicContact CD2-CB 4.42Å; L133-V136 HydrophobicContact CD2-CG1 4.4Å; L133-V136 WeakPolarHBondContact O-CB 3.37Å; L133-V136 PolarHBondContact O-N 3.35Å; C134-V136 VanDerWaalsContact C-N 3.34Å; V136-D138 WeakPolarHBondContact CG1-O 3.36Å; V136-N245 WeakPolarHBondContact O-CB 3.27Å
137	S	86.1	Confident	88.7	Confident	32 Å²	32	26.8 Å²	26.8	22%	0.224	16%	0.159	C	C	.	.			trans	-73.4	-44.8	178.6	65.1	0	0	0	0	112.8	R163 N245	S137-R163 PolarHBondContact O-NH1 2.99Å; S137-N245 WeakPolarHBondContact O-CB 3.5Å; S137-N245 PolarHBondContact O-N 3.5Å
138	D	92.7	Very high	88.5	Confident	5 Å²	5	27 Å²	27	3%	0.027	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	143.6	-168.1	-50	-71.7	0	0	0	111.4	V136 H159 K160 R163 C243	V136-D138 WeakPolarHBondContact CG1-O 3.36Å; D138-H159 IonicContact OD1-CD2 2.59Å; D138-H159 PolarHBondContact OD1-CD2 3.19Å; D138-H159 IonicContact OD1-NE2 3.47Å; D138-K160 HydrophobicContact CB-CG 4.41Å; D138-K160 WeakPolarHBondContact OD2-CG 3.32Å; D138-R163 WeakPolarHBondContact OD1-CD 3.42Å; D138-R163 IonicContact OD1-CZ 3.19Å; D138-R163 IonicContact OD1-NE 3.75Å; D138-R163 IonicContact OD1-NH1 2.98Å; D138-R163 PolarHBondContact OD1-NH1 3.21Å; D138-C243 WeakPolarHBondContact CA-O 3.34Å
139	F	94.9	Very high	88.2	Confident	1 Å²	1	25 Å²	25	0%	0.004	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	155	177.3	65.4	-81	0	0	0	111.3	Y33 V35 M124 L133 L141 C243 P248	Y33-F139 WeakPolarHBondContact O-CA 3.35Å; V35-F139 HydrophobicContact CB-CD2 4.13Å; V35-F139 HydrophobicContact CB-CE2 4.32Å; V35-F139 HydrophobicContact CG2-CD2 3.55Å; V35-F139 HydrophobicContact CG2-CE2 3.9Å; V35-F139 HydrophobicContact CG2-CG 4.39Å; M124-F139 HydrophobicContact CE-CZ 4.04Å; L133-F139 HydrophobicContact CD1-CD1 3.35Å; L133-F139 HydrophobicContact CD1-CD2 4.41Å; L133-F139 HydrophobicContact CD1-CE1 3.27Å; L133-F139 HydrophobicContact CD1-CE2 4.34Å; L133-F139 HydrophobicContact CD1-CG 3.94Å; L133-F139 HydrophobicContact CD1-CZ 3.78Å; L133-F139 HydrophobicContact CD2-CB 4.13Å; L133-F139 HydrophobicContact CD2-CD1 4.17Å; L133-F139 HydrophobicContact CD2-CG 4.14Å; L133-F139 HydrophobicContact CG-CD1 4.42Å; F139-L141 HydrophobicContact CE2-CB 4.4Å; F139-C243 HydrophobicContact CD1-CB 4.1Å; F139-C243 WeakPolarHBondContact CD1-O 3.28Å; F139-C243 HydrophobicContact CD2-CB 4.24Å; F139-C243 HydrophobicContact CE1-CB 3.53Å; F139-C243 HydrophobicContact CE2-CB 3.7Å; F139-C243 HydrophobicContact CG-CB 4.45Å; F139-C243 HydrophobicContact CZ-CB 3.32Å; F139-C243 PolarHBondContact N-O 2.96Å; F139-C243 PolarHBondContact O-N 3.03Å; F139-P248 HydrophobicContact CE1-CG 4.36Å; F139-P248 HydrophobicContact CZ-CG 4.28Å
140	L	96.5	Very high	88.1	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	127.6	172.5	-179	75	0	0	0	109.6	Y33 A34 V35 L72 F77 A142 L152 L174 L240 I242	Y33-L140 PolarHBondContact O-N 3.17Å; A34-L140 CarbonylContact C-O 3.55Å; A34-L140 VanDerWaalsContact CA-O 3.29Å; A34-L140 WeakPolarHBondContact CA-O 3.45Å; A34-L140 HydrophobicContact CB-CB 4.16Å; A34-L140 HydrophobicContact CB-CD2 4.42Å; V35-L140 PolarHBondContact N-O 3.41Å; L72-L140 HydrophobicContact CD2-CD2 3.57Å; F77-L140 HydrophobicContact CE1-CB 3.74Å; F77-L140 HydrophobicContact CE1-CD2 4.03Å; F77-L140 HydrophobicContact CE2-CD2 4.29Å; F77-L140 HydrophobicContact CZ-CB 4.09Å; F77-L140 HydrophobicContact CZ-CD2 3.75Å; F77-L140 HydrophobicContact CZ-CG 4.46Å; L140-A142 HydrophobicContact CD2-CB 4.48Å; L140-L152 HydrophobicContact CD2-CB 4.41Å; L140-L152 HydrophobicContact CD2-CD1 3.78Å; L140-L174 HydrophobicContact CD1-CD1 4.08Å; L140-L240 HydrophobicContact CD1-CD1 4Å; L140-L240 HydrophobicContact CG-CD1 4.48Å; L140-I242 HydrophobicContact CD1-CG1 4.17Å
141	L	96.3	Very high	88.3	Confident	4 Å²	4	23.5 Å²	23.5	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.3	167.3	-176.3	67.2	0	0	0	109	V35 I37 L120 F139 S241 M260	V35-L141 HydrophobicContact CB-CD1 4.1Å; V35-L141 HydrophobicContact CG1-CD1 4.04Å; I37-L141 HydrophobicContact CD1-CD1 3.71Å; I37-L141 HydrophobicContact CD1-CG 4.45Å; I37-L141 HydrophobicContact CG1-CD1 4.2Å; L120-L141 HydrophobicContact CD1-CD2 4.24Å; F139-L141 HydrophobicContact CE2-CB 4.4Å; L141-S241 PolarHBondContact N-O 3.21Å; L141-S241 PolarHBondContact O-N 2.91Å; L141-S241 VanDerWaalsContact O-O 3.11Å; L141-M260 HydrophobicContact CD2-CE 3.58Å
142	A	95.5	Very high	89	Confident	2 Å²	2	16.5 Å²	16.5	2%	0.017	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	154.4	-178.8	0	0	0	0	0	112.4	V35 L36 I37 L140 L146 L240	V35-A142 PolarHBondContact O-N 3.21Å; L36-A142 VanDerWaalsContact CA-O 3.28Å; L36-A142 WeakPolarHBondContact CA-O 3.49Å; L36-A142 HydrophobicContact CD2-CB 3.74Å; I37-A142 PolarHBondContact N-O 3.17Å; L140-A142 HydrophobicContact CD2-CB 4.48Å; A142-L146 HydrophobicContact CB-CD2 4.12Å; A142-L240 HydrophobicContact CB-CD1 3.55Å
143	P	93.7	Very high	89.4	Confident	5 Å²	5	14.7 Å²	14.7	3%	0.032	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	148.4	169.7	32.2	-35.8	0	0	0	110.7	D145 L146 I238	P143-D145 PolarHBondContact O-N 2.99Å; P143-L146 HydrophobicContact CG-CB 4.23Å; P143-L146 WeakPolarHBondContact O-CB 3.24Å; P143-L146 PolarHBondContact O-N 3.28Å; P143-I238 WeakPolarHBondContact CG-O 3.47Å
144	A	92.3	Very high	89.9	Confident	1 Å²	1	20.9 Å²	20.9	1%	0.008	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-17.6	-178	0	0	0	0	0	113.9	I37 A38 C55 L65 T68	I37-A144 WeakPolarHBondContact O-CB 3.47Å; I37-A144 PolarHBondContact O-N 3.41Å; A38-A144 HydrophobicContact CB-CB 3.84Å; C55-A144 HydrophobicContact CB-CB 3.8Å; L65-A144 HydrophobicContact CD1-CB 4.14Å; T68-A144 WeakPolarHBondContact CB-O 3.24Å; T68-A144 PolarHBondContact OG1-O 3.25Å
145	D	90.7	Very high	90.6	Very high	12 Å²	12	19.1 Å²	19.1	6%	0.064	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	25.8	179.8	70.9	-42.1	0	0	0	113.5	L64 P143 Q291 A292 A293	L64-D145 HydrophobicContact CB-CB 4.27Å; L64-D145 HydrophobicContact CD1-CB 4.09Å; P143-D145 PolarHBondContact O-N 2.99Å; D145-Q291 WeakPolarHBondContact OD1-CG 3.36Å; D145-Q291 PolarHBondContact OD1-NE2 3.5Å; D145-Q291 WeakPolarHBondContact OD2-CG 3.38Å; D145-A292 VanDerWaalsContact O-CB 3.27Å; D145-A292 WeakPolarHBondContact O-CB 3.36Å; D145-A292 PolarHBondContact O-N 2.99Å; D145-A292 PolarHBondContact OD2-N 3.42Å; D145-A293 PolarHBondContact OD2-N 2.83Å
146	L	91.3	Very high	91.4	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	124.3	177.3	179	68.1	0	0	0	112.3	T68 A142 P143 C148 L152 I238 L240 V289	T68-L146 HydrophobicContact CG2-CB 3.95Å; T68-L146 PolarHBondContact OG1-N 3.12Å; T68-L146 PolarHBondContact OG1-O 3.25Å; A142-L146 HydrophobicContact CB-CD2 4.12Å; P143-L146 HydrophobicContact CG-CB 4.23Å; P143-L146 WeakPolarHBondContact O-CB 3.24Å; P143-L146 PolarHBondContact O-N 3.28Å; L146-C148 HydrophobicContact CD2-CB 4.22Å; L146-C148 HydrophobicContact CG-CB 4.14Å; L146-L152 HydrophobicContact CD2-CD1 4.07Å; L146-I238 HydrophobicContact CD1-CD1 3.82Å; L146-L240 HydrophobicContact CD2-CD1 3.93Å; L146-V289 HydrophobicContact CD1-CG1 4.1Å
147	I	88.2	Confident	91.7	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.021	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	110.3	165.5	-62.3	172.8	0	0	0	108	L59 L64 I288 V289 L290 A292 L302 F313	L59-I147 HydrophobicContact CD2-CD1 3.58Å; L64-I147 HydrophobicContact CD2-CD1 4.33Å; I147-I288 HydrophobicContact CG2-CG2 3.99Å; I147-V289 WeakPolarHBondContact O-CA 3.31Å; I147-L290 HydrophobicContact CB-CD1 4.23Å; I147-L290 HydrophobicContact CD1-CD1 4.35Å; I147-L290 PolarHBondContact N-O 3.15Å; I147-L290 PolarHBondContact O-N 2.96Å; I147-L290 VanDerWaalsContact O-N 3.11Å; I147-A292 HydrophobicContact CD1-CB 3.53Å; I147-A292 HydrophobicContact CG1-CB 3.94Å; I147-L302 HydrophobicContact CD1-CD2 3.78Å; I147-F313 HydrophobicContact CG2-CE1 4.29Å
148	C	86.8	Confident	92.1	Very high	6 Å²	6	24.8 Å²	24.8	4%	0.041	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	129	-178.5	-168.5	0	0	0	0	111.3	T71 L146 I150 I288	T71-C148 VanDerWaalsContact CG2-O 3.31Å; T71-C148 WeakPolarHBondContact CG2-O 3.32Å; L146-C148 HydrophobicContact CD2-CB 4.22Å; L146-C148 HydrophobicContact CG-CB 4.14Å; C148-I150 PolarHBondContact SG-N 3.29Å; C148-I150 VanDerWaalsContact SG-N 3.38Å; C148-I150 PolarHBondContact SG-O 3.3Å; C148-I288 CarbonylContact C-O 3.52Å; C148-I288 WeakPolarHBondContact CA-O 3.44Å
149	G	84	Confident	92.1	Very high	30 Å²	30	24.6 Å²	24.6	31%	0.309	12%	0.122	S	C	.	.			trans	-102.9	11.5	171.3	0	0	0	0	0	113.4	P287 I288	G149-P287 WeakPolarHBondContact O-CB 3.16Å; G149-I288 PolarHBondContact N-O 3.46Å
150	I	86.4	Confident	92	Very high	32 Å²	32	26 Å²	26	16%	0.164	13%	0.128	C	C	.	.	S	Bend	trans	-117.6	146.9	-177.6	-46.6	-177.6	0	0	0	109.4	C148 L152 F155 L283 P284 P287 V289	C148-I150 PolarHBondContact SG-N 3.29Å; C148-I150 VanDerWaalsContact SG-N 3.38Å; C148-I150 PolarHBondContact SG-O 3.3Å; I150-L152 PolarHBondContact O-N 2.85Å; I150-F155 HydrophobicContact CG2-CE2 3.92Å; I150-L283 HydrophobicContact CD1-CB 4.19Å; I150-P284 HydrophobicContact CD1-CG 4.09Å; I150-P287 HydrophobicContact CD1-CB 4.25Å; I150-P287 HydrophobicContact CD1-CG 3.61Å; I150-P287 HydrophobicContact CG1-CB 3.57Å; I150-P287 HydrophobicContact CG1-CG 3.35Å; I150-V289 HydrophobicContact CB-CG2 4.35Å; I150-V289 HydrophobicContact CD1-CG2 3.39Å; I150-V289 HydrophobicContact CG1-CG2 3.61Å
151	S	89.3	Confident	91.8	Very high	32 Å²	32	31.4 Å²	31.4	22%	0.224	15%	0.153	C	C	.	.			trans	-71.3	109.4	166.9	172.1	0	0	0	0	110	D75	D75-S151 WeakPolarHBondContact OD1-CA 3.39Å; D75-S151 WeakPolarHBondContact OD1-CB 3.5Å; D75-S151 PolarHBondContact OD1-OG 3.41Å
152	L	92.9	Very high	91.5	Very high	4 Å²	4	32.1 Å²	32.1	2%	0.021	16%	0.157	C	C	.	.	S	Bend	trans	-77.4	-28.7	176.9	-62.5	179	0	0	0	112.3	L72 D75 F77 L140 L146 I150 K154 F155 V156 L174 L240	L72-L152 HydrophobicContact CD2-CD1 3.92Å; D75-L152 VanDerWaalsContact OD2-CA 3.32Å; D75-L152 WeakPolarHBondContact OD2-CA 3.12Å; D75-L152 PolarHBondContact OD2-N 3.02Å; F77-L152 HydrophobicContact CE2-CB 4.18Å; F77-L152 HydrophobicContact CZ-CB 4.41Å; L140-L152 HydrophobicContact CD2-CB 4.41Å; L140-L152 HydrophobicContact CD2-CD1 3.78Å; L146-L152 HydrophobicContact CD2-CD1 4.07Å; I150-L152 PolarHBondContact O-N 2.85Å; L152-K154 PolarHBondContact O-N 3.34Å; L152-F155 PolarHBondContact O-N 3.4Å; L152-V156 PolarHBondContact O-N 3.14Å; L152-L174 HydrophobicContact CD2-CD1 4.39Å; L152-L240 HydrophobicContact CD1-CD1 4.33Å; L152-L240 HydrophobicContact CD2-CD2 4Å
153	A	93.1	Very high	91.3	Very high	4 Å²	4	33.5 Å²	33.5	3%	0.033	16%	0.162	C	C	.	.	H	α-helix	trans	-54.4	-38.5	177.7	0	0	0	0	0	111.9	L32 D75 F77 F155 V156 Y157	L32-A153 HydrophobicContact CD1-CB 3.61Å; D75-A153 WeakPolarHBondContact O-CB 3.25Å; D75-A153 PolarHBondContact OD2-N 2.95Å; F77-A153 HydrophobicContact CE2-CB 4.33Å; A153-F155 VanDerWaalsContact C-N 3.26Å; A153-F155 PolarHBondContact O-N 2.82Å; A153-V156 PolarHBondContact O-N 3.42Å; A153-V156 VanDerWaalsContact O-N 3.14Å; A153-Y157 HydrophobicContact CB-CE2 4.15Å; A153-Y157 WeakPolarHBondContact O-CD2 3.42Å; A153-Y157 PolarHBondContact O-N 2.62Å
154	K	93.3	Very high	91.2	Very high	148 Å²	148	41.1 Å²	41.1	64%	0.643	20%	0.197	S	C	*	.	H	α-helix	trans	-55.9	-41	175.6	-68.9	175.3	-174.8	-179.9	0	112.5	L152 K158	L152-K154 PolarHBondContact O-N 3.34Å; K154-K158 WeakPolarHBondContact O-CB 3.32Å; K154-K158 PolarHBondContact O-N 3.08Å
155	F	94.4	Very high	91.1	Very high	28 Å²	28	48.7 Å²	48.7	12%	0.123	23%	0.23	C	C	.	.	H	α-helix	trans	-75.4	-33.3	179.9	-59.1	-69.1	0	0	0	111.6	I150 L152 A153 K158 H159 L174 I242 E281 L283	I150-F155 HydrophobicContact CG2-CE2 3.92Å; L152-F155 PolarHBondContact O-N 3.4Å; A153-F155 VanDerWaalsContact C-N 3.26Å; A153-F155 PolarHBondContact O-N 2.82Å; F155-K158 PolarHBondContact O-N 3.35Å; F155-H159 WeakPolarHBondContact O-CB 3.47Å; F155-H159 PolarHBondContact O-N 3.11Å; F155-L174 HydrophobicContact CB-CD2 3.76Å; F155-L174 HydrophobicContact CD1-CD2 4.25Å; F155-L174 HydrophobicContact CD2-CD2 4.19Å; F155-L174 HydrophobicContact CG-CD2 3.82Å; F155-I242 VanDerWaalsContact C-CD1 3.43Å; F155-I242 HydrophobicContact CB-CD1 3.78Å; F155-I242 WeakPolarHBondContact O-CD1 3.18Å; F155-E281 HydrophobicContact CD1-CG 3.57Å; F155-E281 HydrophobicContact CE1-CG 3.71Å; F155-L283 HydrophobicContact CD2-CD2 4.02Å; F155-L283 HydrophobicContact CE1-CD2 4.17Å; F155-L283 HydrophobicContact CE2-CD2 3.42Å; F155-L283 VanDerWaalsContact CE2-CD2 3.42Å; F155-L283 HydrophobicContact CZ-CD2 3.5Å; F155-L283 VanDerWaalsContact CZ-CD2 3.5Å
156	V	94.2	Very high	91	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.012	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-44.6	172.2	-178.3	0	0	0	0	111.1	L32 F77 L152 A153 K158 H159 K160 I242	L32-V156 HydrophobicContact CD2-CB 4.19Å; L32-V156 HydrophobicContact CD2-CG1 3.71Å; F77-V156 HydrophobicContact CE1-CG2 4.33Å; F77-V156 HydrophobicContact CZ-CG2 3.95Å; L152-V156 PolarHBondContact O-N 3.14Å; A153-V156 PolarHBondContact O-N 3.42Å; A153-V156 VanDerWaalsContact O-N 3.14Å; V156-K158 PolarHBondContact O-N 3.46Å; V156-H159 PolarHBondContact O-N 3.03Å; V156-K160 WeakPolarHBondContact O-CG 3.04Å; V156-K160 PolarHBondContact O-N 3.37Å; V156-I242 HydrophobicContact CG2-CD1 4.14Å; V156-I242 HydrophobicContact CG2-CG1 4.27Å; V156-I242 HydrophobicContact CG2-CG2 4.43Å
157	Y	94	Very high	90.9	Very high	114 Å²	114	54.6 Å²	54.6	45%	0.447	27%	0.268	S	S	.	.	H	α-helix	trans	-63.5	-41.1	175	-67.4	-58.2	0	0	0	112.2	L32 A153 H159 K160 E161	L32-Y157 HydrophobicContact CD1-CE2 4.24Å; L32-Y157 HydrophobicContact CD2-CE1 4.19Å; A153-Y157 HydrophobicContact CB-CE2 4.15Å; A153-Y157 WeakPolarHBondContact O-CD2 3.42Å; A153-Y157 PolarHBondContact O-N 2.62Å; Y157-H159 VanDerWaalsContact C-N 3.32Å; Y157-H159 PolarHBondContact O-N 3.24Å; Y157-K160 WeakPolarHBondContact O-CB 3.38Å; Y157-K160 PolarHBondContact O-N 3.12Å; Y157-E161 WeakPolarHBondContact O-CG 3.48Å; Y157-E161 PolarHBondContact O-N 3.07Å
158	K	93.4	Very high	91	Very high	86 Å²	86	57.1 Å²	57.1	37%	0.374	28%	0.281	S	S	.	.	H	α-helix	trans	-59.2	-43	174.1	-171.4	-171.8	-178.1	-170	0	111.9	K154 F155 V156 E161 Q162 E281	K154-K158 WeakPolarHBondContact O-CB 3.32Å; K154-K158 PolarHBondContact O-N 3.08Å; F155-K158 PolarHBondContact O-N 3.35Å; V156-K158 PolarHBondContact O-N 3.46Å; K158-E161 PolarHBondContact O-N 3.33Å; K158-Q162 WeakPolarHBondContact O-CB 3.35Å; K158-Q162 PolarHBondContact O-N 2.93Å; K158-E281 IonicContact NZ-OE1 3.84Å; K158-E281 PolarHBondContact NZ-OE1 3.46Å; K158-E281 IonicContact NZ-OE2 2.66Å; K158-E281 PolarHBondContact NZ-OE2 3.16Å
159	H	93.5	Very high	91.3	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.009	28%	0.279	C	S	.	.	H	α-helix	trans	-64.7	-41.7	176.6	-177.4	73.8	0	0	0	111.8	D138 F155 V156 Y157 Q162 R163 A169 T172 I242	D138-H159 IonicContact OD1-CD2 2.59Å; D138-H159 PolarHBondContact OD1-CD2 3.19Å; D138-H159 IonicContact OD1-NE2 3.47Å; F155-H159 WeakPolarHBondContact O-CB 3.47Å; F155-H159 PolarHBondContact O-N 3.11Å; V156-H159 PolarHBondContact O-N 3.03Å; Y157-H159 VanDerWaalsContact C-N 3.32Å; Y157-H159 PolarHBondContact O-N 3.24Å; H159-Q162 WeakPolarHBondContact O-CB 3.24Å; H159-Q162 PolarHBondContact O-N 3.41Å; H159-Q162 VanDerWaalsContact O-N 3.13Å; H159-R163 WeakPolarHBondContact NE2-CD 3.4Å; H159-R163 PolarHBondContact O-N 2.85Å; H159-A169 PolarHBondContact CE1-O 3.28Å; H159-A169 VanDerWaalsContact CE1-O 3.3Å; H159-T172 PolarHBondContact CE1-OG1 2.8Å; H159-T172 PolarHBondContact ND1-OG1 3.48Å; H159-I242 HydrophobicContact CB-CD1 4.19Å; H159-I242 HydrophobicContact CB-CG2 4Å
160	K	92.8	Very high	91.8	Very high	30 Å²	30	55.4 Å²	55.4	13%	0.13	26%	0.264	C	S	.	.	H	α-helix	trans	-57.4	-50.8	173.7	-79.2	-177.1	173.9	-162.7	0	112.1	D29 D138 V156 Y157 Q162 R163 E164	D29-K160 PolarHBondContact O-NZ 3.32Å; D29-K160 VanDerWaalsContact O-NZ 3.12Å; D138-K160 HydrophobicContact CB-CG 4.41Å; D138-K160 WeakPolarHBondContact OD2-CG 3.32Å; V156-K160 WeakPolarHBondContact O-CG 3.04Å; V156-K160 PolarHBondContact O-N 3.37Å; Y157-K160 WeakPolarHBondContact O-CB 3.38Å; Y157-K160 PolarHBondContact O-N 3.12Å; K160-Q162 PolarHBondContact O-N 3.43Å; K160-R163 PolarHBondContact O-N 3.15Å; K160-R163 VanDerWaalsContact O-N 3.13Å; K160-E164 WeakPolarHBondContact O-CG 3.47Å; K160-E164 PolarHBondContact O-N 3.4Å
161	E	92.5	Very high	92.2	Very high	113 Å²	113	53.9 Å²	53.9	53%	0.528	26%	0.257	S	S	.	.	H	α-helix	trans	-59.5	-32.2	176.1	-71.7	179.5	-174	0	0	112.5	Y157 K158	Y157-E161 WeakPolarHBondContact O-CG 3.48Å; Y157-E161 PolarHBondContact O-N 3.07Å; K158-E161 PolarHBondContact O-N 3.33Å
162	Q	90	Very high	92.6	Very high	19 Å²	19	52.8 Å²	52.8	9%	0.089	25%	0.249	C	C	.	.	H	α-helix	trans	-72.1	-43.3	176.1	-178.3	168.3	-3.1	0	0	111.7	K158 H159 K160 E164 K165 T166 A169 H279	K158-Q162 WeakPolarHBondContact O-CB 3.35Å; K158-Q162 PolarHBondContact O-N 2.93Å; H159-Q162 WeakPolarHBondContact O-CB 3.24Å; H159-Q162 PolarHBondContact O-N 3.41Å; H159-Q162 VanDerWaalsContact O-N 3.13Å; K160-Q162 PolarHBondContact O-N 3.43Å; Q162-E164 VanDerWaalsContact C-N 3.29Å; Q162-E164 PolarHBondContact O-N 3.19Å; Q162-K165 PolarHBondContact O-N 2.72Å; Q162-T166 PolarHBondContact O-N 2.9Å; Q162-T166 PolarHBondContact O-OG1 3.39Å; Q162-A169 HydrophobicContact CG-CB 4.29Å; Q162-H279 PolarHBondContact NE2-CD2 2.9Å; Q162-H279 PolarHBondContact NE2-CE1 3.43Å; Q162-H279 PolarHBondContact NE2-ND1 2.92Å; Q162-H279 PolarHBondContact NE2-NE2 3.27Å
163	R	91.1	Very high	92.7	Very high	32 Å²	32	52.9 Å²	52.9	12%	0.121	25%	0.249	C	C	.	.	H	α-helix	trans	-65.4	-31.7	176.1	-77.3	-168.6	71.6	-176.7	0.5	113.5	S137 D138 H159 K160 K165 T166 P167 A169 N245 H246	S137-R163 PolarHBondContact O-NH1 2.99Å; D138-R163 WeakPolarHBondContact OD1-CD 3.42Å; D138-R163 IonicContact OD1-CZ 3.19Å; D138-R163 IonicContact OD1-NE 3.75Å; D138-R163 IonicContact OD1-NH1 2.98Å; D138-R163 PolarHBondContact OD1-NH1 3.21Å; H159-R163 WeakPolarHBondContact NE2-CD 3.4Å; H159-R163 PolarHBondContact O-N 2.85Å; K160-R163 PolarHBondContact O-N 3.15Å; K160-R163 VanDerWaalsContact O-N 3.13Å; R163-K165 PolarHBondContact O-N 2.87Å; R163-T166 WeakPolarHBondContact CA-O 3.39Å; R163-T166 CarbonylContact O-C 3.27Å; R163-T166 VanDerWaalsContact O-C 3.27Å; R163-T166 PolarHBondContact O-N 3.29Å; R163-P167 WeakPolarHBondContact O-CA 3.06Å; R163-A169 VanDerWaalsContact CD-O 3.3Å; R163-A169 WeakPolarHBondContact CD-O 3.4Å; R163-A169 HydrophobicContact CG-CB 4.18Å; R163-A169 WeakPolarHBondContact CG-O 3.22Å; R163-N245 PolarHBondContact NH1-OD1 3.15Å; R163-N245 PolarHBondContact NH2-OD1 2.97Å; R163-H246 PolarHBondContact NH2-CD2 3.49Å; R163-H246 PolarHBondContact NH2-NE2 3.47Å; R163-H246 VanDerWaalsContact NH2-NE2 3.17Å
164	E	90.8	Very high	92.8	Very high	165 Å²	165	52.7 Å²	52.7	77%	0.771	25%	0.248	S	C	*	.	H	α-helix	trans	-60.2	-32.5	171.5	-73.3	177.7	-179	0	0	112.3	K160 Q162	K160-E164 WeakPolarHBondContact O-CG 3.47Å; K160-E164 PolarHBondContact O-N 3.4Å; Q162-E164 VanDerWaalsContact C-N 3.29Å; Q162-E164 PolarHBondContact O-N 3.19Å
165	K	90.6	Very high	92.9	Very high	160 Å²	160	45.7 Å²	45.7	70%	0.696	22%	0.217	S	C	*	.	H	α-helix	trans	-86.1	-42	176.8	-64.4	172.4	-172.9	168.6	0	112.3	Q162 R163	Q162-K165 PolarHBondContact O-N 2.72Å; R163-K165 PolarHBondContact O-N 2.87Å
166	T	88.9	Confident	92.8	Very high	54 Å²	54	44.6 Å²	44.6	33%	0.331	21%	0.213	S	C	.	.			trans	-131.4	93.8	-176.6	50.5	0	0	0	0	108.8	Q162 R163 N168 A169	Q162-T166 PolarHBondContact O-N 2.9Å; Q162-T166 PolarHBondContact O-OG1 3.39Å; R163-T166 WeakPolarHBondContact CA-O 3.39Å; R163-T166 CarbonylContact O-C 3.27Å; R163-T166 VanDerWaalsContact O-C 3.27Å; R163-T166 PolarHBondContact O-N 3.29Å; T166-N168 PolarHBondContact O-N 3.3Å; T166-N168 VanDerWaalsContact O-N 3.1Å; T166-A169 WeakPolarHBondContact O-CB 3.35Å; T166-A169 PolarHBondContact O-N 2.99Å; T166-A169 VanDerWaalsContact O-N 3.1Å
167	P	89	Confident	92.5	Very high	82 Å²	82	45.3 Å²	45.3	53%	0.532	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.9	-175.2	23.8	-33.5	0	0	0	113.1	R163 A169	R163-P167 WeakPolarHBondContact O-CA 3.06Å; P167-A169 PolarHBondContact O-N 3.45Å
168	N	91	Very high	92.1	Very high	56 Å²	56	43.1 Å²	43.1	30%	0.299	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-2.4	179.4	-58.1	5.9	0	0	0	114	T166 I170 E275 Y276 T277	T166-N168 PolarHBondContact O-N 3.3Å; T166-N168 VanDerWaalsContact O-N 3.1Å; N168-I170 PolarHBondContact O-N 3.02Å; N168-E275 VanDerWaalsContact CB-O 3.24Å; N168-E275 WeakPolarHBondContact CB-O 3.25Å; N168-E275 WeakPolarHBondContact ND2-CB 3.27Å; N168-E275 PolarHBondContact ND2-O 3.25Å; N168-Y276 HydrophobicContact CB-CD1 4.44Å; N168-Y276 WeakPolarHBondContact O-CA 3.41Å; N168-T277 PolarHBondContact O-N 3.45Å
169	A	92.8	Very high	91.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	85.2	175.5	0	0	0	0	0	110.7	H159 Q162 R163 T166 P167 T277	H159-A169 PolarHBondContact CE1-O 3.28Å; H159-A169 VanDerWaalsContact CE1-O 3.3Å; Q162-A169 HydrophobicContact CG-CB 4.29Å; R163-A169 VanDerWaalsContact CD-O 3.3Å; R163-A169 WeakPolarHBondContact CD-O 3.4Å; R163-A169 HydrophobicContact CG-CB 4.18Å; R163-A169 WeakPolarHBondContact CG-O 3.22Å; T166-A169 WeakPolarHBondContact O-CB 3.35Å; T166-A169 PolarHBondContact O-N 2.99Å; T166-A169 VanDerWaalsContact O-N 3.1Å; P167-A169 PolarHBondContact O-N 3.45Å; A169-T277 WeakPolarHBondContact CA-O 3.31Å; A169-T277 WeakPolarHBondContact CA-OG1 3.42Å
170	I	93.8	Very high	90.6	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-23.3	-169.6	58.7	166.3	0	0	0	114.7	N168 G244 H246 I247 L250 V267 Y276 T277	N168-I170 PolarHBondContact O-N 3.02Å; I170-G244 PolarHBondContact O-N 2.83Å; I170-H246 HydrophobicContact CG2-CB 3.99Å; I170-I247 HydrophobicContact CB-CD1 4.16Å; I170-I247 HydrophobicContact CD1-CD1 3.91Å; I170-I247 HydrophobicContact CG1-CD1 4.16Å; I170-L250 HydrophobicContact CD1-CD1 3.75Å; I170-V267 HydrophobicContact CD1-CG1 4.4Å; I170-V267 HydrophobicContact CD1-CG2 4.15Å; I170-Y276 HydrophobicContact CD1-CD2 4.1Å; I170-Y276 HydrophobicContact CD1-CG 3.84Å; I170-Y276 HydrophobicContact CG1-CG 4.34Å; I170-Y276 HydrophobicContact CG2-CD1 3.36Å; I170-Y276 HydrophobicContact CG2-CE1 3.8Å; I170-Y276 HydrophobicContact CG2-CG 3.81Å; I170-T277 PolarHBondContact N-O 3.34Å; I170-T277 VanDerWaalsContact N-O 3.17Å
171	L	95.6	Very high	89.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	138.7	-171.1	-173.7	64.9	0	0	0	110.8	L173 I242 I247 M260 L263 V264 I278 H279	L171-L173 HydrophobicContact CD2-CD2 3.87Å; L171-L173 HydrophobicContact CD2-CG 4.42Å; L171-L173 HydrophobicContact CG-CD2 4.11Å; L171-I242 WeakPolarHBondContact CA-O 3.42Å; L171-I247 HydrophobicContact CB-CD1 4.02Å; L171-I247 HydrophobicContact CD1-CD1 4.22Å; L171-M260 HydrophobicContact CD1-CE 4.45Å; L171-M260 HydrophobicContact CD1-SD 4.39Å; L171-M260 HydrophobicContact CD2-SD 3.87Å; L171-L263 HydrophobicContact CD2-CD2 4.44Å; L171-V264 HydrophobicContact CD2-CG2 4.11Å; L171-I278 HydrophobicContact CB-CG1 4.18Å; L171-I278 HydrophobicContact CB-CG2 4.17Å; L171-I278 HydrophobicContact CD2-CD1 4.21Å; L171-I278 HydrophobicContact CD2-CG1 4.35Å; L171-I278 HydrophobicContact CD2-CG2 4.04Å; L171-I278 HydrophobicContact CG-CG2 4.24Å; L171-H279 PolarHBondContact O-N 3Å
172	T	96.5	Very high	89.1	Confident	9 Å²	9	43 Å²	43	6%	0.055	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	116.9	166.7	-62.8	0	0	0	0	110.6	H159 S241 I242 H279 E281	H159-T172 PolarHBondContact CE1-OG1 2.8Å; H159-T172 PolarHBondContact ND1-OG1 3.48Å; T172-S241 CarbonylContact O-C 3.56Å; T172-S241 WeakPolarHBondContact O-CA 3.43Å; T172-I242 PolarHBondContact N-O 2.79Å; T172-I242 PolarHBondContact O-N 2.75Å; T172-H279 CarbonylContact C-O 3.57Å; T172-H279 VanDerWaalsContact CA-O 3.26Å; T172-H279 WeakPolarHBondContact CA-O 3.47Å; T172-H279 HydrophobicContact CG2-CB 4.49Å; T172-E281 HydrophobicContact CG2-CB 3.92Å
173	L	96.2	Very high	88.6	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	121.2	177.5	-59.8	177.9	0	0	0	109.6	L171 L175 L204 L207 V264 I278 H279 E281	L171-L173 HydrophobicContact CD2-CD2 3.87Å; L171-L173 HydrophobicContact CD2-CG 4.42Å; L171-L173 HydrophobicContact CG-CD2 4.11Å; L173-L175 HydrophobicContact CB-CD2 4.3Å; L173-L175 HydrophobicContact CB-CG 4.26Å; L173-L204 HydrophobicContact CD1-CD2 4.19Å; L173-L207 HydrophobicContact CD1-CD1 3.68Å; L173-V264 HydrophobicContact CD1-CG2 4.28Å; L173-I278 HydrophobicContact CD1-CG2 4.23Å; L173-I278 HydrophobicContact CG-CG2 4.22Å; L173-H279 PolarHBondContact N-O 3.35Å; L173-E281 PolarHBondContact O-N 2.73Å
174	L	95.6	Very high	87.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	99.7	178.8	-66.3	169.5	0	0	0	109.1	L140 L152 F155 P176 L240 I242 E281 L283	L140-L174 HydrophobicContact CD1-CD1 4.08Å; L152-L174 HydrophobicContact CD2-CD1 4.39Å; F155-L174 HydrophobicContact CB-CD2 3.76Å; F155-L174 HydrophobicContact CD1-CD2 4.25Å; F155-L174 HydrophobicContact CD2-CD2 4.19Å; F155-L174 HydrophobicContact CG-CD2 3.82Å; L174-P176 VanDerWaalsContact O-CD 3.3Å; L174-P176 WeakPolarHBondContact O-CD 3.21Å; L174-L240 HydrophobicContact CB-CB 4.35Å; L174-L240 HydrophobicContact CB-CD2 3.92Å; L174-L240 HydrophobicContact CB-CG 3.9Å; L174-L240 HydrophobicContact CD1-CD2 4.08Å; L174-L240 HydrophobicContact CD1-CG 3.88Å; L174-L240 PolarHBondContact N-O 3.25Å; L174-I242 HydrophobicContact CD1-CD1 4Å; L174-I242 HydrophobicContact CD1-CG1 3.81Å; L174-I242 HydrophobicContact CD2-CD1 4.23Å; L174-I242 HydrophobicContact CG-CD1 4.3Å; L174-I242 HydrophobicContact CG-CG1 4.28Å; L174-E281 HydrophobicContact CD2-CB 3.88Å; L174-E281 HydrophobicContact CD2-CG 4.13Å; L174-L283 HydrophobicContact CB-CD1 4.46Å; L174-L283 HydrophobicContact CB-CD2 4.46Å; L174-L283 HydrophobicContact CD2-CD2 4.06Å
175	L	94.2	Very high	87.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	109.3	-171.2	-58.4	-178.8	0	0	0	111.2	L173 V192 V194 L235 M236 D237 V280 E281 P282 L283	L173-L175 HydrophobicContact CB-CD2 4.3Å; L173-L175 HydrophobicContact CB-CG 4.26Å; L175-V192 HydrophobicContact CD1-CG2 4.26Å; L175-V194 HydrophobicContact CD1-CG1 4.41Å; L175-V194 HydrophobicContact CD1-CG2 3.67Å; L175-L235 HydrophobicContact CB-CB 4.06Å; L175-L235 HydrophobicContact CB-CD1 4.18Å; L175-L235 HydrophobicContact CB-CD2 4.41Å; L175-L235 HydrophobicContact CB-CG 4.43Å; L175-L235 HydrophobicContact CD1-CB 4.31Å; L175-L235 HydrophobicContact CD1-CD1 4.03Å; L175-M236 WeakPolarHBondContact CD2-O 3.37Å; L175-D237 HydrophobicContact CD2-CB 4.18Å; L175-V280 HydrophobicContact CD1-CG1 3.66Å; L175-V280 HydrophobicContact CG-CG1 4.22Å; L175-E281 PolarHBondContact N-O 2.8Å; L175-E281 VanDerWaalsContact N-O 3.13Å; L175-P282 WeakPolarHBondContact O-CA 3.34Å; L175-L283 PolarHBondContact O-N 2.98Å
176	P	91.6	Very high	86.7	Confident	6 Å²	6	33.6 Å²	33.6	4%	0.039	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-67.8	145.4	172.1	25.3	-33.3	0	0	0	112.7	L174 L235 M236 I238 L283 V289	L174-P176 VanDerWaalsContact O-CD 3.3Å; L174-P176 WeakPolarHBondContact O-CD 3.21Å; P176-L235 WeakPolarHBondContact O-CA 3.33Å; P176-M236 HydrophobicContact CB-CE 4.15Å; P176-M236 VanDerWaalsContact CD-O 3.31Å; P176-M236 WeakPolarHBondContact CD-O 3.5Å; P176-M236 HydrophobicContact CG-CB 4.5Å; P176-M236 HydrophobicContact CG-CE 4.06Å; P176-M236 PolarHBondContact O-N 2.89Å; P176-I238 HydrophobicContact CG-CD1 3.88Å; P176-I238 HydrophobicContact CG-CG1 3.96Å; P176-I238 HydrophobicContact CG-CG2 4.2Å; P176-L283 HydrophobicContact CB-CD1 4.19Å; P176-V289 HydrophobicContact CB-CB 4.12Å; P176-V289 HydrophobicContact CB-CG1 4.47Å; P176-V289 HydrophobicContact CG-CG1 4.5Å
177	S	88.8	Confident	86.3	Confident	17 Å²	17	31.2 Å²	31.2	12%	0.119	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-71.9	148.2	167.3	-65.5	0	0	0	0	110.8	T179 Q234 M236	S177-T179 PolarHBondContact O-N 3.32Å; S177-Q234 WeakPolarHBondContact CA-O 3.23Å; S177-M236 WeakPolarHBondContact O-CE 3.05Å
178	I	84.6	Confident	85.9	Confident	68 Å²	68	28.9 Å²	28.9	35%	0.349	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-56.7	128.5	172.7	-61.3	162.5	0	0	0	109.7	A187 K191 Q234 M236	I178-A187 HydrophobicContact CD1-CB 4.47Å; I178-A187 HydrophobicContact CG1-CB 4.37Å; I178-A187 HydrophobicContact CG2-CB 4.11Å; I178-K191 HydrophobicContact CD1-CD 3.92Å; I178-K191 HydrophobicContact CD1-CG 4.36Å; I178-Q234 WeakPolarHBondContact CG1-O 3.46Å; I178-Q234 PolarHBondContact N-O 3.2Å; I178-M236 HydrophobicContact CB-SD 4.35Å; I178-M236 HydrophobicContact CG1-CG 3.69Å; I178-M236 HydrophobicContact CG1-SD 3.79Å
179	T	79.2	Confident	85.4	Confident	31 Å²	31	27.6 Å²	27.6	19%	0.19	16%	0.157	C	C	.	.			trans	-117	158.5	178.2	57.8	0	0	0	0	111	S177 A181 I182	S177-T179 PolarHBondContact O-N 3.32Å; T179-A181 PolarHBondContact O-N 3.07Å; T179-A181 VanDerWaalsContact O-N 3.11Å; T179-I182 PolarHBondContact O-N 3.17Å; T179-I182 VanDerWaalsContact O-N 3.13Å
180	E	77.3	Confident	85	Confident	178 Å²	178	28.7 Å²	28.7	83%	0.832	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-15.7	176.6	-60	-178.8	174.5	0	0	113.5	I182 K305	E180-I182 VanDerWaalsContact C-N 3.29Å; E180-I182 PolarHBondContact O-N 3.28Å; E180-K305 PolarHBondContact O-NZ 3.4Å; E180-K305 VanDerWaalsContact O-NZ 3.15Å
181	A	73.6	Confident	84.7	Confident	8 Å²	8	30.7 Å²	30.7	7%	0.066	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.3	176.5	0	0	0	0	0	112.2	T179 I288 L290 K305 F313	T179-A181 PolarHBondContact O-N 3.07Å; T179-A181 VanDerWaalsContact O-N 3.11Å; A181-I288 HydrophobicContact CB-CD1 3.54Å; A181-I288 HydrophobicContact CB-CG1 4.21Å; A181-L290 HydrophobicContact CB-CD2 4.3Å; A181-K305 VanDerWaalsContact C-NZ 3.34Å; A181-K305 PolarHBondContact O-NZ 3.23Å; A181-F313 HydrophobicContact CB-CE2 4.43Å
182	I	79.3	Confident	84.4	Confident	11 Å²	11	30.7 Å²	30.7	6%	0.056	17%	0.171	C	C	.	.	S	Bend	trans	-91.4	138.6	-178.1	-63.7	169	0	0	0	108.8	T179 E180 Q186 A187 M236 L290	T179-I182 PolarHBondContact O-N 3.17Å; T179-I182 VanDerWaalsContact O-N 3.13Å; E180-I182 VanDerWaalsContact C-N 3.29Å; E180-I182 PolarHBondContact O-N 3.28Å; I182-Q186 HydrophobicContact CG2-CB 3.89Å; I182-Q186 HydrophobicContact CG2-CG 3.92Å; I182-A187 HydrophobicContact CG2-CB 4.08Å; I182-M236 HydrophobicContact CD1-CE 3.32Å; I182-M236 HydrophobicContact CD1-SD 3.46Å; I182-M236 WeakPolarHBondContact CD1-SD 3.44Å; I182-M236 HydrophobicContact CG2-SD 4.38Å; I182-L290 HydrophobicContact CD1-CB 4.01Å; I182-L290 HydrophobicContact CG1-CB 4.33Å; I182-L290 HydrophobicContact CG1-CD2 4.37Å
183	S	79.5	Confident	84	Confident	36 Å²	36	31.2 Å²	31.2	25%	0.252	17%	0.174	S	C	.	.			trans	-67.5	145.5	175.4	76.8	0	0	0	0	109.8	V185 Q186 A187	S183-V185 PolarHBondContact O-N 2.91Å; S183-Q186 PolarHBondContact O-N 3.45Å; S183-Q186 VanDerWaalsContact O-N 3.09Å; S183-Q186 VanDerWaalsContact OG-CB 3.23Å; S183-Q186 WeakPolarHBondContact OG-CB 3.47Å; S183-Q186 PolarHBondContact OG-N 2.98Å; S183-Q186 VanDerWaalsContact OG-N 3.12Å; S183-A187 PolarHBondContact O-N 3.2Å
184	P	77	Confident	83.7	Confident	111 Å²	111	31 Å²	31	72%	0.721	17%	0.172	S	C	*	.	H	α-helix	trans	-58.4	-26	-179.4	23.1	-33.6	0	0	0	112.5	S188	P184-S188 PolarHBondContact O-N 3.46Å; P184-S188 VanDerWaalsContact O-N 3.08Å
185	V	76.6	Confident	83.3	Confident	21 Å²	21	31.8 Å²	31.8	13%	0.127	18%	0.177	C	C	.	.	H	α-helix	trans	-72.3	-50.2	177.3	-163.9	0	0	0	0	111.5	S183 A187 S188 E189 A513 W514	S183-V185 PolarHBondContact O-N 2.91Å; V185-A187 PolarHBondContact O-N 3.25Å; V185-S188 PolarHBondContact O-N 3.32Å; V185-S188 VanDerWaalsContact O-N 3.1Å; V185-S188 PolarHBondContact O-OG 2.92Å; V185-E189 PolarHBondContact O-N 3.33Å; V185-A513 HydrophobicContact CB-CB 4.38Å; V185-A513 HydrophobicContact CG1-CB 3.69Å; V185-W514 HydrophobicContact CB-CG 4.44Å; V185-W514 HydrophobicContact CG1-CB 4Å; V185-W514 HydrophobicContact CG1-CD2 3.6Å; V185-W514 HydrophobicContact CG1-CE3 4.48Å; V185-W514 HydrophobicContact CG1-CG 3.32Å; V185-W514 HydrophobicContact CG1-CZ2 4.43Å; V185-W514 VanDerWaalsContact CG1-N 3.33Å; V185-W514 HydrophobicContact CG2-CD2 4.4Å; V185-W514 HydrophobicContact CG2-CG 4.37Å; V185-W514 HydrophobicContact CG2-CZ2 4Å
186	Q	78.8	Confident	83.1	Confident	10 Å²	10	32 Å²	32	5%	0.047	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-39.2	176.1	-178.1	-169.9	-5.1	0	0	110.1	I182 S183 S188 E189 L190 P294	I182-Q186 HydrophobicContact CG2-CB 3.89Å; I182-Q186 HydrophobicContact CG2-CG 3.92Å; S183-Q186 PolarHBondContact O-N 3.45Å; S183-Q186 VanDerWaalsContact O-N 3.09Å; S183-Q186 VanDerWaalsContact OG-CB 3.23Å; S183-Q186 WeakPolarHBondContact OG-CB 3.47Å; S183-Q186 PolarHBondContact OG-N 2.98Å; S183-Q186 VanDerWaalsContact OG-N 3.12Å; Q186-S188 VanDerWaalsContact C-N 3.33Å; Q186-S188 PolarHBondContact O-N 2.77Å; Q186-E189 PolarHBondContact O-N 3.04Å; Q186-L190 HydrophobicContact CG-CD1 4.17Å; Q186-L190 PolarHBondContact O-N 2.88Å; Q186-P294 HydrophobicContact CG-CG 4.08Å; Q186-P294 VanDerWaalsContact NE2-CG 3.33Å
187	A	82.1	Confident	83	Confident	4 Å²	4	32.2 Å²	32.2	3%	0.033	18%	0.179	C	C	.	.	H	α-helix	trans	-56.7	-47.2	172.2	0	0	0	0	0	110.5	I178 I182 S183 V185 E189 L190 K191 M236	I178-A187 HydrophobicContact CD1-CB 4.47Å; I178-A187 HydrophobicContact CG1-CB 4.37Å; I178-A187 HydrophobicContact CG2-CB 4.11Å; I182-A187 HydrophobicContact CG2-CB 4.08Å; S183-A187 PolarHBondContact O-N 3.2Å; V185-A187 PolarHBondContact O-N 3.25Å; A187-E189 VanDerWaalsContact C-N 3.25Å; A187-E189 PolarHBondContact O-N 3.26Å; A187-L190 CarbonylContact O-C 3.54Å; A187-L190 PolarHBondContact O-N 3.36Å; A187-L190 VanDerWaalsContact O-N 3.15Å; A187-K191 WeakPolarHBondContact O-CA 3.42Å; A187-K191 WeakPolarHBondContact O-CB 3.5Å; A187-K191 PolarHBondContact O-N 3.29Å; A187-M236 HydrophobicContact CB-SD 4.48Å
188	S	79.6	Confident	82.7	Confident	34 Å²	34	37.7 Å²	37.7	24%	0.238	20%	0.197	C	C	.	.	H	α-helix	trans	-63.2	-23.1	-179.9	65.2	0	0	0	0	115.8	P184 V185 Q186 I517	P184-S188 PolarHBondContact O-N 3.46Å; P184-S188 VanDerWaalsContact O-N 3.08Å; V185-S188 PolarHBondContact O-N 3.32Å; V185-S188 VanDerWaalsContact O-N 3.1Å; V185-S188 PolarHBondContact O-OG 2.92Å; Q186-S188 VanDerWaalsContact C-N 3.33Å; Q186-S188 PolarHBondContact O-N 2.77Å; S188-I517 WeakPolarHBondContact OG-CD1 3.49Å
189	E	81.4	Confident	82.5	Confident	28 Å²	28	38 Å²	38	13%	0.131	20%	0.202	C	C	.	.	H	α-helix	trans	-78.1	-38.5	173.9	-176.9	-179.1	169.3	0	0	111.9	R44 V185 Q186 A187 A513 R516	R44-E189 IonicContact CZ-OE1 3.17Å; R44-E189 IonicContact NH1-OE1 2.79Å; R44-E189 PolarHBondContact NH1-OE1 2.78Å; R44-E189 IonicContact NH2-OE1 3.37Å; R44-E189 PolarHBondContact NH2-OE1 3.46Å; R44-E189 VanDerWaalsContact NH2-OE1 3.11Å; V185-E189 PolarHBondContact O-N 3.33Å; Q186-E189 PolarHBondContact O-N 3.04Å; A187-E189 VanDerWaalsContact C-N 3.25Å; A187-E189 PolarHBondContact O-N 3.26Å; E189-A513 HydrophobicContact CB-CB 4.21Å; E189-A513 WeakPolarHBondContact OE2-CA 3.44Å; E189-A513 WeakPolarHBondContact OE2-CB 3.36Å; E189-R516 VanDerWaalsContact CD-NE 3.33Å; E189-R516 IonicContact OE1-CZ 3.16Å; E189-R516 IonicContact OE1-NE 2.91Å; E189-R516 PolarHBondContact OE1-NE 2.87Å; E189-R516 IonicContact OE1-NH2 3.14Å; E189-R516 PolarHBondContact OE1-NH2 3.33Å; E189-R516 IonicContact OE2-CZ 3.96Å; E189-R516 VanDerWaalsContact OE2-CZ 3.29Å; E189-R516 IonicContact OE2-NE 2.88Å; E189-R516 PolarHBondContact OE2-NE 3.41Å; E189-R516 VanDerWaalsContact OE2-NE 3.09Å; E189-R516 IonicContact OE2-NH2 3.76Å; E189-R516 PolarHBondContact OE2-NH2 2.76Å
190	L	84.2	Confident	82.6	Confident	23 Å²	23	40.1 Å²	40.1	12%	0.12	21%	0.212	C	C	.	.	H	α-helix	trans	-94	-8.3	-176.3	-60.8	170.7	0	0	0	113.1	Q186 A187 V192 M236 D237	Q186-L190 HydrophobicContact CG-CD1 4.17Å; Q186-L190 PolarHBondContact O-N 2.88Å; A187-L190 CarbonylContact O-C 3.54Å; A187-L190 PolarHBondContact O-N 3.36Å; A187-L190 VanDerWaalsContact O-N 3.15Å; L190-V192 PolarHBondContact O-N 3.13Å; L190-M236 HydrophobicContact CB-CB 4.21Å; L190-M236 CarbonylContact O-C 3.55Å; L190-M236 VanDerWaalsContact O-CA 3.25Å; L190-M236 WeakPolarHBondContact O-CA 3.35Å; L190-D237 WeakPolarHBondContact CD2-O 3.21Å; L190-D237 PolarHBondContact O-N 3.37Å
191	K	88	Confident	83	Confident	44 Å²	44	35.9 Å²	35.9	19%	0.191	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	127.4	-173	177.6	173.6	172.5	-133	0	110.1	I178 A187 E210 S233 L235	I178-K191 HydrophobicContact CD1-CD 3.92Å; I178-K191 HydrophobicContact CD1-CG 4.36Å; A187-K191 WeakPolarHBondContact O-CA 3.42Å; A187-K191 WeakPolarHBondContact O-CB 3.5Å; A187-K191 PolarHBondContact O-N 3.29Å; K191-E210 VanDerWaalsContact CD-OE2 3.25Å; K191-E210 WeakPolarHBondContact CD-OE2 3.48Å; K191-E210 WeakPolarHBondContact CE-OE1 3.26Å; K191-E210 WeakPolarHBondContact CE-OE2 3.28Å; K191-E210 HydrophobicContact CG-CG 4.43Å; K191-E210 IonicContact NZ-OE1 2.67Å; K191-E210 PolarHBondContact NZ-OE1 2.9Å; K191-E210 IonicContact NZ-OE2 3.71Å; K191-E210 PolarHBondContact NZ-OE2 3.34Å; K191-E210 PolarHBondContact O-N 3Å; K191-S233 WeakPolarHBondContact CE-O 3.25Å; K191-L235 WeakPolarHBondContact CA-O 3.3Å
192	V	88.5	Confident	83.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.1	179.1	-73	0	0	0	0	109.5	L175 L190 V194 L207 H209 L235 D237	L175-V192 HydrophobicContact CD1-CG2 4.26Å; L190-V192 PolarHBondContact O-N 3.13Å; V192-V194 HydrophobicContact CB-CG2 4Å; V192-V194 HydrophobicContact CG2-CG2 3.66Å; V192-L207 HydrophobicContact CG1-CD2 4.23Å; V192-H209 WeakPolarHBondContact CG1-CE1 3.32Å; V192-H209 VanDerWaalsContact CG1-ND1 3.27Å; V192-H209 WeakPolarHBondContact CG1-ND1 3.32Å; V192-L235 HydrophobicContact CG2-CB 4.28Å; V192-L235 PolarHBondContact N-O 3.07Å; V192-D237 HydrophobicContact CG1-CB 3.79Å; V192-D237 HydrophobicContact CG2-CB 4.25Å
193	N	87.8	Confident	84.2	Confident	20 Å²	20	37.9 Å²	37.9	11%	0.107	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	123.8	163.8	-75.1	-18.5	0	0	0	107.8	F208 S233	N193-F208 HydrophobicContact CB-CD1 4.19Å; N193-F208 HydrophobicContact CB-CD2 3.86Å; N193-F208 HydrophobicContact CB-CE1 3.73Å; N193-F208 HydrophobicContact CB-CE2 3.4Å; N193-F208 VanDerWaalsContact CB-CE2 3.4Å; N193-F208 HydrophobicContact CB-CG 4.24Å; N193-F208 HydrophobicContact CB-CZ 3.31Å; N193-F208 PolarHBondContact N-O 2.98Å; N193-F208 WeakPolarHBondContact ND2-CE2 3.08Å; N193-F208 PolarHBondContact O-N 3.22Å; N193-S233 WeakPolarHBondContact OD1-CA 3.18Å; N193-S233 WeakPolarHBondContact OD1-CB 3.35Å
194	V	89.4	Confident	84.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	128.7	-173.8	-170.8	0	0	0	0	108.9	L175 V192 F196 L204 L207 E231 S232 L235 V280	L175-V194 HydrophobicContact CD1-CG1 4.41Å; L175-V194 HydrophobicContact CD1-CG2 3.67Å; V192-V194 HydrophobicContact CB-CG2 4Å; V192-V194 HydrophobicContact CG2-CG2 3.66Å; V194-F196 HydrophobicContact CG1-CD1 4.05Å; V194-L204 HydrophobicContact CG1-CD1 3.47Å; V194-L204 VanDerWaalsContact CG1-CD1 3.47Å; V194-L207 HydrophobicContact CG2-CD1 4.22Å; V194-L207 HydrophobicContact CG2-CG 4.35Å; V194-E231 WeakPolarHBondContact O-CA 3.18Å; V194-S232 PolarHBondContact N-O 3.38Å; V194-S232 PolarHBondContact O-N 2.8Å; V194-L235 HydrophobicContact CB-CD1 4.49Å; V194-L235 HydrophobicContact CG2-CD1 4.48Å; V194-V280 HydrophobicContact CG1-CG1 4.26Å; V194-V280 HydrophobicContact CG1-CG2 3.81Å
195	I	88.8	Confident	85.2	Confident	18 Å²	18	32 Å²	32	9%	0.092	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.6	174.4	-56.5	176.5	0	0	0	106.8	I205 N206 V218 V229 I230 E231	I195-I205 HydrophobicContact CB-CB 4.46Å; I195-I205 HydrophobicContact CG2-CB 4.13Å; I195-I205 HydrophobicContact CG2-CD1 4.26Å; I195-I205 HydrophobicContact CG2-CG2 4.44Å; I195-I205 WeakPolarHBondContact O-CB 3.39Å; I195-I205 PolarHBondContact O-N 3.05Å; I195-N206 HydrophobicContact CB-CB 4.42Å; I195-N206 HydrophobicContact CD1-CB 4.43Å; I195-N206 PolarHBondContact N-O 3.29Å; I195-N206 PolarHBondContact O-N 3.03Å; I195-V218 HydrophobicContact CD1-CG2 3.98Å; I195-V229 HydrophobicContact CG2-CG1 3.42Å; I195-V229 VanDerWaalsContact CG2-CG1 3.42Å; I195-I230 WeakPolarHBondContact CA-O 2.96Å; I195-E231 HydrophobicContact CG1-CB 4.35Å; I195-E231 HydrophobicContact CG1-CG 4.14Å
196	F	89.6	Confident	85.7	Confident	5 Å²	5	31.3 Å²	31.3	2%	0.022	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	150.2	-179.2	64	-87	0	0	0	112.2	V194 N202 R203 I230 V280 P282	V194-F196 HydrophobicContact CG1-CD1 4.05Å; F196-N202 HydrophobicContact CD2-CB 3.89Å; F196-N202 HydrophobicContact CE2-CB 4.3Å; F196-R203 CarbonylContact C-O 3.58Å; F196-R203 WeakPolarHBondContact CA-O 3.49Å; F196-R203 VanDerWaalsContact CB-O 3.28Å; F196-R203 WeakPolarHBondContact CB-O 3.15Å; F196-I230 HydrophobicContact CE1-CB 4.27Å; F196-I230 HydrophobicContact CE1-CG2 4.1Å; F196-I230 HydrophobicContact CE2-CB 4.21Å; F196-I230 HydrophobicContact CE2-CD1 4.24Å; F196-I230 HydrophobicContact CZ-CB 4.01Å; F196-I230 HydrophobicContact CZ-CD1 4.39Å; F196-I230 HydrophobicContact CZ-CG2 3.92Å; F196-I230 PolarHBondContact N-O 3.33Å; F196-I230 PolarHBondContact O-N 2.88Å; F196-V280 HydrophobicContact CB-CB 4.5Å; F196-V280 HydrophobicContact CB-CG2 4.43Å; F196-V280 HydrophobicContact CG-CB 4.46Å; F196-P282 HydrophobicContact CZ-CG 4.05Å
197	S	88.1	Confident	86	Confident	9 Å²	9	31.1 Å²	31.1	6%	0.063	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.3	178.3	176.7	0	0	0	0	110.6	T199 N200 N202 R203	S197-T199 VanDerWaalsContact C-N 3.29Å; S197-T199 PolarHBondContact O-N 3.05Å; S197-T199 PolarHBondContact OG-OG1 3.24Å; S197-T199 VanDerWaalsContact OG-OG1 3.09Å; S197-N200 PolarHBondContact O-N 3.31Å; S197-N200 PolarHBondContact OG-N 3Å; S197-N202 CarbonylContact O-C 3.47Å; S197-N202 WeakPolarHBondContact O-CA 3.49Å; S197-N202 PolarHBondContact O-N 2.66Å; S197-R203 PolarHBondContact N-O 3.42Å; S197-R203 PolarHBondContact O-N 3.48Å
198	R	83.2	Confident	86.1	Confident	133 Å²	133	32.6 Å²	32.6	50%	0.502	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-37.4	178.1	-167.6	76.6	176.4	-169.9	3.8	111.6	N200 E228 I230	R198-N200 VanDerWaalsContact C-N 3.32Å; R198-N200 PolarHBondContact O-N 3.44Å; R198-E228 HydrophobicContact CB-CB 4.28Å; R198-E228 PolarHBondContact N-O 3.09Å; R198-I230 HydrophobicContact CB-CD1 3.93Å; R198-I230 HydrophobicContact CB-CG1 4.4Å; R198-I230 HydrophobicContact CG-CD1 4.1Å
199	T	81	Confident	86	Confident	74 Å²	74	32.2 Å²	32.2	45%	0.454	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-29.7	-177	47.8	0	0	0	0	112.6	S197 N201 G227 E228	S197-T199 VanDerWaalsContact C-N 3.29Å; S197-T199 PolarHBondContact O-N 3.05Å; S197-T199 PolarHBondContact OG-OG1 3.24Å; S197-T199 VanDerWaalsContact OG-OG1 3.09Å; T199-N201 PolarHBondContact O-N 3.17Å; T199-G227 VanDerWaalsContact OG1-CA 3.28Å; T199-G227 WeakPolarHBondContact OG1-CA 3.1Å; T199-E228 HydrophobicContact CG2-CB 4.26Å
200	N	81.6	Confident	85.4	Confident	76 Å²	76	34.4 Å²	34.4	41%	0.406	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	53	-179.8	-69.3	-8.6	0	0	0	112	S197 R198 N202 R203	S197-N200 PolarHBondContact O-N 3.31Å; S197-N200 PolarHBondContact OG-N 3Å; R198-N200 VanDerWaalsContact C-N 3.32Å; R198-N200 PolarHBondContact O-N 3.44Å; N200-N202 VanDerWaalsContact C-N 3.29Å; N200-N202 PolarHBondContact O-N 3.19Å; N200-R203 HydrophobicContact CB-CB 4.11Å; N200-R203 VanDerWaalsContact O-CB 3.27Å; N200-R203 WeakPolarHBondContact O-CB 3.34Å; N200-R203 PolarHBondContact O-N 3.39Å
201	N	84.3	Confident	84.5	Confident	89 Å²	89	35.6 Å²	35.6	48%	0.476	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	46.2	179.1	-64.3	-21.7	0	0	0	113.2	T199 R203 H279	T199-N201 PolarHBondContact O-N 3.17Å; N201-R203 VanDerWaalsContact C-N 3.26Å; N201-R203 PolarHBondContact O-N 3.2Å; N201-H279 PolarHBondContact O-ND1 2.73Å
202	N	90	Very high	83.4	Confident	16 Å²	16	38.4 Å²	38.4	9%	0.086	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	38.6	-176.6	-56.7	-24	0	0	0	114.2	F196 S197 N200 L204 H279 V280 E281	F196-N202 HydrophobicContact CD2-CB 3.89Å; F196-N202 HydrophobicContact CE2-CB 4.3Å; S197-N202 CarbonylContact O-C 3.47Å; S197-N202 WeakPolarHBondContact O-CA 3.49Å; S197-N202 PolarHBondContact O-N 2.66Å; N200-N202 VanDerWaalsContact C-N 3.29Å; N200-N202 PolarHBondContact O-N 3.19Å; N202-L204 PolarHBondContact O-N 2.7Å; N202-H279 WeakPolarHBondContact O-CA 3.43Å; N202-V280 WeakPolarHBondContact CB-O 3.49Å; N202-V280 PolarHBondContact ND2-O 2.98Å; N202-V280 PolarHBondContact O-N 2.9Å; N202-E281 PolarHBondContact ND2-OE2 3.13Å
203	R	89.6	Confident	81.9	Confident	44 Å²	44	48.7 Å²	48.7	17%	0.166	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	130.7	174.9	171.9	173.8	153.6	179.7	-12.7	110.7	F196 S197 N200 N201 E271 I278	F196-R203 CarbonylContact C-O 3.58Å; F196-R203 WeakPolarHBondContact CA-O 3.49Å; F196-R203 VanDerWaalsContact CB-O 3.28Å; F196-R203 WeakPolarHBondContact CB-O 3.15Å; S197-R203 PolarHBondContact N-O 3.42Å; S197-R203 PolarHBondContact O-N 3.48Å; N200-R203 HydrophobicContact CB-CB 4.11Å; N200-R203 VanDerWaalsContact O-CB 3.27Å; N200-R203 WeakPolarHBondContact O-CB 3.34Å; N200-R203 PolarHBondContact O-N 3.39Å; N201-R203 VanDerWaalsContact C-N 3.26Å; N201-R203 PolarHBondContact O-N 3.2Å; R203-E271 IonicContact CZ-OE1 3.26Å; R203-E271 IonicContact CZ-OE2 3.62Å; R203-E271 IonicContact NE-OE1 2.95Å; R203-E271 IonicContact NE-OE2 3.85Å; R203-E271 IonicContact NH1-OE1 3.83Å; R203-E271 PolarHBondContact NH1-OE1 3.28Å; R203-E271 IonicContact NH2-OE1 2.64Å; R203-E271 PolarHBondContact NH2-OE1 2.51Å; R203-E271 IonicContact NH2-OE2 3.17Å; R203-E271 PolarHBondContact NH2-OE2 2.96Å; R203-I278 CarbonylContact C-O 3.59Å; R203-I278 WeakPolarHBondContact CA-O 3.5Å
204	L	90.8	Very high	80.6	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	136.3	175.2	-174.2	65.8	0	0	0	110.2	L173 V194 N202 N206 L207 V264 L268 I278 V280	L173-L204 HydrophobicContact CD1-CD2 4.19Å; V194-L204 HydrophobicContact CG1-CD1 3.47Å; V194-L204 VanDerWaalsContact CG1-CD1 3.47Å; N202-L204 PolarHBondContact O-N 2.7Å; L204-N206 WeakPolarHBondContact CD1-O 3.48Å; L204-L207 HydrophobicContact CD1-CB 4.13Å; L204-L207 HydrophobicContact CD2-CB 4.23Å; L204-V264 HydrophobicContact CD2-CG1 3.58Å; L204-L268 HydrophobicContact CD2-CD1 3.97Å; L204-L268 HydrophobicContact CD2-CD2 4.46Å; L204-L268 HydrophobicContact CG-CD1 4.27Å; L204-L268 HydrophobicContact CG-CD2 4.35Å; L204-I278 HydrophobicContact CB-CB 4.1Å; L204-I278 HydrophobicContact CB-CG2 4.06Å; L204-I278 WeakPolarHBondContact CB-O 3.47Å; L204-I278 HydrophobicContact CD2-CB 4.16Å; L204-I278 HydrophobicContact CD2-CG2 3.72Å; L204-I278 PolarHBondContact N-O 3.02Å; L204-V280 HydrophobicContact CB-CG2 4Å; L204-V280 HydrophobicContact CD1-CG2 3.56Å; L204-V280 HydrophobicContact CG-CG2 4.29Å
205	I	85.7	Confident	79	Confident	22 Å²	22	60 Å²	60	11%	0.113	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-47.2	173.1	-61.3	173	0	0	0	109.4	I195 V218 D222 V229	I195-I205 HydrophobicContact CB-CB 4.46Å; I195-I205 HydrophobicContact CG2-CB 4.13Å; I195-I205 HydrophobicContact CG2-CD1 4.26Å; I195-I205 HydrophobicContact CG2-CG2 4.44Å; I195-I205 WeakPolarHBondContact O-CB 3.39Å; I195-I205 PolarHBondContact O-N 3.05Å; I205-V218 HydrophobicContact CG2-CG1 4.07Å; I205-D222 HydrophobicContact CG2-CB 3.79Å; I205-V229 HydrophobicContact CD1-CG1 4Å; I205-V229 HydrophobicContact CD1-CG2 4.04Å
206	N	86.4	Confident	77.6	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.043	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	147	176.5	-164.6	10.7	0	0	0	110.8	I195 L204 S216 V218	I195-N206 HydrophobicContact CB-CB 4.42Å; I195-N206 HydrophobicContact CD1-CB 4.43Å; I195-N206 PolarHBondContact N-O 3.29Å; I195-N206 PolarHBondContact O-N 3.03Å; L204-N206 WeakPolarHBondContact CD1-O 3.48Å; N206-S216 VanDerWaalsContact CG-OG 3.32Å; N206-S216 PolarHBondContact ND2-O 2.67Å; N206-S216 VanDerWaalsContact ND2-O 3.13Å; N206-S216 PolarHBondContact ND2-OG 3.42Å; N206-S216 PolarHBondContact OD1-OG 3.23Å; N206-V218 HydrophobicContact CB-CG2 3.94Å; N206-V218 WeakPolarHBondContact ND2-CG2 3.26Å
207	L	86.6	Confident	76.5	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.026	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	127.8	174.7	-173.6	146.6	0	0	0	108.6	L173 V192 V194 L204 V264	L173-L207 HydrophobicContact CD1-CD1 3.68Å; V192-L207 HydrophobicContact CG1-CD2 4.23Å; V194-L207 HydrophobicContact CG2-CD1 4.22Å; V194-L207 HydrophobicContact CG2-CG 4.35Å; L204-L207 HydrophobicContact CD1-CB 4.13Å; L204-L207 HydrophobicContact CD2-CB 4.23Å; L207-V264 HydrophobicContact CB-CG1 4.31Å
208	F	83.6	Confident	75.6	Confident	35 Å²	35	68.2 Å²	68.2	15%	0.154	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	138.9	172.8	56.1	-83	0	0	0	111.1	N193 L215	N193-F208 HydrophobicContact CB-CD1 4.19Å; N193-F208 HydrophobicContact CB-CD2 3.86Å; N193-F208 HydrophobicContact CB-CE1 3.73Å; N193-F208 HydrophobicContact CB-CE2 3.4Å; N193-F208 VanDerWaalsContact CB-CE2 3.4Å; N193-F208 HydrophobicContact CB-CG 4.24Å; N193-F208 HydrophobicContact CB-CZ 3.31Å; N193-F208 PolarHBondContact N-O 2.98Å; N193-F208 WeakPolarHBondContact ND2-CE2 3.08Å; N193-F208 PolarHBondContact O-N 3.22Å; F208-L215 HydrophobicContact CE2-CD2 4.26Å
209	H	77.2	Confident	74.8	Confident	27 Å²	27	66.6 Å²	66.6	13%	0.125	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.5	177.5	-71.8	-96.9	0	0	0	110.2	V192 S211 N212 D237 D261	V192-H209 WeakPolarHBondContact CG1-CE1 3.32Å; V192-H209 VanDerWaalsContact CG1-ND1 3.27Å; V192-H209 WeakPolarHBondContact CG1-ND1 3.32Å; H209-S211 PolarHBondContact O-N 3.42Å; H209-S211 VanDerWaalsContact O-N 3.15Å; H209-N212 CarbonylContact O-C 3.49Å; H209-N212 PolarHBondContact O-N 3.07Å; H209-D237 IonicContact CE1-OD2 3.45Å; H209-D237 IonicContact NE2-OD2 2.64Å; H209-D261 IonicContact CD2-OD1 2.89Å; H209-D261 IonicContact CD2-OD2 3.13Å; H209-D261 IonicContact CE1-OD1 3.11Å; H209-D261 IonicContact CE1-OD2 2.95Å; H209-D261 VanDerWaalsContact NE2-CG 3.26Å; H209-D261 IonicContact NE2-OD1 2.91Å; H209-D261 PolarHBondContact NE2-OD1 2.81Å; H209-D261 IonicContact NE2-OD2 2.71Å; H209-D261 PolarHBondContact NE2-OD2 3.26Å
210	E	70.2	Confident	74.3	Confident	73 Å²	73	68.5 Å²	68.5	34%	0.341	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.8	178.9	-76.6	-166.5	155.3	0	0	113.3	K191 N212	K191-E210 VanDerWaalsContact CD-OE2 3.25Å; K191-E210 WeakPolarHBondContact CD-OE2 3.48Å; K191-E210 WeakPolarHBondContact CE-OE1 3.26Å; K191-E210 WeakPolarHBondContact CE-OE2 3.28Å; K191-E210 HydrophobicContact CG-CG 4.43Å; K191-E210 IonicContact NZ-OE1 2.67Å; K191-E210 PolarHBondContact NZ-OE1 2.9Å; K191-E210 IonicContact NZ-OE2 3.71Å; K191-E210 PolarHBondContact NZ-OE2 3.34Å; K191-E210 PolarHBondContact O-N 3Å; E210-N212 VanDerWaalsContact C-N 3.32Å
211	S	65	Low	73.8	Confident	49 Å²	49	67.7 Å²	67.7	34%	0.343	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-33	175.4	60.1	0	0	0	0	112.2	H209	H209-S211 PolarHBondContact O-N 3.42Å; H209-S211 VanDerWaalsContact O-N 3.15Å
212	N	64.8	Low	73	Confident	102 Å²	102	64.8 Å²	64.8	55%	0.545	34%	0.339	S	S	.	.			trans	-98.2	96.5	172.7	-96.7	-14.1	0	0	0	109.3	H209 E210 D214	H209-N212 CarbonylContact O-C 3.49Å; H209-N212 PolarHBondContact O-N 3.07Å; E210-N212 VanDerWaalsContact C-N 3.32Å; N212-D214 PolarHBondContact O-N 3.45Å; N212-D214 VanDerWaalsContact O-N 3.13Å
213	R	57.2	Low	72	Confident	217 Å²	217	67.6 Å²	67.6	82%	0.819	35%	0.354	S	S	*	.			trans	-71.3	0.4	178.4	-69.2	-168	179.1	-164.5	-2	114.7	L215	R213-L215 VanDerWaalsContact C-N 3.34Å; R213-L215 PolarHBondContact O-N 2.87Å
214	D	59.3	Low	71	Confident	115 Å²	115	72.2 Å²	72.2	62%	0.615	38%	0.379	S	S	*	.			trans	-71.7	97.9	172.9	-71.4	-23.3	0	0	0	107.1	N212 S216	N212-D214 PolarHBondContact O-N 3.45Å; N212-D214 VanDerWaalsContact O-N 3.13Å; D214-S216 PolarHBondContact O-N 2.84Å
215	L	56.2	Low	70	Confident	141 Å²	141	76.8 Å²	76.8	74%	0.738	40%	0.399	S	S	*	.			trans	-59.8	110	176.1	-72.3	160.2	0	0	0	107.7	F208 R213 P217	F208-L215 HydrophobicContact CE2-CD2 4.26Å; R213-L215 VanDerWaalsContact C-N 3.34Å; R213-L215 PolarHBondContact O-N 2.87Å; L215-P217 WeakPolarHBondContact O-CD 3.45Å
216	S	60.6	Low	68.7	Low	34 Å²	34	81.9 Å²	81.9	24%	0.238	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-64.2	121.5	168.2	47.6	0	0	0	0	107.6	N206 D214 V218	N206-S216 VanDerWaalsContact CG-OG 3.32Å; N206-S216 PolarHBondContact ND2-O 2.67Å; N206-S216 VanDerWaalsContact ND2-O 3.13Å; N206-S216 PolarHBondContact ND2-OG 3.42Å; N206-S216 PolarHBondContact OD1-OG 3.23Å; D214-S216 PolarHBondContact O-N 2.84Å; S216-V218 PolarHBondContact O-N 3.28Å
217	P	65.8	Low	67.9	Low	125 Å²	125	83.4 Å²	83.4	81%	0.812	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-61.3	128.4	-179.1	24.3	-32	0	0	0	109.1	L215	L215-P217 WeakPolarHBondContact O-CD 3.45Å
218	V	67.9	Low	67.6	Low	46 Å²	46	89 Å²	89	28%	0.279	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-84	125.8	171.9	-177	0	0	0	0	107.7	I195 I205 N206 S216 L220 L223	I195-V218 HydrophobicContact CD1-CG2 3.98Å; I205-V218 HydrophobicContact CG2-CG1 4.07Å; N206-V218 HydrophobicContact CB-CG2 3.94Å; N206-V218 WeakPolarHBondContact ND2-CG2 3.26Å; S216-V218 PolarHBondContact O-N 3.28Å; V218-L220 PolarHBondContact O-N 3.22Å; V218-L223 HydrophobicContact CB-CD1 4.19Å; V218-L223 HydrophobicContact CG1-CD1 3.54Å; V218-L223 HydrophobicContact CG1-CD2 4.48Å; V218-L223 HydrophobicContact CG1-CG 3.8Å
219	L	67.5	Low	67.6	Low	100 Å²	100	89.8 Å²	89.8	52%	0.524	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-65.9	123.3	175.1	-162.4	68.9	0	0	0	109.2	S221 D222	L219-S221 WeakPolarHBondContact CD2-OG 3.45Å; L219-S221 WeakPolarHBondContact CG-OG 3.45Å; L219-S221 PolarHBondContact O-N 3.1Å; L219-S221 VanDerWaalsContact O-N 3.15Å; L219-D222 PolarHBondContact O-N 2.96Å
220	L	70.2	Confident	67.9	Low	113 Å²	113	90.7 Å²	90.7	59%	0.592	49%	0.49	S	S	*	.	H	α-helix	trans	-60.1	-30.1	-174.9	-157.4	80.7	0	0	0	112	V218 D222 L223 M224	V218-L220 PolarHBondContact O-N 3.22Å; L220-D222 VanDerWaalsContact C-N 3.28Å; L220-D222 PolarHBondContact O-N 3.26Å; L220-L223 PolarHBondContact O-N 2.91Å; L220-M224 HydrophobicContact CD2-CE 3.45Å; L220-M224 VanDerWaalsContact CD2-CE 3.45Å; L220-M224 HydrophobicContact CD2-SD 4.2Å; L220-M224 HydrophobicContact CG-CE 4Å; L220-M224 HydrophobicContact CG-SD 4.43Å; L220-M224 WeakPolarHBondContact O-CG 3.28Å; L220-M224 PolarHBondContact O-N 3.29Å
221	S	70.2	Confident	68.8	Low	59 Å²	59	93.4 Å²	93.4	41%	0.413	50%	0.503	S	S	.	.	H	α-helix	trans	-61.3	-34	177.5	55.5	0	0	0	0	112.7	L219 M224 K225	L219-S221 WeakPolarHBondContact CD2-OG 3.45Å; L219-S221 WeakPolarHBondContact CG-OG 3.45Å; L219-S221 PolarHBondContact O-N 3.1Å; L219-S221 VanDerWaalsContact O-N 3.15Å; S221-M224 PolarHBondContact O-N 3.48Å; S221-K225 PolarHBondContact O-N 3.46Å
222	D	68.5	Low	69.8	Low	28 Å²	28	92.4 Å²	92.4	15%	0.15	50%	0.495	C	S	.	.	H	α-helix	trans	-73.7	-31.2	178.7	-70.2	-41	0	0	0	112.8	I205 L219 L220 K225	I205-D222 HydrophobicContact CG2-CB 3.79Å; L219-D222 PolarHBondContact O-N 2.96Å; L220-D222 VanDerWaalsContact C-N 3.28Å; L220-D222 PolarHBondContact O-N 3.26Å; D222-K225 IonicContact OD1-NZ 3.4Å; D222-K225 PolarHBondContact OD1-NZ 2.84Å
223	L	69.6	Low	70.8	Confident	76 Å²	76	90 Å²	90	40%	0.398	49%	0.487	S	S	.	.	H	α-helix	trans	-74.8	-27.1	172.2	-71.6	161.3	0	0	0	112.3	V218 L220 V229	V218-L223 HydrophobicContact CB-CD1 4.19Å; V218-L223 HydrophobicContact CG1-CD1 3.54Å; V218-L223 HydrophobicContact CG1-CD2 4.48Å; V218-L223 HydrophobicContact CG1-CG 3.8Å; L220-L223 PolarHBondContact O-N 2.91Å; L223-V229 HydrophobicContact CD2-CG1 4.15Å
224	M	68.5	Low	72.2	Confident	141 Å²	141	84.6 Å²	84.6	70%	0.695	47%	0.471	S	S	*	.	H	α-helix	trans	-83.9	-11.4	-179.8	-75.6	-174.5	170.7	0	0	113.9	L220 S221	L220-M224 HydrophobicContact CD2-CE 3.45Å; L220-M224 VanDerWaalsContact CD2-CE 3.45Å; L220-M224 HydrophobicContact CD2-SD 4.2Å; L220-M224 HydrophobicContact CG-CE 4Å; L220-M224 HydrophobicContact CG-SD 4.43Å; L220-M224 WeakPolarHBondContact O-CG 3.28Å; L220-M224 PolarHBondContact O-N 3.29Å; S221-M224 PolarHBondContact O-N 3.48Å
225	K	69.9	Low	73.7	Confident	96 Å²	96	79.3 Å²	79.3	42%	0.417	44%	0.442	S	S	.	.	S	Bend	trans	-61.7	136.7	174.3	-76.5	168.6	-176.3	162.3	0	109.7	S221 D222 G227	S221-K225 PolarHBondContact O-N 3.46Å; D222-K225 IonicContact OD1-NZ 3.4Å; D222-K225 PolarHBondContact OD1-NZ 2.84Å; K225-G227 PolarHBondContact O-N 2.86Å
226	P	58.4	Low	75.3	Confident	130 Å²	130	72.6 Å²	72.6	84%	0.844	41%	0.407	S	S	*	.	S	Bend	trans	-63.2	114.3	-178	24.9	-32.4	0	0	0	110
227	G	69.2	Low	76.7	Confident	39 Å²	39	71.8 Å²	71.8	40%	0.402	40%	0.4	S	S	.	.	S	Bend	trans	171	162.9	-178.9	0	0	0	0	0	113.4	T199 K225 V229	T199-G227 VanDerWaalsContact OG1-CA 3.28Å; T199-G227 WeakPolarHBondContact OG1-CA 3.1Å; K225-G227 PolarHBondContact O-N 2.86Å; G227-V229 PolarHBondContact O-N 2.84Å
228	E	79	Confident	77.9	Confident	124 Å²	124	65.9 Å²	65.9	58%	0.579	36%	0.362	S	S	*	.			trans	-82.8	109.5	171.5	-170.1	178.8	-173.4	0	0	108.4	R198 T199	R198-E228 HydrophobicContact CB-CB 4.28Å; R198-E228 PolarHBondContact N-O 3.09Å; T199-E228 HydrophobicContact CG2-CB 4.26Å
229	V	83.8	Confident	78.9	Confident	50 Å²	50	67.5 Å²	67.5	30%	0.303	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	129.7	173.7	-179.6	0	0	0	0	108.5	I195 I205 L223 G227	I195-V229 HydrophobicContact CG2-CG1 3.42Å; I195-V229 VanDerWaalsContact CG2-CG1 3.42Å; I205-V229 HydrophobicContact CD1-CG1 4Å; I205-V229 HydrophobicContact CD1-CG2 4.04Å; L223-V229 HydrophobicContact CD2-CG1 4.15Å; G227-V229 PolarHBondContact O-N 2.84Å
230	I	85.3	Confident	80.2	Confident	46 Å²	46	62.8 Å²	62.8	24%	0.236	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.3	177.7	-60.2	178.8	0	0	0	108.4	I195 F196 R198	I195-I230 WeakPolarHBondContact CA-O 2.96Å; F196-I230 HydrophobicContact CE1-CB 4.27Å; F196-I230 HydrophobicContact CE1-CG2 4.1Å; F196-I230 HydrophobicContact CE2-CB 4.21Å; F196-I230 HydrophobicContact CE2-CD1 4.24Å; F196-I230 HydrophobicContact CZ-CB 4.01Å; F196-I230 HydrophobicContact CZ-CD1 4.39Å; F196-I230 HydrophobicContact CZ-CG2 3.92Å; F196-I230 PolarHBondContact N-O 3.33Å; F196-I230 PolarHBondContact O-N 2.88Å; R198-I230 HydrophobicContact CB-CD1 3.93Å; R198-I230 HydrophobicContact CB-CG1 4.4Å; R198-I230 HydrophobicContact CG-CD1 4.1Å
231	E	87.2	Confident	81.5	Confident	131 Å²	131	57.6 Å²	57.6	61%	0.612	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	127.7	163.9	-176.2	-175.2	176.8	0	0	108.8	V194 I195	V194-E231 WeakPolarHBondContact O-CA 3.18Å; I195-E231 HydrophobicContact CG1-CB 4.35Å; I195-E231 HydrophobicContact CG1-CG 4.14Å
232	S	86.1	Confident	82.7	Confident	27 Å²	27	54.8 Å²	54.8	19%	0.189	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	122.4	174.9	179.6	0	0	0	0	110.9	V194 Q234	V194-S232 PolarHBondContact N-O 3.38Å; V194-S232 PolarHBondContact O-N 2.8Å; S232-Q234 PolarHBondContact OG-N 3.25Å
233	S	85.6	Confident	84	Confident	52 Å²	52	53.4 Å²	53.4	36%	0.364	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	8.3	172.7	58.8	0	0	0	0	113	K191 N193	K191-S233 WeakPolarHBondContact CE-O 3.25Å; N193-S233 WeakPolarHBondContact OD1-CA 3.18Å; N193-S233 WeakPolarHBondContact OD1-CB 3.35Å
234	Q	87.5	Confident	85.1	Confident	104 Å²	104	49.8 Å²	49.8	49%	0.486	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	9.9	-176.8	-63.4	-172.3	-7.1	0	0	113.7	S177 I178 S232 K285	S177-Q234 WeakPolarHBondContact CA-O 3.23Å; I178-Q234 WeakPolarHBondContact CG1-O 3.46Å; I178-Q234 PolarHBondContact N-O 3.2Å; S232-Q234 PolarHBondContact OG-N 3.25Å; Q234-K285 VanDerWaalsContact OE1-NZ 3.16Å
235	L	90.8	Very high	86.2	Confident	3 Å²	3	46.1 Å²	46.1	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	151.5	-173.4	-61.4	178.3	0	0	0	110.8	L175 P176 K191 V192 V194 P282	L175-L235 HydrophobicContact CB-CB 4.06Å; L175-L235 HydrophobicContact CB-CD1 4.18Å; L175-L235 HydrophobicContact CB-CD2 4.41Å; L175-L235 HydrophobicContact CB-CG 4.43Å; L175-L235 HydrophobicContact CD1-CB 4.31Å; L175-L235 HydrophobicContact CD1-CD1 4.03Å; P176-L235 WeakPolarHBondContact O-CA 3.33Å; K191-L235 WeakPolarHBondContact CA-O 3.3Å; V192-L235 HydrophobicContact CG2-CB 4.28Å; V192-L235 PolarHBondContact N-O 3.07Å; V194-L235 HydrophobicContact CB-CD1 4.49Å; V194-L235 HydrophobicContact CG2-CD1 4.48Å; L235-P282 HydrophobicContact CD1-CG 4.46Å; L235-P282 HydrophobicContact CD2-CB 4.15Å
236	M	90.6	Very high	87.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140.2	176.4	-59.8	170	-56.9	0	0	109.5	L175 P176 S177 I178 I182 A187 L190	L175-M236 WeakPolarHBondContact CD2-O 3.37Å; P176-M236 HydrophobicContact CB-CE 4.15Å; P176-M236 VanDerWaalsContact CD-O 3.31Å; P176-M236 WeakPolarHBondContact CD-O 3.5Å; P176-M236 HydrophobicContact CG-CB 4.5Å; P176-M236 HydrophobicContact CG-CE 4.06Å; P176-M236 PolarHBondContact O-N 2.89Å; S177-M236 WeakPolarHBondContact O-CE 3.05Å; I178-M236 HydrophobicContact CB-SD 4.35Å; I178-M236 HydrophobicContact CG1-CG 3.69Å; I178-M236 HydrophobicContact CG1-SD 3.79Å; I182-M236 HydrophobicContact CD1-CE 3.32Å; I182-M236 HydrophobicContact CD1-SD 3.46Å; I182-M236 WeakPolarHBondContact CD1-SD 3.44Å; I182-M236 HydrophobicContact CG2-SD 4.38Å; A187-M236 HydrophobicContact CB-SD 4.48Å; L190-M236 HydrophobicContact CB-CB 4.21Å; L190-M236 CarbonylContact O-C 3.55Å; L190-M236 VanDerWaalsContact O-CA 3.25Å; L190-M236 WeakPolarHBondContact O-CA 3.35Å
237	D	90.1	Very high	88.8	Confident	17 Å²	17	38.5 Å²	38.5	9%	0.091	21%	0.206	C	C	.	.			trans	-93.1	117.7	167.2	-176.1	14.1	0	0	0	109.6	L175 L190 V192 H209 Q239	L175-D237 HydrophobicContact CD2-CB 4.18Å; L190-D237 WeakPolarHBondContact CD2-O 3.21Å; L190-D237 PolarHBondContact O-N 3.37Å; V192-D237 HydrophobicContact CG1-CB 3.79Å; V192-D237 HydrophobicContact CG2-CB 4.25Å; H209-D237 IonicContact CE1-OD2 3.45Å; H209-D237 IonicContact NE2-OD2 2.64Å; D237-Q239 PolarHBondContact OD1-N 3.32Å
238	I	89.6	Confident	90	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	19%	0.187	C	C	.	.			trans	-114	18	177.7	57.9	160.2	0	0	0	111.4	P143 L146 P176 L240 V289	P143-I238 WeakPolarHBondContact CG-O 3.47Å; L146-I238 HydrophobicContact CD1-CD1 3.82Å; P176-I238 HydrophobicContact CG-CD1 3.88Å; P176-I238 HydrophobicContact CG-CG1 3.96Å; P176-I238 HydrophobicContact CG-CG2 4.2Å; I238-L240 HydrophobicContact CD1-CB 3.92Å; I238-L240 HydrophobicContact CD1-CD2 4.16Å; I238-L240 HydrophobicContact CG1-CB 3.81Å; I238-L240 PolarHBondContact O-N 3.02Å; I238-V289 HydrophobicContact CD1-CG1 3.68Å
239	Q	90	Very high	90.6	Very high	81 Å²	81	32.6 Å²	32.6	38%	0.379	17%	0.172	S	C	.	.	S	Bend	trans	60.7	32.1	-176.2	-54	178.6	-27.4	0	0	113.3	D237	D237-Q239 PolarHBondContact OD1-N 3.32Å
240	L	94.8	Very high	91.1	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.159	C	C	.	.			trans	-100.4	113.9	175.2	-174.5	65.4	0	0	0	109.1	L140 A142 L146 L152 L174 I238 L283 V289	L140-L240 HydrophobicContact CD1-CD1 4Å; L140-L240 HydrophobicContact CG-CD1 4.48Å; A142-L240 HydrophobicContact CB-CD1 3.55Å; L146-L240 HydrophobicContact CD2-CD1 3.93Å; L152-L240 HydrophobicContact CD1-CD1 4.33Å; L152-L240 HydrophobicContact CD2-CD2 4Å; L174-L240 HydrophobicContact CB-CB 4.35Å; L174-L240 HydrophobicContact CB-CD2 3.92Å; L174-L240 HydrophobicContact CB-CG 3.9Å; L174-L240 HydrophobicContact CD1-CD2 4.08Å; L174-L240 HydrophobicContact CD1-CG 3.88Å; L174-L240 PolarHBondContact N-O 3.25Å; I238-L240 HydrophobicContact CD1-CB 3.92Å; I238-L240 HydrophobicContact CD1-CD2 4.16Å; I238-L240 HydrophobicContact CG1-CB 3.81Å; I238-L240 PolarHBondContact O-N 3.02Å; L240-L283 HydrophobicContact CD2-CD1 4.44Å; L240-V289 HydrophobicContact CD2-CG1 4.16Å
241	S	96	Very high	91.4	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.021	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	155.8	-176.4	55.7	0	0	0	0	112.1	L141 T172	L141-S241 PolarHBondContact N-O 3.21Å; L141-S241 PolarHBondContact O-N 2.91Å; L141-S241 VanDerWaalsContact O-O 3.11Å; T172-S241 CarbonylContact O-C 3.56Å; T172-S241 WeakPolarHBondContact O-CA 3.43Å
242	I	96.6	Very high	91.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	117.8	171.9	-53	168.7	0	0	0	106.1	L140 F155 V156 H159 L171 T172 L174	L140-I242 HydrophobicContact CD1-CG1 4.17Å; F155-I242 VanDerWaalsContact C-CD1 3.43Å; F155-I242 HydrophobicContact CB-CD1 3.78Å; F155-I242 WeakPolarHBondContact O-CD1 3.18Å; V156-I242 HydrophobicContact CG2-CD1 4.14Å; V156-I242 HydrophobicContact CG2-CG1 4.27Å; V156-I242 HydrophobicContact CG2-CG2 4.43Å; H159-I242 HydrophobicContact CB-CD1 4.19Å; H159-I242 HydrophobicContact CB-CG2 4Å; L171-I242 WeakPolarHBondContact CA-O 3.42Å; T172-I242 PolarHBondContact N-O 2.79Å; T172-I242 PolarHBondContact O-N 2.75Å; L174-I242 HydrophobicContact CD1-CD1 4Å; L174-I242 HydrophobicContact CD1-CG1 3.81Å; L174-I242 HydrophobicContact CD2-CD1 4.23Å; L174-I242 HydrophobicContact CG-CD1 4.3Å; L174-I242 HydrophobicContact CG-CG1 4.28Å
243	C	95.2	Very high	91.9	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.6	-174.2	-63.3	0	0	0	0	109.7	D138 F139 I247	D138-C243 WeakPolarHBondContact CA-O 3.34Å; F139-C243 HydrophobicContact CD1-CB 4.1Å; F139-C243 WeakPolarHBondContact CD1-O 3.28Å; F139-C243 HydrophobicContact CD2-CB 4.24Å; F139-C243 HydrophobicContact CE1-CB 3.53Å; F139-C243 HydrophobicContact CE2-CB 3.7Å; F139-C243 HydrophobicContact CG-CB 4.45Å; F139-C243 HydrophobicContact CZ-CB 3.32Å; F139-C243 PolarHBondContact N-O 2.96Å; F139-C243 PolarHBondContact O-N 3.03Å; C243-I247 HydrophobicContact CB-CB 4.33Å; C243-I247 HydrophobicContact CB-CG1 3.98Å
244	G	93.2	Very high	92.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	159.6	164.4	0	0	0	0	0	111.8	I170 H246 I247	I170-G244 PolarHBondContact O-N 2.83Å; G244-H246 PolarHBondContact O-N 3.19Å; G244-I247 WeakPolarHBondContact O-CB 3.28Å; G244-I247 WeakPolarHBondContact O-CG1 3.21Å; G244-I247 PolarHBondContact O-N 3.29Å
245	N	90.5	Very high	92.3	Very high	64 Å²	64	32.5 Å²	32.5	34%	0.342	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-15	172.8	63.9	-24.5	0	0	0	115.5	V136 S137 R163 I247 P249	V136-N245 WeakPolarHBondContact O-CB 3.27Å; S137-N245 WeakPolarHBondContact O-CB 3.5Å; S137-N245 PolarHBondContact O-N 3.5Å; R163-N245 PolarHBondContact NH1-OD1 3.15Å; R163-N245 PolarHBondContact NH2-OD1 2.97Å; N245-I247 VanDerWaalsContact C-N 3.34Å; N245-P249 WeakPolarHBondContact O-CD 3.42Å
246	H	90.6	Very high	92.3	Very high	66 Å²	66	37.8 Å²	37.8	31%	0.306	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-18.8	174.6	-58.7	-67.5	0	0	0	113.3	R163 I170 G244 P249 L250	R163-H246 PolarHBondContact NH2-CD2 3.49Å; R163-H246 PolarHBondContact NH2-NE2 3.47Å; R163-H246 VanDerWaalsContact NH2-NE2 3.17Å; I170-H246 HydrophobicContact CG2-CB 3.99Å; G244-H246 PolarHBondContact O-N 3.19Å; H246-P249 WeakPolarHBondContact O-CD 3.38Å; H246-L250 VanDerWaalsContact O-CG 3.24Å; H246-L250 WeakPolarHBondContact O-CG 3.43Å; H246-L250 PolarHBondContact O-N 2.91Å
247	I	94	Very high	92.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67	-49.2	-173.9	-57.3	-81.2	0	0	0	112.4	M124 I170 L171 C243 G244 N245 L250 F251 L263	M124-I247 HydrophobicContact CE-CB 4.12Å; M124-I247 HydrophobicContact CE-CG2 3.37Å; I170-I247 HydrophobicContact CB-CD1 4.16Å; I170-I247 HydrophobicContact CD1-CD1 3.91Å; I170-I247 HydrophobicContact CG1-CD1 4.16Å; L171-I247 HydrophobicContact CB-CD1 4.02Å; L171-I247 HydrophobicContact CD1-CD1 4.22Å; C243-I247 HydrophobicContact CB-CB 4.33Å; C243-I247 HydrophobicContact CB-CG1 3.98Å; G244-I247 WeakPolarHBondContact O-CB 3.28Å; G244-I247 WeakPolarHBondContact O-CG1 3.21Å; G244-I247 PolarHBondContact O-N 3.29Å; N245-I247 VanDerWaalsContact C-N 3.34Å; I247-L250 WeakPolarHBondContact O-CB 3.49Å; I247-L250 PolarHBondContact O-N 3.28Å; I247-L250 VanDerWaalsContact O-N 3.11Å; I247-F251 HydrophobicContact CG2-CD2 3.96Å; I247-F251 HydrophobicContact CG2-CE2 3.78Å; I247-F251 WeakPolarHBondContact O-CD2 3.47Å; I247-F251 PolarHBondContact O-N 2.99Å; I247-L263 HydrophobicContact CD1-CD2 3.79Å; I247-L263 HydrophobicContact CG2-CD2 3.86Å
248	P	93.4	Very high	92.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-43	-178.9	-18.3	30.5	0	0	0	113.8	M124 L127 E128 L133 F139 L250 F251 Q252	M124-P248 HydrophobicContact CE-CG 4.05Å; L127-P248 HydrophobicContact CD2-CB 3.85Å; L127-P248 HydrophobicContact CD2-CG 3.51Å; E128-P248 HydrophobicContact CB-CB 3.9Å; L133-P248 HydrophobicContact CD1-CG 4.33Å; F139-P248 HydrophobicContact CE1-CG 4.36Å; F139-P248 HydrophobicContact CZ-CG 4.28Å; P248-L250 VanDerWaalsContact C-N 3.3Å; P248-L250 PolarHBondContact O-N 2.78Å; P248-F251 PolarHBondContact O-N 3.06Å; P248-Q252 PolarHBondContact O-N 3.01Å
249	P	92.1	Very high	92.5	Very high	39 Å²	39	45.7 Å²	45.7	25%	0.253	23%	0.23	S	C	.	.	H	α-helix	trans	-57.3	-37.9	170.9	-27.7	35.5	0	0	0	113.9	E128 N245 H246 F251 Q252 D253	E128-P249 HydrophobicContact CG-CG 4.47Å; N245-P249 WeakPolarHBondContact O-CD 3.42Å; H246-P249 WeakPolarHBondContact O-CD 3.38Å; P249-F251 VanDerWaalsContact C-N 3.3Å; P249-F251 PolarHBondContact O-N 2.92Å; P249-Q252 CarbonylContact O-C 3.58Å; P249-Q252 WeakPolarHBondContact O-CA 3.36Å; P249-Q252 WeakPolarHBondContact O-CB 3.44Å; P249-Q252 PolarHBondContact O-N 3.3Å; P249-D253 PolarHBondContact O-N 3.48Å
250	L	93.1	Very high	92.6	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-36.5	177.9	-74	170.3	0	0	0	113.3	I170 H246 I247 P248 Q252 N254 L263 M274 Y276	I170-L250 HydrophobicContact CD1-CD1 3.75Å; H246-L250 VanDerWaalsContact O-CG 3.24Å; H246-L250 WeakPolarHBondContact O-CG 3.43Å; H246-L250 PolarHBondContact O-N 2.91Å; I247-L250 WeakPolarHBondContact O-CB 3.49Å; I247-L250 PolarHBondContact O-N 3.28Å; I247-L250 VanDerWaalsContact O-N 3.11Å; P248-L250 VanDerWaalsContact C-N 3.3Å; P248-L250 PolarHBondContact O-N 2.78Å; L250-Q252 VanDerWaalsContact C-N 3.31Å; L250-N254 WeakPolarHBondContact O-CB 3.41Å; L250-N254 PolarHBondContact O-N 3.32Å; L250-N254 PolarHBondContact O-ND2 3.47Å; L250-L263 HydrophobicContact CB-CD1 4.1Å; L250-L263 HydrophobicContact CD1-CD1 4.44Å; L250-M274 HydrophobicContact CD2-CE 3.19Å; L250-Y276 HydrophobicContact CD1-CD2 4.16Å; L250-Y276 HydrophobicContact CD1-CE2 4.15Å; L250-Y276 HydrophobicContact CD2-CD2 4.4Å; L250-Y276 HydrophobicContact CD2-CE2 3.93Å; L250-Y276 HydrophobicContact CG-CE2 4.5Å
251	F	93.3	Very high	92.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-72.1	-26.2	173.2	-83.4	-79.3	0	0	0	112.9	G121 M124 R125 I247 P248 P249 L263	G121-F251 VanDerWaalsContact CA-CD1 3.42Å; M124-F251 HydrophobicContact CB-CB 3.89Å; M124-F251 HydrophobicContact CB-CD2 3.58Å; M124-F251 HydrophobicContact CB-CE2 4.2Å; M124-F251 HydrophobicContact CB-CG 3.77Å; M124-F251 HydrophobicContact CE-CD2 4.27Å; M124-F251 HydrophobicContact CE-CE2 4.28Å; M124-F251 HydrophobicContact CG-CD2 3.78Å; M124-F251 HydrophobicContact CG-CE2 3.87Å; M124-F251 HydrophobicContact CG-CG 4.31Å; M124-F251 HydrophobicContact CG-CZ 4.49Å; R125-F251 HydrophobicContact CG-CB 4.3Å; R125-F251 PolarHBondContact NE-O 3.02Å; R125-F251 PolarHBondContact NH2-O 2.84Å; I247-F251 HydrophobicContact CG2-CD2 3.96Å; I247-F251 HydrophobicContact CG2-CE2 3.78Å; I247-F251 WeakPolarHBondContact O-CD2 3.47Å; I247-F251 PolarHBondContact O-N 2.99Å; P248-F251 PolarHBondContact O-N 3.06Å; P249-F251 VanDerWaalsContact C-N 3.3Å; P249-F251 PolarHBondContact O-N 2.92Å; F251-L263 HydrophobicContact CE1-CB 4.45Å; F251-L263 HydrophobicContact CE2-CB 4.29Å; F251-L263 HydrophobicContact CE2-CD1 4.26Å; F251-L263 HydrophobicContact CE2-CD2 3.81Å; F251-L263 HydrophobicContact CE2-CG 4.34Å; F251-L263 HydrophobicContact CZ-CB 3.84Å; F251-L263 HydrophobicContact CZ-CD1 4.5Å; F251-L263 HydrophobicContact CZ-CD2 4.16Å; F251-L263 HydrophobicContact CZ-CG 4.39Å
252	Q	91.1	Very high	92	Very high	89 Å²	89	47.3 Å²	47.3	42%	0.416	24%	0.24	S	C	.	.	H	α-helix	trans	-76.9	-35.3	175.8	-174.1	169.4	-17.4	0	0	111.9	P248 P249 L250 F255	P248-Q252 PolarHBondContact O-N 3.01Å; P249-Q252 CarbonylContact O-C 3.58Å; P249-Q252 WeakPolarHBondContact O-CA 3.36Å; P249-Q252 WeakPolarHBondContact O-CB 3.44Å; P249-Q252 PolarHBondContact O-N 3.3Å; L250-Q252 VanDerWaalsContact C-N 3.31Å; Q252-F255 WeakPolarHBondContact O-CE2 3.47Å; Q252-F255 WeakPolarHBondContact O-CZ 3.32Å
253	D	91.8	Very high	91.8	Very high	122 Å²	122	47.3 Å²	47.3	65%	0.652	24%	0.24	S	C	*	.	H	α-helix	trans	-76.3	-36.2	176.5	-67.2	-22.3	0	0	0	111.9	P249	P249-D253 PolarHBondContact O-N 3.48Å
254	N	92.3	Very high	91.6	Very high	42 Å²	42	47.4 Å²	47.4	23%	0.225	24%	0.241	C	C	.	.			trans	-107.9	91.5	-179.7	-57	-74.8	0	0	0	111	R125 L250 D256 Y257	R125-N254 PolarHBondContact NH2-O 3Å; L250-N254 WeakPolarHBondContact O-CB 3.41Å; L250-N254 PolarHBondContact O-N 3.32Å; L250-N254 PolarHBondContact O-ND2 3.47Å; N254-D256 WeakPolarHBondContact CB-OD1 3.2Å; N254-D256 PolarHBondContact O-N 3.3Å; N254-Y257 HydrophobicContact CB-CD1 4.17Å; N254-Y257 HydrophobicContact CB-CD2 3.48Å; N254-Y257 VanDerWaalsContact CB-CD2 3.48Å; N254-Y257 HydrophobicContact CB-CE1 4.07Å; N254-Y257 HydrophobicContact CB-CE2 3.37Å; N254-Y257 HydrophobicContact CB-CG 3.88Å; N254-Y257 PolarHBondContact O-N 2.89Å
255	F	89	Confident	91.4	Very high	146 Å²	146	50.5 Å²	50.5	64%	0.64	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.5	-176.1	-78.7	-85.8	0	0	0	114.4	R125 Q252 Y257	R125-F255 VanDerWaalsContact NH2-CA 3.25Å; R125-F255 PolarHBondContact NH2-O 3.41Å; Q252-F255 WeakPolarHBondContact O-CE2 3.47Å; Q252-F255 WeakPolarHBondContact O-CZ 3.32Å; F255-Y257 VanDerWaalsContact C-N 3.3Å
256	D	91.1	Very high	91.4	Very high	114 Å²	114	47.8 Å²	47.8	61%	0.61	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-16.9	176.7	55.8	-42.1	0	0	0	113.5	N254 E258	N254-D256 WeakPolarHBondContact CB-OD1 3.2Å; N254-D256 PolarHBondContact O-N 3.3Å; D256-E258 PolarHBondContact O-N 3.28Å
257	Y	93.1	Very high	91.3	Very high	16 Å²	16	44.9 Å²	44.9	6%	0.063	23%	0.231	C	C	.	.			trans	-75.9	110.2	176.3	-61.6	-11.9	0	0	0	111	R125 N254 F255 D262 L263 G266	R125-Y257 PolarHBondContact NH2-O 2.78Å; N254-Y257 HydrophobicContact CB-CD1 4.17Å; N254-Y257 HydrophobicContact CB-CD2 3.48Å; N254-Y257 VanDerWaalsContact CB-CD2 3.48Å; N254-Y257 HydrophobicContact CB-CE1 4.07Å; N254-Y257 HydrophobicContact CB-CE2 3.37Å; N254-Y257 HydrophobicContact CB-CG 3.88Å; N254-Y257 PolarHBondContact O-N 2.89Å; F255-Y257 VanDerWaalsContact C-N 3.3Å; Y257-D262 HydrophobicContact CD1-CB 4.06Å; Y257-D262 HydrophobicContact CG-CB 4.41Å; Y257-L263 HydrophobicContact CD2-CB 4.36Å; Y257-L263 HydrophobicContact CD2-CD1 3.8Å; Y257-L263 HydrophobicContact CE2-CD1 3.88Å; Y257-G266 WeakPolarHBondContact OH-CA 3.46Å
258	E	91.1	Very high	91.1	Very high	113 Å²	113	46.5 Å²	46.5	53%	0.528	24%	0.24	S	C	.	.			trans	-99	-35.4	177	-63	-169.5	167.8	0	0	112.1	N119 L120 G121 D256 D262	N119-E258 HydrophobicContact CB-CB 4.23Å; N119-E258 WeakPolarHBondContact CB-O 3.47Å; L120-E258 PolarHBondContact N-O 2.74Å; L120-E258 VanDerWaalsContact N-O 3.16Å; G121-E258 PolarHBondContact N-O 3.22Å; D256-E258 PolarHBondContact O-N 3.28Å; E258-D262 PolarHBondContact N-OD2 3.04Å
259	T	90.9	Very high	90.7	Very high	56 Å²	56	51.5 Å²	51.5	34%	0.344	27%	0.271	S	S	.	.	S	Bend	trans	-121.5	169.9	-174	69.3	0	0	0	0	112.5	D261 D262 L263	T259-D261 VanDerWaalsContact C-N 3.25Å; T259-D261 PolarHBondContact O-N 3.38Å; T259-D261 PolarHBondContact OG1-N 3.08Å; T259-D262 WeakPolarHBondContact CB-OD2 3.36Å; T259-D262 PolarHBondContact N-OD2 3.06Å; T259-D262 PolarHBondContact O-N 2.92Å; T259-D262 PolarHBondContact OG1-N 3.12Å; T259-D262 PolarHBondContact OG1-OD2 3.47Å; T259-L263 PolarHBondContact O-N 3.39Å
260	M	90.8	Very high	90.3	Very high	16 Å²	16	52.9 Å²	52.9	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-66.3	-32.4	173	-173.8	59.7	75.2	0	0	111.1	L120 L141 L171 D262 L263 V264	L120-M260 HydrophobicContact CD2-CB 3.72Å; L120-M260 HydrophobicContact CD2-CE 4.1Å; L141-M260 HydrophobicContact CD2-CE 3.58Å; L171-M260 HydrophobicContact CD1-CE 4.45Å; L171-M260 HydrophobicContact CD1-SD 4.39Å; L171-M260 HydrophobicContact CD2-SD 3.87Å; M260-D262 VanDerWaalsContact C-N 3.32Å; M260-D262 PolarHBondContact O-N 2.84Å; M260-L263 PolarHBondContact O-N 3.28Å; M260-L263 HydrophobicContact SD-CD2 3.77Å; M260-V264 HydrophobicContact CG-CG2 4.35Å; M260-V264 VanDerWaalsContact O-CG2 3.28Å; M260-V264 WeakPolarHBondContact O-CG2 3.42Å; M260-V264 PolarHBondContact O-N 3.41Å
261	D	89.4	Confident	89.6	Confident	46 Å²	46	54.2 Å²	54.2	25%	0.246	28%	0.282	C	S	.	.	H	α-helix	trans	-65.2	-37.6	177.8	-64.6	-40.4	0	0	0	111.3	H209 T259 V264 N265	H209-D261 IonicContact CD2-OD1 2.89Å; H209-D261 IonicContact CD2-OD2 3.13Å; H209-D261 IonicContact CE1-OD1 3.11Å; H209-D261 IonicContact CE1-OD2 2.95Å; H209-D261 VanDerWaalsContact NE2-CG 3.26Å; H209-D261 IonicContact NE2-OD1 2.91Å; H209-D261 PolarHBondContact NE2-OD1 2.81Å; H209-D261 IonicContact NE2-OD2 2.71Å; H209-D261 PolarHBondContact NE2-OD2 3.26Å; T259-D261 VanDerWaalsContact C-N 3.25Å; T259-D261 PolarHBondContact O-N 3.38Å; T259-D261 PolarHBondContact OG1-N 3.08Å; D261-V264 PolarHBondContact O-N 3.49Å; D261-N265 WeakPolarHBondContact O-CB 3.44Å; D261-N265 PolarHBondContact O-N 3.02Å; D261-N265 PolarHBondContact O-ND2 3.34Å; D261-N265 VanDerWaalsContact O-ND2 3.1Å
262	D	89.9	Confident	88.9	Confident	56 Å²	56	62.7 Å²	62.7	30%	0.299	32%	0.322	S	S	.	.	H	α-helix	trans	-63.9	-42.5	176.5	-55.1	-42.2	0	0	0	111.2	Y257 E258 T259 M260 G266	Y257-D262 HydrophobicContact CD1-CB 4.06Å; Y257-D262 HydrophobicContact CG-CB 4.41Å; E258-D262 PolarHBondContact N-OD2 3.04Å; T259-D262 WeakPolarHBondContact CB-OD2 3.36Å; T259-D262 PolarHBondContact N-OD2 3.06Å; T259-D262 PolarHBondContact O-N 2.92Å; T259-D262 PolarHBondContact OG1-N 3.12Å; T259-D262 PolarHBondContact OG1-OD2 3.47Å; M260-D262 VanDerWaalsContact C-N 3.32Å; M260-D262 PolarHBondContact O-N 2.84Å; D262-G266 PolarHBondContact O-N 2.93Å
263	L	92.3	Very high	88.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62.1	-48	173.4	-179.7	79	0	0	0	111.2	L171 I247 L250 F251 Y257 T259 M260 N265 G266 V267	L171-L263 HydrophobicContact CD2-CD2 4.44Å; I247-L263 HydrophobicContact CD1-CD2 3.79Å; I247-L263 HydrophobicContact CG2-CD2 3.86Å; L250-L263 HydrophobicContact CB-CD1 4.1Å; L250-L263 HydrophobicContact CD1-CD1 4.44Å; F251-L263 HydrophobicContact CE1-CB 4.45Å; F251-L263 HydrophobicContact CE2-CB 4.29Å; F251-L263 HydrophobicContact CE2-CD1 4.26Å; F251-L263 HydrophobicContact CE2-CD2 3.81Å; F251-L263 HydrophobicContact CE2-CG 4.34Å; F251-L263 HydrophobicContact CZ-CB 3.84Å; F251-L263 HydrophobicContact CZ-CD1 4.5Å; F251-L263 HydrophobicContact CZ-CD2 4.16Å; F251-L263 HydrophobicContact CZ-CG 4.39Å; Y257-L263 HydrophobicContact CD2-CB 4.36Å; Y257-L263 HydrophobicContact CD2-CD1 3.8Å; Y257-L263 HydrophobicContact CE2-CD1 3.88Å; T259-L263 PolarHBondContact O-N 3.39Å; M260-L263 PolarHBondContact O-N 3.28Å; M260-L263 HydrophobicContact SD-CD2 3.77Å; L263-N265 VanDerWaalsContact C-N 3.34Å; L263-N265 PolarHBondContact O-N 3.23Å; L263-G266 PolarHBondContact O-N 3.41Å; L263-V267 HydrophobicContact CD1-CG2 4.3Å; L263-V267 HydrophobicContact CG-CG2 4.38Å; L263-V267 WeakPolarHBondContact O-CB 3.45Å; L263-V267 VanDerWaalsContact O-CG2 3.32Å; L263-V267 WeakPolarHBondContact O-CG2 3.49Å; L263-V267 PolarHBondContact O-N 2.72Å
264	V	91.6	Very high	88	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.012	32%	0.32	C	S	.	.	H	α-helix	trans	-59.4	-48.2	-179.7	169.8	0	0	0	0	110.1	L171 L173 L204 L207 M260 D261 V267 L268 I278	L171-V264 HydrophobicContact CD2-CG2 4.11Å; L173-V264 HydrophobicContact CD1-CG2 4.28Å; L204-V264 HydrophobicContact CD2-CG1 3.58Å; L207-V264 HydrophobicContact CB-CG1 4.31Å; M260-V264 HydrophobicContact CG-CG2 4.35Å; M260-V264 VanDerWaalsContact O-CG2 3.28Å; M260-V264 WeakPolarHBondContact O-CG2 3.42Å; M260-V264 PolarHBondContact O-N 3.41Å; D261-V264 PolarHBondContact O-N 3.49Å; V264-V267 PolarHBondContact O-N 2.9Å; V264-L268 HydrophobicContact CG1-CD1 3.84Å; V264-L268 HydrophobicContact CG1-CG 4.46Å; V264-L268 WeakPolarHBondContact O-CB 3.5Å; V264-L268 WeakPolarHBondContact O-CG 3.41Å; V264-L268 PolarHBondContact O-N 2.83Å; V264-I278 HydrophobicContact CB-CD1 4.24Å; V264-I278 HydrophobicContact CG1-CD1 4.21Å; V264-I278 HydrophobicContact CG2-CD1 4.11Å
265	N	88.9	Confident	87.7	Confident	65 Å²	65	66.4 Å²	66.4	35%	0.348	34%	0.338	S	S	.	.	H	α-helix	trans	-62.1	-46.2	177.4	-70.9	-31.9	0	0	0	111.3	D261 L263 V267 L268 T269	D261-N265 WeakPolarHBondContact O-CB 3.44Å; D261-N265 PolarHBondContact O-N 3.02Å; D261-N265 PolarHBondContact O-ND2 3.34Å; D261-N265 VanDerWaalsContact O-ND2 3.1Å; L263-N265 VanDerWaalsContact C-N 3.34Å; L263-N265 PolarHBondContact O-N 3.23Å; N265-V267 PolarHBondContact O-N 2.97Å; N265-L268 PolarHBondContact O-N 3.16Å; N265-T269 WeakPolarHBondContact O-CG2 3.4Å; N265-T269 PolarHBondContact O-N 2.82Å; N265-T269 PolarHBondContact O-OG1 3.36Å
266	G	88.6	Confident	87.9	Confident	7 Å²	7	62 Å²	62	7%	0.072	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-40.1	179.9	0	0	0	0	0	113.6	Y257 D262 L263 T269 N270	Y257-G266 WeakPolarHBondContact OH-CA 3.46Å; D262-G266 PolarHBondContact O-N 2.93Å; L263-G266 PolarHBondContact O-N 3.41Å; G266-T269 WeakPolarHBondContact CA-OG1 3.45Å; G266-T269 PolarHBondContact O-OG1 2.98Å; G266-N270 WeakPolarHBondContact O-CB 3.44Å; G266-N270 PolarHBondContact O-N 3.09Å; G266-N270 VanDerWaalsContact O-N 3.07Å; G266-N270 PolarHBondContact O-ND2 3.31Å
267	V	90.2	Very high	87.9	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.03	29%	0.294	C	S	.	.	H	α-helix	trans	-71.3	-40.1	176.4	173.5	0	0	0	0	111.4	I170 L263 V264 N265 E271 I278	I170-V267 HydrophobicContact CD1-CG1 4.4Å; I170-V267 HydrophobicContact CD1-CG2 4.15Å; L263-V267 HydrophobicContact CD1-CG2 4.3Å; L263-V267 HydrophobicContact CG-CG2 4.38Å; L263-V267 WeakPolarHBondContact O-CB 3.45Å; L263-V267 VanDerWaalsContact O-CG2 3.32Å; L263-V267 WeakPolarHBondContact O-CG2 3.49Å; L263-V267 PolarHBondContact O-N 2.72Å; V264-V267 PolarHBondContact O-N 2.9Å; N265-V267 PolarHBondContact O-N 2.97Å; V267-E271 WeakPolarHBondContact O-CA 3.37Å; V267-E271 PolarHBondContact O-N 2.83Å; V267-E271 VanDerWaalsContact O-N 3.13Å; V267-I278 HydrophobicContact CB-CD1 3.85Å; V267-I278 HydrophobicContact CG1-CD1 3.88Å; V267-I278 HydrophobicContact CG1-CG1 4Å; V267-I278 HydrophobicContact CG2-CD1 4.5Å
268	L	88.1	Confident	87.9	Confident	34 Å²	34	57 Å²	57	18%	0.178	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-37.3	176.7	-70.2	173.3	0	0	0	112	L204 V264 N265	L204-L268 HydrophobicContact CD2-CD1 3.97Å; L204-L268 HydrophobicContact CD2-CD2 4.46Å; L204-L268 HydrophobicContact CG-CD1 4.27Å; L204-L268 HydrophobicContact CG-CD2 4.35Å; V264-L268 HydrophobicContact CG1-CD1 3.84Å; V264-L268 HydrophobicContact CG1-CG 4.46Å; V264-L268 WeakPolarHBondContact O-CB 3.5Å; V264-L268 WeakPolarHBondContact O-CG 3.41Å; V264-L268 PolarHBondContact O-N 2.83Å; N265-L268 PolarHBondContact O-N 3.16Å
269	T	85.4	Confident	88.1	Confident	105 Å²	105	52 Å²	52	64%	0.644	27%	0.269	S	S	*	.	H	α-helix	trans	-73.7	-34.7	177.9	51.9	0	0	0	0	113.1	N265 G266	N265-T269 WeakPolarHBondContact O-CG2 3.4Å; N265-T269 PolarHBondContact O-N 2.82Å; N265-T269 PolarHBondContact O-OG1 3.36Å; G266-T269 WeakPolarHBondContact CA-OG1 3.45Å; G266-T269 PolarHBondContact O-OG1 2.98Å
270	N	83.9	Confident	88.3	Confident	69 Å²	69	49.4 Å²	49.4	37%	0.369	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	22.7	-175.4	-62.2	-39.3	0	0	0	113	G266 E272 I273 M274	G266-N270 WeakPolarHBondContact O-CB 3.44Å; G266-N270 PolarHBondContact O-N 3.09Å; G266-N270 VanDerWaalsContact O-N 3.07Å; G266-N270 PolarHBondContact O-ND2 3.31Å; N270-E272 PolarHBondContact O-N 3.48Å; N270-I273 PolarHBondContact O-N 3.24Å; N270-I273 VanDerWaalsContact O-N 3.1Å; N270-M274 HydrophobicContact CB-CG 4.5Å; N270-M274 PolarHBondContact O-N 3.34Å; N270-M274 VanDerWaalsContact O-N 3.12Å
271	E	79.8	Confident	88.4	Confident	35 Å²	35	50.1 Å²	50.1	16%	0.164	26%	0.256	C	S	.	.	H	α-helix	trans	-61.4	-32.9	-174.2	-156.8	-166	142.5	0	0	112.3	R203 V267 I273 E275	R203-E271 IonicContact CZ-OE1 3.26Å; R203-E271 IonicContact CZ-OE2 3.62Å; R203-E271 IonicContact NE-OE1 2.95Å; R203-E271 IonicContact NE-OE2 3.85Å; R203-E271 IonicContact NH1-OE1 3.83Å; R203-E271 PolarHBondContact NH1-OE1 3.28Å; R203-E271 IonicContact NH2-OE1 2.64Å; R203-E271 PolarHBondContact NH2-OE1 2.51Å; R203-E271 IonicContact NH2-OE2 3.17Å; R203-E271 PolarHBondContact NH2-OE2 2.96Å; V267-E271 WeakPolarHBondContact O-CA 3.37Å; V267-E271 PolarHBondContact O-N 2.83Å; V267-E271 VanDerWaalsContact O-N 3.13Å; E271-I273 PolarHBondContact O-N 3.22Å; E271-E275 WeakPolarHBondContact O-CA 3.42Å; E271-E275 PolarHBondContact O-N 3.19Å
272	E	76.6	Confident	88.6	Confident	179 Å²	179	49.8 Å²	49.8	84%	0.836	26%	0.256	S	S	*	.	H	α-helix	trans	-62.8	-26.9	178.7	-63	-171.5	168.1	0	0	113.5	N270	N270-E272 PolarHBondContact O-N 3.48Å
273	I	82.4	Confident	88.6	Confident	139 Å²	139	47.3 Å²	47.3	71%	0.713	24%	0.243	S	C	*	.	H	α-helix	trans	-96.2	-43	-176.5	-59.9	167.9	0	0	0	110.6	N270 E271	N270-I273 PolarHBondContact O-N 3.24Å; N270-I273 VanDerWaalsContact O-N 3.1Å; E271-I273 PolarHBondContact O-N 3.22Å
274	M	82.5	Confident	88.3	Confident	67 Å²	67	50.8 Å²	50.8	33%	0.33	27%	0.265	S	S	.	.	H	α-helix	trans	-91.2	-23.7	-170.9	-66.2	-83.7	-104.6	0	0	113	L250 N270 Y276	L250-M274 HydrophobicContact CD2-CE 3.19Å; N270-M274 HydrophobicContact CB-CG 4.5Å; N270-M274 PolarHBondContact O-N 3.34Å; N270-M274 VanDerWaalsContact O-N 3.12Å; M274-Y276 HydrophobicContact CB-CD2 3.69Å; M274-Y276 HydrophobicContact CB-CE2 4.18Å; M274-Y276 HydrophobicContact CB-CG 4.29Å; M274-Y276 HydrophobicContact CE-CD2 4.07Å; M274-Y276 HydrophobicContact CE-CE2 3.9Å; M274-Y276 HydrophobicContact CG-CD2 4.41Å; M274-Y276 PolarHBondContact O-N 3.44Å; M274-Y276 HydrophobicContact SD-CD2 4.31Å; M274-Y276 HydrophobicContact SD-CE2 4.01Å
275	E	86.8	Confident	87.5	Confident	125 Å²	125	57.9 Å²	57.9	58%	0.584	30%	0.296	S	S	*	.			trans	54.8	12.1	-173.3	-57.2	-173	162.6	0	0	115.2	N168 E271	N168-E275 VanDerWaalsContact CB-O 3.24Å; N168-E275 WeakPolarHBondContact CB-O 3.25Å; N168-E275 WeakPolarHBondContact ND2-CB 3.27Å; N168-E275 PolarHBondContact ND2-O 3.25Å; E271-E275 WeakPolarHBondContact O-CA 3.42Å; E271-E275 PolarHBondContact O-N 3.19Å
276	Y	92	Very high	86.9	Confident	54 Å²	54	57 Å²	57	21%	0.212	30%	0.302	C	S	.	.			trans	-75.5	135.3	178.6	-68.9	-41.3	0	0	0	111.5	N168 I170 L250 M274	N168-Y276 HydrophobicContact CB-CD1 4.44Å; N168-Y276 WeakPolarHBondContact O-CA 3.41Å; I170-Y276 HydrophobicContact CD1-CD2 4.1Å; I170-Y276 HydrophobicContact CD1-CG 3.84Å; I170-Y276 HydrophobicContact CG1-CG 4.34Å; I170-Y276 HydrophobicContact CG2-CD1 3.36Å; I170-Y276 HydrophobicContact CG2-CE1 3.8Å; I170-Y276 HydrophobicContact CG2-CG 3.81Å; L250-Y276 HydrophobicContact CD1-CD2 4.16Å; L250-Y276 HydrophobicContact CD1-CE2 4.15Å; L250-Y276 HydrophobicContact CD2-CD2 4.4Å; L250-Y276 HydrophobicContact CD2-CE2 3.93Å; L250-Y276 HydrophobicContact CG-CE2 4.5Å; M274-Y276 HydrophobicContact CB-CD2 3.69Å; M274-Y276 HydrophobicContact CB-CE2 4.18Å; M274-Y276 HydrophobicContact CB-CG 4.29Å; M274-Y276 HydrophobicContact CE-CD2 4.07Å; M274-Y276 HydrophobicContact CE-CE2 3.9Å; M274-Y276 HydrophobicContact CG-CD2 4.41Å; M274-Y276 PolarHBondContact O-N 3.44Å; M274-Y276 HydrophobicContact SD-CD2 4.31Å; M274-Y276 HydrophobicContact SD-CE2 4.01Å
277	T	91.4	Very high	86.4	Confident	20 Å²	20	58.5 Å²	58.5	12%	0.123	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.4	179.9	62	0	0	0	0	111.8	N168 A169 I170 H279	N168-T277 PolarHBondContact O-N 3.45Å; A169-T277 WeakPolarHBondContact CA-O 3.31Å; A169-T277 WeakPolarHBondContact CA-OG1 3.42Å; I170-T277 PolarHBondContact N-O 3.34Å; I170-T277 VanDerWaalsContact N-O 3.17Å; T277-H279 PolarHBondContact OG1-NE2 2.71Å
278	I	94.2	Very high	86	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.015	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	139.6	173.5	-58.3	176.1	0	0	0	108.2	L171 L173 R203 L204 V264 V267	L171-I278 HydrophobicContact CB-CG1 4.18Å; L171-I278 HydrophobicContact CB-CG2 4.17Å; L171-I278 HydrophobicContact CD2-CD1 4.21Å; L171-I278 HydrophobicContact CD2-CG1 4.35Å; L171-I278 HydrophobicContact CD2-CG2 4.04Å; L171-I278 HydrophobicContact CG-CG2 4.24Å; L173-I278 HydrophobicContact CD1-CG2 4.23Å; L173-I278 HydrophobicContact CG-CG2 4.22Å; R203-I278 CarbonylContact C-O 3.59Å; R203-I278 WeakPolarHBondContact CA-O 3.5Å; L204-I278 HydrophobicContact CB-CB 4.1Å; L204-I278 HydrophobicContact CB-CG2 4.06Å; L204-I278 WeakPolarHBondContact CB-O 3.47Å; L204-I278 HydrophobicContact CD2-CB 4.16Å; L204-I278 HydrophobicContact CD2-CG2 3.72Å; L204-I278 PolarHBondContact N-O 3.02Å; V264-I278 HydrophobicContact CB-CD1 4.24Å; V264-I278 HydrophobicContact CG1-CD1 4.21Å; V264-I278 HydrophobicContact CG2-CD1 4.11Å; V267-I278 HydrophobicContact CB-CD1 3.85Å; V267-I278 HydrophobicContact CG1-CD1 3.88Å; V267-I278 HydrophobicContact CG1-CG1 4Å; V267-I278 HydrophobicContact CG2-CD1 4.5Å
279	H	94.5	Very high	86	Confident	9 Å²	9	57 Å²	57	4%	0.042	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153	179.2	-62.8	-84.2	0	0	0	111.3	Q162 L171 T172 L173 N201 N202 T277	Q162-H279 PolarHBondContact NE2-CD2 2.9Å; Q162-H279 PolarHBondContact NE2-CE1 3.43Å; Q162-H279 PolarHBondContact NE2-ND1 2.92Å; Q162-H279 PolarHBondContact NE2-NE2 3.27Å; L171-H279 PolarHBondContact O-N 3Å; T172-H279 CarbonylContact C-O 3.57Å; T172-H279 VanDerWaalsContact CA-O 3.26Å; T172-H279 WeakPolarHBondContact CA-O 3.47Å; T172-H279 HydrophobicContact CG2-CB 4.49Å; L173-H279 PolarHBondContact N-O 3.35Å; N201-H279 PolarHBondContact O-ND1 2.73Å; N202-H279 WeakPolarHBondContact O-CA 3.43Å; T277-H279 PolarHBondContact OG1-NE2 2.71Å
280	V	94.7	Very high	86.2	Confident	1 Å²	1	52 Å²	52	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.1	178.3	179.6	0	0	0	0	109	L175 V194 F196 N202 L204 P282	L175-V280 HydrophobicContact CD1-CG1 3.66Å; L175-V280 HydrophobicContact CG-CG1 4.22Å; V194-V280 HydrophobicContact CG1-CG1 4.26Å; V194-V280 HydrophobicContact CG1-CG2 3.81Å; F196-V280 HydrophobicContact CB-CB 4.5Å; F196-V280 HydrophobicContact CB-CG2 4.43Å; F196-V280 HydrophobicContact CG-CB 4.46Å; N202-V280 WeakPolarHBondContact CB-O 3.49Å; N202-V280 PolarHBondContact ND2-O 2.98Å; N202-V280 PolarHBondContact O-N 2.9Å; L204-V280 HydrophobicContact CB-CG2 4Å; L204-V280 HydrophobicContact CD1-CG2 3.56Å; L204-V280 HydrophobicContact CG-CG2 4.29Å; V280-P282 HydrophobicContact CG1-CG 4.44Å
281	E	93.8	Very high	86.4	Confident	31 Å²	31	49.3 Å²	49.3	15%	0.145	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	99.3	173.4	-172.2	70.5	-179	0	0	109.6	F155 K158 T172 L173 L174 L175 N202 L283	F155-E281 HydrophobicContact CD1-CG 3.57Å; F155-E281 HydrophobicContact CE1-CG 3.71Å; K158-E281 IonicContact NZ-OE1 3.84Å; K158-E281 PolarHBondContact NZ-OE1 3.46Å; K158-E281 IonicContact NZ-OE2 2.66Å; K158-E281 PolarHBondContact NZ-OE2 3.16Å; T172-E281 HydrophobicContact CG2-CB 3.92Å; L173-E281 PolarHBondContact O-N 2.73Å; L174-E281 HydrophobicContact CD2-CB 3.88Å; L174-E281 HydrophobicContact CD2-CG 4.13Å; L175-E281 PolarHBondContact N-O 2.8Å; L175-E281 VanDerWaalsContact N-O 3.13Å; N202-E281 PolarHBondContact ND2-OE2 3.13Å; E281-L283 PolarHBondContact O-N 2.87Å
282	P	92	Very high	86.5	Confident	39 Å²	39	47.7 Å²	47.7	25%	0.253	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	122.1	173.9	-17.5	30.6	0	0	0	110.2	L175 F196 L235 V280	L175-P282 WeakPolarHBondContact O-CA 3.34Å; F196-P282 HydrophobicContact CZ-CG 4.05Å; L235-P282 HydrophobicContact CD1-CG 4.46Å; L235-P282 HydrophobicContact CD2-CB 4.15Å; V280-P282 HydrophobicContact CG1-CG 4.44Å
283	L	91	Very high	86.6	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.026	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-74.3	146	179.9	-60.6	174.5	0	0	0	111.2	I150 F155 L174 L175 P176 L240 E281 V289	I150-L283 HydrophobicContact CD1-CB 4.19Å; F155-L283 HydrophobicContact CD2-CD2 4.02Å; F155-L283 HydrophobicContact CE1-CD2 4.17Å; F155-L283 HydrophobicContact CE2-CD2 3.42Å; F155-L283 VanDerWaalsContact CE2-CD2 3.42Å; F155-L283 HydrophobicContact CZ-CD2 3.5Å; F155-L283 VanDerWaalsContact CZ-CD2 3.5Å; L174-L283 HydrophobicContact CB-CD1 4.46Å; L174-L283 HydrophobicContact CB-CD2 4.46Å; L174-L283 HydrophobicContact CD2-CD2 4.06Å; L175-L283 PolarHBondContact O-N 2.98Å; P176-L283 HydrophobicContact CB-CD1 4.19Å; L240-L283 HydrophobicContact CD2-CD1 4.44Å; E281-L283 PolarHBondContact O-N 2.87Å; L283-V289 HydrophobicContact CD1-CB 4.15Å; L283-V289 HydrophobicContact CD1-CG1 3.9Å; L283-V289 HydrophobicContact CD1-CG2 4.07Å
284	P	85.1	Confident	86.6	Confident	72 Å²	72	32.7 Å²	32.7	47%	0.468	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-64.3	142.4	-176.1	25.7	-34.3	0	0	0	112.2	I150 G286	I150-P284 HydrophobicContact CD1-CG 4.09Å; P284-G286 PolarHBondContact O-N 3.19Å
285	K	76.4	Confident	86.7	Confident	152 Å²	152	29.8 Å²	29.8	66%	0.661	16%	0.163	S	C	*	.	S	Bend	trans	-68	123.7	174.6	-62.8	-175.6	178.9	-173.6	0	109.6	Q234	Q234-K285 VanDerWaalsContact OE1-NZ 3.16Å
286	G	76	Confident	86.8	Confident	45 Å²	45	23.9 Å²	23.9	46%	0.464	14%	0.135	S	C	.	.	S	Bend	trans	146.9	-81.1	173.9	0	0	0	0	0	112.8	P284	P284-G286 PolarHBondContact O-N 3.19Å
287	P	77	Confident	86.6	Confident	40 Å²	40	22 Å²	22	26%	0.26	13%	0.129	S	C	.	.	S	Bend	trans	-62.8	138.3	175.5	24.4	-32.6	0	0	0	111.2	G149 I150	G149-P287 WeakPolarHBondContact O-CB 3.16Å; I150-P287 HydrophobicContact CD1-CB 4.25Å; I150-P287 HydrophobicContact CD1-CG 3.61Å; I150-P287 HydrophobicContact CG1-CB 3.57Å; I150-P287 HydrophobicContact CG1-CG 3.35Å
288	I	83.1	Confident	86.4	Confident	3 Å²	3	21.8 Å²	21.8	2%	0.015	13%	0.129	C	C	.	.			trans	-70.7	134.4	-177.5	-101.9	172.4	0	0	0	111.1	I147 C148 G149 A181 L290 G311 F313	I147-I288 HydrophobicContact CG2-CG2 3.99Å; C148-I288 CarbonylContact C-O 3.52Å; C148-I288 WeakPolarHBondContact CA-O 3.44Å; G149-I288 PolarHBondContact N-O 3.46Å; A181-I288 HydrophobicContact CB-CD1 3.54Å; A181-I288 HydrophobicContact CB-CG1 4.21Å; I288-L290 HydrophobicContact CD1-CD2 4.25Å; I288-L290 HydrophobicContact CG1-CD2 4.35Å; I288-L290 HydrophobicContact CG2-CD2 3.82Å; I288-L290 HydrophobicContact CG2-CG 4.04Å; I288-G311 WeakPolarHBondContact CD1-O 3.38Å; I288-G311 WeakPolarHBondContact CG1-O 3.4Å; I288-F313 HydrophobicContact CB-CE1 4.48Å; I288-F313 HydrophobicContact CD1-CD1 3.83Å; I288-F313 HydrophobicContact CD1-CD2 3.62Å; I288-F313 HydrophobicContact CD1-CE1 3.49Å; I288-F313 VanDerWaalsContact CD1-CE1 3.49Å; I288-F313 HydrophobicContact CD1-CE2 3.24Å; I288-F313 HydrophobicContact CD1-CG 3.89Å; I288-F313 HydrophobicContact CD1-CZ 3.18Å; I288-F313 HydrophobicContact CG2-CD1 4.34Å; I288-F313 HydrophobicContact CG2-CE1 3.84Å; I288-F313 HydrophobicContact CG2-CZ 4.37Å
289	V	88.1	Confident	86.2	Confident	4 Å²	4	21.7 Å²	21.7	2%	0.024	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	113.5	166.4	-174.5	0	0	0	0	106.9	L146 I147 I150 P176 I238 L240 L283	L146-V289 HydrophobicContact CD1-CG1 4.1Å; I147-V289 WeakPolarHBondContact O-CA 3.31Å; I150-V289 HydrophobicContact CB-CG2 4.35Å; I150-V289 HydrophobicContact CD1-CG2 3.39Å; I150-V289 HydrophobicContact CG1-CG2 3.61Å; P176-V289 HydrophobicContact CB-CB 4.12Å; P176-V289 HydrophobicContact CB-CG1 4.47Å; P176-V289 HydrophobicContact CG-CG1 4.5Å; I238-V289 HydrophobicContact CD1-CG1 3.68Å; L240-V289 HydrophobicContact CD2-CG1 4.16Å; L283-V289 HydrophobicContact CD1-CB 4.15Å; L283-V289 HydrophobicContact CD1-CG1 3.9Å; L283-V289 HydrophobicContact CD1-CG2 4.07Å
290	L	88.6	Confident	86	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	160.7	-177.5	61.4	84	0	0	0	111.4	I147 A181 I182 I288 A292 L302 F313	I147-L290 HydrophobicContact CB-CD1 4.23Å; I147-L290 HydrophobicContact CD1-CD1 4.35Å; I147-L290 PolarHBondContact N-O 3.15Å; I147-L290 PolarHBondContact O-N 2.96Å; I147-L290 VanDerWaalsContact O-N 3.11Å; A181-L290 HydrophobicContact CB-CD2 4.3Å; I182-L290 HydrophobicContact CD1-CB 4.01Å; I182-L290 HydrophobicContact CG1-CB 4.33Å; I182-L290 HydrophobicContact CG1-CD2 4.37Å; I288-L290 HydrophobicContact CD1-CD2 4.25Å; I288-L290 HydrophobicContact CG1-CD2 4.35Å; I288-L290 HydrophobicContact CG2-CD2 3.82Å; I288-L290 HydrophobicContact CG2-CG 4.04Å; L290-A292 HydrophobicContact CD1-CB 4.26Å; L290-L302 HydrophobicContact CD1-CD1 3.34Å; L290-L302 HydrophobicContact CD2-CD1 3.87Å; L290-L302 HydrophobicContact CG-CD1 4.28Å; L290-F313 HydrophobicContact CD2-CZ 4.46Å
291	Q	88.1	Confident	85.7	Confident	12 Å²	12	23.7 Å²	23.7	6%	0.056	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	122.3	164.6	-173.9	170.4	47.7	0	0	109.7	D145	D145-Q291 WeakPolarHBondContact OD1-CG 3.36Å; D145-Q291 PolarHBondContact OD1-NE2 3.5Å; D145-Q291 WeakPolarHBondContact OD2-CG 3.38Å
292	A	81.9	Confident	85.4	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.008	14%	0.135	C	C	.	.	S	Bend	trans	-77.6	-32.3	-166.4	0	0	0	0	0	114.3	L64 D145 I147 L290 P294	L64-A292 HydrophobicContact CD1-CB 4.1Å; L64-A292 HydrophobicContact CD2-CB 3.49Å; L64-A292 VanDerWaalsContact CD2-CB 3.49Å; L64-A292 HydrophobicContact CG-CB 4.39Å; D145-A292 VanDerWaalsContact O-CB 3.27Å; D145-A292 WeakPolarHBondContact O-CB 3.36Å; D145-A292 PolarHBondContact O-N 2.99Å; D145-A292 PolarHBondContact OD2-N 3.42Å; I147-A292 HydrophobicContact CD1-CB 3.53Å; I147-A292 HydrophobicContact CG1-CB 3.94Å; L290-A292 HydrophobicContact CD1-CB 4.26Å; A292-P294 VanDerWaalsContact C-CD 3.48Å
293	A	79.6	Confident	85.2	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.123	C	C	.	.			trans	-128.6	66.6	-170.3	0	0	0	0	0	112.8	F45 L64 D145 L299	F45-A293 HydrophobicContact CE2-CB 4.21Å; F45-A293 WeakPolarHBondContact CE2-O 3.39Å; F45-A293 HydrophobicContact CZ-CB 3.73Å; F45-A293 WeakPolarHBondContact CZ-O 3.5Å; L64-A293 HydrophobicContact CD1-CB 3.63Å; D145-A293 PolarHBondContact OD2-N 2.83Å; A293-L299 HydrophobicContact CB-CD1 4.21Å; A293-L299 HydrophobicContact CB-CD2 4.43Å
294	P	81.3	Confident	85.1	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.013	13%	0.125	C	C	.	.	S	Bend	trans	-77.6	-26.7	168.4	31.2	-34.6	0	0	0	113.2	R44 Q186 A292	R44-P294 WeakPolarHBondContact CD-O 3.31Å; Q186-P294 HydrophobicContact CG-CG 4.08Å; Q186-P294 VanDerWaalsContact NE2-CG 3.33Å; A292-P294 VanDerWaalsContact C-CD 3.48Å
295	D	86.1	Confident	85.1	Confident	7 Å²	7	20.5 Å²	20.5	4%	0.037	11%	0.114	C	C	.	.	S	Bend	trans	-157.5	159.1	177.4	66.9	-77	0	0	0	111	S297 S298 L299	D295-S297 VanDerWaalsContact C-N 3.34Å; D295-S297 PolarHBondContact O-N 3.19Å; D295-S297 WeakPolarHBondContact OD2-CB 3.44Å; D295-S297 PolarHBondContact OD2-N 3.36Å; D295-S298 VanDerWaalsContact CG-OG 3.24Å; D295-S298 PolarHBondContact O-N 2.99Å; D295-S298 WeakPolarHBondContact OD1-CB 3.33Å; D295-S298 PolarHBondContact OD1-OG 3.38Å; D295-S298 PolarHBondContact OD2-N 3.36Å; D295-S298 PolarHBondContact OD2-OG 3.49Å; D295-L299 PolarHBondContact O-N 3.04Å
296	L	88.2	Confident	85.5	Confident	1 Å²	1	13.5 Å²	13.5	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-66	-35.1	-175.7	-173.1	63.7	0	0	0	112.7	F45 L48 L299 I300 W406 F424 L509 W510	F45-L296 HydrophobicContact CE1-CB 4.29Å; L48-L296 HydrophobicContact CD2-CD1 4.19Å; L296-L299 PolarHBondContact O-N 3.39Å; L296-I300 HydrophobicContact CG-CD1 4.21Å; L296-I300 VanDerWaalsContact O-CG1 3.28Å; L296-I300 WeakPolarHBondContact O-CG1 3.46Å; L296-I300 PolarHBondContact O-N 3.21Å; L296-I300 VanDerWaalsContact O-N 3.08Å; L296-W406 HydrophobicContact CD1-CD2 3.84Å; L296-W406 HydrophobicContact CD1-CE3 3.54Å; L296-W406 HydrophobicContact CD1-CG 4.33Å; L296-W406 HydrophobicContact CD1-CZ3 3.94Å; L296-W406 HydrophobicContact CD2-CB 4.3Å; L296-F424 HydrophobicContact CD2-CD2 3.94Å; L296-L509 WeakPolarHBondContact CB-O 3.39Å; L296-L509 HydrophobicContact CD2-CD1 4.12Å; L296-L509 HydrophobicContact CD2-CD2 3.92Å; L296-L509 HydrophobicContact CD2-CG 3.79Å; L296-W510 HydrophobicContact CB-CZ3 4.48Å; L296-W510 HydrophobicContact CD2-CD2 4.45Å; L296-W510 HydrophobicContact CD2-CE3 4.25Å; L296-W510 HydrophobicContact CD2-CH2 3.66Å; L296-W510 HydrophobicContact CD2-CZ2 3.86Å; L296-W510 HydrophobicContact CD2-CZ3 3.87Å; L296-W510 HydrophobicContact CG-CH2 4.26Å; L296-W510 HydrophobicContact CG-CZ3 4.11Å
297	S	88.2	Confident	85.9	Confident	13 Å²	13	11.4 Å²	11.4	9%	0.091	6%	0.062	C	C	.	.	H	α-helix	trans	-67	-47.3	179.4	-168.1	0	0	0	0	110.6	D295 L299 I300 D301	D295-S297 VanDerWaalsContact C-N 3.34Å; D295-S297 PolarHBondContact O-N 3.19Å; D295-S297 WeakPolarHBondContact OD2-CB 3.44Å; D295-S297 PolarHBondContact OD2-N 3.36Å; S297-L299 VanDerWaalsContact C-N 3.3Å; S297-L299 PolarHBondContact O-N 3.17Å; S297-I300 PolarHBondContact O-N 3.11Å; S297-D301 PolarHBondContact O-N 3.25Å; S297-D301 VanDerWaalsContact O-N 3.12Å
298	S	87.5	Confident	86.2	Confident	17 Å²	17	10.2 Å²	10.2	12%	0.119	6%	0.055	C	C	.	.	H	α-helix	trans	-62.4	-38.3	177.2	-60.1	0	0	0	0	112	D295 I300 D301 L302	D295-S298 VanDerWaalsContact CG-OG 3.24Å; D295-S298 PolarHBondContact O-N 2.99Å; D295-S298 WeakPolarHBondContact OD1-CB 3.33Å; D295-S298 PolarHBondContact OD1-OG 3.38Å; D295-S298 PolarHBondContact OD2-N 3.36Å; D295-S298 PolarHBondContact OD2-OG 3.49Å; S298-I300 PolarHBondContact O-N 3.46Å; S298-D301 PolarHBondContact O-N 2.9Å; S298-L302 VanDerWaalsContact O-CB 3.24Å; S298-L302 WeakPolarHBondContact O-CB 3.35Å; S298-L302 PolarHBondContact O-N 3.32Å
299	L	89.1	Confident	85.9	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-61.6	-43.4	176.2	-177.8	64	0	0	0	112.2	L57 L59 L64 A293 D295 L296 S297 D301 L302 N303 W406	L57-L299 HydrophobicContact CB-CD2 4.05Å; L57-L299 HydrophobicContact CD1-CD2 3.72Å; L57-L299 HydrophobicContact CG-CD2 4.45Å; L59-L299 HydrophobicContact CD1-CD1 3.87Å; L64-L299 HydrophobicContact CD1-CD1 4.08Å; L64-L299 HydrophobicContact CD2-CD1 4.44Å; A293-L299 HydrophobicContact CB-CD1 4.21Å; A293-L299 HydrophobicContact CB-CD2 4.43Å; D295-L299 PolarHBondContact O-N 3.04Å; L296-L299 PolarHBondContact O-N 3.39Å; S297-L299 VanDerWaalsContact C-N 3.3Å; S297-L299 PolarHBondContact O-N 3.17Å; L299-D301 VanDerWaalsContact C-N 3.33Å; L299-D301 PolarHBondContact O-N 3.09Å; L299-L302 PolarHBondContact O-N 3.02Å; L299-N303 PolarHBondContact O-N 3.26Å; L299-N303 VanDerWaalsContact O-N 3.08Å; L299-W406 HydrophobicContact CD2-CH2 3.91Å; L299-W406 HydrophobicContact CD2-CZ3 3.93Å; L299-W406 HydrophobicContact CG-CZ3 4.36Å
300	I	90.5	Very high	85.2	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.3	-45.7	176.4	-69.2	164.7	0	0	0	110.4	L296 S297 S298 L302 N303 F304 I389 V404 W406 W510	L296-I300 HydrophobicContact CG-CD1 4.21Å; L296-I300 VanDerWaalsContact O-CG1 3.28Å; L296-I300 WeakPolarHBondContact O-CG1 3.46Å; L296-I300 PolarHBondContact O-N 3.21Å; L296-I300 VanDerWaalsContact O-N 3.08Å; S297-I300 PolarHBondContact O-N 3.11Å; S298-I300 PolarHBondContact O-N 3.46Å; I300-L302 VanDerWaalsContact C-N 3.35Å; I300-N303 WeakPolarHBondContact O-CB 3.25Å; I300-N303 PolarHBondContact O-N 2.98Å; I300-F304 HydrophobicContact CG2-CD2 4.3Å; I300-F304 HydrophobicContact CG2-CE2 3.63Å; I300-F304 WeakPolarHBondContact O-CD2 3.3Å; I300-F304 WeakPolarHBondContact O-CE2 3.46Å; I300-I389 HydrophobicContact CB-CD1 4.18Å; I300-I389 HydrophobicContact CG1-CD1 3.85Å; I300-I389 HydrophobicContact CG1-CG1 4.48Å; I300-I389 HydrophobicContact CG2-CD1 4.24Å; I300-V404 HydrophobicContact CD1-CG1 4.37Å; I300-W406 HydrophobicContact CD1-CE3 4.37Å; I300-W406 HydrophobicContact CG1-CE3 3.89Å; I300-W406 HydrophobicContact CG1-CZ3 4.33Å; I300-W510 HydrophobicContact CD1-CH2 4.01Å; I300-W510 HydrophobicContact CD1-CZ3 4.03Å
301	D	88.3	Confident	84	Confident	51 Å²	51	21.7 Å²	21.7	27%	0.273	11%	0.112	S	C	.	.	H	α-helix	trans	-67.4	-40.9	-177	-69.5	27.2	0	0	0	111	S297 S298 L299 N303 F304 K305 R387	S297-D301 PolarHBondContact O-N 3.25Å; S297-D301 VanDerWaalsContact O-N 3.12Å; S298-D301 PolarHBondContact O-N 2.9Å; L299-D301 VanDerWaalsContact C-N 3.33Å; L299-D301 PolarHBondContact O-N 3.09Å; D301-N303 VanDerWaalsContact C-N 3.28Å; D301-N303 PolarHBondContact O-N 2.92Å; D301-F304 PolarHBondContact O-N 2.88Å; D301-K305 WeakPolarHBondContact O-CG 3.47Å; D301-K305 PolarHBondContact O-N 2.78Å; D301-R387 IonicContact OD1-CZ 3.62Å; D301-R387 IonicContact OD1-NH2 3.66Å; D301-R387 PolarHBondContact OD1-NH2 3Å; D301-R387 IonicContact OD2-CZ 2.52Å; D301-R387 IonicContact OD2-NH2 2.75Å; D301-R387 PolarHBondContact OD2-NH2 3.38Å
302	L	87.3	Confident	82.8	Confident	10 Å²	10	22 Å²	22	5%	0.052	12%	0.119	C	C	.	.	H	α-helix	trans	-61.7	-38.1	177.4	-168.7	139.7	0	0	0	111.8	L59 I147 L290 S298 L299 I300 F304 K305 L306 F313	L59-L302 HydrophobicContact CD1-CD2 3.61Å; L59-L302 HydrophobicContact CD2-CD2 3.51Å; L59-L302 HydrophobicContact CG-CD2 4.18Å; I147-L302 HydrophobicContact CD1-CD2 3.78Å; L290-L302 HydrophobicContact CD1-CD1 3.34Å; L290-L302 HydrophobicContact CD2-CD1 3.87Å; L290-L302 HydrophobicContact CG-CD1 4.28Å; S298-L302 VanDerWaalsContact O-CB 3.24Å; S298-L302 WeakPolarHBondContact O-CB 3.35Å; S298-L302 PolarHBondContact O-N 3.32Å; L299-L302 PolarHBondContact O-N 3.02Å; I300-L302 VanDerWaalsContact C-N 3.35Å; L302-F304 VanDerWaalsContact C-N 3.31Å; L302-F304 PolarHBondContact O-N 3.49Å; L302-K305 PolarHBondContact O-N 2.58Å; L302-L306 WeakPolarHBondContact O-CB 3.04Å; L302-L306 PolarHBondContact O-N 3.18Å; L302-F313 HydrophobicContact CG-CZ 4.41Å
303	N	88.7	Confident	82	Confident	1 Å²	1	22 Å²	22	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-55.8	-46.6	177.3	-165.2	29.6	0	0	0	111.9	L59 S60 L299 I300 D301 L306 L307 S372 I389	L59-N303 HydrophobicContact CD1-CB 3.81Å; S60-N303 WeakPolarHBondContact CA-OD1 3.44Å; S60-N303 PolarHBondContact N-OD1 3.33Å; S60-N303 PolarHBondContact OG-OD1 3.36Å; L299-N303 PolarHBondContact O-N 3.26Å; L299-N303 VanDerWaalsContact O-N 3.08Å; I300-N303 WeakPolarHBondContact O-CB 3.25Å; I300-N303 PolarHBondContact O-N 2.98Å; D301-N303 VanDerWaalsContact C-N 3.28Å; D301-N303 PolarHBondContact O-N 2.92Å; N303-L306 PolarHBondContact O-N 2.97Å; N303-L307 WeakPolarHBondContact O-CG 3.18Å; N303-L307 PolarHBondContact O-N 2.64Å; N303-L307 VanDerWaalsContact O-N 3.08Å; N303-S372 VanDerWaalsContact ND2-CB 3.29Å; N303-S372 WeakPolarHBondContact ND2-CB 3.45Å; N303-S372 PolarHBondContact ND2-OG 3.05Å; N303-I389 HydrophobicContact CB-CD1 4.03Å; N303-I389 WeakPolarHBondContact ND2-CD1 3.3Å
304	F	88.1	Confident	80.9	Confident	15 Å²	15	28.8 Å²	28.8	7%	0.066	15%	0.15	C	C	.	.	H	α-helix	trans	-76.5	-32.7	-179.5	-56	-56.2	0	0	0	112.8	I300 D301 L302 L306 L307 S308 A353 D370 R387 I389	I300-F304 HydrophobicContact CG2-CD2 4.3Å; I300-F304 HydrophobicContact CG2-CE2 3.63Å; I300-F304 WeakPolarHBondContact O-CD2 3.3Å; I300-F304 WeakPolarHBondContact O-CE2 3.46Å; D301-F304 PolarHBondContact O-N 2.88Å; L302-F304 VanDerWaalsContact C-N 3.31Å; L302-F304 PolarHBondContact O-N 3.49Å; F304-L306 VanDerWaalsContact C-N 3.33Å; F304-L307 HydrophobicContact CD1-CD1 4.29Å; F304-L307 PolarHBondContact O-N 3.14Å; F304-S308 VanDerWaalsContact O-CB 3.3Å; F304-S308 WeakPolarHBondContact O-CB 3.22Å; F304-S308 PolarHBondContact O-N 2.88Å; F304-S308 PolarHBondContact O-OG 2.7Å; F304-A353 HydrophobicContact CB-CB 4.22Å; F304-A353 HydrophobicContact CD1-CB 4.39Å; F304-A353 WeakPolarHBondContact CD1-O 3.2Å; F304-D370 HydrophobicContact CD1-CB 3.93Å; F304-D370 HydrophobicContact CD2-CB 4.35Å; F304-D370 HydrophobicContact CE1-CB 4.19Å; F304-D370 WeakPolarHBondContact CE1-O 3.42Å; F304-D370 HydrophobicContact CG-CB 4.04Å; F304-D370 HydrophobicContact CZ-CB 4.48Å; F304-D370 WeakPolarHBondContact CZ-O 3.24Å; F304-R387 HydrophobicContact CD2-CG 4.29Å; F304-R387 HydrophobicContact CE2-CB 3.96Å; F304-R387 HydrophobicContact CE2-CG 4.01Å; F304-I389 HydrophobicContact CZ-CG1 4.15Å
305	K	85.6	Confident	79.5	Confident	55 Å²	55	35.2 Å²	35.2	24%	0.239	18%	0.184	C	C	.	.	H	α-helix	trans	-62.6	-41.3	171.5	-72.3	-175	-177.3	-173.1	0	111.8	E180 A181 D301 L302 S308 R309 Q310 F313	E180-K305 PolarHBondContact O-NZ 3.4Å; E180-K305 VanDerWaalsContact O-NZ 3.15Å; A181-K305 VanDerWaalsContact C-NZ 3.34Å; A181-K305 PolarHBondContact O-NZ 3.23Å; D301-K305 WeakPolarHBondContact O-CG 3.47Å; D301-K305 PolarHBondContact O-N 2.78Å; L302-K305 PolarHBondContact O-N 2.58Å; K305-S308 WeakPolarHBondContact CA-OG 3.44Å; K305-S308 PolarHBondContact O-N 3.39Å; K305-S308 PolarHBondContact O-OG 2.99Å; K305-R309 PolarHBondContact O-N 3.42Å; K305-Q310 PolarHBondContact O-N 2.96Å; K305-F313 HydrophobicContact CB-CE2 4.06Å
306	L	84.4	Confident	78	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.026	19%	0.185	C	C	.	.	H	α-helix	trans	-60.2	-56.8	174.5	-177.7	130.4	0	0	0	110.1	L59 L302 N303 F304 S308 R309 F313 L317	L59-L306 HydrophobicContact CD2-CD1 3.85Å; L302-L306 WeakPolarHBondContact O-CB 3.04Å; L302-L306 PolarHBondContact O-N 3.18Å; N303-L306 PolarHBondContact O-N 2.97Å; F304-L306 VanDerWaalsContact C-N 3.33Å; L306-S308 VanDerWaalsContact C-N 3.26Å; L306-S308 PolarHBondContact O-N 2.81Å; L306-R309 PolarHBondContact O-N 3.35Å; L306-F313 HydrophobicContact CB-CD1 4.43Å; L306-F313 HydrophobicContact CB-CE1 4.38Å; L306-F313 HydrophobicContact CB-CZ 4.41Å; L306-F313 HydrophobicContact CD1-CD1 3.89Å; L306-F313 HydrophobicContact CD1-CE1 3.92Å; L306-F313 HydrophobicContact CG-CD1 4.28Å; L306-L317 HydrophobicContact CD2-CD2 3.48Å; L306-L317 VanDerWaalsContact CD2-CD2 3.48Å; L306-L317 HydrophobicContact CG-CD2 3.76Å; L306-L317 WeakPolarHBondContact O-CD2 3.43Å
307	L	84.2	Confident	76.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.2	-37.8	179.4	-71.4	174.3	0	0	0	113.5	S60 N303 F304 R309 F337 A353 F355	S60-L307 WeakPolarHBondContact OG-CD2 3.31Å; S60-L307 WeakPolarHBondContact OG-CG 3.31Å; N303-L307 WeakPolarHBondContact O-CG 3.18Å; N303-L307 PolarHBondContact O-N 2.64Å; N303-L307 VanDerWaalsContact O-N 3.08Å; F304-L307 HydrophobicContact CD1-CD1 4.29Å; F304-L307 PolarHBondContact O-N 3.14Å; L307-R309 VanDerWaalsContact C-N 3.28Å; L307-R309 PolarHBondContact O-N 3.14Å; L307-F337 HydrophobicContact CD2-CD2 3.62Å; L307-F337 HydrophobicContact CD2-CE2 3.88Å; L307-A353 HydrophobicContact CB-CB 3.9Å; L307-F355 HydrophobicContact CD1-CB 3.94Å; L307-F355 HydrophobicContact CD2-CB 4.13Å; L307-F355 HydrophobicContact CD2-CD2 4.22Å
308	S	83.1	Confident	74.5	Confident	15 Å²	15	36.1 Å²	36.1	11%	0.105	19%	0.189	C	C	.	.	H	α-helix	trans	-78.3	-6.1	178.5	59.8	0	0	0	0	114.7	F304 K305 L306 Q310	F304-S308 VanDerWaalsContact O-CB 3.3Å; F304-S308 WeakPolarHBondContact O-CB 3.22Å; F304-S308 PolarHBondContact O-N 2.88Å; F304-S308 PolarHBondContact O-OG 2.7Å; K305-S308 WeakPolarHBondContact CA-OG 3.44Å; K305-S308 PolarHBondContact O-N 3.39Å; K305-S308 PolarHBondContact O-OG 2.99Å; L306-S308 VanDerWaalsContact C-N 3.26Å; L306-S308 PolarHBondContact O-N 2.81Å; S308-Q310 PolarHBondContact O-N 2.99Å
309	R	77.9	Confident	72.7	Confident	101 Å²	101	40.3 Å²	40.3	38%	0.381	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	18.8	-176	-60.1	173.7	-170.1	-168.1	-3.3	114.1	K305 L306 L307 H314 L317	K305-R309 PolarHBondContact O-N 3.42Å; L306-R309 PolarHBondContact O-N 3.35Å; L307-R309 VanDerWaalsContact C-N 3.28Å; L307-R309 PolarHBondContact O-N 3.14Å; R309-H314 PolarHBondContact O-CE1 3.17Å; R309-L317 HydrophobicContact CB-CD1 4.46Å; R309-L317 HydrophobicContact CG-CD1 3.12Å; R309-L317 HydrophobicContact CG-CG 4.28Å
310	Q	71.8	Confident	70.7	Confident	116 Å²	116	47.5 Å²	47.5	54%	0.542	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	139.5	-176.7	-72.2	-174.1	-12.6	0	0	111.4	K305 S308 F313	K305-Q310 PolarHBondContact O-N 2.96Å; S308-Q310 PolarHBondContact O-N 2.99Å; Q310-F313 WeakPolarHBondContact O-CD2 3.3Å; Q310-F313 WeakPolarHBondContact O-CE2 3.47Å
311	G	63.5	Low	68.8	Low	32 Å²	32	49.4 Å²	49.4	33%	0.33	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	22.7	175.4	0	0	0	0	0	115.3	I288	I288-G311 WeakPolarHBondContact CD1-O 3.38Å; I288-G311 WeakPolarHBondContact CG1-O 3.4Å
312	G	63.9	Low	66.9	Low	20 Å²	20	47.6 Å²	47.6	21%	0.206	25%	0.253	C	S	.	.	S	Bend	trans	100.2	6.7	170.8	0	0	0	0	0	115.9	H314	G312-H314 PolarHBondContact O-N 2.96Å
313	F	64	Low	65.2	Low	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-69.1	13.1	175.5	-67.5	-75.7	0	0	0	114.9	I147 A181 I288 L290 L302 K305 L306 Q310 L315 S316	I147-F313 HydrophobicContact CG2-CE1 4.29Å; A181-F313 HydrophobicContact CB-CE2 4.43Å; I288-F313 HydrophobicContact CB-CE1 4.48Å; I288-F313 HydrophobicContact CD1-CD1 3.83Å; I288-F313 HydrophobicContact CD1-CD2 3.62Å; I288-F313 HydrophobicContact CD1-CE1 3.49Å; I288-F313 VanDerWaalsContact CD1-CE1 3.49Å; I288-F313 HydrophobicContact CD1-CE2 3.24Å; I288-F313 HydrophobicContact CD1-CG 3.89Å; I288-F313 HydrophobicContact CD1-CZ 3.18Å; I288-F313 HydrophobicContact CG2-CD1 4.34Å; I288-F313 HydrophobicContact CG2-CE1 3.84Å; I288-F313 HydrophobicContact CG2-CZ 4.37Å; L290-F313 HydrophobicContact CD2-CZ 4.46Å; L302-F313 HydrophobicContact CG-CZ 4.41Å; K305-F313 HydrophobicContact CB-CE2 4.06Å; L306-F313 HydrophobicContact CB-CD1 4.43Å; L306-F313 HydrophobicContact CB-CE1 4.38Å; L306-F313 HydrophobicContact CB-CZ 4.41Å; L306-F313 HydrophobicContact CD1-CD1 3.89Å; L306-F313 HydrophobicContact CD1-CE1 3.92Å; L306-F313 HydrophobicContact CG-CD1 4.28Å; Q310-F313 WeakPolarHBondContact O-CD2 3.3Å; Q310-F313 WeakPolarHBondContact O-CE2 3.47Å; F313-L315 PolarHBondContact O-N 2.79Å; F313-S316 WeakPolarHBondContact CD1-OG 3.5Å; F313-S316 PolarHBondContact O-N 3.19Å; F313-S316 PolarHBondContact O-OG 3.07Å
314	H	56.8	Low	63.6	Low	143 Å²	143	54 Å²	54	66%	0.662	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-58.7	-24.4	-177.8	-55.5	-62.7	0	0	0	113.3	R309 G312	R309-H314 PolarHBondContact O-CE1 3.17Å; G312-H314 PolarHBondContact O-N 2.96Å
315	L	51.8	Low	62.1	Low	136 Å²	136	56.1 Å²	56.1	71%	0.712	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-95.4	-14.8	-176.7	-77.4	149.9	0	0	0	114.5	F313	F313-L315 PolarHBondContact O-N 2.79Å
316	S	55.1	Low	61	Low	10 Å²	10	56 Å²	56	7%	0.07	32%	0.318	C	S	.	.	S	Bend	trans	-114.9	13.5	-164.1	45	0	0	0	0	115.6	F313	F313-S316 WeakPolarHBondContact CD1-OG 3.5Å; F313-S316 PolarHBondContact O-N 3.19Å; F313-S316 PolarHBondContact O-OG 3.07Å
317	L	56.1	Low	60.1	Low	18 Å²	18	57.2 Å²	57.2	9%	0.094	33%	0.327	C	S	.	.			trans	-89.9	163	-173	-93	-168.7	0	0	0	116.1	L306 R309 P319 F337	L306-L317 HydrophobicContact CD2-CD2 3.48Å; L306-L317 VanDerWaalsContact CD2-CD2 3.48Å; L306-L317 HydrophobicContact CG-CD2 3.76Å; L306-L317 WeakPolarHBondContact O-CD2 3.43Å; R309-L317 HydrophobicContact CB-CD1 4.46Å; R309-L317 HydrophobicContact CG-CD1 3.12Å; R309-L317 HydrophobicContact CG-CG 4.28Å; L317-P319 WeakPolarHBondContact O-CD 3.41Å; L317-F337 HydrophobicContact CD1-CZ 4.15Å
318	P	47.8	Very low	59.7	Low	12 Å²	12	63.2 Å²	63.2	8%	0.078	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	5.3	-134.8	-6.5	29.3	0	0	0	118.3	L320 Y321 A322	P318-L320 PolarHBondContact O-N 3.28Å; P318-Y321 PolarHBondContact O-N 2.8Å; P318-Y321 VanDerWaalsContact O-N 3.1Å; P318-A322 HydrophobicContact CB-CB 3.9Å; P318-A322 WeakPolarHBondContact O-CB 3.47Å; P318-A322 PolarHBondContact O-N 3.17Å
319	P	47.7	Very low	59.7	Low	105 Å²	105	64.6 Å²	64.6	68%	0.682	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.8	175.7	-18.4	30.2	0	0	0	111.9	L317	L317-P319 WeakPolarHBondContact O-CD 3.41Å
320	L	47.2	Very low	60	Low	152 Å²	152	62.7 Å²	62.7	80%	0.796	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-29	176.9	-83.6	151.3	0	0	0	114.3	P318	P318-L320 PolarHBondContact O-N 3.28Å
321	Y	52.1	Low	60.6	Low	41 Å²	41	59.8 Å²	59.8	16%	0.161	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-19.5	-172.3	-57.4	-65.5	0	0	0	114.2	V62 M67 S70 P318 N323	V62-Y321 WeakPolarHBondContact CG2-O 3.49Å; M67-Y321 HydrophobicContact CE-CD2 3.89Å; M67-Y321 HydrophobicContact CE-CE2 4.28Å; M67-Y321 HydrophobicContact CE-CG 4.13Å; M67-Y321 HydrophobicContact SD-CD1 4.3Å; M67-Y321 HydrophobicContact SD-CD2 4.22Å; M67-Y321 HydrophobicContact SD-CG 3.84Å; S70-Y321 VanDerWaalsContact CB-CE1 3.5Å; S70-Y321 VanDerWaalsContact OG-CD1 3.31Å; S70-Y321 WeakPolarHBondContact OG-CD1 3.5Å; S70-Y321 WeakPolarHBondContact OG-CE1 3.24Å; P318-Y321 PolarHBondContact O-N 2.8Å; P318-Y321 VanDerWaalsContact O-N 3.1Å; Y321-N323 VanDerWaalsContact C-N 3.32Å; Y321-N323 PolarHBondContact O-N 2.91Å
322	A	47.3	Very low	61.7	Low	12 Å²	12	63.4 Å²	63.4	10%	0.099	37%	0.371	C	S	.	.	S	Bend	trans	-85.8	-2	-176.5	0	0	0	0	0	113.8	V62 P318 L324 I329	V62-A322 HydrophobicContact CG2-CB 4.16Å; P318-A322 HydrophobicContact CB-CB 3.9Å; P318-A322 WeakPolarHBondContact O-CB 3.47Å; P318-A322 PolarHBondContact O-N 3.17Å; A322-L324 PolarHBondContact O-N 3.27Å; A322-I329 HydrophobicContact CB-CD1 3.38Å
323	N	51.9	Low	62.7	Low	88 Å²	88	63.5 Å²	63.5	47%	0.471	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	36.7	-177	-148.1	19.5	0	0	0	113.4	Y321 S325 G326 S327	Y321-N323 VanDerWaalsContact C-N 3.32Å; Y321-N323 PolarHBondContact O-N 2.91Å; N323-S325 VanDerWaalsContact C-N 3.3Å; N323-G326 WeakPolarHBondContact OD1-CA 3.23Å; N323-G326 PolarHBondContact OD1-N 3.31Å; N323-S327 PolarHBondContact OD1-N 2.71Å
324	L	56.2	Low	63.6	Low	57 Å²	57	68.7 Å²	68.7	30%	0.298	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-36.3	170.9	-83.5	150.5	0	0	0	110.9	V62 P63 Y94 A322	V62-L324 HydrophobicContact CG1-CD1 4.16Å; P63-L324 HydrophobicContact CG-CD1 4.47Å; Y94-L324 HydrophobicContact CE2-CD2 4.3Å; A322-L324 PolarHBondContact O-N 3.27Å
325	S	56	Low	65	Low	61 Å²	61	64.7 Å²	64.7	43%	0.427	39%	0.388	S	S	.	.	S	Bend	trans	-98.8	4.7	-178.2	59.7	0	0	0	0	114.8	N323 S327 E375	N323-S325 VanDerWaalsContact C-N 3.3Å; S325-S327 PolarHBondContact O-N 3.21Å; S325-S327 PolarHBondContact OG-OG 3.41Å; S325-S327 VanDerWaalsContact OG-OG 3.05Å; S325-E375 VanDerWaalsContact CB-OE1 3.32Å; S325-E375 WeakPolarHBondContact CB-OE1 3.17Å; S325-E375 PolarHBondContact OG-OE1 2.88Å
326	G	62.9	Low	66.8	Low	53 Å²	53	59.2 Å²	59.2	55%	0.546	36%	0.36	S	S	.	.			trans	72.9	5.7	-175.2	0	0	0	0	0	114	N323	N323-G326 WeakPolarHBondContact OD1-CA 3.23Å; N323-G326 PolarHBondContact OD1-N 3.31Å
327	S	64.9	Low	68.5	Low	29 Å²	29	59.1 Å²	59.1	20%	0.203	36%	0.359	C	S	.	.			trans	-82.6	121.4	-172.2	-63.2	0	0	0	0	111.7	N323 S325 I329	N323-S327 PolarHBondContact OD1-N 2.71Å; S325-S327 PolarHBondContact O-N 3.21Å; S325-S327 PolarHBondContact OG-OG 3.41Å; S325-S327 VanDerWaalsContact OG-OG 3.05Å; S327-I329 PolarHBondContact O-N 3.46Å; S327-I329 VanDerWaalsContact O-N 3.1Å
328	E	76.3	Confident	70.1	Confident	126 Å²	126	59 Å²	59	59%	0.589	36%	0.358	S	S	*	.			trans	-70.2	107.7	175.2	-66.5	-173.6	145.9	0	0	110.9	K340	E328-K340 HydrophobicContact CB-CD 3.89Å; E328-K340 HydrophobicContact CB-CG 4.26Å; E328-K340 WeakPolarHBondContact O-CG 3.47Å; E328-K340 PolarHBondContact O-N 2.99Å; E328-K340 VanDerWaalsContact OE2-CD 3.27Å; E328-K340 WeakPolarHBondContact OE2-CD 3.45Å; E328-K340 VanDerWaalsContact OE2-CE 3.25Å; E328-K340 WeakPolarHBondContact OE2-CE 3.23Å; E328-K340 IonicContact OE2-NZ 4Å; E328-K340 PolarHBondContact OE2-NZ 3.21Å
329	I	81.6	Confident	72.1	Confident	44 Å²	44	58.5 Å²	58.5	23%	0.226	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	132.2	174.3	-64.2	155.1	0	0	0	109.3	A322 S327 F337 A339 F355	A322-I329 HydrophobicContact CB-CD1 3.38Å; S327-I329 PolarHBondContact O-N 3.46Å; S327-I329 VanDerWaalsContact O-N 3.1Å; I329-F337 HydrophobicContact CG2-CB 3.94Å; I329-A339 HydrophobicContact CG1-CB 4.39Å; I329-F355 HydrophobicContact CD1-CE2 4Å; I329-F355 HydrophobicContact CD1-CZ 3.69Å; I329-F355 HydrophobicContact CG1-CZ 4.41Å; I329-F355 HydrophobicContact CG2-CE2 4.29Å
330	V	85	Confident	74	Confident	61 Å²	61	59.9 Å²	59.9	37%	0.37	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.1	-179.6	-175.3	0	0	0	0	109.3	V332 V338 K340	V330-V332 PolarHBondContact O-N 2.72Å; V330-V338 PolarHBondContact N-O 3.07Å; V330-V338 PolarHBondContact O-N 3.04Å; V330-K340 HydrophobicContact CG2-CD 4.18Å; V330-K340 VanDerWaalsContact CG2-CE 3.42Å; V330-K340 HydrophobicContact CG2-CG 3.67Å
331	A	85	Confident	76	Confident	56 Å²	56	55.9 Å²	55.9	46%	0.463	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	105.5	168.7	0	0	0	0	0	109	V336 F337	A331-V336 CarbonylContact C-O 3.6Å; A331-V336 WeakPolarHBondContact CA-O 3.37Å; A331-F337 HydrophobicContact CB-CD1 3.96Å; A331-F337 HydrophobicContact CB-CE1 3.88Å
332	V	86.5	Confident	77.9	Confident	107 Å²	107	54.8 Å²	54.8	65%	0.648	34%	0.335	S	S	*	.	S	Bend	trans	-82.5	-26.2	178.5	-179.8	0	0	0	0	110.9	V330 V336 V338	V330-V332 PolarHBondContact O-N 2.72Å; V332-V336 PolarHBondContact N-O 3.03Å; V332-V338 HydrophobicContact CB-CG2 4.41Å; V332-V338 HydrophobicContact CG2-CB 3.87Å; V332-V338 HydrophobicContact CG2-CG2 3.79Å
333	G	84.3	Confident	80.2	Confident	23 Å²	23	60.6 Å²	60.6	24%	0.237	36%	0.358	C	S	.	.	S	Bend	trans	-142.4	-179	174.7	0	0	0	0	0	111.3	Q335 V336	G333-Q335 PolarHBondContact O-N 2.85Å; G333-V336 PolarHBondContact N-O 2.85Å; G333-V336 PolarHBondContact O-N 3.13Å
334	P	82.2	Confident	82.2	Confident	108 Å²	108	59.4 Å²	59.4	70%	0.701	35%	0.351	S	S	*	.	S	Bend	trans	-61.4	-28.3	-178.4	23.3	-32.5	0	0	0	113.2
335	Q	87.6	Confident	84.1	Confident	59 Å²	59	60 Å²	60	28%	0.276	35%	0.352	S	S	.	.	S	Bend	trans	-129.5	9.1	-176.4	-47.8	-177.8	-9	0	0	112.3	G333 A353 C354	G333-Q335 PolarHBondContact O-N 2.85Å; Q335-A353 HydrophobicContact CB-CB 4.28Å; Q335-A353 CarbonylContact O-C 3.53Å; Q335-A353 WeakPolarHBondContact O-CA 3.46Å; Q335-C354 PolarHBondContact O-N 3.21Å
336	V	89.9	Confident	85.9	Confident	22 Å²	22	64.3 Å²	64.3	13%	0.133	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	118.6	-173.5	-178.4	0	0	0	0	109.8	A331 V332 G333 V338 I350 G352 C354	A331-V336 CarbonylContact C-O 3.6Å; A331-V336 WeakPolarHBondContact CA-O 3.37Å; V332-V336 PolarHBondContact N-O 3.03Å; G333-V336 PolarHBondContact N-O 2.85Å; G333-V336 PolarHBondContact O-N 3.13Å; V336-V338 HydrophobicContact CG1-CG2 4Å; V336-I350 HydrophobicContact CG1-CG2 3.93Å; V336-I350 HydrophobicContact CG2-CG2 4.16Å; V336-G352 WeakPolarHBondContact CG2-O 3.41Å; V336-C354 WeakPolarHBondContact CA-O 3.49Å; V336-C354 HydrophobicContact CG1-CB 4.42Å; V336-C354 HydrophobicContact CG2-CB 4.47Å
337	F	88.9	Confident	87.5	Confident	8 Å²	8	66.4 Å²	66.4	4%	0.035	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.8	-178.2	-59.2	-91.6	0	0	0	109.7	L307 L317 I329 A331 C354 F355 I356	L307-F337 HydrophobicContact CD2-CD2 3.62Å; L307-F337 HydrophobicContact CD2-CE2 3.88Å; L317-F337 HydrophobicContact CD1-CZ 4.15Å; I329-F337 HydrophobicContact CG2-CB 3.94Å; A331-F337 HydrophobicContact CB-CD1 3.96Å; A331-F337 HydrophobicContact CB-CE1 3.88Å; F337-C354 PolarHBondContact N-O 2.94Å; F337-F355 HydrophobicContact CB-CD2 3.87Å; F337-F355 HydrophobicContact CB-CE2 4.33Å; F337-F355 CarbonylContact O-C 3.54Å; F337-F355 WeakPolarHBondContact O-CA 3.31Å; F337-I356 PolarHBondContact O-N 2.98Å
338	V	90.1	Very high	88.9	Confident	14 Å²	14	66 Å²	66	9%	0.085	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	128.7	-173.7	-176.4	0	0	0	0	109.3	V330 V332 V336 A342 I344 I356	V330-V338 PolarHBondContact N-O 3.07Å; V330-V338 PolarHBondContact O-N 3.04Å; V332-V338 HydrophobicContact CB-CG2 4.41Å; V332-V338 HydrophobicContact CG2-CB 3.87Å; V332-V338 HydrophobicContact CG2-CG2 3.79Å; V336-V338 HydrophobicContact CG1-CG2 4Å; V338-A342 HydrophobicContact CG1-CB 3.87Å; V338-I344 HydrophobicContact CG1-CD1 3.64Å; V338-I344 HydrophobicContact CG2-CD1 4.1Å; V338-I356 HydrophobicContact CG1-CB 4.29Å; V338-I356 HydrophobicContact CG1-CG2 4.46Å; V338-I356 HydrophobicContact CG2-CB 4.34Å; V338-I356 HydrophobicContact CG2-CD1 4.19Å; V338-I356 HydrophobicContact CG2-CG1 4.5Å
339	A	89.5	Confident	89.8	Confident	2 Å²	2	67.5 Å²	67.5	2%	0.017	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	138.2	169.5	0	0	0	0	0	110.6	I329 S341 A342 I356	I329-A339 HydrophobicContact CG1-CB 4.39Å; A339-S341 PolarHBondContact O-N 2.84Å; A339-A342 WeakPolarHBondContact O-CB 3.43Å; A339-A342 PolarHBondContact O-N 2.9Å; A339-I356 PolarHBondContact N-O 2.85Å
340	K	87.9	Confident	90.4	Very high	135 Å²	135	67.7 Å²	67.7	59%	0.587	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-25.2	-178.9	-71.4	-173.6	-174.5	176.8	0	114.3	E328 V330 A342	E328-K340 HydrophobicContact CB-CD 3.89Å; E328-K340 HydrophobicContact CB-CG 4.26Å; E328-K340 WeakPolarHBondContact O-CG 3.47Å; E328-K340 PolarHBondContact O-N 2.99Å; E328-K340 VanDerWaalsContact OE2-CD 3.27Å; E328-K340 WeakPolarHBondContact OE2-CD 3.45Å; E328-K340 VanDerWaalsContact OE2-CE 3.25Å; E328-K340 WeakPolarHBondContact OE2-CE 3.23Å; E328-K340 IonicContact OE2-NZ 4Å; E328-K340 PolarHBondContact OE2-NZ 3.21Å; V330-K340 HydrophobicContact CG2-CD 4.18Å; V330-K340 VanDerWaalsContact CG2-CE 3.42Å; V330-K340 HydrophobicContact CG2-CG 3.67Å; K340-A342 VanDerWaalsContact C-N 3.33Å
341	S	90.2	Very high	90.8	Very high	68 Å²	68	67.9 Å²	67.9	48%	0.476	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-9.3	178.9	56.8	0	0	0	0	114.2	A339 S358 G359	A339-S341 PolarHBondContact O-N 2.84Å; S341-S358 VanDerWaalsContact OG-CA 3.28Å; S341-S358 WeakPolarHBondContact OG-CA 3.34Å; S341-S358 WeakPolarHBondContact OG-CB 3.39Å; S341-G359 PolarHBondContact OG-N 2.87Å; S341-G359 VanDerWaalsContact OG-N 3.1Å
342	A	91.8	Very high	91	Very high	18 Å²	18	66.6 Å²	66.6	15%	0.149	35%	0.349	C	S	.	.			trans	-72.6	137.7	-178.5	0	0	0	0	0	111.8	V338 A339 K340 I356 C360	V338-A342 HydrophobicContact CG1-CB 3.87Å; A339-A342 WeakPolarHBondContact O-CB 3.43Å; A339-A342 PolarHBondContact O-N 2.9Å; K340-A342 VanDerWaalsContact C-N 3.33Å; A342-I356 HydrophobicContact CB-CG2 3.77Å; A342-C360 CarbonylContact C-O 3.59Å; A342-C360 WeakPolarHBondContact CA-O 3.44Å; A342-C360 HydrophobicContact CB-CB 4.3Å
343	K	94.6	Very high	91.2	Very high	134 Å²	134	61.6 Å²	61.6	58%	0.583	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	107.9	176.8	-59.2	-179.3	-161.1	152.9	0	109.8	C360 E361 V362	K343-C360 PolarHBondContact N-O 2.89Å; K343-E361 HydrophobicContact CB-CG 4.29Å; K343-E361 HydrophobicContact CD-CG 4.35Å; K343-E361 WeakPolarHBondContact CD-OE1 3.47Å; K343-E361 IonicContact NZ-OE1 4Å; K343-E361 PolarHBondContact NZ-OE1 3.47Å; K343-E361 WeakPolarHBondContact O-CA 3.47Å; K343-V362 PolarHBondContact O-N 2.9Å
344	I	94.5	Very high	91.6	Very high	63 Å²	63	60.5 Å²	60.5	32%	0.323	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	122.6	-179.9	-57.5	168.2	0	0	0	108.8	V338 A348 I350 I356 V362	V338-I344 HydrophobicContact CG1-CD1 3.64Å; V338-I344 HydrophobicContact CG2-CD1 4.1Å; I344-A348 HydrophobicContact CG2-CB 4.03Å; I344-I350 HydrophobicContact CD1-CD1 3.94Å; I344-I350 HydrophobicContact CG2-CD1 4.06Å; I344-I356 HydrophobicContact CD1-CD1 3.71Å; I344-I356 HydrophobicContact CG1-CD1 4.37Å; I344-V362 HydrophobicContact CG1-CB 4.48Å; I344-V362 HydrophobicContact CG1-CG2 4.46Å; I344-V362 HydrophobicContact CG2-CB 4.42Å
345	H	96.4	Very high	92.1	Very high	69 Å²	69	55.5 Å²	55.5	32%	0.319	28%	0.275	S	S	.	.			trans	-68.8	139.5	176.4	-169.6	-88.4	0	0	0	111.2	K347 A348 V362 A364	H345-K347 PolarHBondContact ND1-N 2.89Å; H345-K347 PolarHBondContact O-N 3.47Å; H345-A348 VanDerWaalsContact O-CB 3.23Å; H345-A348 WeakPolarHBondContact O-CB 3.24Å; H345-A348 PolarHBondContact O-N 3.49Å; H345-V362 WeakPolarHBondContact CB-O 3.31Å; H345-V362 PolarHBondContact N-O 2.88Å; H345-A364 WeakPolarHBondContact ND1-CB 3.34Å
346	H	93.6	Very high	92.3	Very high	151 Å²	151	52.8 Å²	52.8	70%	0.699	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.7	-176.1	66.7	-83.6	0	0	0	115.5
347	K	95.7	Very high	92.3	Very high	98 Å²	98	51.9 Å²	51.9	43%	0.426	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.8	175.4	-57.7	-172.6	-176.9	175.4	0	114.1	H345 F365	H345-K347 PolarHBondContact ND1-N 2.89Å; H345-K347 PolarHBondContact O-N 3.47Å; K347-F365 HydrophobicContact CB-CD1 4.25Å; K347-F365 HydrophobicContact CB-CE1 4.29Å; K347-F365 HydrophobicContact CD-CD1 4.42Å; K347-F365 HydrophobicContact CD-CE1 3.68Å; K347-F365 HydrophobicContact CD-CE2 3.99Å; K347-F365 HydrophobicContact CD-CZ 3.44Å; K347-F365 VanDerWaalsContact CD-CZ 3.44Å
348	A	94.9	Very high	92.4	Very high	19 Å²	19	52.1 Å²	52.1	16%	0.157	26%	0.26	C	S	.	.			trans	-70.3	145.3	175	0	0	0	0	0	109.7	I344 H345 V362 A366	I344-A348 HydrophobicContact CG2-CB 4.03Å; H345-A348 VanDerWaalsContact O-CB 3.23Å; H345-A348 WeakPolarHBondContact O-CB 3.24Å; H345-A348 PolarHBondContact O-N 3.49Å; A348-V362 HydrophobicContact CB-CG1 3.78Å; A348-A366 WeakPolarHBondContact CA-O 3.21Å
349	R	95	Very high	92.4	Very high	158 Å²	158	52.9 Å²	52.9	60%	0.596	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	121.7	178.4	-67.3	177.6	63.7	-170.1	-1.2	108.7	A366 C367 L368	R349-A366 PolarHBondContact N-O 3.4Å; R349-C367 WeakPolarHBondContact O-CA 3.44Å; R349-L368 PolarHBondContact O-N 2.96Å
350	I	94.6	Very high	92.7	Very high	49 Å²	49	52.8 Å²	52.8	25%	0.251	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	119.2	176.2	-55.7	170.1	0	0	0	106.3	V336 I344 C354 I356 L368	V336-I350 HydrophobicContact CG1-CG2 3.93Å; V336-I350 HydrophobicContact CG2-CG2 4.16Å; I344-I350 HydrophobicContact CD1-CD1 3.94Å; I344-I350 HydrophobicContact CG2-CD1 4.06Å; I350-C354 HydrophobicContact CG2-CB 3.49Å; I350-C354 VanDerWaalsContact CG2-CB 3.49Å; I350-I356 HydrophobicContact CD1-CD1 3.68Å; I350-L368 HydrophobicContact CG1-CD1 4.48Å
351	I	93	Very high	93.1	Very high	65 Å²	65	50 Å²	50	33%	0.333	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.8	-170.9	-53.1	176.6	0	0	0	108.4	L368 I369 D370	I351-L368 PolarHBondContact N-O 3.34Å; I351-I369 HydrophobicContact CB-CG1 4.27Å; I351-I369 HydrophobicContact CD1-CG1 4.4Å; I351-I369 WeakPolarHBondContact O-CA 3.34Å; I351-D370 PolarHBondContact O-N 2.69Å
352	G	90.5	Very high	93.4	Very high	28 Å²	28	47 Å²	47	29%	0.289	24%	0.237	S	C	.	.	S	Bend	trans	77.1	-145.3	178	0	0	0	0	0	113.4	V336 C354 D370	V336-G352 WeakPolarHBondContact CG2-O 3.41Å; G352-C354 PolarHBondContact O-N 3.34Å; G352-D370 WeakPolarHBondContact CA-OD1 3.37Å
353	A	90.6	Very high	93.6	Very high	2 Å²	2	47.1 Å²	47.1	2%	0.017	24%	0.237	C	C	.	.	S	Bend	trans	-90.1	97.2	-172.7	0	0	0	0	0	111.4	F304 L307 Q335 D370 C371	F304-A353 HydrophobicContact CB-CB 4.22Å; F304-A353 HydrophobicContact CD1-CB 4.39Å; F304-A353 WeakPolarHBondContact CD1-O 3.2Å; L307-A353 HydrophobicContact CB-CB 3.9Å; Q335-A353 HydrophobicContact CB-CB 4.28Å; Q335-A353 CarbonylContact O-C 3.53Å; Q335-A353 WeakPolarHBondContact O-CA 3.46Å; A353-D370 PolarHBondContact N-OD1 3.1Å; A353-D370 CarbonylContact O-C 3.53Å; A353-D370 VanDerWaalsContact O-CA 3.23Å; A353-D370 WeakPolarHBondContact O-CA 3.5Å; A353-C371 PolarHBondContact O-N 3.29Å
354	C	92.7	Very high	93.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	137.5	-174	-69.9	0	0	0	0	112.6	Q335 V336 F337 I350 G352 C371	Q335-C354 PolarHBondContact O-N 3.21Å; V336-C354 WeakPolarHBondContact CA-O 3.49Å; V336-C354 HydrophobicContact CG1-CB 4.42Å; V336-C354 HydrophobicContact CG2-CB 4.47Å; F337-C354 PolarHBondContact N-O 2.94Å; I350-C354 HydrophobicContact CG2-CB 3.49Å; I350-C354 VanDerWaalsContact CG2-CB 3.49Å; G352-C354 PolarHBondContact O-N 3.34Å; C354-C371 CarbonylContact C-O 3.56Å; C354-C371 WeakPolarHBondContact CA-O 3.29Å; C354-C371 PolarHBondContact SG-N 3.13Å; C354-C371 VanDerWaalsContact SG-N 3.37Å
355	F	91.6	Very high	93.7	Very high	4 Å²	4	43.6 Å²	43.6	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.8	171.3	-175.2	-81.4	0	0	0	109.4	N61 L307 I329 F337 C371 L373	N61-F355 HydrophobicContact CB-CE1 4Å; N61-F355 HydrophobicContact CB-CZ 4.41Å; N61-F355 WeakPolarHBondContact ND2-CE1 3.26Å; L307-F355 HydrophobicContact CD1-CB 3.94Å; L307-F355 HydrophobicContact CD2-CB 4.13Å; L307-F355 HydrophobicContact CD2-CD2 4.22Å; I329-F355 HydrophobicContact CD1-CE2 4Å; I329-F355 HydrophobicContact CD1-CZ 3.69Å; I329-F355 HydrophobicContact CG1-CZ 4.41Å; I329-F355 HydrophobicContact CG2-CE2 4.29Å; F337-F355 HydrophobicContact CB-CD2 3.87Å; F337-F355 HydrophobicContact CB-CE2 4.33Å; F337-F355 CarbonylContact O-C 3.54Å; F337-F355 WeakPolarHBondContact O-CA 3.31Å; F355-C371 PolarHBondContact N-O 3.19Å; F355-L373 PolarHBondContact O-N 3.27Å
356	I	92.4	Very high	93.8	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	111.4	179.1	-58.2	179	0	0	0	108.8	F337 V338 A339 A342 I344 I350 C360 L368 L373	F337-I356 PolarHBondContact O-N 2.98Å; V338-I356 HydrophobicContact CG1-CB 4.29Å; V338-I356 HydrophobicContact CG1-CG2 4.46Å; V338-I356 HydrophobicContact CG2-CB 4.34Å; V338-I356 HydrophobicContact CG2-CD1 4.19Å; V338-I356 HydrophobicContact CG2-CG1 4.5Å; A339-I356 PolarHBondContact N-O 2.85Å; A342-I356 HydrophobicContact CB-CG2 3.77Å; I344-I356 HydrophobicContact CD1-CD1 3.71Å; I344-I356 HydrophobicContact CG1-CD1 4.37Å; I350-I356 HydrophobicContact CD1-CD1 3.68Å; I356-C360 HydrophobicContact CG2-CB 3.52Å; I356-L368 HydrophobicContact CD1-CD1 4.39Å; I356-L373 HydrophobicContact CG1-CD1 4.48Å
357	G	90.1	Very high	93.9	Very high	3 Å²	3	34.1 Å²	34.1	3%	0.031	18%	0.18	C	C	.	.			trans	-70.7	175.9	179.4	0	0	0	0	0	114.5	C360 L373 G374	G357-C360 WeakPolarHBondContact O-CB 3.48Å; G357-C360 PolarHBondContact O-SG 2.92Å; G357-L373 PolarHBondContact N-O 3.3Å; G357-G374 WeakPolarHBondContact CA-O 3.29Å
358	S	89.9	Confident	93.9	Very high	13 Å²	13	29.5 Å²	29.5	9%	0.091	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	144.3	-178.8	57.9	0	0	0	0	111.5	S341 C360 E375 N376	S341-S358 VanDerWaalsContact OG-CA 3.28Å; S341-S358 WeakPolarHBondContact OG-CA 3.34Å; S341-S358 WeakPolarHBondContact OG-CB 3.39Å; S358-C360 PolarHBondContact O-N 2.88Å; S358-E375 CarbonylContact O-C 3.6Å; S358-E375 WeakPolarHBondContact O-CA 3.2Å; S358-E375 VanDerWaalsContact OG-CG 3.29Å; S358-E375 WeakPolarHBondContact OG-CG 3.38Å; S358-E375 PolarHBondContact OG-OE1 3.24Å; S358-N376 PolarHBondContact O-N 2.82Å
359	G	91	Very high	94	Very high	30 Å²	30	30.9 Å²	30.9	31%	0.309	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	6.8	177.4	0	0	0	0	0	115.7	S341	S341-G359 PolarHBondContact OG-N 2.87Å; S341-G359 VanDerWaalsContact OG-N 3.1Å
360	C	94.7	Very high	93.9	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	15%	0.147	C	C	.	.			trans	-67.5	142.6	175.5	-78.5	0	0	0	0	112.4	A342 K343 I356 G357 S358 G374 C377	A342-C360 CarbonylContact C-O 3.59Å; A342-C360 WeakPolarHBondContact CA-O 3.44Å; A342-C360 HydrophobicContact CB-CB 4.3Å; K343-C360 PolarHBondContact N-O 2.89Å; I356-C360 HydrophobicContact CG2-CB 3.52Å; G357-C360 WeakPolarHBondContact O-CB 3.48Å; G357-C360 PolarHBondContact O-SG 2.92Å; S358-C360 PolarHBondContact O-N 2.88Å; C360-G374 PolarHBondContact SG-O 3.01Å; C360-C377 CarbonylContact C-O 3.59Å; C360-C377 VanDerWaalsContact CA-O 3.24Å; C360-C377 WeakPolarHBondContact CA-O 3.38Å
361	E	96.7	Very high	93.9	Very high	76 Å²	76	23.2 Å²	23.2	36%	0.355	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.4	173.9	-61.3	-165.5	159.2	0	0	110.8	K343 C377 F378 V379	K343-E361 HydrophobicContact CB-CG 4.29Å; K343-E361 HydrophobicContact CD-CG 4.35Å; K343-E361 WeakPolarHBondContact CD-OE1 3.47Å; K343-E361 IonicContact NZ-OE1 4Å; K343-E361 PolarHBondContact NZ-OE1 3.47Å; K343-E361 WeakPolarHBondContact O-CA 3.47Å; E361-C377 PolarHBondContact N-O 3.15Å; E361-F378 HydrophobicContact CB-CD2 4Å; E361-V379 PolarHBondContact O-N 3.36Å
362	V	96.9	Very high	94	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.024	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	114	179	-176.5	0	0	0	0	109.8	K343 I344 H345 A348 A366 L368 L373 V379	K343-V362 PolarHBondContact O-N 2.9Å; I344-V362 HydrophobicContact CG1-CB 4.48Å; I344-V362 HydrophobicContact CG1-CG2 4.46Å; I344-V362 HydrophobicContact CG2-CB 4.42Å; H345-V362 WeakPolarHBondContact CB-O 3.31Å; H345-V362 PolarHBondContact N-O 2.88Å; A348-V362 HydrophobicContact CB-CG1 3.78Å; V362-A366 HydrophobicContact CG1-CB 3.79Å; V362-L368 HydrophobicContact CG1-CD1 4.31Å; V362-L368 HydrophobicContact CG2-CD1 4.21Å; V362-L373 HydrophobicContact CG2-CD1 4.45Å; V362-V379 HydrophobicContact CG1-CB 4.49Å
363	S	96.9	Very high	94.1	Very high	22 Å²	22	18.9 Å²	18.9	15%	0.154	11%	0.106	C	C	.	.			trans	-78.8	175.3	-172.8	-55.9	0	0	0	0	113.7	A366 V379	S363-A366 WeakPolarHBondContact O-CB 2.86Å; S363-A366 PolarHBondContact O-N 2.85Å; S363-V379 WeakPolarHBondContact CB-O 3.43Å; S363-V379 PolarHBondContact N-O 3.47Å; S363-V379 PolarHBondContact OG-O 3.24Å
364	A	95.5	Very high	94.2	Very high	10 Å²	10	18.8 Å²	18.8	8%	0.083	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	140.2	-178.3	0	0	0	0	0	112.8	H345 A366 E381 N382	H345-A364 WeakPolarHBondContact ND1-CB 3.34Å; A364-A366 PolarHBondContact O-N 3.07Å; A364-E381 VanDerWaalsContact O-CA 3.32Å; A364-E381 WeakPolarHBondContact O-CA 3.46Å; A364-N382 PolarHBondContact O-N 3.26Å
365	F	96	Very high	94.1	Very high	113 Å²	113	21.3 Å²	21.3	50%	0.496	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	9.8	177.6	-51.1	-76.6	0	0	0	115.6	K347 N382	K347-F365 HydrophobicContact CB-CD1 4.25Å; K347-F365 HydrophobicContact CB-CE1 4.29Å; K347-F365 HydrophobicContact CD-CD1 4.42Å; K347-F365 HydrophobicContact CD-CE1 3.68Å; K347-F365 HydrophobicContact CD-CE2 3.99Å; K347-F365 HydrophobicContact CD-CZ 3.44Å; K347-F365 VanDerWaalsContact CD-CZ 3.44Å; F365-N382 WeakPolarHBondContact CB-OD1 3.45Å
366	A	96.6	Very high	94.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.14	C	C	.	.			trans	-63.6	139.4	168.5	0	0	0	0	0	110	A348 R349 V362 S363 A364 V379 A383	A348-A366 WeakPolarHBondContact CA-O 3.21Å; R349-A366 PolarHBondContact N-O 3.4Å; V362-A366 HydrophobicContact CG1-CB 3.79Å; S363-A366 WeakPolarHBondContact O-CB 2.86Å; S363-A366 PolarHBondContact O-N 2.85Å; A364-A366 PolarHBondContact O-N 3.07Å; A366-V379 HydrophobicContact CB-CG1 3.93Å; A366-A383 CarbonylContact C-O 3.55Å; A366-A383 WeakPolarHBondContact CA-O 3.25Å
367	C	96.6	Very high	94.3	Very high	21 Å²	21	25.5 Å²	25.5	14%	0.142	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	110.6	179.7	-173.5	0	0	0	0	109.1	R349 A383 C384 L385	R349-C367 WeakPolarHBondContact O-CA 3.44Å; C367-A383 PolarHBondContact N-O 3.13Å; C367-C384 WeakPolarHBondContact O-CA 3.47Å; C367-L385 PolarHBondContact O-N 2.95Å
368	L	96.4	Very high	94.6	Very high	1 Å²	1	28 Å²	28	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.6	177.5	-57.1	-178.4	0	0	0	108.6	R349 I350 I351 I356 V362 C371 L373 V379 L385	R349-L368 PolarHBondContact O-N 2.96Å; I350-L368 HydrophobicContact CG1-CD1 4.48Å; I351-L368 PolarHBondContact N-O 3.34Å; I356-L368 HydrophobicContact CD1-CD1 4.39Å; V362-L368 HydrophobicContact CG1-CD1 4.31Å; V362-L368 HydrophobicContact CG2-CD1 4.21Å; L368-C371 HydrophobicContact CB-CB 4.28Å; L368-L373 HydrophobicContact CD1-CD1 4.06Å; L368-V379 HydrophobicContact CD2-CG1 4.32Å; L368-L385 HydrophobicContact CD2-CB 3.95Å; L368-L385 HydrophobicContact CD2-CD1 3.67Å; L368-L385 HydrophobicContact CD2-CG 4.06Å
369	I	95.3	Very high	95	Very high	47 Å²	47	27.4 Å²	27.4	24%	0.241	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	113.2	178.1	-52.9	176.5	0	0	0	107.8	I351 C371 L385 R386 R387	I351-I369 HydrophobicContact CB-CG1 4.27Å; I351-I369 HydrophobicContact CD1-CG1 4.4Å; I351-I369 WeakPolarHBondContact O-CA 3.34Å; I369-C371 PolarHBondContact O-SG 3.27Å; I369-L385 PolarHBondContact N-O 3.46Å; I369-R386 HydrophobicContact CB-CB 4.35Å; I369-R386 HydrophobicContact CB-CG 4.22Å; I369-R386 HydrophobicContact CG2-CG 4.28Å; I369-R386 CarbonylContact O-C 3.44Å; I369-R386 VanDerWaalsContact O-CA 3.26Å; I369-R386 WeakPolarHBondContact O-CA 3.47Å; I369-R387 PolarHBondContact O-N 3.43Å
370	D	94.4	Very high	95.2	Very high	45 Å²	45	26 Å²	26	24%	0.241	13%	0.132	C	C	.	.	S	Bend	trans	48.2	69.2	-176.1	-56.6	-41.1	0	0	0	111.4	F304 I351 G352 A353 R387	F304-D370 HydrophobicContact CD1-CB 3.93Å; F304-D370 HydrophobicContact CD2-CB 4.35Å; F304-D370 HydrophobicContact CE1-CB 4.19Å; F304-D370 WeakPolarHBondContact CE1-O 3.42Å; F304-D370 HydrophobicContact CG-CB 4.04Å; F304-D370 HydrophobicContact CZ-CB 4.48Å; F304-D370 WeakPolarHBondContact CZ-O 3.24Å; I351-D370 PolarHBondContact O-N 2.69Å; G352-D370 WeakPolarHBondContact CA-OD1 3.37Å; A353-D370 PolarHBondContact N-OD1 3.1Å; A353-D370 CarbonylContact O-C 3.53Å; A353-D370 VanDerWaalsContact O-CA 3.23Å; A353-D370 WeakPolarHBondContact O-CA 3.5Å; D370-R387 HydrophobicContact CB-CG 3.93Å; D370-R387 WeakPolarHBondContact O-CA 3.11Å; D370-R387 PolarHBondContact O-N 2.72Å; D370-R387 VanDerWaalsContact O-N 3.08Å
371	C	95	Very high	95.3	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.007	15%	0.154	C	C	.	.			trans	-128.2	140	-173.9	-70.3	0	0	0	0	111.8	A353 C354 F355 L368 I369 L385 V388	A353-C371 PolarHBondContact O-N 3.29Å; C354-C371 CarbonylContact C-O 3.56Å; C354-C371 WeakPolarHBondContact CA-O 3.29Å; C354-C371 PolarHBondContact SG-N 3.13Å; C354-C371 VanDerWaalsContact SG-N 3.37Å; F355-C371 PolarHBondContact N-O 3.19Å; L368-C371 HydrophobicContact CB-CB 4.28Å; I369-C371 PolarHBondContact O-SG 3.27Å; C371-L385 PolarHBondContact SG-O 3.16Å; C371-L385 VanDerWaalsContact SG-O 3.38Å; C371-V388 WeakPolarHBondContact CA-O 3.26Å
372	S	93.4	Very high	95.3	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	118.3	175	-171	0	0	0	0	108.9	N303 V388 I389 A390	N303-S372 VanDerWaalsContact ND2-CB 3.29Å; N303-S372 WeakPolarHBondContact ND2-CB 3.45Å; N303-S372 PolarHBondContact ND2-OG 3.05Å; S372-V388 PolarHBondContact N-O 3.09Å; S372-I389 WeakPolarHBondContact O-CA 3.2Å; S372-A390 PolarHBondContact O-N 3.42Å
373	L	94.1	Very high	95.2	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.8	179.1	-56.7	179.9	0	0	0	110.4	N61 F355 I356 G357 V362 L368 C377 V379 A390	N61-L373 PolarHBondContact ND2-O 3.16Å; F355-L373 PolarHBondContact O-N 3.27Å; I356-L373 HydrophobicContact CG1-CD1 4.48Å; G357-L373 PolarHBondContact N-O 3.3Å; V362-L373 HydrophobicContact CG2-CD1 4.45Å; L368-L373 HydrophobicContact CD1-CD1 4.06Å; L373-C377 HydrophobicContact CB-CB 4.38Å; L373-V379 HydrophobicContact CD1-CG2 3.93Å; L373-A390 CarbonylContact C-O 3.54Å; L373-A390 HydrophobicContact CD2-CB 3.82Å
374	G	91	Very high	95.2	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.01	16%	0.163	C	C	.	.			trans	-61.3	-167.7	173.7	0	0	0	0	0	113.9	N61 G357 C360 C377 A390	N61-G374 VanDerWaalsContact ND2-CA 3.27Å; N61-G374 WeakPolarHBondContact ND2-CA 3.32Å; G357-G374 WeakPolarHBondContact CA-O 3.29Å; C360-G374 PolarHBondContact SG-O 3.01Å; G374-C377 PolarHBondContact N-SG 2.94Å; G374-C377 VanDerWaalsContact N-SG 3.39Å; G374-A390 WeakPolarHBondContact CA-O 3.27Å; G374-A390 PolarHBondContact N-O 2.65Å
375	E	90.5	Very high	95.2	Very high	53 Å²	53	31.1 Å²	31.1	25%	0.248	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	144.4	170.4	-53.9	-165.2	157.9	0	0	110.7	S325 S358 C377 E392 N393	S325-E375 VanDerWaalsContact CB-OE1 3.32Å; S325-E375 WeakPolarHBondContact CB-OE1 3.17Å; S325-E375 PolarHBondContact OG-OE1 2.88Å; S358-E375 CarbonylContact O-C 3.6Å; S358-E375 WeakPolarHBondContact O-CA 3.2Å; S358-E375 VanDerWaalsContact OG-CG 3.29Å; S358-E375 WeakPolarHBondContact OG-CG 3.38Å; S358-E375 PolarHBondContact OG-OE1 3.24Å; E375-C377 VanDerWaalsContact C-N 3.3Å; E375-C377 PolarHBondContact O-N 3.06Å; E375-E392 HydrophobicContact CB-CG 4.26Å; E375-E392 CarbonylContact O-C 3.52Å; E375-E392 VanDerWaalsContact O-CA 3.27Å; E375-E392 WeakPolarHBondContact O-CA 3.33Å; E375-N393 PolarHBondContact O-N 2.88Å
376	N	93.5	Very high	95.2	Very high	88 Å²	88	31 Å²	31	47%	0.471	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	34.7	175.6	-54.4	-48.5	0	0	0	115	S358 N393	S358-N376 PolarHBondContact O-N 2.82Å; N376-N393 WeakPolarHBondContact CB-OD1 3.25Å
377	C	95.6	Very high	95.1	Very high	4 Å²	4	34.4 Å²	34.4	3%	0.027	17%	0.168	C	C	.	.			trans	-81.7	146.6	173.6	-52.9	0	0	0	0	112	C360 E361 L373 G374 E375 L391 V394	C360-C377 CarbonylContact C-O 3.59Å; C360-C377 VanDerWaalsContact CA-O 3.24Å; C360-C377 WeakPolarHBondContact CA-O 3.38Å; E361-C377 PolarHBondContact N-O 3.15Å; L373-C377 HydrophobicContact CB-CB 4.38Å; G374-C377 PolarHBondContact N-SG 2.94Å; G374-C377 VanDerWaalsContact N-SG 3.39Å; E375-C377 VanDerWaalsContact C-N 3.3Å; E375-C377 PolarHBondContact O-N 3.06Å; C377-L391 PolarHBondContact SG-O 3.28Å; C377-V394 CarbonylContact C-O 3.53Å; C377-V394 VanDerWaalsContact CA-O 3.26Å; C377-V394 WeakPolarHBondContact CA-O 3.29Å
378	F	97.4	Very high	95	Very high	56 Å²	56	33.4 Å²	33.4	25%	0.246	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131	172.8	177.1	-94.5	0	0	0	110.7	E361 V394 H395 I396	E361-F378 HydrophobicContact CB-CD2 4Å; F378-V394 PolarHBondContact N-O 3.11Å; F378-H395 AromaticContact CD1-CD2 3.49Å; F378-H395 VanDerWaalsContact CD1-CD2 3.49Å; F378-H395 WeakPolarHBondContact CD1-CD2 3.5Å; F378-H395 AromaticContact CD1-CE1 3.75Å; F378-H395 AromaticContact CD1-NE2 3.21Å; F378-H395 WeakPolarHBondContact CD1-NE2 3.28Å; F378-H395 AromaticContact CE1-NE2 3.7Å; F378-H395 AromaticContact CG-CD2 3.76Å; F378-H395 AromaticContact CG-NE2 3.82Å; F378-I396 PolarHBondContact O-N 3.23Å
379	V	97.3	Very high	95	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	115.6	173.2	-176.5	0	0	0	0	109.4	E361 V362 S363 A366 L368 L373 A383 L385 I396	E361-V379 PolarHBondContact O-N 3.36Å; V362-V379 HydrophobicContact CG1-CB 4.49Å; S363-V379 WeakPolarHBondContact CB-O 3.43Å; S363-V379 PolarHBondContact N-O 3.47Å; S363-V379 PolarHBondContact OG-O 3.24Å; A366-V379 HydrophobicContact CB-CG1 3.93Å; L368-V379 HydrophobicContact CD2-CG1 4.32Å; L373-V379 HydrophobicContact CD1-CG2 3.93Å; V379-A383 HydrophobicContact CG1-CB 3.77Å; V379-L385 HydrophobicContact CG1-CD1 4.24Å; V379-L385 HydrophobicContact CG2-CD1 4.3Å; V379-I396 CarbonylContact C-O 3.3Å; V379-I396 WeakPolarHBondContact CA-O 3.37Å
380	G	96.2	Very high	94.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.151	C	C	.	.			trans	-75.3	175.6	-177.2	0	0	0	0	0	114.3	A383 I396	G380-A383 WeakPolarHBondContact O-CB 3.45Å; G380-A383 PolarHBondContact O-N 3.23Å; G380-I396 PolarHBondContact N-O 3.4Å
381	E	96.2	Very high	94.9	Very high	99 Å²	99	29.6 Å²	29.6	46%	0.463	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	142.2	-174.5	-63.9	-176.9	169.1	0	0	112.3	A364 A383 S398 H399	A364-E381 VanDerWaalsContact O-CA 3.32Å; A364-E381 WeakPolarHBondContact O-CA 3.46Å; E381-A383 PolarHBondContact O-N 2.8Å; E381-S398 PolarHBondContact N-OG 2.98Å; E381-S398 CarbonylContact O-C 3.5Å; E381-S398 WeakPolarHBondContact O-CA 3.49Å; E381-S398 VanDerWaalsContact O-CB 3.25Å; E381-S398 WeakPolarHBondContact O-CB 3.47Å; E381-H399 PolarHBondContact O-N 3.22Å
382	N	95.6	Very high	94.7	Very high	70 Å²	70	34.3 Å²	34.3	37%	0.374	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	20.1	-179.1	-60.9	-57.5	0	0	0	114.7	A364 F365 H399	A364-N382 PolarHBondContact O-N 3.26Å; F365-N382 WeakPolarHBondContact CB-OD1 3.45Å; N382-H399 PolarHBondContact ND2-CE1 3.37Å; N382-H399 VanDerWaalsContact ND2-CE1 3.32Å
383	A	96.2	Very high	94.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.			trans	-70.4	137.4	171.1	0	0	0	0	0	110	A366 C367 V379 G380 E381 I396 V400	A366-A383 CarbonylContact C-O 3.55Å; A366-A383 WeakPolarHBondContact CA-O 3.25Å; C367-A383 PolarHBondContact N-O 3.13Å; V379-A383 HydrophobicContact CG1-CB 3.77Å; G380-A383 WeakPolarHBondContact O-CB 3.45Å; G380-A383 PolarHBondContact O-N 3.23Å; E381-A383 PolarHBondContact O-N 2.8Å; A383-I396 HydrophobicContact CB-CG2 4.47Å; A383-V400 CarbonylContact C-O 3.54Å; A383-V400 WeakPolarHBondContact CA-O 3.48Å
384	C	96.1	Very high	94.7	Very high	51 Å²	51	38.4 Å²	38.4	35%	0.345	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	106.6	177.4	-170.2	0	0	0	0	109.1	C367 V400 K401 A402	C367-C384 WeakPolarHBondContact O-CA 3.47Å; C384-V400 PolarHBondContact N-O 2.96Å; C384-K401 HydrophobicContact CB-CG 4.35Å; C384-K401 WeakPolarHBondContact O-CA 3.47Å; C384-A402 PolarHBondContact O-N 2.93Å
385	L	96.6	Very high	94.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.9	-176.6	-53.8	-179	0	0	0	108.7	C367 L368 I369 C371 V379 V388 I396 A402	C367-L385 PolarHBondContact O-N 2.95Å; L368-L385 HydrophobicContact CD2-CB 3.95Å; L368-L385 HydrophobicContact CD2-CD1 3.67Å; L368-L385 HydrophobicContact CD2-CG 4.06Å; I369-L385 PolarHBondContact N-O 3.46Å; C371-L385 PolarHBondContact SG-O 3.16Å; C371-L385 VanDerWaalsContact SG-O 3.38Å; V379-L385 HydrophobicContact CG1-CD1 4.24Å; V379-L385 HydrophobicContact CG2-CD1 4.3Å; L385-V388 HydrophobicContact CB-CB 4.36Å; L385-V388 HydrophobicContact CB-CG2 3.98Å; L385-V388 HydrophobicContact CD2-CG2 4.43Å; L385-I396 HydrophobicContact CD1-CD1 3.46Å; L385-I396 VanDerWaalsContact CD1-CD1 3.46Å; L385-I396 HydrophobicContact CD2-CD1 4.22Å; L385-I396 HydrophobicContact CD2-CG2 4.23Å; L385-A402 HydrophobicContact CD2-CB 3.79Å
386	R	95.4	Very high	95.2	Very high	111 Å²	111	39.4 Å²	39.4	42%	0.419	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124.8	175.3	-177.4	169.9	128.7	-117.7	-17.7	110.2	I369 V388 A402 D403 V404	I369-R386 HydrophobicContact CB-CB 4.35Å; I369-R386 HydrophobicContact CB-CG 4.22Å; I369-R386 HydrophobicContact CG2-CG 4.28Å; I369-R386 CarbonylContact O-C 3.44Å; I369-R386 VanDerWaalsContact O-CA 3.26Å; I369-R386 WeakPolarHBondContact O-CA 3.47Å; R386-V388 VanDerWaalsContact C-N 3.26Å; R386-V388 PolarHBondContact O-N 3.07Å; R386-A402 PolarHBondContact N-O 3.37Å; R386-D403 VanDerWaalsContact CZ-CG 3.44Å; R386-D403 IonicContact CZ-OD1 2.95Å; R386-D403 IonicContact CZ-OD2 3.17Å; R386-D403 IonicContact NE-OD1 3.33Å; R386-D403 PolarHBondContact NE-OD1 3.44Å; R386-D403 VanDerWaalsContact NH1-CG 3.25Å; R386-D403 IonicContact NH1-OD1 3.21Å; R386-D403 PolarHBondContact NH1-OD1 3.46Å; R386-D403 IonicContact NH1-OD2 2.7Å; R386-D403 PolarHBondContact NH1-OD2 3.05Å; R386-D403 IonicContact NH2-OD1 3.09Å; R386-D403 PolarHBondContact NH2-OD1 3.43Å; R386-D403 VanDerWaalsContact NH2-OD1 3.09Å; R386-D403 IonicContact NH2-OD2 3.17Å; R386-D403 PolarHBondContact NH2-OD2 2.85Å; R386-D403 CarbonylContact O-C 3.48Å; R386-D403 WeakPolarHBondContact O-CA 3.36Å; R386-V404 PolarHBondContact O-N 3.21Å
387	R	94.5	Very high	95.3	Very high	72 Å²	72	36 Å²	36	27%	0.272	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	55	42	178.3	-68	177.5	62.6	166.8	-8.1	113	D301 F304 I369 D370 V404 A405	D301-R387 IonicContact OD1-CZ 3.62Å; D301-R387 IonicContact OD1-NH2 3.66Å; D301-R387 PolarHBondContact OD1-NH2 3Å; D301-R387 IonicContact OD2-CZ 2.52Å; D301-R387 IonicContact OD2-NH2 2.75Å; D301-R387 PolarHBondContact OD2-NH2 3.38Å; F304-R387 HydrophobicContact CD2-CG 4.29Å; F304-R387 HydrophobicContact CE2-CB 3.96Å; F304-R387 HydrophobicContact CE2-CG 4.01Å; I369-R387 PolarHBondContact O-N 3.43Å; D370-R387 HydrophobicContact CB-CG 3.93Å; D370-R387 WeakPolarHBondContact O-CA 3.11Å; D370-R387 PolarHBondContact O-N 2.72Å; D370-R387 VanDerWaalsContact O-N 3.08Å; R387-V404 HydrophobicContact CB-CG2 4.01Å; R387-V404 WeakPolarHBondContact O-CA 3.47Å; R387-A405 PolarHBondContact O-N 3.25Å
388	V	95.1	Very high	95.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.8	180	-179.5	0	0	0	0	109.7	C371 S372 L385 R386 A402 A405 L407	C371-V388 WeakPolarHBondContact CA-O 3.26Å; S372-V388 PolarHBondContact N-O 3.09Å; L385-V388 HydrophobicContact CB-CB 4.36Å; L385-V388 HydrophobicContact CB-CG2 3.98Å; L385-V388 HydrophobicContact CD2-CG2 4.43Å; R386-V388 VanDerWaalsContact C-N 3.26Å; R386-V388 PolarHBondContact O-N 3.07Å; V388-A402 HydrophobicContact CG2-CB 3.82Å; V388-A405 WeakPolarHBondContact CA-O 3.46Å; V388-A405 HydrophobicContact CG1-CB 4.46Å; V388-A405 HydrophobicContact CG2-CB 4.31Å; V388-L407 HydrophobicContact CG1-CD1 3.82Å; V388-L407 HydrophobicContact CG1-CG 4.14Å
389	I	94.8	Very high	95.1	Very high	3 Å²	3	40 Å²	40	2%	0.015	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112.8	168	-59.9	-173.2	0	0	0	107.2	I300 N303 F304 S372 L391 A405 W406 L407	I300-I389 HydrophobicContact CB-CD1 4.18Å; I300-I389 HydrophobicContact CG1-CD1 3.85Å; I300-I389 HydrophobicContact CG1-CG1 4.48Å; I300-I389 HydrophobicContact CG2-CD1 4.24Å; N303-I389 HydrophobicContact CB-CD1 4.03Å; N303-I389 WeakPolarHBondContact ND2-CD1 3.3Å; F304-I389 HydrophobicContact CZ-CG1 4.15Å; S372-I389 WeakPolarHBondContact O-CA 3.2Å; I389-L391 HydrophobicContact CG2-CD2 4.37Å; I389-A405 PolarHBondContact N-O 3.08Å; I389-W406 HydrophobicContact CB-CD2 4.39Å; I389-W406 HydrophobicContact CB-CE3 3.94Å; I389-W406 HydrophobicContact CB-CZ3 4.25Å; I389-W406 HydrophobicContact CD1-CE3 3.93Å; I389-W406 HydrophobicContact CD1-CZ3 3.65Å; I389-W406 HydrophobicContact CG1-CE3 4.42Å; I389-W406 HydrophobicContact CG2-CD2 4.32Å; I389-W406 HydrophobicContact CG2-CE3 4Å; I389-W406 HydrophobicContact CG2-CH2 4.17Å; I389-W406 HydrophobicContact CG2-CZ2 4.47Å; I389-W406 HydrophobicContact CG2-CZ3 3.93Å; I389-L407 PolarHBondContact O-N 3.29Å
390	A	94.9	Very high	95	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	127.5	175	0	0	0	0	0	109.4	S372 L373 G374 V394 L407	S372-A390 PolarHBondContact O-N 3.42Å; L373-A390 CarbonylContact C-O 3.54Å; L373-A390 HydrophobicContact CD2-CB 3.82Å; G374-A390 WeakPolarHBondContact CA-O 3.27Å; G374-A390 PolarHBondContact N-O 2.65Å; A390-V394 HydrophobicContact CB-CB 4.09Å; A390-V394 HydrophobicContact CB-CG1 4.07Å; A390-V394 HydrophobicContact CB-CG2 4.21Å; A390-L407 HydrophobicContact CB-CB 4.3Å; A390-L407 HydrophobicContact CB-CD1 4.36Å
391	L	92.7	Very high	94.9	Very high	9 Å²	9	46 Å²	46	5%	0.047	22%	0.221	C	C	.	.			trans	-81.4	-164.3	174.1	-54.8	-169.9	0	0	0	110.7	I52 P58 C377 I389 V394 W406 L407 C408 S409	I52-L391 HydrophobicContact CD1-CD1 3.78Å; P58-L391 HydrophobicContact CB-CD2 4.47Å; P58-L391 HydrophobicContact CG-CD1 4.47Å; P58-L391 HydrophobicContact CG-CD2 3.35Å; C377-L391 PolarHBondContact SG-O 3.28Å; I389-L391 HydrophobicContact CG2-CD2 4.37Å; L391-V394 VanDerWaalsContact O-CG2 3.25Å; L391-V394 WeakPolarHBondContact O-CG2 3.38Å; L391-W406 HydrophobicContact CD2-CZ2 4.21Å; L391-L407 WeakPolarHBondContact CG-O 3.44Å; L391-L407 PolarHBondContact N-O 2.98Å; L391-C408 HydrophobicContact CD1-CB 4.46Å; L391-S409 WeakPolarHBondContact CB-OG 3.35Å
392	E	90.6	Very high	94.8	Very high	99 Å²	99	41.7 Å²	41.7	46%	0.463	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	146.7	-172.9	-61	169.4	-167	0	0	113.4	E375 V394 S409 G410	E375-E392 HydrophobicContact CB-CG 4.26Å; E375-E392 CarbonylContact O-C 3.52Å; E375-E392 VanDerWaalsContact O-CA 3.27Å; E375-E392 WeakPolarHBondContact O-CA 3.33Å; E392-V394 PolarHBondContact O-N 2.87Å; E392-V394 VanDerWaalsContact O-N 3.14Å; E392-S409 CarbonylContact O-C 3.59Å; E392-S409 WeakPolarHBondContact O-CA 3.41Å; E392-S409 WeakPolarHBondContact O-CB 3.45Å; E392-G410 PolarHBondContact O-N 3.48Å
393	N	93	Very high	94.6	Very high	87 Å²	87	40.3 Å²	40.3	47%	0.465	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	26.8	173.3	-53.9	-58.9	0	0	0	114.5	E375 N376 G410	E375-N393 PolarHBondContact O-N 2.88Å; N376-N393 WeakPolarHBondContact CB-OD1 3.25Å; N393-G410 WeakPolarHBondContact O-CA 3.36Å
394	V	95.2	Very high	94.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	20%	0.198	C	C	.	.			trans	-80.3	130.9	176.5	175.6	0	0	0	0	110.4	C377 F378 A390 L391 E392 I396 L407 C408 V411	C377-V394 CarbonylContact C-O 3.53Å; C377-V394 VanDerWaalsContact CA-O 3.26Å; C377-V394 WeakPolarHBondContact CA-O 3.29Å; F378-V394 PolarHBondContact N-O 3.11Å; A390-V394 HydrophobicContact CB-CB 4.09Å; A390-V394 HydrophobicContact CB-CG1 4.07Å; A390-V394 HydrophobicContact CB-CG2 4.21Å; L391-V394 VanDerWaalsContact O-CG2 3.25Å; L391-V394 WeakPolarHBondContact O-CG2 3.38Å; E392-V394 PolarHBondContact O-N 2.87Å; E392-V394 VanDerWaalsContact O-N 3.14Å; V394-I396 HydrophobicContact CG1-CD1 4.37Å; V394-I396 HydrophobicContact CG1-CG1 3.98Å; V394-L407 HydrophobicContact CG1-CB 4.16Å; V394-L407 HydrophobicContact CG1-CD1 3.97Å; V394-L407 HydrophobicContact CG2-CB 4.34Å; V394-C408 WeakPolarHBondContact CG2-O 2.95Å; V394-V411 WeakPolarHBondContact CA-O 3.47Å; V394-V411 HydrophobicContact CG1-CB 4.49Å; V394-V411 HydrophobicContact CG2-CB 4.43Å
395	H	95.8	Very high	94.3	Very high	74 Å²	74	38.3 Å²	38.3	34%	0.343	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	107.7	-178.8	-173.3	-83.9	0	0	0	111.2	F378 V411 R412 I413	F378-H395 AromaticContact CD1-CD2 3.49Å; F378-H395 VanDerWaalsContact CD1-CD2 3.49Å; F378-H395 WeakPolarHBondContact CD1-CD2 3.5Å; F378-H395 AromaticContact CD1-CE1 3.75Å; F378-H395 AromaticContact CD1-NE2 3.21Å; F378-H395 WeakPolarHBondContact CD1-NE2 3.28Å; F378-H395 AromaticContact CE1-NE2 3.7Å; F378-H395 AromaticContact CG-CD2 3.76Å; F378-H395 AromaticContact CG-NE2 3.82Å; H395-V411 PolarHBondContact N-O 3.45Å; H395-R412 HydrophobicContact CB-CG 4.28Å; H395-R412 WeakPolarHBondContact O-CA 3.48Å; H395-I413 PolarHBondContact O-N 3.19Å
396	I	96.5	Very high	94.2	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	112.9	177.8	-54.9	178.4	0	0	0	107.5	F378 V379 G380 A383 L385 V394 V400 L407 I413	F378-I396 PolarHBondContact O-N 3.23Å; V379-I396 CarbonylContact C-O 3.3Å; V379-I396 WeakPolarHBondContact CA-O 3.37Å; G380-I396 PolarHBondContact N-O 3.4Å; A383-I396 HydrophobicContact CB-CG2 4.47Å; L385-I396 HydrophobicContact CD1-CD1 3.46Å; L385-I396 VanDerWaalsContact CD1-CD1 3.46Å; L385-I396 HydrophobicContact CD2-CD1 4.22Å; L385-I396 HydrophobicContact CD2-CG2 4.23Å; V394-I396 HydrophobicContact CG1-CD1 4.37Å; V394-I396 HydrophobicContact CG1-CG1 3.98Å; I396-V400 HydrophobicContact CG2-CB 3.77Å; I396-V400 HydrophobicContact CG2-CG1 3.82Å; I396-V400 HydrophobicContact CG2-CG2 4.08Å; I396-L407 HydrophobicContact CD1-CD1 3.83Å; I396-L407 HydrophobicContact CG1-CD1 4.34Å; I396-I413 HydrophobicContact CG1-CD1 4.35Å
397	S	95.4	Very high	94.2	Very high	15 Å²	15	33 Å²	33	11%	0.105	16%	0.161	C	C	.	.			trans	-83.1	-173.9	-178.1	67.8	0	0	0	0	113.2	V400 I413 L414 S415	S397-V400 VanDerWaalsContact O-CG2 3.29Å; S397-V400 WeakPolarHBondContact O-CG2 3.34Å; S397-I413 VanDerWaalsContact CB-O 3.28Å; S397-I413 WeakPolarHBondContact CB-O 3.5Å; S397-I413 PolarHBondContact N-O 2.59Å; S397-I413 PolarHBondContact OG-O 2.98Å; S397-L414 WeakPolarHBondContact OG-CA 3.45Å; S397-L414 PolarHBondContact OG-O 3.27Å; S397-S415 WeakPolarHBondContact OG-CA 3.31Å; S397-S415 PolarHBondContact OG-N 3.48Å
398	S	95.1	Very high	94.1	Very high	37 Å²	37	29.6 Å²	29.6	26%	0.259	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	148.5	-173.7	-49.6	0	0	0	0	113.7	E381 V400 S415 G416	E381-S398 PolarHBondContact N-OG 2.98Å; E381-S398 CarbonylContact O-C 3.5Å; E381-S398 WeakPolarHBondContact O-CA 3.49Å; E381-S398 VanDerWaalsContact O-CB 3.25Å; E381-S398 WeakPolarHBondContact O-CB 3.47Å; S398-V400 PolarHBondContact O-N 3.37Å; S398-S415 VanDerWaalsContact O-CA 3.28Å; S398-S415 WeakPolarHBondContact O-CA 3.32Å; S398-S415 WeakPolarHBondContact O-CB 3.43Å; S398-G416 PolarHBondContact O-N 3.32Å; S398-G416 VanDerWaalsContact O-N 3.1Å
399	H	94.5	Very high	93.9	Very high	107 Å²	107	31.8 Å²	31.8	50%	0.495	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	22.3	178.5	-55	-79.2	0	0	0	115.4	E381 N382	E381-H399 PolarHBondContact O-N 3.22Å; N382-H399 PolarHBondContact ND2-CE1 3.37Å; N382-H399 VanDerWaalsContact ND2-CE1 3.32Å
400	V	94.8	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.			trans	-77.1	138.8	173.8	174.2	0	0	0	0	110.2	A383 C384 I396 S397 S398 I413 L414 F417	A383-V400 CarbonylContact C-O 3.54Å; A383-V400 WeakPolarHBondContact CA-O 3.48Å; C384-V400 PolarHBondContact N-O 2.96Å; I396-V400 HydrophobicContact CG2-CB 3.77Å; I396-V400 HydrophobicContact CG2-CG1 3.82Å; I396-V400 HydrophobicContact CG2-CG2 4.08Å; S397-V400 VanDerWaalsContact O-CG2 3.29Å; S397-V400 WeakPolarHBondContact O-CG2 3.34Å; S398-V400 PolarHBondContact O-N 3.37Å; V400-I413 HydrophobicContact CB-CG2 4.43Å; V400-I413 HydrophobicContact CG1-CG2 3.75Å; V400-I413 HydrophobicContact CG2-CB 4.46Å; V400-I413 HydrophobicContact CG2-CG2 3.73Å; V400-L414 WeakPolarHBondContact CG2-O 3.1Å; V400-F417 WeakPolarHBondContact CA-O 3.36Å
401	K	94.3	Very high	93.6	Very high	129 Å²	129	32.8 Å²	32.8	56%	0.561	17%	0.174	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.9	171.4	-65.6	-175.9	-177.8	178.7	0	109.6	C384 F417 K418 L419	C384-K401 HydrophobicContact CB-CG 4.35Å; C384-K401 WeakPolarHBondContact O-CA 3.47Å; K401-F417 PolarHBondContact N-O 3.01Å; K401-K418 HydrophobicContact CB-CG 4.26Å; K401-K418 CarbonylContact O-C 3.49Å; K401-K418 WeakPolarHBondContact O-CA 3.13Å; K401-L419 PolarHBondContact O-N 3.44Å
402	A	93.9	Very high	93.7	Very high	7 Å²	7	39 Å²	39	6%	0.058	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	138.6	176.9	0	0	0	0	0	110.7	C384 L385 R386 V388 L419	C384-A402 PolarHBondContact O-N 2.93Å; L385-A402 HydrophobicContact CD2-CB 3.79Å; R386-A402 PolarHBondContact N-O 3.37Å; V388-A402 HydrophobicContact CG2-CB 3.82Å; A402-L419 HydrophobicContact CB-CB 3.9Å; A402-L419 HydrophobicContact CB-CD1 3.77Å; A402-L419 HydrophobicContact CB-CG 4.35Å
403	D	92	Very high	93.9	Very high	41 Å²	41	34.3 Å²	34.3	22%	0.219	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	119.5	178.1	-163.6	6.4	0	0	0	108.1	R386 N421	R386-D403 VanDerWaalsContact CZ-CG 3.44Å; R386-D403 IonicContact CZ-OD1 2.95Å; R386-D403 IonicContact CZ-OD2 3.17Å; R386-D403 IonicContact NE-OD1 3.33Å; R386-D403 PolarHBondContact NE-OD1 3.44Å; R386-D403 VanDerWaalsContact NH1-CG 3.25Å; R386-D403 IonicContact NH1-OD1 3.21Å; R386-D403 PolarHBondContact NH1-OD1 3.46Å; R386-D403 IonicContact NH1-OD2 2.7Å; R386-D403 PolarHBondContact NH1-OD2 3.05Å; R386-D403 IonicContact NH2-OD1 3.09Å; R386-D403 PolarHBondContact NH2-OD1 3.43Å; R386-D403 VanDerWaalsContact NH2-OD1 3.09Å; R386-D403 IonicContact NH2-OD2 3.17Å; R386-D403 PolarHBondContact NH2-OD2 2.85Å; R386-D403 CarbonylContact O-C 3.48Å; R386-D403 WeakPolarHBondContact O-CA 3.36Å; D403-N421 VanDerWaalsContact O-CA 3.32Å; D403-N421 WeakPolarHBondContact O-CA 3.46Å
404	V	92.8	Very high	93.9	Very high	10 Å²	10	32 Å²	32	6%	0.061	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	48.8	86.2	-175.1	-168.3	0	0	0	0	112.2	I300 R386 R387 N421 R422 C423	I300-V404 HydrophobicContact CD1-CG1 4.37Å; R386-V404 PolarHBondContact O-N 3.21Å; R387-V404 HydrophobicContact CB-CG2 4.01Å; R387-V404 WeakPolarHBondContact O-CA 3.47Å; V404-N421 VanDerWaalsContact CB-OD1 3.26Å; V404-N421 WeakPolarHBondContact CB-OD1 3.19Å; V404-N421 WeakPolarHBondContact CG2-OD1 3.25Å; V404-R422 HydrophobicContact CB-CG 4.47Å; V404-R422 HydrophobicContact CG1-CG 4.04Å; V404-R422 CarbonylContact O-C 3.58Å; V404-R422 WeakPolarHBondContact O-CA 3.42Å; V404-R422 PolarHBondContact O-N 3.16Å; V404-C423 PolarHBondContact O-N 2.93Å; V404-C423 VanDerWaalsContact O-N 3.14Å
405	A	93.5	Very high	93.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	145.2	179.6	0	0	0	0	0	112.1	R387 V388 I389 L407 L419 C423	R387-A405 PolarHBondContact O-N 3.25Å; V388-A405 WeakPolarHBondContact CA-O 3.46Å; V388-A405 HydrophobicContact CG1-CB 4.46Å; V388-A405 HydrophobicContact CG2-CB 4.31Å; I389-A405 PolarHBondContact N-O 3.08Å; A405-L407 HydrophobicContact CB-CD2 4.4Å; A405-L419 HydrophobicContact CB-CD1 4.33Å; A405-C423 CarbonylContact C-O 3.56Å; A405-C423 WeakPolarHBondContact CA-O 3.32Å; A405-C423 HydrophobicContact CB-CB 4.42Å; A405-C423 WeakPolarHBondContact CB-O 3.27Å
406	W	94.2	Very high	93.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	116.2	170.8	-173.2	-73.1	0	0	0	109.2	L48 L57 P58 L296 L299 I300 I389 L391 C423 F424 I425	L48-W406 HydrophobicContact CD2-CZ2 4.4Å; L57-W406 HydrophobicContact CD2-CZ2 4.35Å; P58-W406 HydrophobicContact CG-CZ2 4.32Å; L296-W406 HydrophobicContact CD1-CD2 3.84Å; L296-W406 HydrophobicContact CD1-CE3 3.54Å; L296-W406 HydrophobicContact CD1-CG 4.33Å; L296-W406 HydrophobicContact CD1-CZ3 3.94Å; L296-W406 HydrophobicContact CD2-CB 4.3Å; L299-W406 HydrophobicContact CD2-CH2 3.91Å; L299-W406 HydrophobicContact CD2-CZ3 3.93Å; L299-W406 HydrophobicContact CG-CZ3 4.36Å; I300-W406 HydrophobicContact CD1-CE3 4.37Å; I300-W406 HydrophobicContact CG1-CE3 3.89Å; I300-W406 HydrophobicContact CG1-CZ3 4.33Å; I389-W406 HydrophobicContact CB-CD2 4.39Å; I389-W406 HydrophobicContact CB-CE3 3.94Å; I389-W406 HydrophobicContact CB-CZ3 4.25Å; I389-W406 HydrophobicContact CD1-CE3 3.93Å; I389-W406 HydrophobicContact CD1-CZ3 3.65Å; I389-W406 HydrophobicContact CG1-CE3 4.42Å; I389-W406 HydrophobicContact CG2-CD2 4.32Å; I389-W406 HydrophobicContact CG2-CE3 4Å; I389-W406 HydrophobicContact CG2-CH2 4.17Å; I389-W406 HydrophobicContact CG2-CZ2 4.47Å; I389-W406 HydrophobicContact CG2-CZ3 3.93Å; L391-W406 HydrophobicContact CD2-CZ2 4.21Å; W406-C423 PolarHBondContact N-O 3.36Å; W406-F424 HydrophobicContact CB-CD2 3.96Å; W406-F424 AromaticContact CD1-CD2 3.77Å; W406-F424 AromaticContact CD1-CE2 3.58Å; W406-F424 HydrophobicContact CG-CD2 4.05Å; W406-F424 HydrophobicContact CG-CE2 4.24Å; W406-I425 PolarHBondContact O-N 3Å
407	L	94.5	Very high	93.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	111.1	-176.9	-51.5	178.7	0	0	0	109.1	V388 I389 A390 L391 V394 I396 A405 V411 I413 L419 I425	V388-L407 HydrophobicContact CG1-CD1 3.82Å; V388-L407 HydrophobicContact CG1-CG 4.14Å; I389-L407 PolarHBondContact O-N 3.29Å; A390-L407 HydrophobicContact CB-CB 4.3Å; A390-L407 HydrophobicContact CB-CD1 4.36Å; L391-L407 WeakPolarHBondContact CG-O 3.44Å; L391-L407 PolarHBondContact N-O 2.98Å; V394-L407 HydrophobicContact CG1-CB 4.16Å; V394-L407 HydrophobicContact CG1-CD1 3.97Å; V394-L407 HydrophobicContact CG2-CB 4.34Å; I396-L407 HydrophobicContact CD1-CD1 3.83Å; I396-L407 HydrophobicContact CG1-CD1 4.34Å; A405-L407 HydrophobicContact CB-CD2 4.4Å; L407-V411 HydrophobicContact CD2-CG1 4.45Å; L407-I413 HydrophobicContact CD1-CD1 3.72Å; L407-I413 HydrophobicContact CD2-CD1 3.98Å; L407-L419 HydrophobicContact CD2-CD1 4.15Å; L407-I425 HydrophobicContact CD2-CB 4.08Å; L407-I425 HydrophobicContact CD2-CD1 3.66Å; L407-I425 HydrophobicContact CD2-CG1 3.87Å
408	C	93	Very high	93.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.			trans	-73.3	171.6	179	-63.9	0	0	0	0	112.6	L391 V394 G410 V411 I425 P427	L391-C408 HydrophobicContact CD1-CB 4.46Å; V394-C408 WeakPolarHBondContact CG2-O 2.95Å; C408-G410 PolarHBondContact O-N 3.16Å; C408-V411 WeakPolarHBondContact O-CB 3.07Å; C408-V411 WeakPolarHBondContact O-CG2 3.41Å; C408-V411 PolarHBondContact O-N 3.48Å; C408-I425 VanDerWaalsContact CB-O 3.31Å; C408-I425 WeakPolarHBondContact CB-O 3.46Å; C408-I425 PolarHBondContact N-O 2.96Å; C408-I425 PolarHBondContact SG-O 2.91Å; C408-P427 HydrophobicContact CB-CB 3.99Å; C408-P427 HydrophobicContact CB-CG 3.71Å; C408-P427 WeakPolarHBondContact SG-CD 3.5Å
409	S	91	Very high	92.9	Very high	46 Å²	46	37 Å²	37	32%	0.322	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	137.3	-173	-52	0	0	0	0	112.5	L391 E392 V411	L391-S409 WeakPolarHBondContact CB-OG 3.35Å; E392-S409 CarbonylContact O-C 3.59Å; E392-S409 WeakPolarHBondContact O-CA 3.41Å; E392-S409 WeakPolarHBondContact O-CB 3.45Å; S409-V411 VanDerWaalsContact C-N 3.33Å; S409-V411 PolarHBondContact O-N 3.16Å
410	G	90	Very high	92.7	Very high	23 Å²	23	33 Å²	33	24%	0.237	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	4.1	177.4	0	0	0	0	0	116.2	E392 N393 C408 A432	E392-G410 PolarHBondContact O-N 3.48Å; N393-G410 WeakPolarHBondContact O-CA 3.36Å; C408-G410 PolarHBondContact O-N 3.16Å; G410-A432 WeakPolarHBondContact O-CB 3.5Å
411	V	93.8	Very high	92.4	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.012	20%	0.197	C	C	.	.			trans	-64.2	141.8	177.9	168.6	0	0	0	0	111.8	V394 H395 L407 C408 S409 I413 I425 V433	V394-V411 WeakPolarHBondContact CA-O 3.47Å; V394-V411 HydrophobicContact CG1-CB 4.49Å; V394-V411 HydrophobicContact CG2-CB 4.43Å; H395-V411 PolarHBondContact N-O 3.45Å; L407-V411 HydrophobicContact CD2-CG1 4.45Å; C408-V411 WeakPolarHBondContact O-CB 3.07Å; C408-V411 WeakPolarHBondContact O-CG2 3.41Å; C408-V411 PolarHBondContact O-N 3.48Å; S409-V411 VanDerWaalsContact C-N 3.33Å; S409-V411 PolarHBondContact O-N 3.16Å; V411-I413 HydrophobicContact CG1-CG1 4.2Å; V411-I425 HydrophobicContact CB-CG2 4.36Å; V411-I425 HydrophobicContact CG1-CB 4.21Å; V411-I425 HydrophobicContact CG1-CD1 4.17Å; V411-I425 HydrophobicContact CG1-CG2 3.74Å; V411-I425 HydrophobicContact CG2-CB 4.16Å; V411-I425 HydrophobicContact CG2-CG2 3.59Å; V411-V433 HydrophobicContact CG2-CB 4.47Å
412	R	94.1	Very high	92.2	Very high	140 Å²	140	34.1 Å²	34.1	53%	0.528	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	120.3	178.7	-62.1	-176.5	-178.9	177.7	0.1	111.6	H395 A432 V433 T434 L435	H395-R412 HydrophobicContact CB-CG 4.28Å; H395-R412 WeakPolarHBondContact O-CA 3.48Å; R412-A432 HydrophobicContact CG-CB 4.17Å; R412-V433 PolarHBondContact N-O 2.97Å; R412-T434 HydrophobicContact CB-CG2 4.25Å; R412-T434 VanDerWaalsContact O-CA 3.3Å; R412-T434 WeakPolarHBondContact O-CA 3.4Å; R412-L435 PolarHBondContact O-N 3.23Å
413	I	94.2	Very high	92.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	113.7	175.5	-52.5	170.5	0	0	0	108.7	H395 I396 S397 V400 L407 V411 F417 L419	H395-I413 PolarHBondContact O-N 3.19Å; I396-I413 HydrophobicContact CG1-CD1 4.35Å; S397-I413 VanDerWaalsContact CB-O 3.28Å; S397-I413 WeakPolarHBondContact CB-O 3.5Å; S397-I413 PolarHBondContact N-O 2.59Å; S397-I413 PolarHBondContact OG-O 2.98Å; V400-I413 HydrophobicContact CB-CG2 4.43Å; V400-I413 HydrophobicContact CG1-CG2 3.75Å; V400-I413 HydrophobicContact CG2-CB 4.46Å; V400-I413 HydrophobicContact CG2-CG2 3.73Å; L407-I413 HydrophobicContact CD1-CD1 3.72Å; L407-I413 HydrophobicContact CD2-CD1 3.98Å; V411-I413 HydrophobicContact CG1-CG1 4.2Å; I413-F417 HydrophobicContact CG2-CB 3.82Å; I413-F417 HydrophobicContact CG2-CD1 4.15Å; I413-F417 HydrophobicContact CG2-CG 4.29Å; I413-L419 HydrophobicContact CD1-CD1 3.53Å; I413-L419 HydrophobicContact CD1-CG 4.49Å
414	L	94	Very high	92.1	Very high	37 Å²	37	31.8 Å²	31.8	19%	0.194	17%	0.171	C	C	.	.			trans	-83.7	171.4	-177.9	-56.1	179.6	0	0	0	112	S397 V400 F417 T434 L435 P437 Q466	S397-L414 WeakPolarHBondContact OG-CA 3.45Å; S397-L414 PolarHBondContact OG-O 3.27Å; V400-L414 WeakPolarHBondContact CG2-O 3.1Å; L414-F417 WeakPolarHBondContact O-CB 3.23Å; L414-F417 PolarHBondContact O-N 2.92Å; L414-T434 HydrophobicContact CD1-CG2 3.68Å; L414-T434 HydrophobicContact CD2-CG2 4.48Å; L414-T434 HydrophobicContact CG-CG2 3.89Å; L414-L435 VanDerWaalsContact CB-O 3.26Å; L414-L435 WeakPolarHBondContact CB-O 3.46Å; L414-L435 WeakPolarHBondContact CG-O 3.32Å; L414-L435 PolarHBondContact N-O 3.03Å; L414-P437 HydrophobicContact CB-CB 4.22Å; L414-Q466 HydrophobicContact CD1-CB 3.98Å; L414-Q466 VanDerWaalsContact CD1-OE1 3.3Å
415	S	92.6	Very high	92	Very high	60 Å²	60	31.3 Å²	31.3	42%	0.42	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	143.4	-158.1	53.7	0	0	0	0	112.8	S397 S398 F417 P437 G438	S397-S415 WeakPolarHBondContact OG-CA 3.31Å; S397-S415 PolarHBondContact OG-N 3.48Å; S398-S415 VanDerWaalsContact O-CA 3.28Å; S398-S415 WeakPolarHBondContact O-CA 3.32Å; S398-S415 WeakPolarHBondContact O-CB 3.43Å; S415-F417 PolarHBondContact O-N 2.98Å; S415-P437 WeakPolarHBondContact O-CA 3.19Å; S415-G438 PolarHBondContact O-N 2.89Å; S415-G438 VanDerWaalsContact O-N 3.14Å
416	G	89	Confident	91.3	Very high	35 Å²	35	31.3 Å²	31.3	36%	0.361	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	9.7	178.7	0	0	0	0	0	115.4	S398 G438	S398-G416 PolarHBondContact O-N 3.32Å; S398-G416 VanDerWaalsContact O-N 3.1Å; G416-G438 CarbonylContact C-O 3.57Å
417	F	91.4	Very high	90.2	Very high	1 Å²	1	32 Å²	32	0%	0.004	17%	0.172	C	C	.	.			trans	-76.7	138.9	179.3	-159	-96.5	0	0	0	112.2	V400 K401 I413 L414 S415 L419 L435 G438 L442 G463	V400-F417 WeakPolarHBondContact CA-O 3.36Å; K401-F417 PolarHBondContact N-O 3.01Å; I413-F417 HydrophobicContact CG2-CB 3.82Å; I413-F417 HydrophobicContact CG2-CD1 4.15Å; I413-F417 HydrophobicContact CG2-CG 4.29Å; L414-F417 WeakPolarHBondContact O-CB 3.23Å; L414-F417 PolarHBondContact O-N 2.92Å; S415-F417 PolarHBondContact O-N 2.98Å; F417-L419 HydrophobicContact CD1-CD2 4.06Å; F417-L419 HydrophobicContact CD1-CG 4.15Å; F417-L419 HydrophobicContact CE1-CD2 3.7Å; F417-L419 HydrophobicContact CE1-CG 4.25Å; F417-L435 HydrophobicContact CD1-CB 4.2Å; F417-L435 HydrophobicContact CD2-CB 4.32Å; F417-L435 HydrophobicContact CE1-CB 3.96Å; F417-L435 HydrophobicContact CE1-CD1 3.75Å; F417-L435 HydrophobicContact CE1-CG 4.42Å; F417-L435 HydrophobicContact CE2-CB 4.07Å; F417-L435 HydrophobicContact CG-CB 4.38Å; F417-L435 HydrophobicContact CZ-CB 3.89Å; F417-L435 HydrophobicContact CZ-CD1 4.01Å; F417-L435 HydrophobicContact CZ-CD2 4.4Å; F417-L435 HydrophobicContact CZ-CG 4.34Å; F417-G438 VanDerWaalsContact CA-O 3.3Å; F417-G438 WeakPolarHBondContact CA-O 3.38Å; F417-G438 WeakPolarHBondContact CD2-O 3.27Å; F417-L442 HydrophobicContact CE1-CD1 3.8Å; F417-L442 HydrophobicContact CZ-CD1 3.66Å; F417-L442 HydrophobicContact CZ-CG 4.31Å; F417-G463 WeakPolarHBondContact CE2-O 3.48Å
418	K	91.7	Very high	89.1	Confident	134 Å²	134	33.4 Å²	33.4	58%	0.583	18%	0.182	S	C	*	.	B	Isolated β-bridge	trans	-113.7	111.3	176.6	-174.4	179.6	177.4	-170.2	0	109.1	K401	K401-K418 HydrophobicContact CB-CG 4.26Å; K401-K418 CarbonylContact O-C 3.49Å; K401-K418 WeakPolarHBondContact O-CA 3.13Å
419	L	92	Very high	87.9	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.021	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-78.8	133.6	171.9	-72.2	171.3	0	0	0	110.1	K401 A402 A405 L407 I413 F417 C423 I425 L435 L442	K401-L419 PolarHBondContact O-N 3.44Å; A402-L419 HydrophobicContact CB-CB 3.9Å; A402-L419 HydrophobicContact CB-CD1 3.77Å; A402-L419 HydrophobicContact CB-CG 4.35Å; A405-L419 HydrophobicContact CB-CD1 4.33Å; L407-L419 HydrophobicContact CD2-CD1 4.15Å; I413-L419 HydrophobicContact CD1-CD1 3.53Å; I413-L419 HydrophobicContact CD1-CG 4.49Å; F417-L419 HydrophobicContact CD1-CD2 4.06Å; F417-L419 HydrophobicContact CD1-CG 4.15Å; F417-L419 HydrophobicContact CE1-CD2 3.7Å; F417-L419 HydrophobicContact CE1-CG 4.25Å; L419-C423 HydrophobicContact CD2-CB 4.28Å; L419-I425 HydrophobicContact CD1-CD1 4.42Å; L419-I425 HydrophobicContact CD2-CD1 3.9Å; L419-L435 HydrophobicContact CD2-CD1 4Å; L419-L442 HydrophobicContact CD2-CD1 4.42Å
420	P	89.9	Confident	87	Confident	23 Å²	23	41.8 Å²	41.8	15%	0.149	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-72.4	170.2	174.2	33.7	-36.8	0	0	0	110.8	C423 L442 P443	P420-C423 HydrophobicContact CG-CB 4.24Å; P420-L442 WeakPolarHBondContact CB-O 3.47Å; P420-L442 HydrophobicContact CG-CB 3.74Å; P420-L442 WeakPolarHBondContact CG-O 3.23Å; P420-P443 VanDerWaalsContact CG-O 3.29Å; P420-P443 WeakPolarHBondContact CG-O 3.06Å
421	N	89.5	Confident	86.2	Confident	76 Å²	76	42.5 Å²	42.5	41%	0.406	24%	0.24	S	C	.	.	S	Bend	trans	-63.4	137	175.4	-166.3	11.6	0	0	0	111	D403 V404 N445	D403-N421 VanDerWaalsContact O-CA 3.32Å; D403-N421 WeakPolarHBondContact O-CA 3.46Å; V404-N421 VanDerWaalsContact CB-OD1 3.26Å; V404-N421 WeakPolarHBondContact CB-OD1 3.19Å; V404-N421 WeakPolarHBondContact CG2-OD1 3.25Å; N421-N445 PolarHBondContact O-N 3.14Å
422	R	89.4	Confident	85.7	Confident	77 Å²	77	44 Å²	44	29%	0.291	25%	0.252	S	S	.	.	S	Bend	trans	58.1	57	-179.2	-63.2	176.6	177	-169.2	-0.9	112	V404 N445 W510	V404-R422 HydrophobicContact CB-CG 4.47Å; V404-R422 HydrophobicContact CG1-CG 4.04Å; V404-R422 CarbonylContact O-C 3.58Å; V404-R422 WeakPolarHBondContact O-CA 3.42Å; V404-R422 PolarHBondContact O-N 3.16Å; R422-N445 WeakPolarHBondContact CB-OD1 3.48Å; R422-N445 WeakPolarHBondContact CD-OD1 3.48Å; R422-N445 CarbonylContact O-C 3.56Å; R422-N445 WeakPolarHBondContact O-CA 3.29Å; R422-N445 PolarHBondContact O-N 3.21Å; R422-W510 HydrophobicContact CB-CD2 4.01Å; R422-W510 HydrophobicContact CB-CE3 3.92Å; R422-W510 HydrophobicContact CB-CH2 4.11Å; R422-W510 HydrophobicContact CB-CZ2 4.19Å; R422-W510 HydrophobicContact CB-CZ3 3.96Å; R422-W510 HydrophobicContact CG-CE3 4.21Å; R422-W510 HydrophobicContact CG-CZ3 4.15Å; R422-W510 WeakPolarHBondContact O-CZ2 3.22Å; R422-W510 PolarHBondContact O-NE1 3.42Å
423	C	90.7	Very high	85.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.7	176.2	-165.3	0	0	0	0	110.6	V404 A405 W406 L419 P420 S446	V404-C423 PolarHBondContact O-N 2.93Å; V404-C423 VanDerWaalsContact O-N 3.14Å; A405-C423 CarbonylContact C-O 3.56Å; A405-C423 WeakPolarHBondContact CA-O 3.32Å; A405-C423 HydrophobicContact CB-CB 4.42Å; A405-C423 WeakPolarHBondContact CB-O 3.27Å; W406-C423 PolarHBondContact N-O 3.36Å; L419-C423 HydrophobicContact CD2-CB 4.28Å; P420-C423 HydrophobicContact CG-CB 4.24Å; C423-S446 PolarHBondContact SG-OG 3.4Å
424	F	92.6	Very high	85.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.7	173	174.6	-93.5	0	0	0	108.9	P47 L48 L296 W406 S446 V447 L448 L509 W510	P47-F424 HydrophobicContact CG-CE1 3.95Å; L48-F424 HydrophobicContact CB-CE2 3.92Å; L48-F424 HydrophobicContact CB-CZ 3.74Å; L48-F424 HydrophobicContact CD1-CE2 3.92Å; L48-F424 HydrophobicContact CD1-CZ 3.96Å; L48-F424 HydrophobicContact CD2-CE2 4.09Å; L48-F424 HydrophobicContact CG-CE2 4.2Å; L48-F424 HydrophobicContact CG-CZ 4.33Å; L296-F424 HydrophobicContact CD2-CD2 3.94Å; W406-F424 HydrophobicContact CB-CD2 3.96Å; W406-F424 AromaticContact CD1-CD2 3.77Å; W406-F424 AromaticContact CD1-CE2 3.58Å; W406-F424 HydrophobicContact CG-CD2 4.05Å; W406-F424 HydrophobicContact CG-CE2 4.24Å; F424-S446 PolarHBondContact N-O 3.44Å; F424-V447 HydrophobicContact CB-CG2 4.4Å; F424-V447 HydrophobicContact CD1-CG1 3.63Å; F424-V447 HydrophobicContact CE1-CG1 4.24Å; F424-V447 HydrophobicContact CG-CG1 4.46Å; F424-L448 PolarHBondContact O-N 2.91Å; F424-L509 HydrophobicContact CB-CD2 3.66Å; F424-L509 HydrophobicContact CD1-CD2 3.61Å; F424-L509 HydrophobicContact CD2-CD2 3.51Å; F424-L509 HydrophobicContact CE1-CD2 4.02Å; F424-L509 HydrophobicContact CE2-CD2 3.96Å; F424-L509 HydrophobicContact CG-CD2 3.3Å; F424-L509 HydrophobicContact CZ-CD2 4.18Å; F424-W510 HydrophobicContact CB-CZ2 3.71Å
425	I	91	Very high	85.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	107.6	172.3	-50.6	-174	0	0	0	107.5	W406 L407 C408 V411 L419 V433 L435	W406-I425 PolarHBondContact O-N 3Å; L407-I425 HydrophobicContact CD2-CB 4.08Å; L407-I425 HydrophobicContact CD2-CD1 3.66Å; L407-I425 HydrophobicContact CD2-CG1 3.87Å; C408-I425 VanDerWaalsContact CB-O 3.31Å; C408-I425 WeakPolarHBondContact CB-O 3.46Å; C408-I425 PolarHBondContact N-O 2.96Å; C408-I425 PolarHBondContact SG-O 2.91Å; V411-I425 HydrophobicContact CB-CG2 4.36Å; V411-I425 HydrophobicContact CG1-CB 4.21Å; V411-I425 HydrophobicContact CG1-CD1 4.17Å; V411-I425 HydrophobicContact CG1-CG2 3.74Å; V411-I425 HydrophobicContact CG2-CB 4.16Å; V411-I425 HydrophobicContact CG2-CG2 3.59Å; L419-I425 HydrophobicContact CD1-CD1 4.42Å; L419-I425 HydrophobicContact CD2-CD1 3.9Å; I425-V433 HydrophobicContact CG2-CB 3.73Å; I425-V433 HydrophobicContact CG2-CG1 3.5Å; I425-V433 VanDerWaalsContact CG2-CG1 3.5Å; I425-V433 HydrophobicContact CG2-CG2 4.37Å; I425-L435 HydrophobicContact CD1-CD1 3.47Å; I425-L435 VanDerWaalsContact CD1-CD1 3.47Å; I425-L435 HydrophobicContact CG1-CD1 4.44Å
426	G	78.8	Confident	84.8	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.205	C	C	.	.			trans	-76	164.9	-168.3	0	0	0	0	0	114.4	L448	G426-L448 PolarHBondContact N-O 3.21Å
427	P	72.1	Confident	84.7	Confident	13 Å²	13	33.9 Å²	33.9	8%	0.084	20%	0.199	C	C	.	.			trans	-68.2	153.1	179.8	-9.4	26.1	0	0	0	109.9	L48 Y51 C408	L48-P427 HydrophobicContact CD1-CG 4.37Å; Y51-P427 HydrophobicContact CD1-CB 3.94Å; Y51-P427 HydrophobicContact CD1-CG 4.43Å; Y51-P427 HydrophobicContact CD2-CB 3.89Å; Y51-P427 HydrophobicContact CD2-CG 3.57Å; Y51-P427 HydrophobicContact CE1-CB 4.37Å; Y51-P427 HydrophobicContact CE2-CB 4.31Å; Y51-P427 HydrophobicContact CE2-CG 4.26Å; Y51-P427 HydrophobicContact CG-CB 3.67Å; Y51-P427 HydrophobicContact CG-CG 3.66Å; Y51-P427 PolarHBondContact OH-O 3.28Å; C408-P427 HydrophobicContact CB-CB 3.99Å; C408-P427 HydrophobicContact CB-CG 3.71Å; C408-P427 WeakPolarHBondContact SG-CD 3.5Å
428	S	71.2	Confident	84.3	Confident	30 Å²	30	35.3 Å²	35.3	21%	0.21	21%	0.213	C	C	.	.			trans	-135	126.2	174.1	-178.5	0	0	0	0	110.2	T430 A431 A450	S428-T430 PolarHBondContact OG-N 2.94Å; S428-A431 WeakPolarHBondContact CB-O 3.27Å; S428-A431 PolarHBondContact OG-N 3.4Å; S428-A431 VanDerWaalsContact OG-N 3.08Å; S428-A431 PolarHBondContact OG-O 2.83Å; S428-A450 WeakPolarHBondContact OG-CB 3.47Å
429	S	68	Low	83.6	Confident	105 Å²	105	34.3 Å²	34.3	73%	0.734	22%	0.222	S	C	*	.	S	Bend	trans	-82.6	-22.1	172.8	52.2	0	0	0	0	112.8
430	T	70.1	Confident	82.7	Confident	118 Å²	118	34.5 Å²	34.5	72%	0.724	23%	0.225	S	C	*	.	S	Bend	trans	-101.5	-47.8	-171.4	53.1	0	0	0	0	112.8	S428	S428-T430 PolarHBondContact OG-N 2.94Å
431	A	75.2	Confident	82.3	Confident	38 Å²	38	40 Å²	40	31%	0.314	25%	0.253	S	S	.	.	S	Bend	trans	-153.6	133.5	-174.4	0	0	0	0	0	111.6	S428 V433	S428-A431 WeakPolarHBondContact CB-O 3.27Å; S428-A431 PolarHBondContact OG-N 3.4Å; S428-A431 VanDerWaalsContact OG-N 3.08Å; S428-A431 PolarHBondContact OG-O 2.83Å; A431-V433 PolarHBondContact O-N 3.23Å
432	A	82.7	Confident	82.1	Confident	32 Å²	32	36.9 Å²	36.9	26%	0.264	24%	0.236	S	C	.	.			trans	-50.6	123.2	177.5	0	0	0	0	0	111.8	G410 R412 T434	G410-A432 WeakPolarHBondContact O-CB 3.5Å; R412-A432 HydrophobicContact CG-CB 4.17Å; A432-T434 PolarHBondContact O-N 3.45Å; A432-T434 VanDerWaalsContact O-N 3.14Å; A432-T434 PolarHBondContact O-OG1 3.26Å
433	V	88.8	Confident	82	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	24%	0.244	C	C	.	.			trans	-62.3	119.8	172.8	-173.2	0	0	0	0	107.5	V411 R412 I425 A431 A450 A469	V411-V433 HydrophobicContact CG2-CB 4.47Å; R412-V433 PolarHBondContact N-O 2.97Å; I425-V433 HydrophobicContact CG2-CB 3.73Å; I425-V433 HydrophobicContact CG2-CG1 3.5Å; I425-V433 VanDerWaalsContact CG2-CG1 3.5Å; I425-V433 HydrophobicContact CG2-CG2 4.37Å; A431-V433 PolarHBondContact O-N 3.23Å; V433-A450 HydrophobicContact CG2-CB 3.99Å; V433-A469 HydrophobicContact CG1-CB 3.63Å
434	T	90.4	Very high	81.7	Confident	23 Å²	23	40.3 Å²	40.3	14%	0.141	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	129.8	-172.3	-55.2	0	0	0	0	109.8	R412 L414 A432 A467 W468	R412-T434 HydrophobicContact CB-CG2 4.25Å; R412-T434 VanDerWaalsContact O-CA 3.3Å; R412-T434 WeakPolarHBondContact O-CA 3.4Å; L414-T434 HydrophobicContact CD1-CG2 3.68Å; L414-T434 HydrophobicContact CD2-CG2 4.48Å; L414-T434 HydrophobicContact CG-CG2 3.89Å; A432-T434 PolarHBondContact O-N 3.45Å; A432-T434 VanDerWaalsContact O-N 3.14Å; A432-T434 PolarHBondContact O-OG1 3.26Å; T434-A467 CarbonylContact O-C 3.52Å; T434-A467 WeakPolarHBondContact O-CA 3.26Å; T434-W468 PolarHBondContact N-O 3.13Å; T434-W468 VanDerWaalsContact N-O 3.16Å; T434-W468 PolarHBondContact O-N 3.37Å
435	L	90.9	Very high	81.4	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	146.5	175.5	-64.9	176.4	0	0	0	110.3	R412 L414 F417 L419 I425 L442 L448 A469	R412-L435 PolarHBondContact O-N 3.23Å; L414-L435 VanDerWaalsContact CB-O 3.26Å; L414-L435 WeakPolarHBondContact CB-O 3.46Å; L414-L435 WeakPolarHBondContact CG-O 3.32Å; L414-L435 PolarHBondContact N-O 3.03Å; F417-L435 HydrophobicContact CD1-CB 4.2Å; F417-L435 HydrophobicContact CD2-CB 4.32Å; F417-L435 HydrophobicContact CE1-CB 3.96Å; F417-L435 HydrophobicContact CE1-CD1 3.75Å; F417-L435 HydrophobicContact CE1-CG 4.42Å; F417-L435 HydrophobicContact CE2-CB 4.07Å; F417-L435 HydrophobicContact CG-CB 4.38Å; F417-L435 HydrophobicContact CZ-CB 3.89Å; F417-L435 HydrophobicContact CZ-CD1 4.01Å; F417-L435 HydrophobicContact CZ-CD2 4.4Å; F417-L435 HydrophobicContact CZ-CG 4.34Å; L419-L435 HydrophobicContact CD2-CD1 4Å; I425-L435 HydrophobicContact CD1-CD1 3.47Å; I425-L435 VanDerWaalsContact CD1-CD1 3.47Å; I425-L435 HydrophobicContact CG1-CD1 4.44Å; L435-L442 HydrophobicContact CD1-CD1 4.1Å; L435-L448 HydrophobicContact CD1-CD1 3.81Å; L435-L448 HydrophobicContact CD2-CD1 4.11Å; L435-A469 HydrophobicContact CD2-CB 3.85Å
436	G	86.1	Confident	81.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	29%	0.291	C	S	.	.			trans	89.6	-168.1	-177.2	0	0	0	0	0	113.2	G463 Q466	G436-G463 PolarHBondContact N-O 3.29Å; G436-Q466 CarbonylContact O-C 3.54Å; G436-Q466 VanDerWaalsContact O-C 3.3Å; G436-Q466 VanDerWaalsContact O-CA 3.27Å; G436-Q466 WeakPolarHBondContact O-CA 3.19Å; G436-Q466 WeakPolarHBondContact O-CB 3.5Å; G436-Q466 PolarHBondContact O-N 3.08Å
437	P	86.6	Confident	81.8	Confident	36 Å²	36	44.7 Å²	44.7	23%	0.234	30%	0.295	C	S	.	.	S	Bend	cis	-71.3	155.7	-9.9	30.9	-34.2	0	0	0	111.7	L414 S415 K465	L414-P437 HydrophobicContact CB-CB 4.22Å; S415-P437 WeakPolarHBondContact O-CA 3.19Å; P437-K465 HydrophobicContact CG-CB 4.34Å; P437-K465 PolarHBondContact O-N 3.3Å
438	G	83.5	Confident	82.6	Confident	30 Å²	30	44.1 Å²	44.1	31%	0.309	29%	0.291	S	S	.	.	S	Bend	trans	123.5	169.3	177.8	0	0	0	0	0	114	S415 G416 F417 G440	S415-G438 PolarHBondContact O-N 2.89Å; S415-G438 VanDerWaalsContact O-N 3.14Å; G416-G438 CarbonylContact C-O 3.57Å; F417-G438 VanDerWaalsContact CA-O 3.3Å; F417-G438 WeakPolarHBondContact CA-O 3.38Å; F417-G438 WeakPolarHBondContact CD2-O 3.27Å; G438-G440 VanDerWaalsContact C-N 3.33Å; G438-G440 PolarHBondContact O-N 3.5Å
439	C	75.5	Confident	83.4	Confident	114 Å²	114	43 Å²	43	77%	0.77	28%	0.283	S	S	*	.			trans	-72.1	85.4	177.5	50.2	0	0	0	0	110.3
440	G	73.3	Confident	84.2	Confident	8 Å²	8	38.2 Å²	38.2	8%	0.082	25%	0.25	C	C	.	.			trans	-62	144.7	172.5	0	0	0	0	0	112.2	G438 V462	G438-G440 VanDerWaalsContact C-N 3.33Å; G438-G440 PolarHBondContact O-N 3.5Å; G440-V462 CarbonylContact C-O 3.58Å; G440-V462 WeakPolarHBondContact CA-O 3.37Å
441	N	82.4	Confident	84.8	Confident	138 Å²	138	33.4 Å²	33.4	74%	0.738	22%	0.221	S	C	*	.			trans	-129.1	59	-178.4	-153.8	25.4	0	0	0	110.4	V462	N441-V462 PolarHBondContact N-O 3.31Å
442	L	85.8	Confident	85.1	Confident	10 Å²	10	37 Å²	37	5%	0.052	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-74.2	146.6	177.5	-71.3	160.9	0	0	0	110.9	F417 L419 P420 L435 L448 I458 V462 Y471	F417-L442 HydrophobicContact CE1-CD1 3.8Å; F417-L442 HydrophobicContact CZ-CD1 3.66Å; F417-L442 HydrophobicContact CZ-CG 4.31Å; L419-L442 HydrophobicContact CD2-CD1 4.42Å; P420-L442 WeakPolarHBondContact CB-O 3.47Å; P420-L442 HydrophobicContact CG-CB 3.74Å; P420-L442 WeakPolarHBondContact CG-O 3.23Å; L435-L442 HydrophobicContact CD1-CD1 4.1Å; L442-L448 HydrophobicContact CD1-CD1 3.73Å; L442-L448 HydrophobicContact CD2-CD1 3.99Å; L442-L448 HydrophobicContact CD2-CD2 4.32Å; L442-I458 HydrophobicContact CD2-CD1 4.19Å; L442-V462 HydrophobicContact CD2-CG1 3.8Å; L442-V462 HydrophobicContact CG-CG1 4.22Å; L442-Y471 HydrophobicContact CD2-CE1 4.47Å
443	P	85.8	Confident	84.8	Confident	69 Å²	69	41.7 Å²	41.7	45%	0.448	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-66.4	154.4	172.3	28.5	-33.1	0	0	0	111.1	P420 S446 Y471	P420-P443 VanDerWaalsContact CG-O 3.29Å; P420-P443 WeakPolarHBondContact CG-O 3.06Å; P443-S446 VanDerWaalsContact O-CB 3.27Å; P443-S446 WeakPolarHBondContact O-CB 3.25Å; P443-S446 PolarHBondContact O-OG 2.93Å; P443-Y471 VanDerWaalsContact CD-OH 3.23Å; P443-Y471 WeakPolarHBondContact CD-OH 3.27Å; P443-Y471 HydrophobicContact CG-CE1 4.17Å
444	S	85.5	Confident	84.1	Confident	80 Å²	80	45.4 Å²	45.4	56%	0.559	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	153.6	169.9	50.5	0	0	0	0	111.5	S446	S444-S446 PolarHBondContact O-N 3.49Å
445	N	86.4	Confident	83.7	Confident	75 Å²	75	46.7 Å²	46.7	40%	0.401	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	23.7	-176.8	-55	-16.2	0	0	0	113.5	N421 R422 V447 W510	N421-N445 PolarHBondContact O-N 3.14Å; R422-N445 WeakPolarHBondContact CB-OD1 3.48Å; R422-N445 WeakPolarHBondContact CD-OD1 3.48Å; R422-N445 CarbonylContact O-C 3.56Å; R422-N445 WeakPolarHBondContact O-CA 3.29Å; R422-N445 PolarHBondContact O-N 3.21Å; N445-V447 PolarHBondContact O-N 2.91Å; N445-W510 HydrophobicContact CB-CB 4.3Å; N445-W510 HydrophobicContact CB-CG 4.21Å
446	S	88.3	Confident	83.2	Confident	5 Å²	5	53.9 Å²	53.9	4%	0.035	33%	0.334	C	S	.	.			trans	-68.2	132.5	179.3	30.3	0	0	0	0	111	C423 F424 P443 S444	C423-S446 PolarHBondContact SG-OG 3.4Å; F424-S446 PolarHBondContact N-O 3.44Å; P443-S446 VanDerWaalsContact O-CB 3.27Å; P443-S446 WeakPolarHBondContact O-CB 3.25Å; P443-S446 PolarHBondContact O-OG 2.93Å; S444-S446 PolarHBondContact O-N 3.49Å
447	V	88.9	Confident	83.1	Confident	13 Å²	13	56.4 Å²	56.4	8%	0.079	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	108.7	175.2	-178.4	0	0	0	0	107.9	P47 F424 N445 Y472 L509	P47-V447 HydrophobicContact CG-CG1 3.94Å; F424-V447 HydrophobicContact CB-CG2 4.4Å; F424-V447 HydrophobicContact CD1-CG1 3.63Å; F424-V447 HydrophobicContact CE1-CG1 4.24Å; F424-V447 HydrophobicContact CG-CG1 4.46Å; N445-V447 PolarHBondContact O-N 2.91Å; V447-Y472 HydrophobicContact CG1-CG 4.39Å; V447-Y472 PolarHBondContact O-N 3.24Å; V447-L509 HydrophobicContact CG1-CD2 4.1Å; V447-L509 HydrophobicContact CG2-CB 4.38Å; V447-L509 HydrophobicContact CG2-CD2 4.04Å
448	L	89.6	Confident	83.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137.3	-174.5	-56.5	-174.7	0	0	0	110.6	F424 G426 L435 L442 I458 A469 A470 Y471	F424-L448 PolarHBondContact O-N 2.91Å; G426-L448 PolarHBondContact N-O 3.21Å; L435-L448 HydrophobicContact CD1-CD1 3.81Å; L435-L448 HydrophobicContact CD2-CD1 4.11Å; L442-L448 HydrophobicContact CD1-CD1 3.73Å; L442-L448 HydrophobicContact CD2-CD1 3.99Å; L442-L448 HydrophobicContact CD2-CD2 4.32Å; L448-I458 HydrophobicContact CD1-CD1 3.88Å; L448-I458 HydrophobicContact CD2-CD1 3.44Å; L448-I458 VanDerWaalsContact CD2-CD1 3.44Å; L448-I458 HydrophobicContact CG-CD1 4.21Å; L448-A469 HydrophobicContact CB-CB 4.46Å; L448-A470 WeakPolarHBondContact CA-O 3.19Å; L448-Y471 HydrophobicContact CD2-CD1 3.67Å; L448-Y471 HydrophobicContact CD2-CE1 3.77Å; L448-Y471 HydrophobicContact CD2-CG 4.3Å
449	V	87.4	Confident	83.1	Confident	7 Å²	7	59 Å²	59	4%	0.042	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	162.5	178.6	-172.7	0	0	0	0	108.7	P47 A470 Y472	P47-V449 HydrophobicContact CB-CG2 4.5Å; P47-V449 HydrophobicContact CG-CG2 3.87Å; V449-A470 PolarHBondContact N-O 3.42Å; V449-A470 PolarHBondContact O-N 2.94Å; V449-Y472 HydrophobicContact CG2-CD2 4.03Å; V449-Y472 HydrophobicContact CG2-CG 4.39Å
450	A	85.5	Confident	83.4	Confident	5 Å²	5	57.4 Å²	57.4	4%	0.041	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-60.3	135.7	170.9	0	0	0	0	0	110.6	S428 V433 R452	S428-A450 WeakPolarHBondContact OG-CB 3.47Å; V433-A450 HydrophobicContact CG2-CB 3.99Å; A450-R452 PolarHBondContact O-N 3.03Å
451	P	82.8	Confident	83.8	Confident	17 Å²	17	61.6 Å²	61.6	11%	0.11	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-60.2	127.2	179.5	-13.8	25.2	0	0	0	110.8	V457 W468 A470	P451-V457 HydrophobicContact CB-CG2 4Å; P451-V457 HydrophobicContact CG-CG2 3.85Å; P451-W468 HydrophobicContact CB-CZ2 4.34Å; P451-W468 HydrophobicContact CG-CD2 3.99Å; P451-W468 HydrophobicContact CG-CE3 4.39Å; P451-W468 HydrophobicContact CG-CG 4.4Å; P451-W468 HydrophobicContact CG-CH2 4.43Å; P451-W468 HydrophobicContact CG-CZ2 4.03Å; P451-A470 HydrophobicContact CB-CB 4.16Å; P451-A470 HydrophobicContact CG-CB 4.34Å
452	R	80.3	Confident	84	Confident	114 Å²	114	56.8 Å²	56.8	43%	0.43	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-94	171.1	169.4	-56.7	177.5	179.4	175	-0.7	109.8	Y51 A450 G454 D455	Y51-R452 PolarHBondContact OH-NH2 3.5Å; A450-R452 PolarHBondContact O-N 3.03Å; R452-G454 PolarHBondContact O-N 3.14Å; R452-G454 VanDerWaalsContact O-N 3.09Å; R452-D455 VanDerWaalsContact CB-OD2 3.31Å; R452-D455 WeakPolarHBondContact CB-OD2 3.18Å; R452-D455 PolarHBondContact N-OD2 3.21Å; R452-D455 PolarHBondContact O-N 3.43Å
453	T	76.3	Confident	83.6	Confident	129 Å²	129	56.3 Å²	56.3	79%	0.791	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	116.4	174.4	42.9	0	0	0	0	110.8	R475	T453-R475 PolarHBondContact O-NH2 2.88Å
454	G	75.9	Confident	83.6	Confident	80 Å²	80	53.2 Å²	53.2	83%	0.825	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.9	-7.6	-178.4	0	0	0	0	0	115.2	R452	R452-G454 PolarHBondContact O-N 3.14Å; R452-G454 VanDerWaalsContact O-N 3.09Å
455	D	80.7	Confident	83.4	Confident	50 Å²	50	58 Å²	58	27%	0.267	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-83.4	140.4	177.9	-59.4	-13.5	0	0	0	110.6	R452 V457 A470 R475	R452-D455 VanDerWaalsContact CB-OD2 3.31Å; R452-D455 WeakPolarHBondContact CB-OD2 3.18Å; R452-D455 PolarHBondContact N-OD2 3.21Å; R452-D455 PolarHBondContact O-N 3.43Å; D455-V457 PolarHBondContact O-N 3.01Å; D455-A470 HydrophobicContact CB-CB 4Å; D455-R475 IonicContact OD1-NH2 3.96Å; D455-R475 PolarHBondContact OD1-NH2 3.42Å
456	L	80.4	Confident	83.4	Confident	151 Å²	151	60.5 Å²	60.5	79%	0.791	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-77.9	118.4	175	-78	152.8	0	0	0	109.5	A470	L456-A470 WeakPolarHBondContact O-CB 3.48Å
457	V	85.3	Confident	83.3	Confident	54 Å²	54	60.9 Å²	60.9	33%	0.327	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-63.2	139	171	-174.4	0	0	0	0	108.7	P451 D455 D459 W468 A469	P451-V457 HydrophobicContact CB-CG2 4Å; P451-V457 HydrophobicContact CG-CG2 3.85Å; D455-V457 PolarHBondContact O-N 3.01Å; V457-D459 PolarHBondContact O-N 3.05Å; V457-W468 HydrophobicContact CG1-CE3 4.31Å; V457-W468 HydrophobicContact CG2-CE3 4.26Å; V457-W468 HydrophobicContact CG2-CH2 4.36Å; V457-W468 HydrophobicContact CG2-CZ3 3.86Å; V457-A469 WeakPolarHBondContact CA-O 3.27Å
458	I	86	Confident	83.2	Confident	9 Å²	9	65.8 Å²	65.8	5%	0.046	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-56.7	136.9	177.8	-63.9	167.1	0	0	0	109.7	L442 L448 V462 A469 Y471	L442-I458 HydrophobicContact CD2-CD1 4.19Å; L448-I458 HydrophobicContact CD1-CD1 3.88Å; L448-I458 HydrophobicContact CD2-CD1 3.44Å; L448-I458 VanDerWaalsContact CD2-CD1 3.44Å; L448-I458 HydrophobicContact CG-CD1 4.21Å; I458-V462 HydrophobicContact CG2-CB 3.87Å; I458-V462 HydrophobicContact CG2-CG1 3.92Å; I458-A469 HydrophobicContact CD1-CB 3.6Å; I458-A469 HydrophobicContact CG1-CB 4.46Å; I458-A469 VanDerWaalsContact CG1-O 3.31Å; I458-A469 WeakPolarHBondContact CG1-O 3.46Å; I458-A469 PolarHBondContact N-O 2.76Å; I458-Y471 HydrophobicContact CG1-CD2 4.19Å; I458-Y471 HydrophobicContact CG1-CE2 4.03Å
459	D	84	Confident	83.1	Confident	110 Å²	110	65.8 Å²	65.8	59%	0.588	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-55.1	137	177.5	-83.8	-40.2	0	0	0	111.8	V457 S461 V462 G463	V457-D459 PolarHBondContact O-N 3.05Å; D459-S461 PolarHBondContact O-N 3.38Å; D459-V462 HydrophobicContact CB-CG2 4.42Å; D459-V462 PolarHBondContact O-N 2.95Å; D459-G463 PolarHBondContact O-N 3.27Å
460	P	81.8	Confident	83.1	Confident	82 Å²	82	65.6 Å²	65.6	53%	0.532	36%	0.364	S	S	.	.	H	α-helix	trans	-59.1	-22.4	178.7	-24.7	32.8	0	0	0	114.1	V462 G464	P460-V462 VanDerWaalsContact C-N 3.31Å; P460-G464 VanDerWaalsContact CA-O 3.26Å; P460-G464 WeakPolarHBondContact CA-O 2.92Å; P460-G464 CarbonylContact O-C 3.16Å; P460-G464 WeakPolarHBondContact O-CA 2.71Å; P460-G464 PolarHBondContact O-N 3.49Å
461	S	81.8	Confident	83.1	Confident	95 Å²	95	68.9 Å²	68.9	66%	0.664	38%	0.376	S	S	*	.	H	α-helix	trans	-68.6	-30.2	173.5	55.7	0	0	0	0	112.6	D459	D459-S461 PolarHBondContact O-N 3.38Å
462	V	85.2	Confident	83.1	Confident	37 Å²	37	69.4 Å²	69.4	22%	0.224	38%	0.376	C	S	.	.	H	α-helix	trans	-97.5	-47	-177.7	177.6	0	0	0	0	110.9	G440 N441 L442 I458 D459 P460	G440-V462 CarbonylContact C-O 3.58Å; G440-V462 WeakPolarHBondContact CA-O 3.37Å; N441-V462 PolarHBondContact N-O 3.31Å; L442-V462 HydrophobicContact CD2-CG1 3.8Å; L442-V462 HydrophobicContact CG-CG1 4.22Å; I458-V462 HydrophobicContact CG2-CB 3.87Å; I458-V462 HydrophobicContact CG2-CG1 3.92Å; D459-V462 HydrophobicContact CB-CG2 4.42Å; D459-V462 PolarHBondContact O-N 2.95Å; P460-V462 VanDerWaalsContact C-N 3.31Å
463	G	78.1	Confident	82.8	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-91.8	-7.3	-175.8	0	0	0	0	0	114.7	F417 G436 D459 A467	F417-G463 WeakPolarHBondContact CE2-O 3.48Å; G436-G463 PolarHBondContact N-O 3.29Å; D459-G463 PolarHBondContact O-N 3.27Å; G463-A467 VanDerWaalsContact C-CB 3.5Å; G463-A467 WeakPolarHBondContact O-CB 3.4Å
464	G	84.7	Confident	82.2	Confident	5 Å²	5	68.2 Å²	68.2	5%	0.052	36%	0.363	C	S	.	.			trans	91.8	171.4	-175.4	0	0	0	0	0	113.9	P460 Q466 A467	P460-G464 VanDerWaalsContact CA-O 3.26Å; P460-G464 WeakPolarHBondContact CA-O 2.92Å; P460-G464 CarbonylContact O-C 3.16Å; P460-G464 WeakPolarHBondContact O-CA 2.71Å; P460-G464 PolarHBondContact O-N 3.49Å; G464-Q466 VanDerWaalsContact C-N 3.26Å; G464-Q466 PolarHBondContact O-N 2.86Å; G464-Q466 VanDerWaalsContact O-N 3.15Å; G464-A467 WeakPolarHBondContact O-CB 3.18Å; G464-A467 PolarHBondContact O-N 3.11Å
465	K	82.3	Confident	81.4	Confident	179 Å²	179	71.4 Å²	71.4	78%	0.778	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-28.6	-168.4	-67	-177.5	178.5	-178.8	0	114.9	P437	P437-K465 HydrophobicContact CG-CB 4.34Å; P437-K465 PolarHBondContact O-N 3.3Å
466	Q	85.7	Confident	79.8	Confident	128 Å²	128	77.6 Å²	77.6	60%	0.598	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	34.6	-178.9	-63.2	-178.7	-32.8	0	0	110.8	L414 G436 G464 W468	L414-Q466 HydrophobicContact CD1-CB 3.98Å; L414-Q466 VanDerWaalsContact CD1-OE1 3.3Å; G436-Q466 CarbonylContact O-C 3.54Å; G436-Q466 VanDerWaalsContact O-C 3.3Å; G436-Q466 VanDerWaalsContact O-CA 3.27Å; G436-Q466 WeakPolarHBondContact O-CA 3.19Å; G436-Q466 WeakPolarHBondContact O-CB 3.5Å; G436-Q466 PolarHBondContact O-N 3.08Å; G464-Q466 VanDerWaalsContact C-N 3.26Å; G464-Q466 PolarHBondContact O-N 2.86Å; G464-Q466 VanDerWaalsContact O-N 3.15Å; Q466-W468 PolarHBondContact O-N 3.1Å
467	A	85.9	Confident	77.9	Confident	14 Å²	14	76.5 Å²	76.5	12%	0.116	38%	0.379	C	S	.	.			trans	-62	123.5	177	0	0	0	0	0	111.1	T434 G463 G464	T434-A467 CarbonylContact O-C 3.52Å; T434-A467 WeakPolarHBondContact O-CA 3.26Å; G463-A467 VanDerWaalsContact C-CB 3.5Å; G463-A467 WeakPolarHBondContact O-CB 3.4Å; G464-A467 WeakPolarHBondContact O-CB 3.18Å; G464-A467 PolarHBondContact O-N 3.11Å
468	W	87.9	Confident	75.5	Confident	116 Å²	116	79.3 Å²	79.3	44%	0.439	40%	0.401	S	S	.	.	B	Isolated β-bridge	trans	-129.5	79.2	170	-169.4	-106.5	0	0	0	108.9	T434 P451 V457 Q466	T434-W468 PolarHBondContact N-O 3.13Å; T434-W468 VanDerWaalsContact N-O 3.16Å; T434-W468 PolarHBondContact O-N 3.37Å; P451-W468 HydrophobicContact CB-CZ2 4.34Å; P451-W468 HydrophobicContact CG-CD2 3.99Å; P451-W468 HydrophobicContact CG-CE3 4.39Å; P451-W468 HydrophobicContact CG-CG 4.4Å; P451-W468 HydrophobicContact CG-CH2 4.43Å; P451-W468 HydrophobicContact CG-CZ2 4.03Å; V457-W468 HydrophobicContact CG1-CE3 4.31Å; V457-W468 HydrophobicContact CG2-CE3 4.26Å; V457-W468 HydrophobicContact CG2-CH2 4.36Å; V457-W468 HydrophobicContact CG2-CZ3 3.86Å; Q466-W468 PolarHBondContact O-N 3.1Å
469	A	88	Confident	72.8	Confident	0 Å²	0	81.9 Å²	81.9	0%	0	43%	0.43	C	S	.	.			trans	-156.6	154	-178.4	0	0	0	0	0	109.1	V433 L435 L448 V457 I458	V433-A469 HydrophobicContact CG1-CB 3.63Å; L435-A469 HydrophobicContact CD2-CB 3.85Å; L448-A469 HydrophobicContact CB-CB 4.46Å; V457-A469 WeakPolarHBondContact CA-O 3.27Å; I458-A469 HydrophobicContact CD1-CB 3.6Å; I458-A469 HydrophobicContact CG1-CB 4.46Å; I458-A469 VanDerWaalsContact CG1-O 3.31Å; I458-A469 WeakPolarHBondContact CG1-O 3.46Å; I458-A469 PolarHBondContact N-O 2.76Å
470	A	86.7	Confident	70.2	Confident	2 Å²	2	83.1 Å²	83.1	2%	0.017	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	152.9	171.8	0	0	0	0	0	109.5	L448 V449 P451 D455 L456	L448-A470 WeakPolarHBondContact CA-O 3.19Å; V449-A470 PolarHBondContact N-O 3.42Å; V449-A470 PolarHBondContact O-N 2.94Å; P451-A470 HydrophobicContact CB-CB 4.16Å; P451-A470 HydrophobicContact CG-CB 4.34Å; D455-A470 HydrophobicContact CB-CB 4Å; L456-A470 WeakPolarHBondContact O-CB 3.48Å
471	Y	85.1	Confident	67.5	Low	74 Å²	74	84.7 Å²	84.7	29%	0.29	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.4	169.6	-70.2	-77.3	0	0	0	109.8	L442 P443 L448 I458 K473	L442-Y471 HydrophobicContact CD2-CE1 4.47Å; P443-Y471 VanDerWaalsContact CD-OH 3.23Å; P443-Y471 WeakPolarHBondContact CD-OH 3.27Å; P443-Y471 HydrophobicContact CG-CE1 4.17Å; L448-Y471 HydrophobicContact CD2-CD1 3.67Å; L448-Y471 HydrophobicContact CD2-CE1 3.77Å; L448-Y471 HydrophobicContact CD2-CG 4.3Å; I458-Y471 HydrophobicContact CG1-CD2 4.19Å; I458-Y471 HydrophobicContact CG1-CE2 4.03Å; Y471-K473 PolarHBondContact O-N 3.48Å
472	Y	82.7	Confident	64.8	Low	29 Å²	29	87.4 Å²	87.4	11%	0.114	46%	0.462	C	S	.	.			trans	-63.9	131	177.6	178.5	-109.5	0	0	0	111.5	P47 V447 V449 K474 C507	P47-Y472 HydrophobicContact CB-CD2 3.7Å; P47-Y472 HydrophobicContact CB-CE1 4.35Å; P47-Y472 HydrophobicContact CB-CE2 3.46Å; P47-Y472 VanDerWaalsContact CB-CE2 3.46Å; P47-Y472 HydrophobicContact CB-CG 4.24Å; P47-Y472 HydrophobicContact CG-CD1 4.28Å; P47-Y472 HydrophobicContact CG-CD2 3.79Å; P47-Y472 HydrophobicContact CG-CE1 4.49Å; P47-Y472 HydrophobicContact CG-CE2 4.06Å; P47-Y472 HydrophobicContact CG-CG 3.9Å; V447-Y472 HydrophobicContact CG1-CG 4.39Å; V447-Y472 PolarHBondContact O-N 3.24Å; V449-Y472 HydrophobicContact CG2-CD2 4.03Å; V449-Y472 HydrophobicContact CG2-CG 4.39Å; Y472-K474 HydrophobicContact CE1-CB 4.2Å; Y472-C507 HydrophobicContact CD1-CB 3.98Å; Y472-C507 HydrophobicContact CE1-CB 4.41Å
473	K	73.7	Confident	62.1	Low	129 Å²	129	90.9 Å²	90.9	56%	0.561	49%	0.487	S	S	*	.			trans	-127.5	127.1	167.2	-68.3	-173.4	178.5	-175.6	0	109.1	Y471 R475	Y471-K473 PolarHBondContact O-N 3.48Å; K473-R475 PolarHBondContact O-N 3.03Å
474	K	65.2	Low	59.7	Low	89 Å²	89	96.8 Å²	96.8	39%	0.387	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-71.4	118.4	175.7	-164.8	175.8	-175.4	-178.3	0	108.6	Y472	Y472-K474 HydrophobicContact CE1-CB 4.2Å
475	R	59.3	Low	56.8	Low	147 Å²	147	103.1 Å²	103.1	56%	0.555	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-86.2	130	170.8	-68.4	-172.4	-174	-173.9	2	108.3	T453 D455 K473	T453-R475 PolarHBondContact O-NH2 2.88Å; D455-R475 IonicContact OD1-NH2 3.96Å; D455-R475 PolarHBondContact OD1-NH2 3.42Å; K473-R475 PolarHBondContact O-N 3.03Å
476	Q	47	Very low	54.2	Low	179 Å²	179	102.7 Å²	102.7	84%	0.836	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-65.8	140.4	164.8	-67.6	-153.7	-3.1	0	0	108.6	S478	Q476-S478 PolarHBondContact O-N 3.28Å
477	P	40.2	Very low	51.3	Low	128 Å²	128	104.6 Å²	104.6	83%	0.831	58%	0.575	S	S	*	*			trans	-65.7	100.6	174.6	26.8	-30.6	0	0	0	108	G479	P477-G479 PolarHBondContact O-N 2.98Å; P477-G479 VanDerWaalsContact O-N 3.13Å
478	S	33.6	Very low	48.6	Very low	114 Å²	114	109.7 Å²	109.7	80%	0.797	61%	0.611	S	S	*	*			trans	-63.4	113.4	170.6	53.5	0	0	0	0	108	Q476 T480	Q476-S478 PolarHBondContact O-N 3.28Å; S478-T480 PolarHBondContact O-N 3.06Å
479	G	29.2	Very low	45.6	Very low	63 Å²	63	112.6 Å²	112.6	65%	0.649	63%	0.629	S	S	*	*			trans	-54.2	135.7	170	0	0	0	0	0	110.8	P477	P477-G479 PolarHBondContact O-N 2.98Å; P477-G479 VanDerWaalsContact O-N 3.13Å
480	T	29.4	Very low	42.6	Very low	135 Å²	135	121.4 Å²	121.4	83%	0.828	67%	0.67	S	S	*	*			trans	36.3	103.1	153.3	51.7	0	0	0	0	117.2	S478 D482	S478-T480 PolarHBondContact O-N 3.06Å; T480-D482 PolarHBondContact O-N 3.18Å
481	S	25.2	Very low	39.7	Very low	115 Å²	115	129.3 Å²	129.3	80%	0.804	71%	0.712	S	S	*	*			trans	-60.7	109.3	151.3	54.1	0	0	0	0	110
482	D	25.8	Very low	36.9	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	74%	0.738	S	S	*	*			trans	-162.3	136.3	147.8	-95.1	-24.4	0	0	0	110.6	T480	T480-D482 PolarHBondContact O-N 3.18Å
483	S	29.2	Very low	34.2	Very low	109 Å²	109	139.7 Å²	139.7	76%	0.762	77%	0.774	S	S	*	*			trans	66.2	104.5	176.5	61.9	0	0	0	0	116.7
484	V	26.5	Very low	31.8	Very low	124 Å²	124	138.7 Å²	138.7	75%	0.752	78%	0.783	S	S	*	*				59	109.1	67	-162.1	0	0	0	0	113.5
485	D	24.1	Very low	29.9	Very low	139 Å²	139	141.8 Å²	141.8	74%	0.743	80%	0.804	S	S	*	*			trans	55.9	107.9	155.8	-58.6	-24.7	0	0	0	119.7
486	N	28.8	Very low	28.1	Very low	170 Å²	170	143.7 Å²	143.7	91%	0.909	82%	0.819	S	S	*	*				-164.7	120.4	115.5	-92.7	-33.3	0	0	0	111.8
487	L	23.9	Very low	27.1	Very low	167 Å²	167	140.9 Å²	140.9	87%	0.874	81%	0.814	S	S	*	*			trans	-77	132	168.2	-71	153.6	0	0	0	109.2
488	S	28.5	Very low	26.4	Very low	122 Å²	122	144.3 Å²	144.3	85%	0.853	81%	0.811	S	S	*	*			trans	-144.9	110.1	145.4	57.3	0	0	0	0	108.5
489	E	25.3	Very low	25.9	Very low	177 Å²	177	146.5 Å²	146.5	83%	0.827	81%	0.814	S	S	*	*			trans	-68	125.4	167.3	-61.5	171.9	153	0	0	108.4
490	E	24.6	Very low	25.7	Very low	184 Å²	184	152.1 Å²	152.1	86%	0.86	82%	0.82	S	S	*	*			trans	173.1	95.8	146.9	-97.7	170	-154.7	0	0	108.5
491	D	27.2	Very low	25.5	Very low	168 Å²	168	152.7 Å²	152.7	90%	0.898	82%	0.818	S	S	*	*			trans	177.8	86	136.5	-91.2	-22	0	0	0	109.2
492	T	25.7	Very low	25.6	Very low	138 Å²	138	154.6 Å²	154.6	85%	0.847	82%	0.819	S	S	*	*			trans	-97.6	97.2	167.3	-46.8	0	0	0	0	107.4
493	Q	25.1	Very low	25.7	Very low	184 Å²	184	156 Å²	156	86%	0.86	82%	0.821	S	S	*	*			trans	-160.6	123.1	154.4	-110.5	157.4	58.3	0	0	112.3
494	S	23.8	Very low	26	Very low	107 Å²	107	158.5 Å²	158.5	75%	0.748	82%	0.818	S	S	*	*			trans	63.2	89.1	159.4	59.6	0	0	0	0	118.3
495	N	24.6	Very low	26.9	Very low	155 Å²	155	155.4 Å²	155.4	83%	0.829	80%	0.8	S	S	*	*			trans	-154.2	96.4	131	-96.6	-30.2	0	0	0	109.4	V497	N495-V497 PolarHBondContact O-N 3.38Å
496	Q	22.8	Very low	28.3	Very low	187 Å²	187	154.1 Å²	154.1	87%	0.874	79%	0.793	S	S	*	*			trans	-63	93.5	158.5	-81.3	179.1	-11.2	0	0	106.8	Y498	Q496-Y498 PolarHBondContact O-N 2.99Å
497	V	26	Very low	29.9	Very low	120 Å²	120	148.2 Å²	148.2	73%	0.727	76%	0.764	S	S	*	*			trans	-66.2	104.3	171.8	175.5	0	0	0	0	106.9	N495 L499	N495-V497 PolarHBondContact O-N 3.38Å; V497-L499 PolarHBondContact O-N 3.04Å
498	Y	24.4	Very low	32.1	Very low	199 Å²	199	143.4 Å²	143.4	78%	0.78	74%	0.737	S	S	*	*			trans	-50	110.2	154.1	-77.8	-88.9	0	0	0	107.5	Q496 K500	Q496-Y498 PolarHBondContact O-N 2.99Å; Y498-K500 VanDerWaalsContact C-N 3.25Å; Y498-K500 PolarHBondContact O-N 2.86Å
499	L	23.5	Very low	34.7	Very low	161 Å²	161	137.6 Å²	137.6	84%	0.843	70%	0.697	S	S	*	*			trans	-54.6	93.6	163.1	-72.9	161	0	0	0	107.6	V497	V497-L499 PolarHBondContact O-N 3.04Å
500	K	24.4	Very low	37.4	Very low	181 Å²	181	129.9 Å²	129.9	79%	0.787	66%	0.66	S	S	*	*			trans	-89.3	112.9	163.6	-90.6	-178	175.1	173.4	0	106.7	Y498 N502	Y498-K500 VanDerWaalsContact C-N 3.25Å; Y498-K500 PolarHBondContact O-N 2.86Å; K500-N502 PolarHBondContact O-N 2.86Å
501	D	27.1	Very low	40	Very low	147 Å²	147	123 Å²	123	79%	0.786	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	37.5	178.1	-68.1	-46	0	0	0	115.4
502	N	25.5	Very low	42.4	Very low	154 Å²	154	116 Å²	116	82%	0.824	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	15.5	-172.5	-89.5	-17.5	0	0	0	115.9	K500	K500-N502 PolarHBondContact O-N 2.86Å
503	E	29.2	Very low	44.8	Very low	183 Å²	183	109.5 Å²	109.5	86%	0.855	55%	0.552	S	S	*	*			trans	-100.9	51.3	170.2	-69.5	-175	175.8	0	0	111.9	T505	E503-T505 VanDerWaalsContact C-N 3.26Å; E503-T505 PolarHBondContact O-N 3.21Å
504	F	35.8	Very low	47.2	Very low	162 Å²	162	108.6 Å²	108.6	71%	0.711	54%	0.54	S	S	*	.			trans	-72.9	92.4	156.5	-89.4	-84.8	0	0	0	107.6	D506	F504-D506 PolarHBondContact O-N 3.26Å
505	T	43.9	Very low	49.9	Very low	58 Å²	58	106.8 Å²	106.8	36%	0.356	52%	0.522	S	S	.	.			trans	-28.3	121.8	171.6	50.4	0	0	0	0	113.5	E503 C507	E503-T505 VanDerWaalsContact C-N 3.26Å; E503-T505 PolarHBondContact O-N 3.21Å; T505-C507 PolarHBondContact O-N 2.77Å
506	D	54	Low	52.5	Low	112 Å²	112	101.2 Å²	101.2	60%	0.599	49%	0.49	S	S	*	.			trans	-30.6	91.8	-177	-66.9	-33.6	0	0	0	115.6	F504	F504-D506 PolarHBondContact O-N 3.26Å
507	C	62.7	Low	55	Low	46 Å²	46	94.7 Å²	94.7	31%	0.311	46%	0.46	S	S	.	.			trans	-110.9	102.5	166.5	-173.1	0	0	0	0	109	Y472 T505 L509	Y472-C507 HydrophobicContact CD1-CB 3.98Å; Y472-C507 HydrophobicContact CE1-CB 4.41Å; T505-C507 PolarHBondContact O-N 2.77Å; C507-L509 VanDerWaalsContact C-N 3.29Å; C507-L509 PolarHBondContact O-N 2.96Å
508	H	70.6	Confident	57.6	Low	66 Å²	66	96.5 Å²	96.5	31%	0.306	46%	0.458	S	S	.	.			trans	-84.8	4.1	-177	-57	-70.8	0	0	0	113.8	W510 E511	H508-W510 VanDerWaalsContact C-N 3.32Å; H508-W510 PolarHBondContact O-N 3.5Å; H508-E511 HydrophobicContact CB-CB 4.17Å; H508-E511 WeakPolarHBondContact CB-OE2 3.29Å; H508-E511 IonicContact CE1-OE2 3.34Å; H508-E511 IonicContact CG-OE2 2.89Å; H508-E511 IonicContact ND1-OE2 3Å; H508-E511 PolarHBondContact ND1-OE2 3.22Å; H508-E511 WeakPolarHBondContact O-CA 2.98Å; H508-E511 WeakPolarHBondContact O-CB 3.39Å; H508-E511 PolarHBondContact O-N 2.96Å
509	L	82.3	Confident	60.1	Low	1 Å²	1	94.2 Å²	94.2	1%	0.005	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-41.2	-169.6	-171.3	69	0	0	0	113.8	F45 L48 L296 F424 V447 C507	F45-L509 HydrophobicContact CB-CD1 4.45Å; F45-L509 HydrophobicContact CD1-CD1 4.41Å; F45-L509 WeakPolarHBondContact O-CD1 3.37Å; L48-L509 HydrophobicContact CB-CD1 4.21Å; L296-L509 WeakPolarHBondContact CB-O 3.39Å; L296-L509 HydrophobicContact CD2-CD1 4.12Å; L296-L509 HydrophobicContact CD2-CD2 3.92Å; L296-L509 HydrophobicContact CD2-CG 3.79Å; F424-L509 HydrophobicContact CB-CD2 3.66Å; F424-L509 HydrophobicContact CD1-CD2 3.61Å; F424-L509 HydrophobicContact CD2-CD2 3.51Å; F424-L509 HydrophobicContact CE1-CD2 4.02Å; F424-L509 HydrophobicContact CE2-CD2 3.96Å; F424-L509 HydrophobicContact CG-CD2 3.3Å; F424-L509 HydrophobicContact CZ-CD2 4.18Å; V447-L509 HydrophobicContact CG1-CD2 4.1Å; V447-L509 HydrophobicContact CG2-CB 4.38Å; V447-L509 HydrophobicContact CG2-CD2 4.04Å; C507-L509 VanDerWaalsContact C-N 3.29Å; C507-L509 PolarHBondContact O-N 2.96Å
510	W	82.8	Confident	62.5	Low	14 Å²	14	88.6 Å²	88.6	5%	0.053	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	5.1	176.9	-66.5	115.6	0	0	0	112.7	L296 I300 R422 F424 N445 H508 T512	L296-W510 HydrophobicContact CB-CZ3 4.48Å; L296-W510 HydrophobicContact CD2-CD2 4.45Å; L296-W510 HydrophobicContact CD2-CE3 4.25Å; L296-W510 HydrophobicContact CD2-CH2 3.66Å; L296-W510 HydrophobicContact CD2-CZ2 3.86Å; L296-W510 HydrophobicContact CD2-CZ3 3.87Å; L296-W510 HydrophobicContact CG-CH2 4.26Å; L296-W510 HydrophobicContact CG-CZ3 4.11Å; I300-W510 HydrophobicContact CD1-CH2 4.01Å; I300-W510 HydrophobicContact CD1-CZ3 4.03Å; R422-W510 HydrophobicContact CB-CD2 4.01Å; R422-W510 HydrophobicContact CB-CE3 3.92Å; R422-W510 HydrophobicContact CB-CH2 4.11Å; R422-W510 HydrophobicContact CB-CZ2 4.19Å; R422-W510 HydrophobicContact CB-CZ3 3.96Å; R422-W510 HydrophobicContact CG-CE3 4.21Å; R422-W510 HydrophobicContact CG-CZ3 4.15Å; R422-W510 WeakPolarHBondContact O-CZ2 3.22Å; R422-W510 PolarHBondContact O-NE1 3.42Å; F424-W510 HydrophobicContact CB-CZ2 3.71Å; N445-W510 HydrophobicContact CB-CB 4.3Å; N445-W510 HydrophobicContact CB-CG 4.21Å; H508-W510 VanDerWaalsContact C-N 3.32Å; H508-W510 PolarHBondContact O-N 3.5Å; W510-T512 PolarHBondContact O-N 3.02Å
511	E	78.8	Confident	65	Low	41 Å²	41	82.1 Å²	82.1	19%	0.192	41%	0.406	C	S	.	.			trans	-68.8	116.4	178.6	-165.3	179.3	-173.9	0	0	109.5	H508 D515 R516	H508-E511 HydrophobicContact CB-CB 4.17Å; H508-E511 WeakPolarHBondContact CB-OE2 3.29Å; H508-E511 IonicContact CE1-OE2 3.34Å; H508-E511 IonicContact CG-OE2 2.89Å; H508-E511 IonicContact ND1-OE2 3Å; H508-E511 PolarHBondContact ND1-OE2 3.22Å; H508-E511 WeakPolarHBondContact O-CA 2.98Å; H508-E511 WeakPolarHBondContact O-CB 3.39Å; H508-E511 PolarHBondContact O-N 2.96Å; E511-D515 HydrophobicContact CG-CB 3.42Å; E511-D515 VanDerWaalsContact CG-CB 3.42Å; E511-R516 HydrophobicContact CG-CG 4.2Å; E511-R516 PolarHBondContact O-NH1 3.26Å
512	T	78.2	Confident	67.5	Low	19 Å²	19	81.1 Å²	81.1	12%	0.117	40%	0.395	C	S	.	.			trans	-89.2	167.2	-179.5	61	0	0	0	0	110.6	W510 W514 D515 R516	W510-T512 PolarHBondContact O-N 3.02Å; T512-W514 PolarHBondContact O-N 3.06Å; T512-W514 VanDerWaalsContact O-N 3.12Å; T512-D515 PolarHBondContact N-OD2 3.05Å; T512-D515 PolarHBondContact O-N 2.85Å; T512-D515 PolarHBondContact OG1-OD2 3.32Å; T512-R516 PolarHBondContact O-N 3.24Å
513	A	75.1	Confident	69.8	Low	3 Å²	3	75.5 Å²	75.5	3%	0.025	37%	0.366	C	S	.	.	H	α-helix	trans	-51.7	-33.1	170.9	0	0	0	0	0	112.6	V185 E189 D515 R516 I517	V185-A513 HydrophobicContact CB-CB 4.38Å; V185-A513 HydrophobicContact CG1-CB 3.69Å; E189-A513 HydrophobicContact CB-CB 4.21Å; E189-A513 WeakPolarHBondContact OE2-CA 3.44Å; E189-A513 WeakPolarHBondContact OE2-CB 3.36Å; A513-D515 PolarHBondContact O-N 3.13Å; A513-R516 PolarHBondContact O-N 3.13Å; A513-I517 WeakPolarHBondContact O-CB 3.21Å; A513-I517 WeakPolarHBondContact O-CD1 3.35Å; A513-I517 WeakPolarHBondContact O-CG1 3.08Å; A513-I517 PolarHBondContact O-N 2.97Å
514	W	76	Confident	71.7	Confident	164 Å²	164	68.9 Å²	68.9	62%	0.621	34%	0.337	S	S	*	.	H	α-helix	trans	-59.6	-44.9	174.5	-84.3	119.2	0	0	0	112.9	V185 T512 R516 I517 K518	V185-W514 HydrophobicContact CB-CG 4.44Å; V185-W514 HydrophobicContact CG1-CB 4Å; V185-W514 HydrophobicContact CG1-CD2 3.6Å; V185-W514 HydrophobicContact CG1-CE3 4.48Å; V185-W514 HydrophobicContact CG1-CG 3.32Å; V185-W514 HydrophobicContact CG1-CZ2 4.43Å; V185-W514 VanDerWaalsContact CG1-N 3.33Å; V185-W514 HydrophobicContact CG2-CD2 4.4Å; V185-W514 HydrophobicContact CG2-CG 4.37Å; V185-W514 HydrophobicContact CG2-CZ2 4Å; T512-W514 PolarHBondContact O-N 3.06Å; T512-W514 VanDerWaalsContact O-N 3.12Å; W514-R516 VanDerWaalsContact C-N 3.35Å; W514-I517 PolarHBondContact O-N 3.07Å; W514-K518 VanDerWaalsContact O-CB 3.26Å; W514-K518 WeakPolarHBondContact O-CB 3.31Å; W514-K518 PolarHBondContact O-N 2.93Å
515	D	79.7	Confident	73.5	Confident	69 Å²	69	69.8 Å²	69.8	37%	0.369	34%	0.335	S	S	.	.	H	α-helix	trans	-68.3	-41.1	-175.3	-59.8	-53	0	0	0	109.8	E511 T512 A513 K518 Y519	E511-D515 HydrophobicContact CG-CB 3.42Å; E511-D515 VanDerWaalsContact CG-CB 3.42Å; T512-D515 PolarHBondContact N-OD2 3.05Å; T512-D515 PolarHBondContact O-N 2.85Å; T512-D515 PolarHBondContact OG1-OD2 3.32Å; A513-D515 PolarHBondContact O-N 3.13Å; D515-K518 PolarHBondContact O-N 3.13Å; D515-Y519 WeakPolarHBondContact O-CB 3.43Å; D515-Y519 PolarHBondContact O-N 3.19Å
516	R	79.6	Confident	75	Confident	39 Å²	39	72 Å²	72	15%	0.147	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-47.5	174.2	-69.3	-168.7	-70.3	-83.2	2.7	112.7	R44 E189 E511 T512 A513 W514 K518 Y519 A520	R44-R516 VanDerWaalsContact NH1-CZ 3.31Å; E189-R516 VanDerWaalsContact CD-NE 3.33Å; E189-R516 IonicContact OE1-CZ 3.16Å; E189-R516 IonicContact OE1-NE 2.91Å; E189-R516 PolarHBondContact OE1-NE 2.87Å; E189-R516 IonicContact OE1-NH2 3.14Å; E189-R516 PolarHBondContact OE1-NH2 3.33Å; E189-R516 IonicContact OE2-CZ 3.96Å; E189-R516 VanDerWaalsContact OE2-CZ 3.29Å; E189-R516 IonicContact OE2-NE 2.88Å; E189-R516 PolarHBondContact OE2-NE 3.41Å; E189-R516 VanDerWaalsContact OE2-NE 3.09Å; E189-R516 IonicContact OE2-NH2 3.76Å; E189-R516 PolarHBondContact OE2-NH2 2.76Å; E511-R516 HydrophobicContact CG-CG 4.2Å; E511-R516 PolarHBondContact O-NH1 3.26Å; T512-R516 PolarHBondContact O-N 3.24Å; A513-R516 PolarHBondContact O-N 3.13Å; W514-R516 VanDerWaalsContact C-N 3.35Å; R516-K518 VanDerWaalsContact C-N 3.28Å; R516-K518 PolarHBondContact O-N 3.16Å; R516-Y519 PolarHBondContact O-N 3.18Å; R516-A520 WeakPolarHBondContact O-CB 3.4Å; R516-A520 PolarHBondContact O-N 3.25Å
517	I	76.7	Confident	75.7	Confident	50 Å²	50	74.6 Å²	74.6	26%	0.256	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-42.4	176.6	-69	164.8	0	0	0	110.4	S188 A513 W514 A521	S188-I517 WeakPolarHBondContact OG-CD1 3.49Å; A513-I517 WeakPolarHBondContact O-CB 3.21Å; A513-I517 WeakPolarHBondContact O-CD1 3.35Å; A513-I517 WeakPolarHBondContact O-CG1 3.08Å; A513-I517 PolarHBondContact O-N 2.97Å; W514-I517 PolarHBondContact O-N 3.07Å; I517-A521 VanDerWaalsContact O-CB 3.32Å; I517-A521 WeakPolarHBondContact O-CB 3.25Å; I517-A521 PolarHBondContact O-N 3.49Å
518	K	79.6	Confident	76	Confident	157 Å²	157	77.9 Å²	77.9	68%	0.683	36%	0.355	S	S	*	.	H	α-helix	trans	-66.2	-40.3	177.8	-173.5	-179.8	-179.6	-176.9	0	111.8	W514 D515 R516 K522	W514-K518 VanDerWaalsContact O-CB 3.26Å; W514-K518 WeakPolarHBondContact O-CB 3.31Å; W514-K518 PolarHBondContact O-N 2.93Å; D515-K518 PolarHBondContact O-N 3.13Å; R516-K518 VanDerWaalsContact C-N 3.28Å; R516-K518 PolarHBondContact O-N 3.16Å; K518-K522 WeakPolarHBondContact O-CB 3.31Å; K518-K522 PolarHBondContact O-N 3.13Å
519	Y	77.4	Confident	76	Confident	152 Å²	152	80 Å²	80	60%	0.596	37%	0.368	S	S	*	.	H	α-helix	trans	-64.2	-50.9	175.7	-177.3	-92.7	0	0	0	110.9	D515 R516 A521 K522 T523	D515-Y519 WeakPolarHBondContact O-CB 3.43Å; D515-Y519 PolarHBondContact O-N 3.19Å; R516-Y519 PolarHBondContact O-N 3.18Å; Y519-A521 VanDerWaalsContact C-N 3.34Å; Y519-A521 PolarHBondContact O-N 3.43Å; Y519-K522 WeakPolarHBondContact O-CA 3.21Å; Y519-K522 WeakPolarHBondContact O-CB 3.38Å; Y519-K522 PolarHBondContact O-N 3.38Å; Y519-T523 WeakPolarHBondContact CE1-OG1 3.46Å; Y519-T523 PolarHBondContact O-N 2.65Å; Y519-T523 PolarHBondContact O-OG1 3.13Å
520	A	73.2	Confident	75	Confident	42 Å²	42	85.7 Å²	85.7	35%	0.347	40%	0.395	S	S	.	.	H	α-helix	trans	-54.3	-49.9	176.2	0	0	0	0	0	111.2	R516 K522 T523 L524	R516-A520 WeakPolarHBondContact O-CB 3.4Å; R516-A520 PolarHBondContact O-N 3.25Å; A520-K522 VanDerWaalsContact C-N 3.29Å; A520-K522 PolarHBondContact O-N 3.35Å; A520-T523 PolarHBondContact O-N 3.27Å; A520-L524 WeakPolarHBondContact O-CB 3.4Å; A520-L524 PolarHBondContact O-N 2.99Å
521	A	76.8	Confident	73.7	Confident	45 Å²	45	92.8 Å²	92.8	37%	0.372	43%	0.426	S	S	.	.	H	α-helix	trans	-60.7	-35.8	177	0	0	0	0	0	113.2	I517 Y519 R525	I517-A521 VanDerWaalsContact O-CB 3.32Å; I517-A521 WeakPolarHBondContact O-CB 3.25Å; I517-A521 PolarHBondContact O-N 3.49Å; Y519-A521 VanDerWaalsContact C-N 3.34Å; Y519-A521 PolarHBondContact O-N 3.43Å; A521-R525 VanDerWaalsContact O-CG 3.3Å; A521-R525 WeakPolarHBondContact O-CG 3.46Å; A521-R525 PolarHBondContact O-N 3.01Å; A521-R525 VanDerWaalsContact O-N 3.11Å
522	K	79.7	Confident	72.4	Confident	127 Å²	127	92.9 Å²	92.9	55%	0.552	43%	0.432	S	S	*	.	H	α-helix	trans	-67.7	-46.7	175.7	-176.5	-175	175.4	-170.4	0	111.2	K518 Y519 A520 L524 R525 Q526	K518-K522 WeakPolarHBondContact O-CB 3.31Å; K518-K522 PolarHBondContact O-N 3.13Å; Y519-K522 WeakPolarHBondContact O-CA 3.21Å; Y519-K522 WeakPolarHBondContact O-CB 3.38Å; Y519-K522 PolarHBondContact O-N 3.38Å; A520-K522 VanDerWaalsContact C-N 3.29Å; A520-K522 PolarHBondContact O-N 3.35Å; K522-L524 VanDerWaalsContact C-N 3.31Å; K522-L524 PolarHBondContact O-N 2.86Å; K522-R525 PolarHBondContact O-N 3.3Å; K522-Q526 WeakPolarHBondContact O-CG 3.26Å; K522-Q526 PolarHBondContact O-N 3.14Å
523	T	74.3	Confident	70.9	Confident	35 Å²	35	95.3 Å²	95.3	22%	0.215	45%	0.449	C	S	.	.	H	α-helix	trans	-63.3	-39.3	178.7	-51.8	0	0	0	0	111.1	Y519 A520 Q526 R527	Y519-T523 WeakPolarHBondContact CE1-OG1 3.46Å; Y519-T523 PolarHBondContact O-N 2.65Å; Y519-T523 PolarHBondContact O-OG1 3.13Å; A520-T523 PolarHBondContact O-N 3.27Å; T523-Q526 WeakPolarHBondContact O-CB 3.47Å; T523-Q526 PolarHBondContact O-N 3.22Å; T523-R527 PolarHBondContact O-N 3.29Å
524	L	68	Low	69.5	Low	45 Å²	45	102.6 Å²	102.6	24%	0.236	48%	0.482	C	S	.	.	H	α-helix	trans	-64.3	-43.7	176.5	-133.8	147.1	0	0	0	111.7	A520 K522 Q526 R527 M528	A520-L524 WeakPolarHBondContact O-CB 3.4Å; A520-L524 PolarHBondContact O-N 2.99Å; K522-L524 VanDerWaalsContact C-N 3.31Å; K522-L524 PolarHBondContact O-N 2.86Å; L524-Q526 VanDerWaalsContact C-N 3.31Å; L524-Q526 PolarHBondContact O-N 3.36Å; L524-R527 PolarHBondContact O-N 3.41Å; L524-M528 HydrophobicContact CD2-CE 3.76Å; L524-M528 PolarHBondContact O-N 3.12Å
525	R	74.7	Confident	67.8	Low	181 Å²	181	98.7 Å²	98.7	68%	0.683	48%	0.48	S	S	*	.	H	α-helix	trans	-61.4	-38.7	172.8	-74	174.9	-175	-172.8	1.9	112.4	A521 K522 N529	A521-R525 VanDerWaalsContact O-CG 3.3Å; A521-R525 WeakPolarHBondContact O-CG 3.46Å; A521-R525 PolarHBondContact O-N 3.01Å; A521-R525 VanDerWaalsContact O-N 3.11Å; K522-R525 PolarHBondContact O-N 3.3Å; R525-N529 WeakPolarHBondContact O-CB 3.44Å; R525-N529 VanDerWaalsContact O-CG 3.24Å; R525-N529 PolarHBondContact O-N 3.48Å
526	Q	74	Confident	65.7	Low	103 Å²	103	104.2 Å²	104.2	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-64.8	-43.3	175.6	-73.4	177	-20.3	0	0	111.5	K522 T523 L524 N529 Q530	K522-Q526 WeakPolarHBondContact O-CG 3.26Å; K522-Q526 PolarHBondContact O-N 3.14Å; T523-Q526 WeakPolarHBondContact O-CB 3.47Å; T523-Q526 PolarHBondContact O-N 3.22Å; L524-Q526 VanDerWaalsContact C-N 3.31Å; L524-Q526 PolarHBondContact O-N 3.36Å; Q526-N529 PolarHBondContact O-N 3.07Å; Q526-Q530 WeakPolarHBondContact O-CG 3.35Å; Q526-Q530 PolarHBondContact O-N 3Å
527	R	69.8	Low	63.5	Low	168 Å²	168	107.6 Å²	107.6	63%	0.634	52%	0.521	S	S	*	.	H	α-helix	trans	-63.1	-43.7	174.8	-76.2	-177.2	176	174.5	-1.2	112.5	T523 L524 N529 Q530 K531	T523-R527 PolarHBondContact O-N 3.29Å; L524-R527 PolarHBondContact O-N 3.41Å; R527-N529 VanDerWaalsContact C-N 3.35Å; R527-N529 PolarHBondContact O-N 3.14Å; R527-Q530 PolarHBondContact O-N 3.05Å; R527-K531 PolarHBondContact O-N 3.14Å
528	M	67.8	Low	61.5	Low	115 Å²	115	109.7 Å²	109.7	57%	0.567	54%	0.54	S	S	*	.	H	α-helix	trans	-60.9	-43.8	174.9	-80	-177.8	-179.3	0	0	111.7	L524 Q530 K531 S532	L524-M528 HydrophobicContact CD2-CE 3.76Å; L524-M528 PolarHBondContact O-N 3.12Å; M528-Q530 VanDerWaalsContact C-N 3.34Å; M528-Q530 PolarHBondContact O-N 3.16Å; M528-K531 PolarHBondContact O-N 3.4Å; M528-S532 WeakPolarHBondContact O-CB 3.47Å; M528-S532 PolarHBondContact O-N 2.79Å
529	N	71.2	Confident	59.1	Low	110 Å²	110	109.4 Å²	109.4	59%	0.588	55%	0.546	S	S	*	.	H	α-helix	trans	-63.3	-40.5	176.8	-73.8	-10	0	0	0	111.6	R525 Q526 R527 S532 S533	R525-N529 WeakPolarHBondContact O-CB 3.44Å; R525-N529 VanDerWaalsContact O-CG 3.24Å; R525-N529 PolarHBondContact O-N 3.48Å; Q526-N529 PolarHBondContact O-N 3.07Å; R527-N529 VanDerWaalsContact C-N 3.35Å; R527-N529 PolarHBondContact O-N 3.14Å; N529-S532 PolarHBondContact O-N 2.67Å; N529-S532 PolarHBondContact O-OG 3.17Å; N529-S533 PolarHBondContact O-N 3Å; N529-S533 PolarHBondContact O-OG 3.38Å
530	Q	61.4	Low	57	Low	120 Å²	120	109.7 Å²	109.7	56%	0.561	56%	0.556	S	S	*	*	H	α-helix	trans	-65.9	-40.2	175.4	-75.8	177.5	-6	0	0	112.9	Q526 R527 M528 S532 S533 H534	Q526-Q530 WeakPolarHBondContact O-CG 3.35Å; Q526-Q530 PolarHBondContact O-N 3Å; R527-Q530 PolarHBondContact O-N 3.05Å; M528-Q530 VanDerWaalsContact C-N 3.34Å; M528-Q530 PolarHBondContact O-N 3.16Å; Q530-S532 VanDerWaalsContact C-N 3.33Å; Q530-S533 WeakPolarHBondContact CA-OG 3.15Å; Q530-S533 PolarHBondContact O-N 2.86Å; Q530-S533 PolarHBondContact O-OG 3.4Å; Q530-H534 PolarHBondContact O-N 2.99Å; Q530-H534 PolarHBondContact O-ND1 2.85Å
531	K	56.2	Low	54.8	Low	163 Å²	163	117.9 Å²	117.9	71%	0.709	58%	0.578	S	S	*	*	H	α-helix	trans	-63.2	-40.6	173.3	-75.8	-174.5	176.5	-175.4	0	111.1	R527 M528 S533 H534 S535	R527-K531 PolarHBondContact O-N 3.14Å; M528-K531 PolarHBondContact O-N 3.4Å; K531-S533 VanDerWaalsContact C-N 3.31Å; K531-S533 PolarHBondContact O-N 3.17Å; K531-H534 PolarHBondContact O-N 2.9Å; K531-S535 PolarHBondContact O-N 3.34Å; K531-S535 PolarHBondContact O-OG 3.34Å
532	S	52	Low	52.4	Low	44 Å²	44	122.3 Å²	122.3	31%	0.308	60%	0.604	S	S	.	*	H	α-helix	trans	-67.6	-26.8	176.4	83.8	0	0	0	0	113.8	M528 N529 Q530 S535 R536	M528-S532 WeakPolarHBondContact O-CB 3.47Å; M528-S532 PolarHBondContact O-N 2.79Å; N529-S532 PolarHBondContact O-N 2.67Å; N529-S532 PolarHBondContact O-OG 3.17Å; Q530-S532 VanDerWaalsContact C-N 3.33Å; S532-S535 WeakPolarHBondContact CA-OG 3.5Å; S532-R536 WeakPolarHBondContact O-CD 3.5Å; S532-R536 VanDerWaalsContact O-CG 3.24Å; S532-R536 WeakPolarHBondContact O-CG 3.06Å
533	S	46.4	Very low	49.8	Very low	69 Å²	69	120.8 Å²	120.8	48%	0.483	61%	0.61	S	S	.	*	H	α-helix	trans	-81.8	-25.7	177.2	56.3	0	0	0	0	113.2	N529 Q530 K531	N529-S533 PolarHBondContact O-N 3Å; N529-S533 PolarHBondContact O-OG 3.38Å; Q530-S533 WeakPolarHBondContact CA-OG 3.15Å; Q530-S533 PolarHBondContact O-N 2.86Å; Q530-S533 PolarHBondContact O-OG 3.4Å; K531-S533 VanDerWaalsContact C-N 3.31Å; K531-S533 PolarHBondContact O-N 3.17Å
534	H	45.9	Very low	47.8	Very low	156 Å²	156	128.1 Å²	128.1	72%	0.722	64%	0.639	S	S	*	*	H	α-helix	trans	-81.9	-18.8	173.5	-71.7	77.3	0	0	0	113.2	Q530 K531	Q530-H534 PolarHBondContact O-N 2.99Å; Q530-H534 PolarHBondContact O-ND1 2.85Å; K531-H534 PolarHBondContact O-N 2.9Å
535	S	39.3	Very low	45.9	Very low	82 Å²	82	131.2 Å²	131.2	57%	0.573	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	9.6	175.6	36.1	0	0	0	0	113.8	K531 S532	K531-S535 PolarHBondContact O-N 3.34Å; K531-S535 PolarHBondContact O-OG 3.34Å; S532-S535 WeakPolarHBondContact CA-OG 3.5Å
536	R	34.8	Very low	43.8	Very low	186 Å²	186	128.2 Å²	128.2	70%	0.702	67%	0.671	S	S	*	*			trans	-98.3	16.4	-179	-87.2	176.2	-179.7	-169.3	1.5	115.5	S532	S532-R536 WeakPolarHBondContact O-CD 3.5Å; S532-R536 VanDerWaalsContact O-CG 3.24Å; S532-R536 WeakPolarHBondContact O-CG 3.06Å
537	T	33.6	Very low	41.6	Very low	109 Å²	109	133.1 Å²	133.1	67%	0.669	69%	0.691	S	S	*	*	S	Bend	trans	-105.2	56.1	169.6	64.1	0	0	0	0	111
538	S	34.8	Very low	39.5	Very low	94 Å²	94	131 Å²	131	66%	0.657	70%	0.699	S	S	*	*			trans	-166	49	162.1	63.1	0	0	0	0	110.5
539	D	29.4	Very low	37.7	Very low	151 Å²	151	137 Å²	137	81%	0.807	72%	0.715	S	S	*	*			trans	-117.4	61.6	162.1	-82.1	-34.8	0	0	0	108.2	R541	D539-R541 PolarHBondContact O-N 3.45Å
540	I	33.7	Very low	35.5	Very low	158 Å²	158	143.2 Å²	143.2	81%	0.81	73%	0.73	S	S	*	*			trans	-79.9	104.3	165.5	-68	173.6	0	0	0	107.4	C542	I540-C542 PolarHBondContact O-N 3Å
541	R	27.8	Very low	33.9	Very low	215 Å²	215	146.4 Å²	146.4	81%	0.811	75%	0.747	S	S	*	*			trans	29.4	77.9	143.5	-64.6	179.8	179.3	173.7	0.7	116	D539 S543	D539-R541 PolarHBondContact O-N 3.45Å; R541-S543 PolarHBondContact O-N 3.08Å
542	C	26.1	Very low	32.4	Very low	137 Å²	137	142.6 Å²	142.6	93%	0.926	75%	0.746	S	S	*	*			trans	-86.3	69.3	148.9	-152.4	0	0	0	0	109	I540 K544	I540-C542 PolarHBondContact O-N 3Å; C542-K544 PolarHBondContact O-N 3.46Å
543	S	25.4	Very low	31.2	Very low	95 Å²	95	145.6 Å²	145.6	66%	0.664	77%	0.767	S	S	*	*			trans	-89.2	92.7	165.7	52.1	0	0	0	0	108.5	R541	R541-S543 PolarHBondContact O-N 3.08Å
544	K	32	Very low	30.4	Very low	190 Å²	190	151.1 Å²	151.1	83%	0.826	79%	0.786	S	S	*	*			trans	-161	108.4	152.8	-103.2	165.5	-166	-176.6	0	110.5	C542	C542-K544 PolarHBondContact O-N 3.46Å
545	S	27.4	Very low	29.6	Very low	109 Å²	109	150.9 Å²	150.9	76%	0.762	79%	0.788	S	S	*	*			trans	45.2	106.3	146.6	62.7	0	0	0	0	119.9
546	S	31.5	Very low	29.2	Very low	119 Å²	119	154.7 Å²	154.7	83%	0.832	80%	0.802	S	S	*	*				179.6	129.8	102.2	47.3	0	0	0	0	110.2
547	K	26.4	Very low	28.9	Very low	205 Å²	205	152.4 Å²	152.4	89%	0.891	80%	0.804	S	S	*	*			trans	-74.2	143.1	175.7	-70.8	168.3	173.2	170.2	0	109.5
548	P	27.7	Very low	28.8	Very low	124 Å²	124	152.9 Å²	152.9	81%	0.805	81%	0.812	S	S	*	*			trans	-104.6	123.6	144.7	25.4	-11.9	0	0	0	109.7
549	R	29.9	Very low	28.5	Very low	240 Å²	240	156.2 Å²	156.2	91%	0.906	82%	0.822	S	S	*	*			trans	-67.4	127.5	167.8	-101.1	175.4	165.5	172.3	-5	108.8
550	R	23.3	Very low	28.5	Very low	242 Å²	242	152.4 Å²	152.4	91%	0.913	82%	0.818	S	S	*	*			trans	-60.1	129.5	155.7	-81.7	176.5	168.5	168.2	-3.7	109.4
551	M	28	Very low	28.3	Very low	186 Å²	186	152 Å²	152	92%	0.916	82%	0.818	S	S	*	*			trans	-137.2	139	144.7	-84.5	-62.3	-122.6	0	0	108.2
552	A	26.1	Very low	28.2	Very low	83 Å²	83	148.5 Å²	148.5	69%	0.686	81%	0.814	S	S	*	*			trans	-85.8	161.5	-177.3	0	0	0	0	0	111.7
553	S	25.7	Very low	28.2	Very low	107 Å²	107	149.9 Å²	149.9	75%	0.748	81%	0.807	S	S	*	*			trans	68	136.1	150.4	76.4	0	0	0	0	115.9
554	E	30.3	Very low	28.2	Very low	186 Å²	186	153.3 Å²	153.3	87%	0.869	81%	0.813	S	S	*	*			cis	-153.7	165.5	24.6	-70.6	179.3	147.9	0	0	110.1
555	I	28.8	Very low	28.1	Very low	150 Å²	150	153 Å²	153	77%	0.769	81%	0.814	S	S	*	*			trans	-71	136.7	172.4	-66.5	150.4	0	0	0	109.4
556	D	30.7	Very low	28	Very low	162 Å²	162	155.4 Å²	155.4	87%	0.866	82%	0.818	S	S	*	*			trans	-150.1	136.8	144.3	-146.5	0.2	0	0	0	110.6
557	D	27.8	Very low	27.8	Very low	139 Å²	139	158.8 Å²	158.8	74%	0.743	82%	0.817	S	S	*	*			trans	-83.5	155.1	-171.7	-73	-54.7	0	0	0	112
558	S	32.5	Very low	27.8	Very low	119 Å²	119	155.3 Å²	155.3	83%	0.832	81%	0.808	S	S	*	*				162.1	135.2	122.4	-174.8	0	0	0	0	113.3
559	D	27.6	Very low	27.7	Very low	163 Å²	163	156.3 Å²	156.3	87%	0.872	81%	0.812	S	S	*	*			trans	-53.9	160.9	178.2	-64.8	-51	0	0	0	117.8
560	G	29.9	Very low	27.7	Very low	71 Å²	71	149.5 Å²	149.5	73%	0.732	80%	0.802	S	S	*	*			trans	156.1	88.8	150.1	0	0	0	0	0	118.7
561	D	29	Very low	27.9	Very low	150 Å²	150	145.8 Å²	145.8	80%	0.802	79%	0.792	S	S	*	*			trans	58.7	120	139.1	-69	-24.4	0	0	0	125.3
562	L	27	Very low	27.9	Very low	141 Å²	141	143.4 Å²	143.4	74%	0.738	79%	0.788	S	S	*	*				68.7	116.5	125.6	-61.6	170.8	0	0	0	123.3
563	E	24.4	Very low	27.9	Very low	167 Å²	167	146.5 Å²	146.5	78%	0.78	79%	0.788	S	S	*	*			trans	85.6	124.8	136.4	-71.1	-173.1	178.3	0	0	122.9
564	H	25.5	Very low	28	Very low	167 Å²	167	145.9 Å²	145.9	77%	0.773	78%	0.784	S	S	*	*			trans	68.2	99.9	154.1	-94.4	-75.9	0	0	0	119.2
565	Q	30.4	Very low	27.9	Very low	184 Å²	184	145 Å²	145	86%	0.86	79%	0.785	S	S	*	*				-171.9	120.3	122.4	-102.4	161.7	67.1	0	0	112.7
566	L	24.7	Very low	28	Very low	159 Å²	159	140.5 Å²	140.5	83%	0.832	78%	0.776	S	S	*	*			trans	10.7	113.8	138.6	-63.7	157.4	0	0	0	116
567	K	27.7	Very low	28.2	Very low	189 Å²	189	139.7 Å²	139.7	82%	0.822	77%	0.772	S	S	*	*			trans	-175.3	126.3	136.2	-104	166.4	-180	-177.5	0	112.6
568	D	27.2	Very low	29	Very low	132 Å²	132	140.7 Å²	140.7	71%	0.706	78%	0.777	S	S	*	*			trans	63.1	72.6	142.8	-52	-25.9	0	0	0	118.7	S570	D568-S570 PolarHBondContact O-N 2.9Å
569	T	26	Very low	29.9	Very low	145 Å²	145	143.3 Å²	143.3	89%	0.89	78%	0.776	S	S	*	*			trans	-77.6	80.4	141.4	54.1	0	0	0	0	107.9	K571	T569-K571 PolarHBondContact O-N 3.48Å; T569-K571 VanDerWaalsContact O-N 3.13Å
570	S	28.7	Very low	31.5	Very low	98 Å²	98	139.9 Å²	139.9	69%	0.685	76%	0.755	S	S	*	*			trans	-65.8	110.7	165.1	51.6	0	0	0	0	107.9	D568 T572	D568-S570 PolarHBondContact O-N 2.9Å; S570-T572 PolarHBondContact O-N 2.96Å; S570-T572 VanDerWaalsContact O-N 3.07Å
571	K	27.3	Very low	33.3	Very low	163 Å²	163	139.8 Å²	139.8	71%	0.709	74%	0.743	S	S	*	*			trans	-22.5	108.5	156	-73.1	169	153.6	-149.1	0	111.1	T569 E573	T569-K571 PolarHBondContact O-N 3.48Å; T569-K571 VanDerWaalsContact O-N 3.13Å; K571-E573 HydrophobicContact CB-CG 4.27Å; K571-E573 WeakPolarHBondContact CD-OE1 3.33Å; K571-E573 WeakPolarHBondContact CE-OE1 3.35Å; K571-E573 IonicContact NZ-OE1 2.59Å; K571-E573 PolarHBondContact NZ-OE1 3.46Å; K571-E573 PolarHBondContact O-N 3.22Å; K571-E573 VanDerWaalsContact O-N 3.09Å
572	T	29.1	Very low	35.4	Very low	136 Å²	136	138.2 Å²	138.2	83%	0.834	73%	0.731	S	S	*	*			trans	-80.9	72.9	155.8	-33.6	0	0	0	0	105.7	S570 S574	S570-T572 PolarHBondContact O-N 2.96Å; S570-T572 VanDerWaalsContact O-N 3.07Å; T572-S574 PolarHBondContact O-N 3.39Å; T572-S574 VanDerWaalsContact O-N 3.16Å
573	E	25.1	Very low	37.9	Very low	148 Å²	148	135.1 Å²	135.1	69%	0.692	72%	0.721	S	S	*	*			trans	-68.2	95.6	153.2	-78.3	169.2	-167.1	0	0	104.6	K571	K571-E573 HydrophobicContact CB-CG 4.27Å; K571-E573 WeakPolarHBondContact CD-OE1 3.33Å; K571-E573 WeakPolarHBondContact CE-OE1 3.35Å; K571-E573 IonicContact NZ-OE1 2.59Å; K571-E573 PolarHBondContact NZ-OE1 3.46Å; K571-E573 PolarHBondContact O-N 3.22Å; K571-E573 VanDerWaalsContact O-N 3.09Å
574	S	28.9	Very low	40.7	Very low	94 Å²	94	131.6 Å²	131.6	66%	0.657	70%	0.703	S	S	*	*			trans	-127.7	53.3	165.4	179.4	0	0	0	0	107.1	T572 G576	T572-S574 PolarHBondContact O-N 3.39Å; T572-S574 VanDerWaalsContact O-N 3.16Å; S574-G576 PolarHBondContact O-N 2.64Å
575	D	28	Very low	43.4	Very low	168 Å²	168	124.3 Å²	124.3	90%	0.898	67%	0.669	S	S	*	*			trans	-71.5	80.9	140.5	-83.2	-22.3	0	0	0	105.2
576	G	31.6	Very low	46	Very low	55 Å²	55	116 Å²	116	57%	0.567	63%	0.631	S	S	*	*			trans	-95.6	100.5	160.8	0	0	0	0	0	104.8	S574 D578	S574-G576 PolarHBondContact O-N 2.64Å; G576-D578 PolarHBondContact O-N 3.46Å
577	D	34.2	Very low	48.9	Very low	146 Å²	146	111.1 Å²	111.1	78%	0.781	61%	0.608	S	S	*	*			trans	-42	129.4	165.9	-82.7	-43.7	0	0	0	108.5	E579	D577-E579 PolarHBondContact O-N 3.06Å
578	D	44.4	Very low	51.8	Low	159 Å²	159	104 Å²	104	85%	0.85	58%	0.578	S	S	*	*			trans	-65.7	63.8	171.4	-75.5	-49.3	0	0	0	109.4	G576 Q580	G576-D578 PolarHBondContact O-N 3.46Å; D578-Q580 VanDerWaalsContact C-N 3.26Å; D578-Q580 PolarHBondContact O-N 3.23Å
579	E	50.8	Low	54.6	Low	175 Å²	175	97.8 Å²	97.8	82%	0.818	54%	0.544	S	S	*	.			trans	-67.3	93.1	164.5	-77.7	-173.8	170.6	0	0	106.6	D577 S581	D577-E579 PolarHBondContact O-N 3.06Å; E579-S581 PolarHBondContact O-N 3.1Å; E579-S581 VanDerWaalsContact O-N 3.11Å
580	Q	60.9	Low	57.6	Low	91 Å²	91	92 Å²	92	43%	0.425	51%	0.507	S	S	.	.			trans	-54	121.1	175.3	-61.2	-177.7	11	0	0	108.4	D578 E582 F584	D578-Q580 VanDerWaalsContact C-N 3.26Å; D578-Q580 PolarHBondContact O-N 3.23Å; Q580-E582 PolarHBondContact O-N 2.95Å; Q580-F584 HydrophobicContact CB-CD1 4.43Å
581	S	68.9	Low	60.4	Low	69 Å²	69	92.5 Å²	92.5	48%	0.483	49%	0.494	S	S	.	.			trans	-53.6	135.4	-174.1	57	0	0	0	0	110.9	E579 S583 F584	E579-S581 PolarHBondContact O-N 3.1Å; E579-S581 VanDerWaalsContact O-N 3.11Å; S581-S583 PolarHBondContact O-N 3.05Å; S581-S583 PolarHBondContact OG-OG 2.99Å; S581-F584 WeakPolarHBondContact O-CA 3.4Å; S581-F584 VanDerWaalsContact O-CB 3.29Å; S581-F584 WeakPolarHBondContact O-CB 3.34Å; S581-F584 PolarHBondContact O-N 3.01Å
582	E	73.7	Confident	63.3	Low	117 Å²	117	84.8 Å²	84.8	55%	0.547	46%	0.46	S	S	.	.	H	α-helix	trans	-47	-35.2	179.2	-66.1	178.1	-176.8	0	0	113.4	Q580 F584 I585 I586 L627	Q580-E582 PolarHBondContact O-N 2.95Å; E582-F584 VanDerWaalsContact C-N 3.31Å; E582-F584 PolarHBondContact O-N 3.3Å; E582-I585 PolarHBondContact O-N 2.77Å; E582-I586 VanDerWaalsContact O-CG1 3.26Å; E582-I586 WeakPolarHBondContact O-CG1 3.34Å; E582-I586 PolarHBondContact O-N 3.29Å; E582-L627 HydrophobicContact CB-CD2 3.94Å; E582-L627 HydrophobicContact CG-CD2 4.24Å
583	S	78.5	Confident	66	Low	75 Å²	75	78.5 Å²	78.5	52%	0.524	42%	0.422	S	S	.	.	H	α-helix	trans	-61.6	-33.4	176.3	61.7	0	0	0	0	114	S581 T587	S581-S583 PolarHBondContact O-N 3.05Å; S581-S583 PolarHBondContact OG-OG 2.99Å; S583-T587 WeakPolarHBondContact O-CB 3.37Å; S583-T587 PolarHBondContact O-N 2.81Å; S583-T587 VanDerWaalsContact O-N 3.07Å; S583-T587 PolarHBondContact O-OG1 3.27Å
584	F	82.4	Confident	69	Low	94 Å²	94	73.5 Å²	73.5	41%	0.412	40%	0.398	S	S	.	.	H	α-helix	trans	-69.1	-45	175.4	178	-100.2	0	0	0	110.6	Q580 S581 E582 T587 E588 Y617	Q580-F584 HydrophobicContact CB-CD1 4.43Å; S581-F584 WeakPolarHBondContact O-CA 3.4Å; S581-F584 VanDerWaalsContact O-CB 3.29Å; S581-F584 WeakPolarHBondContact O-CB 3.34Å; S581-F584 PolarHBondContact O-N 3.01Å; E582-F584 VanDerWaalsContact C-N 3.31Å; E582-F584 PolarHBondContact O-N 3.3Å; F584-T587 WeakPolarHBondContact O-CB 3.39Å; F584-T587 PolarHBondContact O-N 3.46Å; F584-E588 PolarHBondContact O-N 3.07Å; F584-Y617 HydrophobicContact CE1-CE1 4.07Å; F584-Y617 AromaticContact CE1-CZ 3.93Å
585	I	83.3	Confident	71.6	Confident	13 Å²	13	74 Å²	74	7%	0.067	39%	0.386	C	S	.	.	H	α-helix	trans	-64.5	-43.9	178.8	-59.4	172.7	0	0	0	110.4	E582 T587 E588 L589 Y617 V619 L627	E582-I585 PolarHBondContact O-N 2.77Å; I585-T587 VanDerWaalsContact C-N 3.3Å; I585-T587 PolarHBondContact O-N 3.25Å; I585-E588 PolarHBondContact O-N 2.78Å; I585-L589 HydrophobicContact CG2-CD1 3.92Å; I585-L589 HydrophobicContact CG2-CG 4.31Å; I585-L589 WeakPolarHBondContact O-CB 3.14Å; I585-L589 WeakPolarHBondContact O-CG 3.4Å; I585-L589 PolarHBondContact O-N 3.15Å; I585-Y617 HydrophobicContact CG1-CD2 4.26Å; I585-Y617 HydrophobicContact CG1-CG 4.34Å; I585-Y617 HydrophobicContact CG2-CD2 4.33Å; I585-V619 HydrophobicContact CD1-CG2 3.93Å; I585-L627 HydrophobicContact CB-CD1 4.44Å; I585-L627 HydrophobicContact CD1-CD1 4.49Å; I585-L627 HydrophobicContact CG2-CD1 4.01Å
586	I	84.4	Confident	74.2	Confident	9 Å²	9	66.3 Å²	66.3	5%	0.046	35%	0.346	C	S	.	.	H	α-helix	trans	-58.2	-44.5	174.9	-68.5	164.5	0	0	0	110.6	E582 E588 L589 K590 L627 K630 A631 E634	E582-I586 VanDerWaalsContact O-CG1 3.26Å; E582-I586 WeakPolarHBondContact O-CG1 3.34Å; E582-I586 PolarHBondContact O-N 3.29Å; I586-E588 PolarHBondContact O-N 3.26Å; I586-L589 PolarHBondContact O-N 3.05Å; I586-K590 WeakPolarHBondContact O-CB 3.28Å; I586-K590 PolarHBondContact O-N 3.48Å; I586-L627 HydrophobicContact CD1-CD2 3.84Å; I586-L627 HydrophobicContact CG1-CB 4.37Å; I586-L627 HydrophobicContact CG1-CD2 3.76Å; I586-K630 HydrophobicContact CD1-CB 4.17Å; I586-K630 HydrophobicContact CD1-CD 3.85Å; I586-K630 HydrophobicContact CG1-CB 4.39Å; I586-A631 HydrophobicContact CG2-CB 4.15Å; I586-E634 WeakPolarHBondContact CG2-OE2 3.48Å
587	T	86.5	Confident	76.6	Confident	57 Å²	57	66 Å²	66	35%	0.35	33%	0.329	S	S	.	.	H	α-helix	trans	-63.1	-41.1	178.9	-57.8	0	0	0	0	111.9	S583 F584 I585 R591	S583-T587 WeakPolarHBondContact O-CB 3.37Å; S583-T587 PolarHBondContact O-N 2.81Å; S583-T587 VanDerWaalsContact O-N 3.07Å; S583-T587 PolarHBondContact O-OG1 3.27Å; F584-T587 WeakPolarHBondContact O-CB 3.39Å; F584-T587 PolarHBondContact O-N 3.46Å; I585-T587 VanDerWaalsContact C-N 3.3Å; I585-T587 PolarHBondContact O-N 3.25Å; T587-R591 WeakPolarHBondContact O-CG 3.38Å; T587-R591 PolarHBondContact O-N 3.29Å
588	E	87.5	Confident	78.8	Confident	40 Å²	40	68.2 Å²	68.2	19%	0.187	33%	0.327	C	S	.	.	H	α-helix	trans	-73.7	-38.6	-179.1	-163.5	59.8	-159.4	0	0	112.4	F584 I585 I586 R591 T592 L613 Y617	F584-E588 PolarHBondContact O-N 3.07Å; I585-E588 PolarHBondContact O-N 2.78Å; I586-E588 PolarHBondContact O-N 3.26Å; E588-R591 PolarHBondContact O-N 3.04Å; E588-R591 IonicContact OE2-NH1 3.59Å; E588-R591 PolarHBondContact OE2-NH1 3.19Å; E588-T592 WeakPolarHBondContact O-CB 3.49Å; E588-T592 PolarHBondContact O-N 2.69Å; E588-T592 PolarHBondContact O-OG1 3.34Å; E588-L613 HydrophobicContact CG-CD1 4.46Å; E588-L613 HydrophobicContact CG-CD2 4.04Å; E588-Y617 HydrophobicContact CG-CE2 4.45Å
589	L	87.4	Confident	80.5	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-60.7	-46.7	170.9	-74.6	172.1	0	0	0	110.8	I585 I586 R591 T592 L593 V610 L613 F624 L627 L628 A631	I585-L589 HydrophobicContact CG2-CD1 3.92Å; I585-L589 HydrophobicContact CG2-CG 4.31Å; I585-L589 WeakPolarHBondContact O-CB 3.14Å; I585-L589 WeakPolarHBondContact O-CG 3.4Å; I585-L589 PolarHBondContact O-N 3.15Å; I586-L589 PolarHBondContact O-N 3.05Å; L589-R591 PolarHBondContact O-N 2.91Å; L589-T592 WeakPolarHBondContact O-CB 3.42Å; L589-T592 PolarHBondContact O-N 3.11Å; L589-T592 VanDerWaalsContact O-N 3.13Å; L589-L593 WeakPolarHBondContact O-CG 3.44Å; L589-L593 PolarHBondContact O-N 2.89Å; L589-V610 HydrophobicContact CD2-CG1 4.38Å; L589-L613 HydrophobicContact CD2-CB 4.23Å; L589-L613 HydrophobicContact CD2-CD1 3.83Å; L589-F624 HydrophobicContact CD1-CE2 4.26Å; L589-F624 HydrophobicContact CD2-CE2 3.98Å; L589-F624 HydrophobicContact CD2-CZ 4.19Å; L589-L627 HydrophobicContact CD1-CB 4.18Å; L589-L628 HydrophobicContact CD2-CD1 4.33Å; L589-A631 HydrophobicContact CB-CB 3.78Å
590	K	88.9	Confident	81.8	Confident	24 Å²	24	67 Å²	67	10%	0.104	31%	0.313	C	S	.	.	H	α-helix	trans	-57.5	-48.7	176	173.6	176.1	172.5	174.3	0	112	I586 T592 L593 E594 A631 E634 L635 D638	I586-K590 WeakPolarHBondContact O-CB 3.28Å; I586-K590 PolarHBondContact O-N 3.48Å; K590-T592 PolarHBondContact O-N 3.4Å; K590-L593 PolarHBondContact O-N 3.32Å; K590-E594 WeakPolarHBondContact CE-OE1 3.27Å; K590-E594 HydrophobicContact CG-CG 4.44Å; K590-E594 WeakPolarHBondContact O-CG 3.29Å; K590-E594 PolarHBondContact O-N 3.4Å; K590-A631 HydrophobicContact CB-CB 4.25Å; K590-E634 HydrophobicContact CD-CB 4.03Å; K590-E634 PolarHBondContact NZ-O 3.13Å; K590-L635 HydrophobicContact CG-CB 4.25Å; K590-D638 VanDerWaalsContact CE-OD2 3.23Å; K590-D638 WeakPolarHBondContact CE-OD2 3.35Å; K590-D638 IonicContact NZ-OD1 2.74Å; K590-D638 PolarHBondContact NZ-OD1 2.93Å; K590-D638 IonicContact NZ-OD2 2.67Å; K590-D638 PolarHBondContact NZ-OD2 3.16Å
591	R	87.2	Confident	82.6	Confident	108 Å²	108	67.2 Å²	67.2	41%	0.408	31%	0.311	S	S	.	.	H	α-helix	trans	-59.5	-33.6	176.7	-77.3	174.1	177.3	172.3	0.4	112.9	T587 E588 L589 R595	T587-R591 WeakPolarHBondContact O-CG 3.38Å; T587-R591 PolarHBondContact O-N 3.29Å; E588-R591 PolarHBondContact O-N 3.04Å; E588-R591 IonicContact OE2-NH1 3.59Å; E588-R591 PolarHBondContact OE2-NH1 3.19Å; L589-R591 PolarHBondContact O-N 2.91Å; R591-R595 WeakPolarHBondContact O-CB 3.24Å; R591-R595 VanDerWaalsContact O-CG 3.29Å; R591-R595 WeakPolarHBondContact O-CG 3.46Å; R591-R595 PolarHBondContact O-N 3.42Å; R591-R595 VanDerWaalsContact O-N 3.08Å; R591-R595 PolarHBondContact O-NE 3.28Å
592	T	88.3	Confident	83.2	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.012	31%	0.313	C	S	.	.	H	α-helix	trans	-70.7	-44.5	178.2	-57.2	0	0	0	0	110.7	E588 L589 K590 R595 G596 L606 E609 V610 L613	E588-T592 WeakPolarHBondContact O-CB 3.49Å; E588-T592 PolarHBondContact O-N 2.69Å; E588-T592 PolarHBondContact O-OG1 3.34Å; L589-T592 WeakPolarHBondContact O-CB 3.42Å; L589-T592 PolarHBondContact O-N 3.11Å; L589-T592 VanDerWaalsContact O-N 3.13Å; K590-T592 PolarHBondContact O-N 3.4Å; T592-R595 PolarHBondContact O-N 3.36Å; T592-R595 PolarHBondContact OG1-NH2 2.88Å; T592-G596 PolarHBondContact O-N 3.44Å; T592-L606 HydrophobicContact CG2-CD1 4.29Å; T592-E609 HydrophobicContact CG2-CB 3.88Å; T592-E609 WeakPolarHBondContact CG2-OE2 3.41Å; T592-V610 HydrophobicContact CG2-CG2 4.32Å; T592-L613 HydrophobicContact CG2-CD1 4.29Å; T592-L613 WeakPolarHBondContact OG1-CD1 3.25Å
593	L	84.9	Confident	83.5	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-64.3	-41	173.8	-64.2	176.1	0	0	0	112.5	L589 K590 R595 G596 E597 L606 V610 L628 L632 L635 F667	L589-L593 WeakPolarHBondContact O-CG 3.44Å; L589-L593 PolarHBondContact O-N 2.89Å; K590-L593 PolarHBondContact O-N 3.32Å; L593-R595 PolarHBondContact O-N 3.2Å; L593-G596 WeakPolarHBondContact O-CA 3.13Å; L593-G596 PolarHBondContact O-N 3.29Å; L593-G596 VanDerWaalsContact O-N 3.15Å; L593-E597 PolarHBondContact O-N 3.25Å; L593-L606 HydrophobicContact CD2-CD2 4.03Å; L593-V610 HydrophobicContact CD2-CG2 4.46Å; L593-L628 HydrophobicContact CD1-CD1 4.16Å; L593-L632 HydrophobicContact CD1-CD1 4.36Å; L593-L635 HydrophobicContact CB-CD1 3.44Å; L593-L635 VanDerWaalsContact CB-CD1 3.44Å; L593-F667 HydrophobicContact CB-CZ 4.31Å; L593-F667 HydrophobicContact CD2-CD1 4.18Å; L593-F667 HydrophobicContact CD2-CE1 4.09Å; L593-F667 HydrophobicContact CD2-CZ 4.26Å
594	E	87.8	Confident	83.7	Confident	43 Å²	43	68 Å²	68	20%	0.201	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-41.7	175.7	-76.6	-178.2	-163.5	0	0	112.1	K590 G596 E597 R598 L635	K590-E594 WeakPolarHBondContact CE-OE1 3.27Å; K590-E594 HydrophobicContact CG-CG 4.44Å; K590-E594 WeakPolarHBondContact O-CG 3.29Å; K590-E594 PolarHBondContact O-N 3.4Å; E594-G596 VanDerWaalsContact C-N 3.34Å; E594-E597 PolarHBondContact O-N 2.76Å; E594-R598 WeakPolarHBondContact O-CG 3.38Å; E594-R598 PolarHBondContact O-N 3.29Å; E594-R598 IonicContact OE2-NH2 2.7Å; E594-L635 HydrophobicContact CB-CD1 4.34Å; E594-L635 HydrophobicContact CG-CD1 3.61Å; E594-L635 HydrophobicContact CG-CG 4.05Å
595	R	84	Confident	83.8	Confident	105 Å²	105	66.3 Å²	66.3	40%	0.396	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-43.2	173.6	-76.9	-179.7	-71.8	163.5	-5.5	110.8	R591 T592 L593 E597 R598 H599	R591-R595 WeakPolarHBondContact O-CB 3.24Å; R591-R595 VanDerWaalsContact O-CG 3.29Å; R591-R595 WeakPolarHBondContact O-CG 3.46Å; R591-R595 PolarHBondContact O-N 3.42Å; R591-R595 VanDerWaalsContact O-N 3.08Å; R591-R595 PolarHBondContact O-NE 3.28Å; T592-R595 PolarHBondContact O-N 3.36Å; T592-R595 PolarHBondContact OG1-NH2 2.88Å; L593-R595 PolarHBondContact O-N 3.2Å; R595-E597 VanDerWaalsContact C-N 3.34Å; R595-E597 PolarHBondContact O-N 3.36Å; R595-R598 PolarHBondContact O-N 3.49Å; R595-H599 WeakPolarHBondContact O-CB 3.23Å; R595-H599 PolarHBondContact O-CD2 3.37Å; R595-H599 PolarHBondContact O-N 3.19Å
596	G	83.3	Confident	83.9	Confident	5 Å²	5	65.9 Å²	65.9	5%	0.052	31%	0.307	C	S	.	.	H	α-helix	trans	-55.7	-45.2	175.4	0	0	0	0	0	113.1	T592 L593 E594 K600 Y601	T592-G596 PolarHBondContact O-N 3.44Å; L593-G596 WeakPolarHBondContact O-CA 3.13Å; L593-G596 PolarHBondContact O-N 3.29Å; L593-G596 VanDerWaalsContact O-N 3.15Å; E594-G596 VanDerWaalsContact C-N 3.34Å; G596-K600 WeakPolarHBondContact O-CA 3.16Å; G596-K600 PolarHBondContact O-N 3.41Å; G596-Y601 PolarHBondContact O-N 2.9Å
597	E	81.5	Confident	84	Confident	49 Å²	49	66.5 Å²	66.5	23%	0.229	31%	0.31	C	S	.	.	H	α-helix	trans	-69.2	-46	178.4	-163.1	-162.7	-177.9	0	0	112.2	L593 E594 R595 H599 K600 H639 L663 F667	L593-E597 PolarHBondContact O-N 3.25Å; E594-E597 PolarHBondContact O-N 2.76Å; R595-E597 VanDerWaalsContact C-N 3.34Å; R595-E597 PolarHBondContact O-N 3.36Å; E597-H599 PolarHBondContact O-N 2.68Å; E597-K600 PolarHBondContact O-N 3.36Å; E597-H639 IonicContact OE2-CE1 2.88Å; E597-H639 PolarHBondContact OE2-CE1 2.85Å; E597-H639 IonicContact OE2-NE2 3.48Å; E597-H639 PolarHBondContact OE2-NE2 2.8Å; E597-L663 HydrophobicContact CG-CD2 4.42Å; E597-F667 HydrophobicContact CB-CZ 4.5Å
598	R	81.2	Confident	84	Confident	193 Å²	193	69.7 Å²	69.7	73%	0.728	33%	0.325	S	S	*	.	H	α-helix	trans	-63.2	-40.8	-178	-73.9	-178.5	-169.8	173.2	10.3	112.8	E594 R595	E594-R598 WeakPolarHBondContact O-CG 3.38Å; E594-R598 PolarHBondContact O-N 3.29Å; E594-R598 IonicContact OE2-NH2 2.7Å; R595-R598 PolarHBondContact O-N 3.49Å
599	H	79.4	Confident	84	Confident	123 Å²	123	70.4 Å²	70.4	57%	0.569	33%	0.328	S	S	*	.	H	α-helix	trans	-93.2	-4.9	-177.9	-66.3	-69.2	0	0	0	113.7	R595 E597 Y601	R595-H599 WeakPolarHBondContact O-CB 3.23Å; R595-H599 PolarHBondContact O-CD2 3.37Å; R595-H599 PolarHBondContact O-N 3.19Å; E597-H599 PolarHBondContact O-N 2.68Å; H599-Y601 HydrophobicContact CB-CD1 4.09Å; H599-Y601 HydrophobicContact CB-CE1 3.68Å; H599-Y601 HydrophobicContact CB-CE2 4.15Å; H599-Y601 HydrophobicContact CB-CG 4.47Å; H599-Y601 PolarHBondContact O-N 3.25Å
600	K	78.8	Confident	84	Confident	186 Å²	186	70.3 Å²	70.3	81%	0.809	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	52.5	-176.1	-62.2	-175.8	179.3	-178.7	0	112.2	G596 E597	G596-K600 WeakPolarHBondContact O-CA 3.16Å; G596-K600 PolarHBondContact O-N 3.41Å; E597-K600 PolarHBondContact O-N 3.36Å
601	Y	76.9	Confident	83.9	Confident	95 Å²	95	71.1 Å²	71.1	37%	0.373	33%	0.333	S	S	.	.			trans	-61.8	148.4	178.1	-68.9	-41.9	0	0	0	111.8	G596 H599	G596-Y601 PolarHBondContact O-N 2.9Å; H599-Y601 HydrophobicContact CB-CD1 4.09Å; H599-Y601 HydrophobicContact CB-CE1 3.68Å; H599-Y601 HydrophobicContact CB-CE2 4.15Å; H599-Y601 HydrophobicContact CB-CG 4.47Å; H599-Y601 PolarHBondContact O-N 3.25Å
602	P	81.9	Confident	84	Confident	83 Å²	83	69 Å²	69	54%	0.539	34%	0.335	S	S	.	.			trans	-62.3	143.5	168	28	-32.5	0	0	0	109.6	E604 T605 L606	P602-E604 PolarHBondContact O-N 3.37Å; P602-E604 VanDerWaalsContact O-N 3.13Å; P602-T605 WeakPolarHBondContact CG-OG1 3.36Å; P602-T605 PolarHBondContact O-N 3.16Å; P602-L606 PolarHBondContact O-N 3.3Å
603	A	78.8	Confident	84	Confident	38 Å²	38	70 Å²	70	31%	0.314	34%	0.34	S	S	.	.	H	α-helix	trans	-55.1	-35	-174.1	0	0	0	0	0	113.1	T605 L606 I607 T669 V670	A603-T605 PolarHBondContact O-N 2.73Å; A603-L606 PolarHBondContact O-N 3.36Å; A603-I607 WeakPolarHBondContact O-CD1 3.27Å; A603-I607 VanDerWaalsContact O-CG1 3.23Å; A603-I607 WeakPolarHBondContact O-CG1 3.4Å; A603-I607 PolarHBondContact O-N 3.07Å; A603-T669 WeakPolarHBondContact CB-OG1 3.15Å; A603-V670 HydrophobicContact CB-CG2 4.37Å
604	E	82.9	Confident	84	Confident	157 Å²	157	71.5 Å²	71.5	73%	0.734	35%	0.346	S	S	*	.	H	α-helix	trans	-60.3	-42.9	177.7	-63.9	179	-177.4	0	0	112.9	P602 L606 I607 L608	P602-E604 PolarHBondContact O-N 3.37Å; P602-E604 VanDerWaalsContact O-N 3.13Å; E604-L606 VanDerWaalsContact C-N 3.34Å; E604-I607 PolarHBondContact O-N 2.91Å; E604-L608 WeakPolarHBondContact O-CG 3.25Å; E604-L608 PolarHBondContact O-N 3.3Å; E604-L608 VanDerWaalsContact O-N 3.14Å
605	T	85.5	Confident	84	Confident	57 Å²	57	76.3 Å²	76.3	35%	0.35	37%	0.368	S	S	.	.	H	α-helix	trans	-67	-39.8	178.6	-56.4	0	0	0	0	110.9	P602 A603 L608 E609	P602-T605 WeakPolarHBondContact CG-OG1 3.36Å; P602-T605 PolarHBondContact O-N 3.16Å; A603-T605 PolarHBondContact O-N 2.73Å; T605-L608 PolarHBondContact O-N 2.9Å; T605-E609 PolarHBondContact O-N 3.26Å
606	L	85.1	Confident	84.1	Confident	5 Å²	5	74.8 Å²	74.8	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-67.6	-38.6	178.5	-167.3	69.9	0	0	0	111.9	T592 L593 P602 A603 E604 L608 E609 V610 F667 V670	T592-L606 HydrophobicContact CG2-CD1 4.29Å; L593-L606 HydrophobicContact CD2-CD2 4.03Å; P602-L606 PolarHBondContact O-N 3.3Å; A603-L606 PolarHBondContact O-N 3.36Å; E604-L606 VanDerWaalsContact C-N 3.34Å; L606-L608 VanDerWaalsContact C-N 3.29Å; L606-L608 PolarHBondContact O-N 3.28Å; L606-E609 PolarHBondContact O-N 2.82Å; L606-V610 HydrophobicContact CG-CG2 4.36Å; L606-V610 WeakPolarHBondContact O-CB 3.49Å; L606-V610 VanDerWaalsContact O-CG2 3.22Å; L606-V610 WeakPolarHBondContact O-CG2 3.1Å; L606-V610 PolarHBondContact O-N 3.18Å; L606-F667 HydrophobicContact CD2-CD1 3.46Å; L606-F667 VanDerWaalsContact CD2-CD1 3.46Å; L606-F667 HydrophobicContact CD2-CE1 3.21Å; L606-F667 HydrophobicContact CD2-CZ 4.37Å; L606-V670 HydrophobicContact CB-CG2 4.39Å; L606-V670 HydrophobicContact CD2-CG2 3.98Å; L606-V670 HydrophobicContact CG-CG2 4.48Å
607	I	85.9	Confident	84.1	Confident	22 Å²	22	77.1 Å²	77.1	11%	0.113	39%	0.386	C	S	.	.	H	α-helix	trans	-59.6	-41.5	173.6	-69.2	159	0	0	0	110.7	A603 E604 N611 V670	A603-I607 WeakPolarHBondContact O-CD1 3.27Å; A603-I607 VanDerWaalsContact O-CG1 3.23Å; A603-I607 WeakPolarHBondContact O-CG1 3.4Å; A603-I607 PolarHBondContact O-N 3.07Å; E604-I607 PolarHBondContact O-N 2.91Å; I607-N611 WeakPolarHBondContact CG2-ND2 3.21Å; I607-N611 VanDerWaalsContact O-CB 3.25Å; I607-N611 WeakPolarHBondContact O-CB 3.38Å; I607-N611 PolarHBondContact O-N 3.33Å; I607-N611 PolarHBondContact O-ND2 3.43Å; I607-V670 HydrophobicContact CD1-CG2 4.37Å; I607-V670 HydrophobicContact CG1-CB 4.04Å; I607-V670 HydrophobicContact CG1-CG1 3.92Å; I607-V670 HydrophobicContact CG1-CG2 3.83Å
608	L	87.5	Confident	84.2	Confident	124 Å²	124	81.9 Å²	81.9	65%	0.649	41%	0.413	S	S	*	.	H	α-helix	trans	-65.4	-43.6	177.5	-69.5	173.8	0	0	0	112.3	E604 T605 L606 S612	E604-L608 WeakPolarHBondContact O-CG 3.25Å; E604-L608 PolarHBondContact O-N 3.3Å; E604-L608 VanDerWaalsContact O-N 3.14Å; T605-L608 PolarHBondContact O-N 2.9Å; L606-L608 VanDerWaalsContact C-N 3.29Å; L606-L608 PolarHBondContact O-N 3.28Å; L608-S612 WeakPolarHBondContact O-CB 3.48Å; L608-S612 PolarHBondContact O-N 3.17Å
609	E	87.9	Confident	84.3	Confident	54 Å²	54	73.4 Å²	73.4	25%	0.252	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-46	176.8	-71.8	-171.1	-168.5	0	0	111.3	T592 T605 L606 S612 L613	T592-E609 HydrophobicContact CG2-CB 3.88Å; T592-E609 WeakPolarHBondContact CG2-OE2 3.41Å; T605-E609 PolarHBondContact O-N 3.26Å; L606-E609 PolarHBondContact O-N 2.82Å; E609-S612 WeakPolarHBondContact O-CB 3.16Å; E609-S612 PolarHBondContact O-N 2.74Å; E609-S612 VanDerWaalsContact O-N 3.16Å; E609-S612 PolarHBondContact O-OG 3.37Å; E609-L613 PolarHBondContact O-N 3.3Å; E609-L613 VanDerWaalsContact O-N 3.08Å
610	V	87.3	Confident	84.4	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-63.6	-43.9	179.4	171	0	0	0	0	111.1	L589 T592 L593 L606 S612 L613 K614 F624 L628	L589-V610 HydrophobicContact CD2-CG1 4.38Å; T592-V610 HydrophobicContact CG2-CG2 4.32Å; L593-V610 HydrophobicContact CD2-CG2 4.46Å; L606-V610 HydrophobicContact CG-CG2 4.36Å; L606-V610 WeakPolarHBondContact O-CB 3.49Å; L606-V610 VanDerWaalsContact O-CG2 3.22Å; L606-V610 WeakPolarHBondContact O-CG2 3.1Å; L606-V610 PolarHBondContact O-N 3.18Å; V610-S612 VanDerWaalsContact C-N 3.33Å; V610-S612 PolarHBondContact O-N 3.14Å; V610-L613 PolarHBondContact O-N 2.89Å; V610-K614 PolarHBondContact O-N 2.86Å; V610-K614 VanDerWaalsContact O-N 3.15Å; V610-F624 HydrophobicContact CG1-CE1 3.89Å; V610-F624 HydrophobicContact CG1-CZ 3.46Å; V610-F624 VanDerWaalsContact CG1-CZ 3.46Å; V610-F624 WeakPolarHBondContact O-CZ 3.44Å; V610-L628 HydrophobicContact CG1-CD1 4.11Å; V610-L628 HydrophobicContact CG1-CD2 4.18Å
611	N	86.7	Confident	84.3	Confident	40 Å²	40	64.4 Å²	64.4	21%	0.214	35%	0.351	C	S	.	.	H	α-helix	trans	-66.6	-33.1	173.9	-77.7	-26.8	0	0	0	112.6	I607 L613 K614 H615	I607-N611 WeakPolarHBondContact CG2-ND2 3.21Å; I607-N611 VanDerWaalsContact O-CB 3.25Å; I607-N611 WeakPolarHBondContact O-CB 3.38Å; I607-N611 PolarHBondContact O-N 3.33Å; I607-N611 PolarHBondContact O-ND2 3.43Å; N611-L613 VanDerWaalsContact C-N 3.28Å; N611-L613 PolarHBondContact O-N 3.3Å; N611-K614 WeakPolarHBondContact O-CB 3.43Å; N611-K614 PolarHBondContact O-N 3.4Å; N611-H615 PolarHBondContact O-CD2 3.18Å; N611-H615 PolarHBondContact O-N 3.45Å; N611-H615 VanDerWaalsContact O-N 3.08Å
612	S	88.8	Confident	84.2	Confident	65 Å²	65	65 Å²	65	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-36.8	174.4	79.2	0	0	0	0	111.7	L608 E609 V610 H615 A616	L608-S612 WeakPolarHBondContact O-CB 3.48Å; L608-S612 PolarHBondContact O-N 3.17Å; E609-S612 WeakPolarHBondContact O-CB 3.16Å; E609-S612 PolarHBondContact O-N 2.74Å; E609-S612 VanDerWaalsContact O-N 3.16Å; E609-S612 PolarHBondContact O-OG 3.37Å; V610-S612 VanDerWaalsContact C-N 3.33Å; V610-S612 PolarHBondContact O-N 3.14Å; S612-H615 PolarHBondContact O-N 3.37Å; S612-A616 VanDerWaalsContact O-CB 3.25Å; S612-A616 WeakPolarHBondContact O-CB 3.4Å; S612-A616 PolarHBondContact O-N 3.43Å
613	L	87.8	Confident	84	Confident	21 Å²	21	65 Å²	65	11%	0.11	35%	0.353	C	S	.	.	H	α-helix	trans	-68.5	-40.2	175.4	-65.9	172.8	0	0	0	111.7	E588 L589 T592 E609 V610 N611 H615 A616 Y617	E588-L613 HydrophobicContact CG-CD1 4.46Å; E588-L613 HydrophobicContact CG-CD2 4.04Å; L589-L613 HydrophobicContact CD2-CB 4.23Å; L589-L613 HydrophobicContact CD2-CD1 3.83Å; T592-L613 HydrophobicContact CG2-CD1 4.29Å; T592-L613 WeakPolarHBondContact OG1-CD1 3.25Å; E609-L613 PolarHBondContact O-N 3.3Å; E609-L613 VanDerWaalsContact O-N 3.08Å; V610-L613 PolarHBondContact O-N 2.89Å; N611-L613 VanDerWaalsContact C-N 3.28Å; N611-L613 PolarHBondContact O-N 3.3Å; L613-H615 VanDerWaalsContact C-N 3.28Å; L613-H615 PolarHBondContact O-N 3.17Å; L613-A616 PolarHBondContact O-N 2.95Å; L613-Y617 HydrophobicContact CB-CD2 4.29Å; L613-Y617 HydrophobicContact CB-CE2 4.28Å; L613-Y617 HydrophobicContact CD2-CE2 3.76Å; L613-Y617 WeakPolarHBondContact O-CD2 3.42Å; L613-Y617 PolarHBondContact O-N 3.05Å
614	K	86.1	Confident	84.2	Confident	36 Å²	36	63.3 Å²	63.3	16%	0.157	34%	0.338	C	S	.	.	H	α-helix	trans	-54	-46.9	171.9	-178.1	-175.2	169.3	-177.6	0	111.5	V610 N611 N618 V619 F624	V610-K614 PolarHBondContact O-N 2.86Å; V610-K614 VanDerWaalsContact O-N 3.15Å; N611-K614 WeakPolarHBondContact O-CB 3.43Å; N611-K614 PolarHBondContact O-N 3.4Å; K614-N618 PolarHBondContact O-N 2.92Å; K614-N618 VanDerWaalsContact O-N 3.11Å; K614-V619 PolarHBondContact O-N 3.3Å; K614-V619 VanDerWaalsContact O-N 3.12Å; K614-F624 HydrophobicContact CB-CD1 4.49Å; K614-F624 HydrophobicContact CB-CD2 3.75Å; K614-F624 HydrophobicContact CB-CE1 4.3Å; K614-F624 HydrophobicContact CB-CE2 3.54Å; K614-F624 HydrophobicContact CB-CG 4.21Å; K614-F624 HydrophobicContact CB-CZ 3.81Å; K614-F624 HydrophobicContact CD-CD1 4.05Å; K614-F624 HydrophobicContact CD-CD2 4.45Å; K614-F624 HydrophobicContact CD-CE1 4.36Å; K614-F624 HydrophobicContact CD-CG 4.08Å; K614-F624 HydrophobicContact CG-CB 4.42Å; K614-F624 HydrophobicContact CG-CD1 4.37Å; K614-F624 HydrophobicContact CG-CD2 3.88Å; K614-F624 HydrophobicContact CG-CE2 4.19Å; K614-F624 HydrophobicContact CG-CG 3.96Å
615	H	86.1	Confident	84.1	Confident	144 Å²	144	55.8 Å²	55.8	67%	0.667	30%	0.303	S	S	*	.	H	α-helix	trans	-74.1	-37.9	-179.7	-70.6	-58.9	0	0	0	113.2	N611 S612 L613 Y617 N618	N611-H615 PolarHBondContact O-CD2 3.18Å; N611-H615 PolarHBondContact O-N 3.45Å; N611-H615 VanDerWaalsContact O-N 3.08Å; S612-H615 PolarHBondContact O-N 3.37Å; L613-H615 VanDerWaalsContact C-N 3.28Å; L613-H615 PolarHBondContact O-N 3.17Å; H615-Y617 VanDerWaalsContact C-N 3.28Å; H615-Y617 PolarHBondContact O-N 3.03Å; H615-N618 PolarHBondContact O-N 3.08Å
616	A	86.2	Confident	84	Confident	73 Å²	73	54.9 Å²	54.9	60%	0.603	29%	0.294	S	S	*	.	H	α-helix	trans	-63.2	-36.5	178.4	0	0	0	0	0	112.1	S612 L613	S612-A616 VanDerWaalsContact O-CB 3.25Å; S612-A616 WeakPolarHBondContact O-CB 3.4Å; S612-A616 PolarHBondContact O-N 3.43Å; L613-A616 PolarHBondContact O-N 2.95Å
617	Y	84	Confident	84	Confident	55 Å²	55	54.9 Å²	54.9	22%	0.216	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	6.4	-178.1	-57.4	-49.5	0	0	0	113.9	F584 I585 E588 L613 H615 V619	F584-Y617 HydrophobicContact CE1-CE1 4.07Å; F584-Y617 AromaticContact CE1-CZ 3.93Å; I585-Y617 HydrophobicContact CG1-CD2 4.26Å; I585-Y617 HydrophobicContact CG1-CG 4.34Å; I585-Y617 HydrophobicContact CG2-CD2 4.33Å; E588-Y617 HydrophobicContact CG-CE2 4.45Å; L613-Y617 HydrophobicContact CB-CD2 4.29Å; L613-Y617 HydrophobicContact CB-CE2 4.28Å; L613-Y617 HydrophobicContact CD2-CE2 3.76Å; L613-Y617 WeakPolarHBondContact O-CD2 3.42Å; L613-Y617 PolarHBondContact O-N 3.05Å; H615-Y617 VanDerWaalsContact C-N 3.28Å; H615-Y617 PolarHBondContact O-N 3.03Å; Y617-V619 PolarHBondContact O-N 2.98Å; Y617-V619 VanDerWaalsContact O-N 3.14Å
618	N	82.8	Confident	83.9	Confident	148 Å²	148	54 Å²	54	79%	0.791	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	40.3	179.7	-166.6	40.9	0	0	0	113.8	K614 H615	K614-N618 PolarHBondContact O-N 2.92Å; K614-N618 VanDerWaalsContact O-N 3.11Å; H615-N618 PolarHBondContact O-N 3.08Å
619	V	82.9	Confident	83.7	Confident	16 Å²	16	48.2 Å²	48.2	10%	0.097	26%	0.26	C	S	.	.			trans	-80.1	126.5	-177	-174.2	0	0	0	0	109.1	I585 K614 Y617 D623 F624 L627	I585-V619 HydrophobicContact CD1-CG2 3.93Å; K614-V619 PolarHBondContact O-N 3.3Å; K614-V619 VanDerWaalsContact O-N 3.12Å; Y617-V619 PolarHBondContact O-N 2.98Å; Y617-V619 VanDerWaalsContact O-N 3.14Å; V619-D623 HydrophobicContact CG1-CB 3.97Å; V619-F624 HydrophobicContact CB-CB 4.44Å; V619-F624 HydrophobicContact CB-CD2 4.31Å; V619-F624 HydrophobicContact CG1-CB 3.88Å; V619-F624 HydrophobicContact CG1-CD2 4.3Å; V619-L627 HydrophobicContact CG1-CD1 3.96Å
620	P	82.1	Confident	83.6	Confident	69 Å²	69	47 Å²	47	45%	0.448	25%	0.253	S	S	.	.			trans	-61.8	150.9	174.8	28.7	-34.8	0	0	0	109.9	E622 D623 F624	P620-E622 PolarHBondContact O-N 2.85Å; P620-E622 VanDerWaalsContact O-N 3.14Å; P620-D623 HydrophobicContact CG-CB 3.92Å; P620-D623 WeakPolarHBondContact CG-OD2 3.5Å; P620-D623 PolarHBondContact O-N 3.47Å; P620-F624 WeakPolarHBondContact O-CB 3.09Å; P620-F624 PolarHBondContact O-N 3.11Å
621	I	77.2	Confident	83.5	Confident	50 Å²	50	47 Å²	47	26%	0.256	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-29.9	-172.1	-163.3	164	0	0	0	112.9	G625 M675 F678	I621-G625 PolarHBondContact O-N 3.21Å; I621-M675 HydrophobicContact CG1-CE 4.28Å; I621-M675 HydrophobicContact CG1-SD 3.97Å; I621-M675 WeakPolarHBondContact O-CE 3.16Å; I621-F678 HydrophobicContact CG2-CD2 3.89Å; I621-F678 HydrophobicContact CG2-CE2 4.34Å
622	E	73.8	Confident	83.4	Confident	108 Å²	108	45.3 Å²	45.3	51%	0.505	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-52.3	179.2	-51	-170	176.4	0	0	110.7	P620 F624 G625 F626 F678 V684	P620-E622 PolarHBondContact O-N 2.85Å; P620-E622 VanDerWaalsContact O-N 3.14Å; E622-F624 VanDerWaalsContact C-N 3.31Å; E622-F624 PolarHBondContact O-N 3.1Å; E622-G625 PolarHBondContact O-N 3.48Å; E622-F626 PolarHBondContact O-N 3Å; E622-F678 HydrophobicContact CB-CZ 4.44Å; E622-F678 HydrophobicContact CG-CD2 4.42Å; E622-F678 HydrophobicContact CG-CE1 4.46Å; E622-F678 HydrophobicContact CG-CE2 3.51Å; E622-F678 HydrophobicContact CG-CZ 3.53Å; E622-F678 VanDerWaalsContact OE1-CE2 3.3Å; E622-F678 WeakPolarHBondContact OE1-CE2 3.31Å; E622-V684 VanDerWaalsContact O-CG1 3.32Å; E622-V684 WeakPolarHBondContact O-CG1 3.47Å
623	D	79.2	Confident	83.1	Confident	84 Å²	84	42.3 Å²	42.3	45%	0.449	22%	0.223	S	C	.	.	H	α-helix	trans	-70.2	-30.4	178.1	-58	-20.6	0	0	0	111.6	V619 P620 G625 F626 L627	V619-D623 HydrophobicContact CG1-CB 3.97Å; P620-D623 HydrophobicContact CG-CB 3.92Å; P620-D623 WeakPolarHBondContact CG-OD2 3.5Å; P620-D623 PolarHBondContact O-N 3.47Å; D623-G625 PolarHBondContact O-N 3.46Å; D623-F626 WeakPolarHBondContact O-CB 3.48Å; D623-F626 PolarHBondContact O-N 3.13Å; D623-L627 VanDerWaalsContact O-CG 3.25Å; D623-L627 WeakPolarHBondContact O-CG 3.32Å; D623-L627 PolarHBondContact O-N 3.5Å
624	F	82.5	Confident	82.9	Confident	1 Å²	1	45.1 Å²	45.1	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-43.4	178.5	-172.3	-105.8	0	0	0	112.4	L589 V610 K614 V619 P620 E622 F626 L627 L628 C674	L589-F624 HydrophobicContact CD1-CE2 4.26Å; L589-F624 HydrophobicContact CD2-CE2 3.98Å; L589-F624 HydrophobicContact CD2-CZ 4.19Å; V610-F624 HydrophobicContact CG1-CE1 3.89Å; V610-F624 HydrophobicContact CG1-CZ 3.46Å; V610-F624 VanDerWaalsContact CG1-CZ 3.46Å; V610-F624 WeakPolarHBondContact O-CZ 3.44Å; K614-F624 HydrophobicContact CB-CD1 4.49Å; K614-F624 HydrophobicContact CB-CD2 3.75Å; K614-F624 HydrophobicContact CB-CE1 4.3Å; K614-F624 HydrophobicContact CB-CE2 3.54Å; K614-F624 HydrophobicContact CB-CG 4.21Å; K614-F624 HydrophobicContact CB-CZ 3.81Å; K614-F624 HydrophobicContact CD-CD1 4.05Å; K614-F624 HydrophobicContact CD-CD2 4.45Å; K614-F624 HydrophobicContact CD-CE1 4.36Å; K614-F624 HydrophobicContact CD-CG 4.08Å; K614-F624 HydrophobicContact CG-CB 4.42Å; K614-F624 HydrophobicContact CG-CD1 4.37Å; K614-F624 HydrophobicContact CG-CD2 3.88Å; K614-F624 HydrophobicContact CG-CE2 4.19Å; K614-F624 HydrophobicContact CG-CG 3.96Å; V619-F624 HydrophobicContact CB-CB 4.44Å; V619-F624 HydrophobicContact CB-CD2 4.31Å; V619-F624 HydrophobicContact CG1-CB 3.88Å; V619-F624 HydrophobicContact CG1-CD2 4.3Å; P620-F624 WeakPolarHBondContact O-CB 3.09Å; P620-F624 PolarHBondContact O-N 3.11Å; E622-F624 VanDerWaalsContact C-N 3.31Å; E622-F624 PolarHBondContact O-N 3.1Å; F624-F626 VanDerWaalsContact C-N 3.28Å; F624-F626 PolarHBondContact O-N 3.49Å; F624-L627 PolarHBondContact O-N 3Å; F624-L628 HydrophobicContact CE1-CD2 4.19Å; F624-L628 VanDerWaalsContact O-CB 3.24Å; F624-L628 WeakPolarHBondContact O-CB 3.45Å; F624-L628 PolarHBondContact O-N 3.46Å; F624-C674 HydrophobicContact CE1-CB 4.37Å
625	G	80	Confident	82.7	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.9	-39.1	174.8	0	0	0	0	0	112.1	I621 E622 D623 T629	I621-G625 PolarHBondContact O-N 3.21Å; E622-G625 PolarHBondContact O-N 3.48Å; D623-G625 PolarHBondContact O-N 3.46Å; G625-T629 WeakPolarHBondContact O-CB 3.38Å; G625-T629 PolarHBondContact O-N 2.67Å; G625-T629 PolarHBondContact O-OG1 2.82Å
626	F	84.5	Confident	82.5	Confident	37 Å²	37	36.5 Å²	36.5	16%	0.162	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-49.5	176.5	176.7	-97.3	0	0	0	112.1	E622 D623 F624 T629 K630 V684 Q687 A688 D691	E622-F626 PolarHBondContact O-N 3Å; D623-F626 WeakPolarHBondContact O-CB 3.48Å; D623-F626 PolarHBondContact O-N 3.13Å; F624-F626 VanDerWaalsContact C-N 3.28Å; F624-F626 PolarHBondContact O-N 3.49Å; F626-T629 PolarHBondContact O-N 2.86Å; F626-K630 HydrophobicContact CD1-CD 4.24Å; F626-K630 HydrophobicContact CE1-CD 3.74Å; F626-K630 VanDerWaalsContact CE1-CE 3.48Å; F626-K630 VanDerWaalsContact CE1-NZ 3.33Å; F626-K630 HydrophobicContact CZ-CD 4.04Å; F626-K630 VanDerWaalsContact CZ-NZ 3.33Å; F626-K630 PolarHBondContact O-N 3.08Å; F626-V684 HydrophobicContact CB-CG1 3.85Å; F626-Q687 HydrophobicContact CD2-CB 4.49Å; F626-A688 VanDerWaalsContact CD2-CA 3.48Å; F626-A688 HydrophobicContact CD2-CB 3.57Å; F626-A688 VanDerWaalsContact CE2-CA 3.47Å; F626-A688 HydrophobicContact CE2-CB 4.05Å; F626-A688 HydrophobicContact CG-CB 4.2Å; F626-D691 HydrophobicContact CE2-CB 4.02Å; F626-D691 HydrophobicContact CZ-CB 3.96Å
627	L	84.4	Confident	82.1	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-67	-39.3	-179.4	-64.7	172.9	0	0	0	112.6	E582 I585 I586 L589 V619 D623 F624 T629 K630 A631	E582-L627 HydrophobicContact CB-CD2 3.94Å; E582-L627 HydrophobicContact CG-CD2 4.24Å; I585-L627 HydrophobicContact CB-CD1 4.44Å; I585-L627 HydrophobicContact CD1-CD1 4.49Å; I585-L627 HydrophobicContact CG2-CD1 4.01Å; I586-L627 HydrophobicContact CD1-CD2 3.84Å; I586-L627 HydrophobicContact CG1-CB 4.37Å; I586-L627 HydrophobicContact CG1-CD2 3.76Å; L589-L627 HydrophobicContact CD1-CB 4.18Å; V619-L627 HydrophobicContact CG1-CD1 3.96Å; D623-L627 VanDerWaalsContact O-CG 3.25Å; D623-L627 WeakPolarHBondContact O-CG 3.32Å; D623-L627 PolarHBondContact O-N 3.5Å; F624-L627 PolarHBondContact O-N 3Å; L627-T629 VanDerWaalsContact C-N 3.33Å; L627-T629 PolarHBondContact O-N 3.41Å; L627-K630 PolarHBondContact O-N 3.33Å; L627-A631 WeakPolarHBondContact O-CB 3.37Å; L627-A631 PolarHBondContact O-N 3.08Å
628	L	85.1	Confident	81.6	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-64.6	-39.8	177.6	-177	60.9	0	0	0	111.5	L589 L593 V610 F624 A631 L632 L671 C674	L589-L628 HydrophobicContact CD2-CD1 4.33Å; L593-L628 HydrophobicContact CD1-CD1 4.16Å; V610-L628 HydrophobicContact CG1-CD1 4.11Å; V610-L628 HydrophobicContact CG1-CD2 4.18Å; F624-L628 HydrophobicContact CE1-CD2 4.19Å; F624-L628 VanDerWaalsContact O-CB 3.24Å; F624-L628 WeakPolarHBondContact O-CB 3.45Å; F624-L628 PolarHBondContact O-N 3.46Å; L628-A631 PolarHBondContact O-N 3.36Å; L628-L632 PolarHBondContact O-N 3.44Å; L628-L671 HydrophobicContact CD2-CD2 3.69Å; L628-L671 HydrophobicContact CG-CD2 3.93Å; L628-C674 HydrophobicContact CD2-CB 4.47Å
629	T	83	Confident	81	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-68.3	-41.3	177.7	-54.2	0	0	0	0	111.2	G625 F626 L627 L632 L633 Y685 A688 M710	G625-T629 WeakPolarHBondContact O-CB 3.38Å; G625-T629 PolarHBondContact O-N 2.67Å; G625-T629 PolarHBondContact O-OG1 2.82Å; F626-T629 PolarHBondContact O-N 2.86Å; L627-T629 VanDerWaalsContact C-N 3.33Å; L627-T629 PolarHBondContact O-N 3.41Å; T629-L632 PolarHBondContact O-N 3.43Å; T629-L633 WeakPolarHBondContact O-CG 3.47Å; T629-L633 PolarHBondContact O-N 2.66Å; T629-Y685 HydrophobicContact CG2-CD1 4.45Å; T629-Y685 WeakPolarHBondContact OG1-CD1 3.38Å; T629-Y685 WeakPolarHBondContact OG1-CE1 3.42Å; T629-A688 HydrophobicContact CG2-CB 3.82Å; T629-M710 HydrophobicContact CG2-CE 3.97Å
630	K	84.4	Confident	80.3	Confident	28 Å²	28	36.3 Å²	36.3	12%	0.122	18%	0.179	C	C	.	.	H	α-helix	trans	-59	-46.2	170.8	-82	-175.3	162.8	-178.1	0	112.4	I586 F626 L627 L632 L633 E634 A688 D691	I586-K630 HydrophobicContact CD1-CB 4.17Å; I586-K630 HydrophobicContact CD1-CD 3.85Å; I586-K630 HydrophobicContact CG1-CB 4.39Å; F626-K630 HydrophobicContact CD1-CD 4.24Å; F626-K630 HydrophobicContact CE1-CD 3.74Å; F626-K630 VanDerWaalsContact CE1-CE 3.48Å; F626-K630 VanDerWaalsContact CE1-NZ 3.33Å; F626-K630 HydrophobicContact CZ-CD 4.04Å; F626-K630 VanDerWaalsContact CZ-NZ 3.33Å; F626-K630 PolarHBondContact O-N 3.08Å; L627-K630 PolarHBondContact O-N 3.33Å; K630-L632 VanDerWaalsContact C-N 3.28Å; K630-L632 PolarHBondContact O-N 3.02Å; K630-L633 PolarHBondContact O-N 3.44Å; K630-L633 VanDerWaalsContact O-N 3.16Å; K630-E634 PolarHBondContact O-N 3.1Å; K630-A688 HydrophobicContact CG-CB 4.45Å; K630-D691 WeakPolarHBondContact CE-OD2 3.21Å; K630-D691 IonicContact NZ-OD2 3.83Å; K630-D691 PolarHBondContact NZ-OD2 3.2Å
631	A	85.2	Confident	79	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.4	-38.3	177.9	0	0	0	0	0	112.1	I586 L589 K590 L627 L628 E634 L635	I586-A631 HydrophobicContact CG2-CB 4.15Å; L589-A631 HydrophobicContact CB-CB 3.78Å; K590-A631 HydrophobicContact CB-CB 4.25Å; L627-A631 WeakPolarHBondContact O-CB 3.37Å; L627-A631 PolarHBondContact O-N 3.08Å; L628-A631 PolarHBondContact O-N 3.36Å; A631-E634 PolarHBondContact O-N 3.15Å; A631-L635 VanDerWaalsContact O-CB 3.31Å; A631-L635 WeakPolarHBondContact O-CB 3.38Å; A631-L635 PolarHBondContact O-N 2.89Å
632	L	85.2	Confident	77.6	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-64.7	-43.8	174.8	-172.3	71.8	0	0	0	111.8	L593 L628 T629 K630 L635 T636 L663 L664 F667 L671	L593-L632 HydrophobicContact CD1-CD1 4.36Å; L628-L632 PolarHBondContact O-N 3.44Å; T629-L632 PolarHBondContact O-N 3.43Å; K630-L632 VanDerWaalsContact C-N 3.28Å; K630-L632 PolarHBondContact O-N 3.02Å; L632-L635 WeakPolarHBondContact O-CB 3.38Å; L632-L635 PolarHBondContact O-N 3.09Å; L632-T636 WeakPolarHBondContact O-CG2 3.3Å; L632-T636 PolarHBondContact O-N 2.92Å; L632-L663 HydrophobicContact CD1-CB 4.35Å; L632-L664 HydrophobicContact CD2-CD2 3.58Å; L632-L664 HydrophobicContact CD2-CG 4.29Å; L632-F667 HydrophobicContact CD1-CD2 3.64Å; L632-F667 HydrophobicContact CD1-CE2 4.19Å; L632-L671 HydrophobicContact CD2-CD1 4.2Å
633	L	82.5	Confident	76.1	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-66.5	-36	177.7	-67.6	172.4	0	0	0	112.6	T629 K630 T636 R637 F656 L660 V689 A692 I699 I706	T629-L633 WeakPolarHBondContact O-CG 3.47Å; T629-L633 PolarHBondContact O-N 2.66Å; K630-L633 PolarHBondContact O-N 3.44Å; K630-L633 VanDerWaalsContact O-N 3.16Å; L633-T636 WeakPolarHBondContact CA-OG1 3.02Å; L633-T636 PolarHBondContact O-OG1 3.05Å; L633-R637 WeakPolarHBondContact O-CB 3.49Å; L633-R637 PolarHBondContact O-N 3.01Å; L633-R637 VanDerWaalsContact O-N 3.13Å; L633-F656 HydrophobicContact CD2-CZ 4.45Å; L633-L660 HydrophobicContact CD2-CD1 4.25Å; L633-V689 HydrophobicContact CD1-CG2 4.11Å; L633-A692 HydrophobicContact CD1-CB 3.74Å; L633-I699 HydrophobicContact CB-CD1 4.16Å; L633-I706 HydrophobicContact CD2-CD1 4.43Å
634	E	83.8	Confident	74.3	Confident	80 Å²	80	44.9 Å²	44.9	37%	0.374	24%	0.242	S	C	.	.	H	α-helix	trans	-70.2	-33.8	173.3	-73.8	-168.5	176.7	0	0	112.6	I586 K590 K630 A631 D638	I586-E634 WeakPolarHBondContact CG2-OE2 3.48Å; K590-E634 HydrophobicContact CD-CB 4.03Å; K590-E634 PolarHBondContact NZ-O 3.13Å; K630-E634 PolarHBondContact O-N 3.1Å; A631-E634 PolarHBondContact O-N 3.15Å; E634-D638 PolarHBondContact O-N 2.73Å
635	L	82.8	Confident	72.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.7	-46.1	174.1	-173.7	151	0	0	0	110.5	K590 L593 E594 A631 L632 R637 D638 H639 L663	K590-L635 HydrophobicContact CG-CB 4.25Å; L593-L635 HydrophobicContact CB-CD1 3.44Å; L593-L635 VanDerWaalsContact CB-CD1 3.44Å; E594-L635 HydrophobicContact CB-CD1 4.34Å; E594-L635 HydrophobicContact CG-CD1 3.61Å; E594-L635 HydrophobicContact CG-CG 4.05Å; A631-L635 VanDerWaalsContact O-CB 3.31Å; A631-L635 WeakPolarHBondContact O-CB 3.38Å; A631-L635 PolarHBondContact O-N 2.89Å; L632-L635 WeakPolarHBondContact O-CB 3.38Å; L632-L635 PolarHBondContact O-N 3.09Å; L635-R637 PolarHBondContact O-N 2.81Å; L635-D638 PolarHBondContact O-N 2.96Å; L635-D638 VanDerWaalsContact O-N 3.14Å; L635-H639 WeakPolarHBondContact CD2-NE2 3.49Å; L635-H639 PolarHBondContact O-CD2 3.47Å; L635-H639 PolarHBondContact O-N 3.29Å; L635-L663 HydrophobicContact CD2-CD1 3.45Å; L635-L663 VanDerWaalsContact CD2-CD1 3.45Å; L635-L663 HydrophobicContact CD2-CD2 3.72Å; L635-L663 HydrophobicContact CD2-CG 4.22Å
636	T	80.4	Confident	70.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.3	-33.6	178.8	63.5	0	0	0	0	111.8	L632 L633 L640 F656 L660 L663	L632-T636 WeakPolarHBondContact O-CG2 3.3Å; L632-T636 PolarHBondContact O-N 2.92Å; L633-T636 WeakPolarHBondContact CA-OG1 3.02Å; L633-T636 PolarHBondContact O-OG1 3.05Å; T636-L640 WeakPolarHBondContact O-CD1 3.47Å; T636-F656 WeakPolarHBondContact OG1-CE2 3.43Å; T636-F656 VanDerWaalsContact OG1-CZ 3.23Å; T636-F656 WeakPolarHBondContact OG1-CZ 3.4Å; T636-L660 HydrophobicContact CG2-CB 4.28Å; T636-L660 HydrophobicContact CG2-CD1 3.53Å; T636-L663 HydrophobicContact CG2-CB 4.29Å; T636-L663 HydrophobicContact CG2-CD1 3.36Å; T636-L663 HydrophobicContact CG2-CG 4.45Å
637	R	77.6	Confident	68.7	Low	90 Å²	90	66.6 Å²	66.6	34%	0.34	35%	0.349	S	S	.	.	H	α-helix	trans	-65.6	-42.8	174.5	-172.6	-176.1	-174.8	160	17.1	112.6	L633 L635 H639 L640 F656 D696	L633-R637 WeakPolarHBondContact O-CB 3.49Å; L633-R637 PolarHBondContact O-N 3.01Å; L633-R637 VanDerWaalsContact O-N 3.13Å; L635-R637 PolarHBondContact O-N 2.81Å; R637-H639 PolarHBondContact O-N 3.49Å; R637-L640 PolarHBondContact O-N 3.39Å; R637-F656 HydrophobicContact CB-CE2 4.38Å; R637-D696 VanDerWaalsContact CD-OD2 3.26Å; R637-D696 WeakPolarHBondContact CD-OD2 3.12Å; R637-D696 IonicContact CZ-OD1 2.66Å; R637-D696 IonicContact CZ-OD2 2.73Å; R637-D696 IonicContact NE-OD1 3.09Å; R637-D696 IonicContact NE-OD2 2.92Å; R637-D696 PolarHBondContact NE-OD2 2.92Å; R637-D696 VanDerWaalsContact NE-OD2 3.16Å; R637-D696 IonicContact NH1-OD1 2.69Å; R637-D696 PolarHBondContact NH1-OD1 3.29Å; R637-D696 IonicContact NH1-OD2 3.96Å; R637-D696 PolarHBondContact NH1-OD2 3.25Å; R637-D696 VanDerWaalsContact NH2-CG 3.28Å; R637-D696 IonicContact NH2-OD1 3.29Å; R637-D696 PolarHBondContact NH2-OD1 2.89Å; R637-D696 IonicContact NH2-OD2 3.33Å; R637-D696 PolarHBondContact NH2-OD2 3.04Å
638	D	75.1	Confident	67.2	Low	98 Å²	98	69.1 Å²	69.1	52%	0.524	37%	0.366	S	S	.	.	H	α-helix	trans	-67.3	-22.7	-177.8	-85.3	22.3	0	0	0	113.3	K590 E634 L635 L640	K590-D638 VanDerWaalsContact CE-OD2 3.23Å; K590-D638 WeakPolarHBondContact CE-OD2 3.35Å; K590-D638 IonicContact NZ-OD1 2.74Å; K590-D638 PolarHBondContact NZ-OD1 2.93Å; K590-D638 IonicContact NZ-OD2 2.67Å; K590-D638 PolarHBondContact NZ-OD2 3.16Å; E634-D638 PolarHBondContact O-N 2.73Å; L635-D638 PolarHBondContact O-N 2.96Å; L635-D638 VanDerWaalsContact O-N 3.14Å; D638-L640 PolarHBondContact O-N 3.08Å
639	H	69.3	Low	65.9	Low	72 Å²	72	71.4 Å²	71.4	33%	0.333	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-15.7	172.4	-70	-68.8	0	0	0	113.7	E597 L635 R637	E597-H639 IonicContact OE2-CE1 2.88Å; E597-H639 PolarHBondContact OE2-CE1 2.85Å; E597-H639 IonicContact OE2-NE2 3.48Å; E597-H639 PolarHBondContact OE2-NE2 2.8Å; L635-H639 WeakPolarHBondContact CD2-NE2 3.49Å; L635-H639 PolarHBondContact O-CD2 3.47Å; L635-H639 PolarHBondContact O-N 3.29Å; R637-H639 PolarHBondContact O-N 3.49Å
640	L	67.9	Low	64.9	Low	27 Å²	27	80.4 Å²	80.4	14%	0.141	42%	0.421	C	S	.	.	S	Bend	trans	-81.3	121.9	170	-73.8	100.4	0	0	0	110.2	T636 R637 D638 S642 D652 E655 F656 L698	T636-L640 WeakPolarHBondContact O-CD1 3.47Å; R637-L640 PolarHBondContact O-N 3.39Å; D638-L640 PolarHBondContact O-N 3.08Å; L640-S642 PolarHBondContact O-N 3.43Å; L640-D652 HydrophobicContact CD2-CB 4.11Å; L640-E655 HydrophobicContact CD2-CB 4.38Å; L640-F656 HydrophobicContact CD1-CB 3.88Å; L640-F656 HydrophobicContact CD1-CD2 3.61Å; L640-F656 HydrophobicContact CD1-CG 4.24Å; L640-F656 HydrophobicContact CD2-CB 4.44Å; L640-L698 HydrophobicContact CD1-CD2 4.46Å
641	S	54.3	Low	63.9	Low	91 Å²	91	81.9 Å²	81.9	64%	0.636	44%	0.439	S	S	*	.			trans	-43.4	127.2	176.7	175.1	0	0	0	0	111.9	K643	S641-K643 VanDerWaalsContact C-N 3.3Å; S641-K643 PolarHBondContact O-N 3.06Å
642	S	48.9	Very low	63	Low	120 Å²	120	84.3 Å²	84.3	84%	0.839	45%	0.452	S	S	*	.			trans	-53.1	80	178.6	63.7	0	0	0	0	113.9	L640	L640-S642 PolarHBondContact O-N 3.43Å
643	K	42.7	Very low	62.1	Low	173 Å²	173	85.4 Å²	85.4	75%	0.752	46%	0.459	S	S	*	.			trans	-123.3	104.8	166.3	-72.9	-175.2	-178.9	174.3	0	108.6	S641	S641-K643 VanDerWaalsContact C-N 3.3Å; S641-K643 PolarHBondContact O-N 3.06Å
644	S	40.8	Very low	61.5	Low	108 Å²	108	89.7 Å²	89.7	76%	0.755	49%	0.485	S	S	*	.			trans	30.9	105.2	161.6	50.8	0	0	0	0	117.1	N646	S644-N646 PolarHBondContact O-N 3.46Å
645	Q	44.3	Very low	61	Low	156 Å²	156	90.5 Å²	90.5	73%	0.729	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.4	106.8	151	-64.5	171.3	-15.2	0	0	108.6
646	N	42.2	Very low	60.5	Low	157 Å²	157	90.5 Å²	90.5	84%	0.84	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	161.8	0.5	142.3	-77.8	-15.9	0	0	0	116.8	S644	S644-N646 PolarHBondContact O-N 3.46Å
647	E	43.8	Very low	60.1	Low	181 Å²	181	91.4 Å²	91.4	85%	0.846	49%	0.493	S	S	*	.			trans	-135	113.8	169.3	-71.7	-175	172.3	0	0	111.3	S649	E647-S649 PolarHBondContact O-N 3.28Å
648	C	52.1	Low	60.1	Low	58 Å²	58	89.8 Å²	89.8	39%	0.392	50%	0.499	S	S	.	.			trans	-80.6	100.9	180	-164.8	0	0	0	0	109.1
649	S	58.5	Low	60.1	Low	52 Å²	52	87 Å²	87	36%	0.364	48%	0.484	S	S	.	.			trans	-80.9	150.9	172.6	82.5	0	0	0	0	110.2	E647 A651 D652 V653	E647-S649 PolarHBondContact O-N 3.28Å; S649-A651 PolarHBondContact O-N 2.92Å; S649-A651 VanDerWaalsContact O-N 3.14Å; S649-D652 WeakPolarHBondContact CB-OD2 3.39Å; S649-D652 PolarHBondContact N-OD2 3.31Å; S649-D652 VanDerWaalsContact N-OD2 3.17Å; S649-D652 PolarHBondContact O-N 2.59Å; S649-D652 PolarHBondContact OG-N 3.18Å; S649-D652 PolarHBondContact OG-OD1 3.24Å; S649-D652 PolarHBondContact OG-OD2 3.12Å; S649-V653 PolarHBondContact O-N 2.64Å
650	K	61.3	Low	60.5	Low	191 Å²	191	83.5 Å²	83.5	83%	0.83	47%	0.468	S	S	*	.	H	α-helix	trans	-58.6	-24.8	176	-77	-173.9	176	-176.3	0	112.8	T654	K650-T654 PolarHBondContact O-N 3.14Å; K650-T654 PolarHBondContact O-OG1 2.88Å
651	A	62.2	Low	61	Low	59 Å²	59	87.7 Å²	87.7	49%	0.488	48%	0.482	S	S	.	.	H	α-helix	trans	-70.9	-41.3	178	0	0	0	0	0	111.9	S649 V653 T654 E655	S649-A651 PolarHBondContact O-N 2.92Å; S649-A651 VanDerWaalsContact O-N 3.14Å; A651-V653 VanDerWaalsContact C-N 3.29Å; A651-V653 PolarHBondContact O-N 2.87Å; A651-T654 WeakPolarHBondContact CA-OG1 3.24Å; A651-T654 PolarHBondContact O-N 2.93Å; A651-T654 PolarHBondContact O-OG1 3.45Å; A651-E655 PolarHBondContact O-N 3.25Å
652	D	66.6	Low	62.2	Low	51 Å²	51	88.8 Å²	88.8	27%	0.273	48%	0.476	S	S	.	.	H	α-helix	trans	-64.7	-36.4	179.2	-51.7	-43	0	0	0	111.2	L640 S649 E655 F656 L698	L640-D652 HydrophobicContact CD2-CB 4.11Å; S649-D652 WeakPolarHBondContact CB-OD2 3.39Å; S649-D652 PolarHBondContact N-OD2 3.31Å; S649-D652 VanDerWaalsContact N-OD2 3.17Å; S649-D652 PolarHBondContact O-N 2.59Å; S649-D652 PolarHBondContact OG-N 3.18Å; S649-D652 PolarHBondContact OG-OD1 3.24Å; S649-D652 PolarHBondContact OG-OD2 3.12Å; D652-E655 PolarHBondContact O-N 3.42Å; D652-F656 VanDerWaalsContact O-CB 3.27Å; D652-F656 WeakPolarHBondContact O-CB 3.31Å; D652-F656 PolarHBondContact O-N 3.09Å; D652-L698 HydrophobicContact CB-CD1 3.96Å
653	V	66.2	Low	63.4	Low	27 Å²	27	83.2 Å²	83.2	16%	0.164	44%	0.436	C	S	.	.	H	α-helix	trans	-64	-44.8	174.3	173.7	0	0	0	0	111	S649 A651 E655 F656 I657 A701	S649-V653 PolarHBondContact O-N 2.64Å; A651-V653 VanDerWaalsContact C-N 3.29Å; A651-V653 PolarHBondContact O-N 2.87Å; V653-E655 PolarHBondContact O-N 2.69Å; V653-F656 PolarHBondContact O-N 3.45Å; V653-I657 HydrophobicContact CG1-CD1 3.68Å; V653-I657 WeakPolarHBondContact O-CD1 3.4Å; V653-I657 WeakPolarHBondContact O-CG1 3.36Å; V653-I657 PolarHBondContact O-N 3.45Å; V653-A701 HydrophobicContact CG2-CB 4.11Å
654	T	70.6	Confident	65	Low	93 Å²	93	75 Å²	75	57%	0.571	40%	0.401	S	S	*	.	H	α-helix	trans	-67.2	-35.7	178.5	50.3	0	0	0	0	113.1	K650 A651 A658	K650-T654 PolarHBondContact O-N 3.14Å; K650-T654 PolarHBondContact O-OG1 2.88Å; A651-T654 WeakPolarHBondContact CA-OG1 3.24Å; A651-T654 PolarHBondContact O-N 2.93Å; A651-T654 PolarHBondContact O-OG1 3.45Å; T654-A658 WeakPolarHBondContact O-CB 3.33Å; T654-A658 PolarHBondContact O-N 2.97Å; T654-A658 VanDerWaalsContact O-N 3.08Å
655	E	73.1	Confident	66.6	Low	97 Å²	97	75.3 Å²	75.3	45%	0.453	39%	0.393	S	S	.	.	H	α-helix	trans	-71.8	-40.6	177.3	-170.7	172.3	179.7	0	0	111.5	L640 A651 D652 V653 A658 N659	L640-E655 HydrophobicContact CD2-CB 4.38Å; A651-E655 PolarHBondContact O-N 3.25Å; D652-E655 PolarHBondContact O-N 3.42Å; V653-E655 PolarHBondContact O-N 2.69Å; E655-A658 PolarHBondContact O-N 3.04Å; E655-N659 PolarHBondContact O-N 3.24Å; E655-N659 PolarHBondContact O-ND2 3.44Å
656	F	73.6	Confident	68	Low	0 Å²	0	72 Å²	72	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-60.2	-46.1	172.8	-179.1	-93.3	0	0	0	111.9	L633 T636 R637 L640 D652 V653 A658 N659 L660 L698 I699 I706	L633-F656 HydrophobicContact CD2-CZ 4.45Å; T636-F656 WeakPolarHBondContact OG1-CE2 3.43Å; T636-F656 VanDerWaalsContact OG1-CZ 3.23Å; T636-F656 WeakPolarHBondContact OG1-CZ 3.4Å; R637-F656 HydrophobicContact CB-CE2 4.38Å; L640-F656 HydrophobicContact CD1-CB 3.88Å; L640-F656 HydrophobicContact CD1-CD2 3.61Å; L640-F656 HydrophobicContact CD1-CG 4.24Å; L640-F656 HydrophobicContact CD2-CB 4.44Å; D652-F656 VanDerWaalsContact O-CB 3.27Å; D652-F656 WeakPolarHBondContact O-CB 3.31Å; D652-F656 PolarHBondContact O-N 3.09Å; V653-F656 PolarHBondContact O-N 3.45Å; F656-A658 VanDerWaalsContact C-N 3.34Å; F656-A658 PolarHBondContact O-N 2.98Å; F656-N659 PolarHBondContact O-N 3.48Å; F656-L660 HydrophobicContact CE1-CD2 4.24Å; F656-L660 VanDerWaalsContact O-CB 3.28Å; F656-L660 WeakPolarHBondContact O-CB 3.43Å; F656-L660 PolarHBondContact O-N 3.39Å; F656-L698 HydrophobicContact CB-CD2 3.94Å; F656-L698 HydrophobicContact CD1-CD2 4.44Å; F656-L698 HydrophobicContact CD2-CD2 3.39Å; F656-L698 HydrophobicContact CE2-CD2 3.94Å; F656-L698 HydrophobicContact CG-CD2 3.67Å; F656-I699 HydrophobicContact CZ-CG1 4.16Å; F656-I706 HydrophobicContact CE1-CD1 3.78Å; F656-I706 HydrophobicContact CE1-CG1 4.13Å; F656-I706 HydrophobicContact CZ-CD1 4.46Å
657	I	71.8	Confident	69.7	Low	18 Å²	18	65.1 Å²	65.1	9%	0.092	34%	0.343	C	S	.	.	H	α-helix	trans	-63.7	-40.3	178.5	-67.2	160.8	0	0	0	111.2	V653 L660 R661	V653-I657 HydrophobicContact CG1-CD1 3.68Å; V653-I657 WeakPolarHBondContact O-CD1 3.4Å; V653-I657 WeakPolarHBondContact O-CG1 3.36Å; V653-I657 PolarHBondContact O-N 3.45Å; I657-L660 PolarHBondContact O-N 3.24Å; I657-R661 WeakPolarHBondContact O-CB 3.35Å; I657-R661 WeakPolarHBondContact O-CG 3.18Å; I657-R661 PolarHBondContact O-N 3.24Å
658	A	76.3	Confident	71	Confident	56 Å²	56	58.4 Å²	58.4	46%	0.463	31%	0.313	S	S	.	.	H	α-helix	trans	-64.3	-43.4	177.6	0	0	0	0	0	112.1	T654 E655 F656 R661 K662	T654-A658 WeakPolarHBondContact O-CB 3.33Å; T654-A658 PolarHBondContact O-N 2.97Å; T654-A658 VanDerWaalsContact O-N 3.08Å; E655-A658 PolarHBondContact O-N 3.04Å; F656-A658 VanDerWaalsContact C-N 3.34Å; F656-A658 PolarHBondContact O-N 2.98Å; A658-R661 PolarHBondContact O-N 3.12Å; A658-K662 PolarHBondContact O-N 2.91Å; A658-K662 VanDerWaalsContact O-N 3.14Å
659	N	75.6	Confident	72	Confident	39 Å²	39	59.1 Å²	59.1	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-68.6	-39.7	176.9	-73.2	-27	0	0	0	112	E655 F656 K662 L663	E655-N659 PolarHBondContact O-N 3.24Å; E655-N659 PolarHBondContact O-ND2 3.44Å; F656-N659 PolarHBondContact O-N 3.48Å; N659-K662 PolarHBondContact O-N 3.47Å; N659-L663 WeakPolarHBondContact O-CB 3.34Å; N659-L663 WeakPolarHBondContact O-CG 3.37Å; N659-L663 PolarHBondContact O-N 2.67Å
660	L	77.5	Confident	72.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-44.9	174.9	-179	68.7	0	0	0	111.6	L633 T636 F656 I657 K662 L663 L664 I706	L633-L660 HydrophobicContact CD2-CD1 4.25Å; T636-L660 HydrophobicContact CG2-CB 4.28Å; T636-L660 HydrophobicContact CG2-CD1 3.53Å; F656-L660 HydrophobicContact CE1-CD2 4.24Å; F656-L660 VanDerWaalsContact O-CB 3.28Å; F656-L660 WeakPolarHBondContact O-CB 3.43Å; F656-L660 PolarHBondContact O-N 3.39Å; I657-L660 PolarHBondContact O-N 3.24Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 3.45Å; L660-L663 PolarHBondContact O-N 2.82Å; L660-L664 HydrophobicContact CD1-CD1 4.05Å; L660-L664 HydrophobicContact CD1-CG 4.12Å; L660-L664 HydrophobicContact CD2-CD1 4.36Å; L660-L664 HydrophobicContact CG-CD1 3.81Å; L660-L664 HydrophobicContact CG-CG 4.29Å; L660-L664 WeakPolarHBondContact O-CB 3.3Å; L660-L664 WeakPolarHBondContact O-CG 3.45Å; L660-L664 PolarHBondContact O-N 2.94Å; L660-I706 HydrophobicContact CD2-CB 4.16Å; L660-I706 HydrophobicContact CD2-CG1 3.67Å; L660-I706 HydrophobicContact CD2-CG2 4Å
661	R	78.7	Confident	73.4	Confident	114 Å²	114	48 Å²	48	43%	0.43	26%	0.262	S	S	.	.	H	α-helix	trans	-58.1	-43.6	174.5	-78.6	175.2	-179.6	-179.4	-3.5	112	I657 A658 L665 T709	I657-R661 WeakPolarHBondContact O-CB 3.35Å; I657-R661 WeakPolarHBondContact O-CG 3.18Å; I657-R661 PolarHBondContact O-N 3.24Å; A658-R661 PolarHBondContact O-N 3.12Å; R661-L665 WeakPolarHBondContact O-CB 3.48Å; R661-L665 VanDerWaalsContact O-CG 3.25Å; R661-L665 WeakPolarHBondContact O-CG 3.36Å; R661-L665 PolarHBondContact O-N 3.38Å; R661-T709 HydrophobicContact CG-CG2 3.46Å; R661-T709 VanDerWaalsContact CG-CG2 3.46Å; R661-T709 PolarHBondContact NE-OG1 3.32Å
662	K	78.5	Confident	73.8	Confident	115 Å²	115	48.3 Å²	48.3	50%	0.5	26%	0.26	S	S	.	.	H	α-helix	trans	-64	-43.1	178.4	-172.7	-173.6	175.1	-158.1	0	112.1	A658 N659 L660 N666	A658-K662 PolarHBondContact O-N 2.91Å; A658-K662 VanDerWaalsContact O-N 3.14Å; N659-K662 PolarHBondContact O-N 3.47Å; L660-K662 VanDerWaalsContact C-N 3.31Å; L660-K662 PolarHBondContact O-N 3.45Å; K662-N666 VanDerWaalsContact O-CG 3.26Å; K662-N666 PolarHBondContact O-N 3.11Å; K662-N666 PolarHBondContact O-ND2 3.3Å
663	L	75.1	Confident	74	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-72.8	-40	-179.5	-71	163.7	0	0	0	111.7	E597 L632 L635 T636 N659 L660 N666 F667	E597-L663 HydrophobicContact CG-CD2 4.42Å; L632-L663 HydrophobicContact CD1-CB 4.35Å; L635-L663 HydrophobicContact CD2-CD1 3.45Å; L635-L663 VanDerWaalsContact CD2-CD1 3.45Å; L635-L663 HydrophobicContact CD2-CD2 3.72Å; L635-L663 HydrophobicContact CD2-CG 4.22Å; T636-L663 HydrophobicContact CG2-CB 4.29Å; T636-L663 HydrophobicContact CG2-CD1 3.36Å; T636-L663 HydrophobicContact CG2-CG 4.45Å; N659-L663 WeakPolarHBondContact O-CB 3.34Å; N659-L663 WeakPolarHBondContact O-CG 3.37Å; N659-L663 PolarHBondContact O-N 2.67Å; L660-L663 PolarHBondContact O-N 2.82Å; L663-N666 PolarHBondContact O-N 3.36Å; L663-F667 HydrophobicContact CB-CD2 4.31Å; L663-F667 HydrophobicContact CB-CE2 4.46Å; L663-F667 HydrophobicContact CD2-CD2 4.35Å; L663-F667 HydrophobicContact CD2-CE2 3.69Å; L663-F667 WeakPolarHBondContact O-CB 3.4Å; L663-F667 WeakPolarHBondContact O-CD2 3.23Å; L663-F667 PolarHBondContact O-N 2.9Å
664	L	75.9	Confident	74	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.2	-44.2	172.8	-77	171.8	0	0	0	111.2	L632 L660 N666 F667 N668 L671 T709 L715	L632-L664 HydrophobicContact CD2-CD2 3.58Å; L632-L664 HydrophobicContact CD2-CG 4.29Å; L660-L664 HydrophobicContact CD1-CD1 4.05Å; L660-L664 HydrophobicContact CD1-CG 4.12Å; L660-L664 HydrophobicContact CD2-CD1 4.36Å; L660-L664 HydrophobicContact CG-CD1 3.81Å; L660-L664 HydrophobicContact CG-CG 4.29Å; L660-L664 WeakPolarHBondContact O-CB 3.3Å; L660-L664 WeakPolarHBondContact O-CG 3.45Å; L660-L664 PolarHBondContact O-N 2.94Å; L664-N666 VanDerWaalsContact C-N 3.29Å; L664-N666 PolarHBondContact O-N 3.21Å; L664-F667 CarbonylContact O-C 3.55Å; L664-F667 PolarHBondContact O-N 3.22Å; L664-N668 WeakPolarHBondContact O-CA 2.94Å; L664-N668 WeakPolarHBondContact O-CB 3.46Å; L664-N668 PolarHBondContact O-N 2.97Å; L664-L671 HydrophobicContact CD2-CD1 3.92Å; L664-T709 HydrophobicContact CD1-CG2 3.77Å; L664-L715 HydrophobicContact CD2-CD1 3.85Å
665	L	75.3	Confident	73.7	Confident	115 Å²	115	43 Å²	43	60%	0.602	23%	0.231	S	C	*	.	H	α-helix	trans	-59.9	-39	175.5	-74.3	168.4	0	0	0	112.8	R661	R661-L665 WeakPolarHBondContact O-CB 3.48Å; R661-L665 VanDerWaalsContact O-CG 3.25Å; R661-L665 WeakPolarHBondContact O-CG 3.36Å; R661-L665 PolarHBondContact O-N 3.38Å
666	N	73.2	Confident	73.3	Confident	87 Å²	87	42.6 Å²	42.6	47%	0.465	24%	0.239	S	C	.	.	H	α-helix	trans	-72.4	-35.6	178.9	-70.3	-16	0	0	0	112.7	K662 L663 L664	K662-N666 VanDerWaalsContact O-CG 3.26Å; K662-N666 PolarHBondContact O-N 3.11Å; K662-N666 PolarHBondContact O-ND2 3.3Å; L663-N666 PolarHBondContact O-N 3.36Å; L664-N666 VanDerWaalsContact C-N 3.29Å; L664-N666 PolarHBondContact O-N 3.21Å
667	F	76.9	Confident	72.7	Confident	12 Å²	12	46.6 Å²	46.6	5%	0.053	28%	0.28	C	S	.	.	H	α-helix	trans	-105.5	2.6	-174.4	-60.1	-54.8	0	0	0	114.3	L593 E597 L606 L632 L663 L664 T669 V670 L671	L593-F667 HydrophobicContact CB-CZ 4.31Å; L593-F667 HydrophobicContact CD2-CD1 4.18Å; L593-F667 HydrophobicContact CD2-CE1 4.09Å; L593-F667 HydrophobicContact CD2-CZ 4.26Å; E597-F667 HydrophobicContact CB-CZ 4.5Å; L606-F667 HydrophobicContact CD2-CD1 3.46Å; L606-F667 VanDerWaalsContact CD2-CD1 3.46Å; L606-F667 HydrophobicContact CD2-CE1 3.21Å; L606-F667 HydrophobicContact CD2-CZ 4.37Å; L632-F667 HydrophobicContact CD1-CD2 3.64Å; L632-F667 HydrophobicContact CD1-CE2 4.19Å; L663-F667 HydrophobicContact CB-CD2 4.31Å; L663-F667 HydrophobicContact CB-CE2 4.46Å; L663-F667 HydrophobicContact CD2-CD2 4.35Å; L663-F667 HydrophobicContact CD2-CE2 3.69Å; L663-F667 WeakPolarHBondContact O-CB 3.4Å; L663-F667 WeakPolarHBondContact O-CD2 3.23Å; L663-F667 PolarHBondContact O-N 2.9Å; L664-F667 CarbonylContact O-C 3.55Å; L664-F667 PolarHBondContact O-N 3.22Å; F667-T669 VanDerWaalsContact C-N 3.26Å; F667-T669 PolarHBondContact O-N 3.43Å; F667-V670 HydrophobicContact CD1-CG2 4.42Å; F667-V670 CarbonylContact O-C 3.58Å; F667-V670 WeakPolarHBondContact O-CA 3.24Å; F667-V670 WeakPolarHBondContact O-CB 3.46Å; F667-V670 PolarHBondContact O-N 3.22Å; F667-L671 PolarHBondContact O-N 2.89Å
668	N	72.5	Confident	72.2	Confident	39 Å²	39	48.4 Å²	48.4	21%	0.209	29%	0.288	C	S	.	.	H	α-helix	trans	-58.8	-41.7	-179.5	-164	-3.2	0	0	0	111	L664 V670 L671 S672 N713 L715	L664-N668 WeakPolarHBondContact O-CA 2.94Å; L664-N668 WeakPolarHBondContact O-CB 3.46Å; L664-N668 PolarHBondContact O-N 2.97Å; N668-V670 PolarHBondContact O-N 3.03Å; N668-L671 PolarHBondContact O-N 2.89Å; N668-S672 WeakPolarHBondContact O-CB 3.03Å; N668-S672 PolarHBondContact O-N 3.47Å; N668-S672 PolarHBondContact O-OG 3.42Å; N668-N713 PolarHBondContact ND2-O 2.92Å; N668-L715 WeakPolarHBondContact OD1-CD2 3.45Å
669	T	73.5	Confident	71.5	Confident	73 Å²	73	53.6 Å²	53.6	45%	0.448	30%	0.302	S	S	.	.	H	α-helix	trans	-62.3	-31.3	174.4	55.1	0	0	0	0	112.8	A603 F667 S672 S673	A603-T669 WeakPolarHBondContact CB-OG1 3.15Å; F667-T669 VanDerWaalsContact C-N 3.26Å; F667-T669 PolarHBondContact O-N 3.43Å; T669-S672 WeakPolarHBondContact CA-OG 3.26Å; T669-S672 PolarHBondContact O-OG 2.97Å; T669-S673 WeakPolarHBondContact O-CB 3.19Å; T669-S673 PolarHBondContact O-N 3.35Å
670	V	74.1	Confident	71.2	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.012	31%	0.311	C	S	.	.	H	α-helix	trans	-77.6	-45.2	177.7	-179.1	0	0	0	0	110.9	A603 L606 I607 F667 N668 S673 C674	A603-V670 HydrophobicContact CB-CG2 4.37Å; L606-V670 HydrophobicContact CB-CG2 4.39Å; L606-V670 HydrophobicContact CD2-CG2 3.98Å; L606-V670 HydrophobicContact CG-CG2 4.48Å; I607-V670 HydrophobicContact CD1-CG2 4.37Å; I607-V670 HydrophobicContact CG1-CB 4.04Å; I607-V670 HydrophobicContact CG1-CG1 3.92Å; I607-V670 HydrophobicContact CG1-CG2 3.83Å; F667-V670 HydrophobicContact CD1-CG2 4.42Å; F667-V670 CarbonylContact O-C 3.58Å; F667-V670 WeakPolarHBondContact O-CA 3.24Å; F667-V670 WeakPolarHBondContact O-CB 3.46Å; F667-V670 PolarHBondContact O-N 3.22Å; N668-V670 PolarHBondContact O-N 3.03Å; V670-S673 PolarHBondContact O-N 3Å; V670-C674 VanDerWaalsContact O-CB 3.23Å; V670-C674 WeakPolarHBondContact O-CB 3.28Å; V670-C674 PolarHBondContact O-N 3.31Å; V670-C674 PolarHBondContact O-SG 2.92Å
671	L	73.4	Confident	70.8	Confident	9 Å²	9	56.9 Å²	56.9	5%	0.047	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-46.4	177.5	-68.1	173.2	0	0	0	112	L628 L632 L664 F667 N668 M675 Y685 L715	L628-L671 HydrophobicContact CD2-CD2 3.69Å; L628-L671 HydrophobicContact CG-CD2 3.93Å; L632-L671 HydrophobicContact CD2-CD1 4.2Å; L664-L671 HydrophobicContact CD2-CD1 3.92Å; F667-L671 PolarHBondContact O-N 2.89Å; N668-L671 PolarHBondContact O-N 2.89Å; L671-M675 PolarHBondContact O-N 3.46Å; L671-Y685 PolarHBondContact O-OH 3.25Å; L671-L715 HydrophobicContact CB-CD2 4.18Å; L671-L715 HydrophobicContact CD1-CD1 4.05Å; L671-L715 HydrophobicContact CD1-CD2 4.48Å
672	S	71.6	Confident	70.5	Confident	65 Å²	65	51.5 Å²	51.5	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-66.2	-38	178.7	54.2	0	0	0	0	112.8	N668 T669 S676	N668-S672 WeakPolarHBondContact O-CB 3.03Å; N668-S672 PolarHBondContact O-N 3.47Å; N668-S672 PolarHBondContact O-OG 3.42Å; T669-S672 WeakPolarHBondContact CA-OG 3.26Å; T669-S672 PolarHBondContact O-OG 2.97Å; S672-S676 PolarHBondContact O-N 2.55Å
673	S	71.9	Confident	70.6	Confident	49 Å²	49	48.7 Å²	48.7	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-73.6	-43.2	178.6	-172.7	0	0	0	0	112.6	T669 V670 M675 S676	T669-S673 WeakPolarHBondContact O-CB 3.19Å; T669-S673 PolarHBondContact O-N 3.35Å; V670-S673 PolarHBondContact O-N 3Å; S673-M675 PolarHBondContact O-N 3.33Å; S673-S676 WeakPolarHBondContact O-CB 3.26Å; S673-S676 PolarHBondContact O-N 3.08Å; S673-S676 PolarHBondContact O-OG 3.43Å
674	C	64.7	Low	70.7	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.034	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-25.1	-179.3	-72.9	0	0	0	0	113.7	F624 L628 V670	F624-C674 HydrophobicContact CE1-CB 4.37Å; L628-C674 HydrophobicContact CD2-CB 4.47Å; V670-C674 VanDerWaalsContact O-CB 3.23Å; V670-C674 WeakPolarHBondContact O-CB 3.28Å; V670-C674 PolarHBondContact O-N 3.31Å; V670-C674 PolarHBondContact O-SG 2.92Å
675	M	65.1	Low	70.9	Confident	5 Å²	5	49.5 Å²	49.5	3%	0.025	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	10.9	179.5	-62.8	-62.2	-70.9	0	0	113.6	I621 L671 S673 G677 F678 T681 Y685	I621-M675 HydrophobicContact CG1-CE 4.28Å; I621-M675 HydrophobicContact CG1-SD 3.97Å; I621-M675 WeakPolarHBondContact O-CE 3.16Å; L671-M675 PolarHBondContact O-N 3.46Å; S673-M675 PolarHBondContact O-N 3.33Å; M675-G677 PolarHBondContact O-N 3.31Å; M675-F678 HydrophobicContact CE-CB 4.28Å; M675-F678 HydrophobicContact CE-CD1 4.22Å; M675-F678 HydrophobicContact CE-CG 4.4Å; M675-F678 PolarHBondContact O-N 3.36Å; M675-T681 HydrophobicContact CB-CG2 3.71Å; M675-T681 HydrophobicContact CE-CG2 4.1Å; M675-Y685 HydrophobicContact CG-CE1 4.49Å; M675-Y685 VanDerWaalsContact CG-OH 3.28Å; M675-Y685 WeakPolarHBondContact CG-OH 3.47Å
676	S	63.6	Low	71.2	Confident	89 Å²	89	44.1 Å²	44.1	62%	0.622	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	113.9	178	59	0	0	0	0	110.9	S672 S673	S672-S676 PolarHBondContact O-N 2.55Å; S673-S676 WeakPolarHBondContact O-CB 3.26Å; S673-S676 PolarHBondContact O-N 3.08Å; S673-S676 PolarHBondContact O-OG 3.43Å
677	G	61	Low	71.5	Confident	84 Å²	84	41.6 Å²	41.6	87%	0.866	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	110.8	-5.7	179.2	0	0	0	0	0	116.1	M675	M675-G677 PolarHBondContact O-N 3.31Å
678	F	61	Low	71.7	Confident	55 Å²	55	41 Å²	41	24%	0.241	25%	0.246	C	C	.	.			trans	-91.5	133.7	171.2	-165.7	-106.5	0	0	0	110.8	I621 E622 M675 T681 V684	I621-F678 HydrophobicContact CG2-CD2 3.89Å; I621-F678 HydrophobicContact CG2-CE2 4.34Å; E622-F678 HydrophobicContact CB-CZ 4.44Å; E622-F678 HydrophobicContact CG-CD2 4.42Å; E622-F678 HydrophobicContact CG-CE1 4.46Å; E622-F678 HydrophobicContact CG-CE2 3.51Å; E622-F678 HydrophobicContact CG-CZ 3.53Å; E622-F678 VanDerWaalsContact OE1-CE2 3.3Å; E622-F678 WeakPolarHBondContact OE1-CE2 3.31Å; M675-F678 HydrophobicContact CE-CB 4.28Å; M675-F678 HydrophobicContact CE-CD1 4.22Å; M675-F678 HydrophobicContact CE-CG 4.4Å; M675-F678 PolarHBondContact O-N 3.36Å; F678-T681 HydrophobicContact CB-CG2 3.92Å; F678-T681 HydrophobicContact CD1-CG2 4.08Å; F678-T681 WeakPolarHBondContact O-CG2 3.15Å; F678-V684 HydrophobicContact CE1-CG2 4.11Å
679	Q	62.9	Low	72.1	Confident	165 Å²	165	39.3 Å²	39.3	77%	0.771	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.2	139	174.6	-69.7	-177.1	-19.9	0	0	109.5
680	N	68.4	Low	72.4	Confident	73 Å²	73	35.9 Å²	35.9	39%	0.39	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	65	41.6	179.6	-41.7	-42.8	0	0	0	115.2	G682 R683	N680-G682 PolarHBondContact O-N 3.01Å; N680-R683 VanDerWaalsContact CB-CD 3.46Å; N680-R683 HydrophobicContact CB-CG 3.92Å; N680-R683 WeakPolarHBondContact O-CB 3.35Å; N680-R683 PolarHBondContact O-N 2.93Å; N680-R683 VanDerWaalsContact O-N 3.13Å
681	T	69.5	Low	72.8	Confident	36 Å²	36	36.3 Å²	36.3	22%	0.221	22%	0.218	C	C	.	.	H	α-helix	trans	-55.8	-31.9	175.4	49.2	0	0	0	0	113	M675 F678 R683 V684 Y685	M675-T681 HydrophobicContact CB-CG2 3.71Å; M675-T681 HydrophobicContact CE-CG2 4.1Å; F678-T681 HydrophobicContact CB-CG2 3.92Å; F678-T681 HydrophobicContact CD1-CG2 4.08Å; F678-T681 WeakPolarHBondContact O-CG2 3.15Å; T681-R683 PolarHBondContact O-N 3.29Å; T681-V684 PolarHBondContact O-N 3Å; T681-Y685 WeakPolarHBondContact O-CD2 3.34Å; T681-Y685 PolarHBondContact O-N 3.2Å
682	G	72.3	Confident	73	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-34.3	178.4	0	0	0	0	0	112.9	N680 V684 Y685 L686 D720	N680-G682 PolarHBondContact O-N 3.01Å; G682-V684 PolarHBondContact O-N 3.32Å; G682-Y685 PolarHBondContact O-N 3.21Å; G682-L686 VanDerWaalsContact O-CG 3.31Å; G682-L686 WeakPolarHBondContact O-CG 3.41Å; G682-L686 PolarHBondContact O-N 3.32Å; G682-D720 WeakPolarHBondContact CA-OD2 3.37Å; G682-D720 PolarHBondContact N-OD2 2.75Å
683	R	80.5	Confident	73.4	Confident	56 Å²	56	33.6 Å²	33.6	21%	0.211	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-40.8	179.6	-60.7	178.1	-172.8	-170.1	0.7	112.5	N680 T681 L686 Q687 D720 W723	N680-R683 VanDerWaalsContact CB-CD 3.46Å; N680-R683 HydrophobicContact CB-CG 3.92Å; N680-R683 WeakPolarHBondContact O-CB 3.35Å; N680-R683 PolarHBondContact O-N 2.93Å; N680-R683 VanDerWaalsContact O-N 3.13Å; T681-R683 PolarHBondContact O-N 3.29Å; R683-L686 PolarHBondContact O-N 2.99Å; R683-Q687 VanDerWaalsContact O-CG 3.27Å; R683-Q687 WeakPolarHBondContact O-CG 3.42Å; R683-Q687 PolarHBondContact O-N 3.09Å; R683-D720 HydrophobicContact CG-CB 3.94Å; R683-D720 VanDerWaalsContact CG-OD1 3.28Å; R683-D720 WeakPolarHBondContact CG-OD1 3.38Å; R683-D720 IonicContact CZ-OD1 2.7Å; R683-D720 IonicContact NE-OD1 2.8Å; R683-D720 PolarHBondContact NE-OD1 3.01Å; R683-D720 IonicContact NH2-OD1 3.63Å; R683-W723 HydrophobicContact CB-CE3 3.83Å; R683-W723 HydrophobicContact CB-CZ3 3.69Å; R683-W723 VanDerWaalsContact CD-CD2 3.45Å; R683-W723 HydrophobicContact CG-CD2 4.07Å; R683-W723 HydrophobicContact CG-CE3 3.47Å; R683-W723 VanDerWaalsContact CG-CE3 3.47Å; R683-W723 HydrophobicContact CG-CZ3 3.86Å; R683-W723 VanDerWaalsContact CZ-CG 3.43Å; R683-W723 VanDerWaalsContact NH1-CD1 3.33Å
684	V	77	Confident	73.6	Confident	14 Å²	14	31.5 Å²	31.5	9%	0.085	19%	0.187	C	C	.	.	H	α-helix	trans	-69.5	-40.8	-179.5	-179.7	0	0	0	0	110.5	E622 F626 F678 T681 G682 Q687 A688	E622-V684 VanDerWaalsContact O-CG1 3.32Å; E622-V684 WeakPolarHBondContact O-CG1 3.47Å; F626-V684 HydrophobicContact CB-CG1 3.85Å; F678-V684 HydrophobicContact CE1-CG2 4.11Å; T681-V684 PolarHBondContact O-N 3Å; G682-V684 PolarHBondContact O-N 3.32Å; V684-Q687 PolarHBondContact O-N 2.71Å; V684-A688 PolarHBondContact O-N 3.17Å
685	Y	81.1	Confident	74	Confident	7 Å²	7	39 Å²	39	3%	0.027	22%	0.215	C	C	.	.	H	α-helix	trans	-62.5	-43.6	174.8	-60.9	-33.4	0	0	0	112	T629 L671 M675 T681 G682 A688 V689 L715	T629-Y685 HydrophobicContact CG2-CD1 4.45Å; T629-Y685 WeakPolarHBondContact OG1-CD1 3.38Å; T629-Y685 WeakPolarHBondContact OG1-CE1 3.42Å; L671-Y685 PolarHBondContact O-OH 3.25Å; M675-Y685 HydrophobicContact CG-CE1 4.49Å; M675-Y685 VanDerWaalsContact CG-OH 3.28Å; M675-Y685 WeakPolarHBondContact CG-OH 3.47Å; T681-Y685 WeakPolarHBondContact O-CD2 3.34Å; T681-Y685 PolarHBondContact O-N 3.2Å; G682-Y685 PolarHBondContact O-N 3.21Å; Y685-A688 PolarHBondContact O-N 3.46Å; Y685-V689 WeakPolarHBondContact O-CG2 3.26Å; Y685-V689 PolarHBondContact O-N 2.91Å; Y685-L715 HydrophobicContact CD2-CB 4.43Å; Y685-L715 HydrophobicContact CE2-CD2 4.26Å
686	L	80.3	Confident	74.4	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-40.4	176.3	-70.3	176	0	0	0	112.4	G682 R683 A688 V689 E690 I707 V716 I721 W724	G682-L686 VanDerWaalsContact O-CG 3.31Å; G682-L686 WeakPolarHBondContact O-CG 3.41Å; G682-L686 PolarHBondContact O-N 3.32Å; R683-L686 PolarHBondContact O-N 2.99Å; L686-A688 VanDerWaalsContact C-N 3.35Å; L686-A688 PolarHBondContact O-N 3.28Å; L686-V689 PolarHBondContact O-N 3.49Å; L686-E690 WeakPolarHBondContact O-CB 3.38Å; L686-E690 PolarHBondContact O-N 2.86Å; L686-I707 HydrophobicContact CD2-CD1 4.34Å; L686-I707 HydrophobicContact CD2-CG1 3.9Å; L686-I707 HydrophobicContact CD2-CG2 4.03Å; L686-V716 HydrophobicContact CD1-CG1 3.64Å; L686-V716 HydrophobicContact CD2-CG1 4.15Å; L686-V716 HydrophobicContact CD2-CG2 4.32Å; L686-V716 HydrophobicContact CG-CG1 3.88Å; L686-V716 HydrophobicContact CG-CG2 4.2Å; L686-I721 HydrophobicContact CD1-CG1 4.1Å; L686-W724 HydrophobicContact CB-CB 4.24Å; L686-W724 HydrophobicContact CB-CD2 4.11Å; L686-W724 HydrophobicContact CB-CG 3.75Å; L686-W724 HydrophobicContact CD1-CB 3.61Å; L686-W724 HydrophobicContact CD1-CD2 4.24Å; L686-W724 HydrophobicContact CD1-CE3 4.44Å; L686-W724 HydrophobicContact CD1-CG 3.88Å; L686-W724 HydrophobicContact CG-CG 4.43Å
687	Q	80.1	Confident	74.8	Confident	35 Å²	35	39.2 Å²	39.2	16%	0.164	22%	0.216	C	C	.	.	H	α-helix	trans	-62.4	-40.4	173.8	-74	169	0.9	0	0	112.1	F626 R683 V684 E690 D691	F626-Q687 HydrophobicContact CD2-CB 4.49Å; R683-Q687 VanDerWaalsContact O-CG 3.27Å; R683-Q687 WeakPolarHBondContact O-CG 3.42Å; R683-Q687 PolarHBondContact O-N 3.09Å; V684-Q687 PolarHBondContact O-N 2.71Å; Q687-E690 PolarHBondContact O-N 3.3Å; Q687-D691 WeakPolarHBondContact O-CB 3.44Å; Q687-D691 PolarHBondContact O-N 2.6Å
688	A	80.8	Confident	75.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.2	-39.8	176.3	0	0	0	0	0	112.6	F626 T629 K630 V684 Y685 L686 A692	F626-A688 VanDerWaalsContact CD2-CA 3.48Å; F626-A688 HydrophobicContact CD2-CB 3.57Å; F626-A688 VanDerWaalsContact CE2-CA 3.47Å; F626-A688 HydrophobicContact CE2-CB 4.05Å; F626-A688 HydrophobicContact CG-CB 4.2Å; T629-A688 HydrophobicContact CG2-CB 3.82Å; K630-A688 HydrophobicContact CG-CB 4.45Å; V684-A688 PolarHBondContact O-N 3.17Å; Y685-A688 PolarHBondContact O-N 3.46Å; L686-A688 VanDerWaalsContact C-N 3.35Å; L686-A688 PolarHBondContact O-N 3.28Å; A688-A692 VanDerWaalsContact O-CB 3.26Å; A688-A692 WeakPolarHBondContact O-CB 3.49Å; A688-A692 PolarHBondContact O-N 3.05Å
689	V	82	Confident	76.1	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-42.4	174.7	174.8	0	0	0	0	110.9	L633 Y685 L686 A692 A693 I706 M710	L633-V689 HydrophobicContact CD1-CG2 4.11Å; Y685-V689 WeakPolarHBondContact O-CG2 3.26Å; Y685-V689 PolarHBondContact O-N 2.91Å; L686-V689 PolarHBondContact O-N 3.49Å; V689-A692 PolarHBondContact O-N 3.27Å; V689-A693 WeakPolarHBondContact O-CB 3.03Å; V689-A693 PolarHBondContact O-N 3.18Å; V689-I706 HydrophobicContact CG1-CG2 3.95Å; V689-I706 HydrophobicContact CG2-CG2 3.94Å; V689-M710 HydrophobicContact CG2-CE 3.59Å; V689-M710 HydrophobicContact CG2-SD 3.86Å
690	E	80.1	Confident	76.7	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-59.9	-47.8	177.3	-177.2	171.4	-147.6	0	0	111.4	L686 Q687 A693 C694 W724 S728 L730 T740 R744	L686-E690 WeakPolarHBondContact O-CB 3.38Å; L686-E690 PolarHBondContact O-N 2.86Å; Q687-E690 PolarHBondContact O-N 3.3Å; E690-A693 PolarHBondContact O-N 2.85Å; E690-C694 PolarHBondContact O-N 2.89Å; E690-C694 PolarHBondContact O-SG 3.02Å; E690-W724 HydrophobicContact CB-CZ2 3.97Å; E690-W724 HydrophobicContact CG-CZ2 4.11Å; E690-W724 PolarHBondContact OE2-NE1 2.9Å; E690-S728 WeakPolarHBondContact OE2-CB 3.33Å; E690-S728 PolarHBondContact OE2-OG 3.43Å; E690-L730 HydrophobicContact CB-CD1 4.09Å; E690-L730 HydrophobicContact CG-CD1 3.95Å; E690-T740 HydrophobicContact CG-CG2 3.73Å; E690-T740 VanDerWaalsContact OE1-CB 3.27Å; E690-T740 WeakPolarHBondContact OE1-CB 3.46Å; E690-T740 VanDerWaalsContact OE1-CG2 3.32Å; E690-T740 WeakPolarHBondContact OE1-CG2 3.38Å; E690-R744 IonicContact OE1-NH2 2.92Å
691	D	81	Confident	77.1	Confident	12 Å²	12	26.5 Å²	26.5	6%	0.064	14%	0.14	C	C	.	.	H	α-helix	trans	-64.7	-48.3	177.9	-172.7	77.8	0	0	0	111.7	F626 K630 Q687 A693 C694 Y695 L730	F626-D691 HydrophobicContact CE2-CB 4.02Å; F626-D691 HydrophobicContact CZ-CB 3.96Å; K630-D691 WeakPolarHBondContact CE-OD2 3.21Å; K630-D691 IonicContact NZ-OD2 3.83Å; K630-D691 PolarHBondContact NZ-OD2 3.2Å; Q687-D691 WeakPolarHBondContact O-CB 3.44Å; Q687-D691 PolarHBondContact O-N 2.6Å; D691-A693 VanDerWaalsContact C-N 3.27Å; D691-A693 PolarHBondContact O-N 2.93Å; D691-C694 WeakPolarHBondContact O-CB 3.33Å; D691-C694 PolarHBondContact O-N 2.78Å; D691-Y695 WeakPolarHBondContact O-CD2 3.21Å; D691-L730 HydrophobicContact CB-CD1 4.03Å
692	A	78.8	Confident	77.4	Confident	14 Å²	14	24.8 Å²	24.8	12%	0.116	13%	0.129	C	C	.	.	H	α-helix	trans	-60.2	-36.6	177.7	0	0	0	0	0	112.5	L633 A688 V689 C694 Y695 D696 I699	L633-A692 HydrophobicContact CD1-CB 3.74Å; A688-A692 VanDerWaalsContact O-CB 3.26Å; A688-A692 WeakPolarHBondContact O-CB 3.49Å; A688-A692 PolarHBondContact O-N 3.05Å; V689-A692 PolarHBondContact O-N 3.27Å; A692-C694 VanDerWaalsContact C-N 3.27Å; A692-C694 PolarHBondContact O-N 2.73Å; A692-Y695 PolarHBondContact O-N 2.83Å; A692-D696 PolarHBondContact O-N 3.15Å; A692-I699 HydrophobicContact CB-CD1 4.04Å; A692-I699 HydrophobicContact CB-CG2 4.32Å
693	A	79	Confident	77.6	Confident	3 Å²	3	24.9 Å²	24.9	3%	0.025	13%	0.13	C	C	.	.	H	α-helix	trans	-66.8	-26.6	175.6	0	0	0	0	0	113.1	V689 E690 D691 Y695 I699 F700 L743	V689-A693 WeakPolarHBondContact O-CB 3.03Å; V689-A693 PolarHBondContact O-N 3.18Å; E690-A693 PolarHBondContact O-N 2.85Å; D691-A693 VanDerWaalsContact C-N 3.27Å; D691-A693 PolarHBondContact O-N 2.93Å; A693-Y695 VanDerWaalsContact C-N 3.3Å; A693-Y695 PolarHBondContact O-N 2.94Å; A693-I699 HydrophobicContact CB-CG2 4.02Å; A693-F700 HydrophobicContact CB-CB 4.41Å; A693-F700 HydrophobicContact CB-CD2 4.37Å; A693-F700 WeakPolarHBondContact O-CB 3.49Å; A693-L743 HydrophobicContact CB-CD1 3.39Å
694	C	76.1	Confident	77.6	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.034	14%	0.136	C	C	.	.	H	α-helix	trans	-70.8	-29.4	178.3	-69.2	0	0	0	0	112.5	E690 D691 A692 I736 K739	E690-C694 PolarHBondContact O-N 2.89Å; E690-C694 PolarHBondContact O-SG 3.02Å; D691-C694 WeakPolarHBondContact O-CB 3.33Å; D691-C694 PolarHBondContact O-N 2.78Å; A692-C694 VanDerWaalsContact C-N 3.27Å; A692-C694 PolarHBondContact O-N 2.73Å; C694-I736 HydrophobicContact CB-CG2 3.64Å; C694-I736 WeakPolarHBondContact SG-CG2 3.11Å; C694-K739 HydrophobicContact CB-CD 4.42Å; C694-K739 WeakPolarHBondContact O-CD 3.36Å; C694-K739 PolarHBondContact O-NZ 2.82Å
695	Y	73.1	Confident	77.5	Confident	163 Å²	163	26.9 Å²	26.9	64%	0.639	15%	0.146	S	C	*	.	H	α-helix	trans	-97.8	-26.7	-179.3	-60.5	-72.7	0	0	0	114	D691 A692 A693	D691-Y695 WeakPolarHBondContact O-CD2 3.21Å; A692-Y695 PolarHBondContact O-N 2.83Å; A693-Y695 VanDerWaalsContact C-N 3.3Å; A693-Y695 PolarHBondContact O-N 2.94Å
696	D	73.3	Confident	77.3	Confident	12 Å²	12	26.6 Å²	26.6	6%	0.064	15%	0.145	C	C	.	.			trans	-116.9	118.9	-179.4	-167.5	10.6	0	0	0	114.1	R637 A692 L698 I699 F700	R637-D696 VanDerWaalsContact CD-OD2 3.26Å; R637-D696 WeakPolarHBondContact CD-OD2 3.12Å; R637-D696 IonicContact CZ-OD1 2.66Å; R637-D696 IonicContact CZ-OD2 2.73Å; R637-D696 IonicContact NE-OD1 3.09Å; R637-D696 IonicContact NE-OD2 2.92Å; R637-D696 PolarHBondContact NE-OD2 2.92Å; R637-D696 VanDerWaalsContact NE-OD2 3.16Å; R637-D696 IonicContact NH1-OD1 2.69Å; R637-D696 PolarHBondContact NH1-OD1 3.29Å; R637-D696 IonicContact NH1-OD2 3.96Å; R637-D696 PolarHBondContact NH1-OD2 3.25Å; R637-D696 VanDerWaalsContact NH2-CG 3.28Å; R637-D696 IonicContact NH2-OD1 3.29Å; R637-D696 PolarHBondContact NH2-OD1 2.89Å; R637-D696 IonicContact NH2-OD2 3.33Å; R637-D696 PolarHBondContact NH2-OD2 3.04Å; A692-D696 PolarHBondContact O-N 3.15Å; D696-L698 VanDerWaalsContact C-N 3.26Å; D696-L698 PolarHBondContact O-N 2.91Å; D696-L698 PolarHBondContact OD1-N 2.75Å; D696-I699 HydrophobicContact CB-CB 4.1Å; D696-I699 HydrophobicContact CB-CD1 3.87Å; D696-I699 HydrophobicContact CB-CG1 3.94Å; D696-I699 PolarHBondContact O-N 2.81Å; D696-F700 WeakPolarHBondContact O-CB 3.09Å; D696-F700 PolarHBondContact O-N 3.32Å
697	S	73.3	Confident	77.3	Confident	85 Å²	85	26.6 Å²	26.6	59%	0.594	15%	0.145	S	C	*	.	H	α-helix	trans	-61.9	-31.1	179.5	-169.2	0	0	0	0	113.1	A701	S697-A701 WeakPolarHBondContact O-CB 3.26Å; S697-A701 PolarHBondContact O-N 2.9Å
698	L	73.6	Confident	77.4	Confident	26 Å²	26	27.6 Å²	27.6	14%	0.136	15%	0.149	C	C	.	.	H	α-helix	trans	-72	-42.4	178.5	-166.9	107	0	0	0	111.6	L640 D652 F656 D696 A701 S702	L640-L698 HydrophobicContact CD1-CD2 4.46Å; D652-L698 HydrophobicContact CB-CD1 3.96Å; F656-L698 HydrophobicContact CB-CD2 3.94Å; F656-L698 HydrophobicContact CD1-CD2 4.44Å; F656-L698 HydrophobicContact CD2-CD2 3.39Å; F656-L698 HydrophobicContact CE2-CD2 3.94Å; F656-L698 HydrophobicContact CG-CD2 3.67Å; D696-L698 VanDerWaalsContact C-N 3.26Å; D696-L698 PolarHBondContact O-N 2.91Å; D696-L698 PolarHBondContact OD1-N 2.75Å; L698-A701 PolarHBondContact O-N 2.84Å; L698-S702 WeakPolarHBondContact O-CB 3.16Å; L698-S702 PolarHBondContact O-N 2.92Å; L698-S702 PolarHBondContact O-OG 3.12Å
699	I	74.6	Confident	77.2	Confident	7 Å²	7	27.6 Å²	27.6	4%	0.036	15%	0.15	C	C	.	.	H	α-helix	trans	-67.3	-40.5	175	-60.2	177.1	0	0	0	109.6	L633 F656 A692 A693 D696 A701 S702 S703 I706	L633-I699 HydrophobicContact CB-CD1 4.16Å; F656-I699 HydrophobicContact CZ-CG1 4.16Å; A692-I699 HydrophobicContact CB-CD1 4.04Å; A692-I699 HydrophobicContact CB-CG2 4.32Å; A693-I699 HydrophobicContact CB-CG2 4.02Å; D696-I699 HydrophobicContact CB-CB 4.1Å; D696-I699 HydrophobicContact CB-CD1 3.87Å; D696-I699 HydrophobicContact CB-CG1 3.94Å; D696-I699 PolarHBondContact O-N 2.81Å; I699-A701 VanDerWaalsContact C-N 3.34Å; I699-A701 PolarHBondContact O-N 2.82Å; I699-S702 CarbonylContact O-C 3.59Å; I699-S702 PolarHBondContact O-N 2.52Å; I699-S703 WeakPolarHBondContact O-CA 3.44Å; I699-S703 PolarHBondContact O-N 2.93Å; I699-I706 HydrophobicContact CG2-CD1 3.82Å
700	F	76.4	Confident	77	Confident	38 Å²	38	27.7 Å²	27.7	17%	0.167	15%	0.15	C	C	.	.	H	α-helix	trans	-59.5	-42.1	174.1	-172.9	-99.2	0	0	0	113	A693 D696 S702 S703 S742 L743 K746	A693-F700 HydrophobicContact CB-CB 4.41Å; A693-F700 HydrophobicContact CB-CD2 4.37Å; A693-F700 WeakPolarHBondContact O-CB 3.49Å; D696-F700 WeakPolarHBondContact O-CB 3.09Å; D696-F700 PolarHBondContact O-N 3.32Å; F700-S702 VanDerWaalsContact C-N 3.31Å; F700-S703 PolarHBondContact O-OG 2.91Å; F700-S742 VanDerWaalsContact CZ-OG 3.26Å; F700-S742 WeakPolarHBondContact CZ-OG 3.21Å; F700-L743 HydrophobicContact CD2-CB 4.4Å; F700-L743 HydrophobicContact CD2-CD1 3.73Å; F700-L743 HydrophobicContact CE2-CB 3.75Å; F700-L743 HydrophobicContact CE2-CD1 3.96Å; F700-L743 HydrophobicContact CE2-CG 4.36Å; F700-K746 HydrophobicContact CD1-CD 4.45Å; F700-K746 HydrophobicContact CE1-CD 3.79Å; F700-K746 VanDerWaalsContact CE1-NZ 3.3Å; F700-K746 HydrophobicContact CZ-CD 4.14Å
701	A	75.6	Confident	77	Confident	40 Å²	40	30.8 Å²	30.8	33%	0.331	16%	0.162	S	C	.	.	H	α-helix	trans	-68.9	-30.4	177.5	0	0	0	0	0	112.9	V653 S697 L698 I699	V653-A701 HydrophobicContact CG2-CB 4.11Å; S697-A701 WeakPolarHBondContact O-CB 3.26Å; S697-A701 PolarHBondContact O-N 2.9Å; L698-A701 PolarHBondContact O-N 2.84Å; I699-A701 VanDerWaalsContact C-N 3.34Å; I699-A701 PolarHBondContact O-N 2.82Å
702	S	76.6	Confident	76.9	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-95.9	-6.4	-176.9	-47.6	0	0	0	0	113.5	L698 I699 F700 M704 S705 I706	L698-S702 WeakPolarHBondContact O-CB 3.16Å; L698-S702 PolarHBondContact O-N 2.92Å; L698-S702 PolarHBondContact O-OG 3.12Å; I699-S702 CarbonylContact O-C 3.59Å; I699-S702 PolarHBondContact O-N 2.52Å; F700-S702 VanDerWaalsContact C-N 3.31Å; S702-M704 PolarHBondContact O-N 2.97Å; S702-S705 CarbonylContact O-C 3.59Å; S702-S705 WeakPolarHBondContact O-CA 3.3Å; S702-S705 WeakPolarHBondContact O-CB 3.45Å; S702-S705 PolarHBondContact O-N 2.78Å; S702-I706 WeakPolarHBondContact O-CG1 3.27Å; S702-I706 PolarHBondContact O-N 2.95Å
703	S	76.2	Confident	76.5	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.007	18%	0.182	C	C	.	.	H	α-helix	trans	-50.5	-45.4	-169.5	54.2	0	0	0	0	114.6	I699 F700 S705 I706 I707	I699-S703 WeakPolarHBondContact O-CA 3.44Å; I699-S703 PolarHBondContact O-N 2.93Å; F700-S703 PolarHBondContact O-OG 2.91Å; S703-S705 VanDerWaalsContact C-N 3.35Å; S703-S705 PolarHBondContact O-N 3.23Å; S703-I706 PolarHBondContact O-N 2.97Å; S703-I707 WeakPolarHBondContact O-CG1 3.31Å; S703-I707 PolarHBondContact O-N 2.97Å
704	M	79.7	Confident	76.4	Confident	70 Å²	70	41.6 Å²	41.6	35%	0.345	22%	0.217	S	C	.	.	H	α-helix	trans	-58.8	-44.1	175.5	-174.7	-171	176.9	0	0	112.1	S702 H708 I747 P749 F750	S702-M704 PolarHBondContact O-N 2.97Å; M704-H708 WeakPolarHBondContact O-CB 3.09Å; M704-H708 PolarHBondContact O-N 2.93Å; M704-I747 HydrophobicContact CB-CG1 4.28Å; M704-P749 HydrophobicContact CE-CB 4.08Å; M704-F750 HydrophobicContact CE-CB 3.63Å; M704-F750 HydrophobicContact CG-CB 3.92Å; M704-F750 HydrophobicContact SD-CB 4.5Å
705	S	76.1	Confident	76.2	Confident	43 Å²	43	42.1 Å²	42.1	30%	0.301	22%	0.22	S	C	.	.	H	α-helix	trans	-74.1	-28.8	178.8	-55.7	0	0	0	0	113	S702 S703 T709	S702-S705 CarbonylContact O-C 3.59Å; S702-S705 WeakPolarHBondContact O-CA 3.3Å; S702-S705 WeakPolarHBondContact O-CB 3.45Å; S702-S705 PolarHBondContact O-N 2.78Å; S703-S705 VanDerWaalsContact C-N 3.35Å; S703-S705 PolarHBondContact O-N 3.23Å; S705-T709 VanDerWaalsContact O-CB 3.3Å; S705-T709 WeakPolarHBondContact O-CB 3.43Å; S705-T709 PolarHBondContact O-N 3.26Å; S705-T709 PolarHBondContact O-OG1 2.99Å
706	I	77.6	Confident	76.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-50.8	172.6	-63.9	171.8	0	0	0	109.3	L633 F656 L660 V689 I699 S702 S703 T709 M710	L633-I706 HydrophobicContact CD2-CD1 4.43Å; F656-I706 HydrophobicContact CE1-CD1 3.78Å; F656-I706 HydrophobicContact CE1-CG1 4.13Å; F656-I706 HydrophobicContact CZ-CD1 4.46Å; L660-I706 HydrophobicContact CD2-CB 4.16Å; L660-I706 HydrophobicContact CD2-CG1 3.67Å; L660-I706 HydrophobicContact CD2-CG2 4Å; V689-I706 HydrophobicContact CG1-CG2 3.95Å; V689-I706 HydrophobicContact CG2-CG2 3.94Å; I699-I706 HydrophobicContact CG2-CD1 3.82Å; S702-I706 WeakPolarHBondContact O-CG1 3.27Å; S702-I706 PolarHBondContact O-N 2.95Å; S703-I706 PolarHBondContact O-N 2.97Å; I706-T709 PolarHBondContact O-N 2.88Å; I706-T709 VanDerWaalsContact O-N 3.14Å; I706-M710 HydrophobicContact CG2-CE 4.11Å; I706-M710 HydrophobicContact CG2-SD 4.34Å; I706-M710 WeakPolarHBondContact O-CG 3.23Å; I706-M710 PolarHBondContact O-N 3.03Å
707	I	80.1	Confident	76.7	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-45.7	179.9	-65.9	167.9	0	0	0	110.4	L686 S703 T709 M710 Y711 I721 W724 I747 F750	L686-I707 HydrophobicContact CD2-CD1 4.34Å; L686-I707 HydrophobicContact CD2-CG1 3.9Å; L686-I707 HydrophobicContact CD2-CG2 4.03Å; S703-I707 WeakPolarHBondContact O-CG1 3.31Å; S703-I707 PolarHBondContact O-N 2.97Å; I707-T709 VanDerWaalsContact C-N 3.3Å; I707-T709 PolarHBondContact O-N 2.81Å; I707-M710 PolarHBondContact O-N 3.19Å; I707-M710 VanDerWaalsContact O-N 3.14Å; I707-Y711 WeakPolarHBondContact O-CB 3.5Å; I707-Y711 PolarHBondContact O-N 2.95Å; I707-I721 HydrophobicContact CG2-CD1 4.5Å; I707-W724 HydrophobicContact CD1-CH2 4.01Å; I707-W724 HydrophobicContact CD1-CZ3 4.07Å; I707-I747 HydrophobicContact CD1-CD1 3.53Å; I707-I747 HydrophobicContact CD1-CG1 4.4Å; I707-F750 HydrophobicContact CG2-CD1 4.31Å; I707-F750 HydrophobicContact CG2-CE1 3.72Å; I707-F750 HydrophobicContact CG2-CZ 4.46Å
708	H	80.9	Confident	76.9	Confident	56 Å²	56	36.5 Å²	36.5	26%	0.259	19%	0.193	S	C	.	.	H	α-helix	trans	-58	-41.6	173.8	-172.8	-61.2	0	0	0	112.1	M704 Y711 D712 F750	M704-H708 WeakPolarHBondContact O-CB 3.09Å; M704-H708 PolarHBondContact O-N 2.93Å; H708-Y711 WeakPolarHBondContact O-CB 3.47Å; H708-Y711 PolarHBondContact O-N 3.14Å; H708-D712 IonicContact CE1-OD1 3.55Å; H708-D712 PolarHBondContact CE1-OD1 2.87Å; H708-D712 IonicContact CE1-OD2 2.65Å; H708-D712 PolarHBondContact CE1-OD2 3.48Å; H708-D712 VanDerWaalsContact ND1-CG 3.31Å; H708-D712 IonicContact ND1-OD1 3.18Å; H708-D712 PolarHBondContact ND1-OD1 2.76Å; H708-D712 IonicContact ND1-OD2 3.25Å; H708-D712 PolarHBondContact ND1-OD2 3.04Å; H708-D712 PolarHBondContact O-N 2.91Å; H708-F750 HydrophobicContact CB-CD2 4.44Å; H708-F750 HydrophobicContact CB-CE2 3.9Å; H708-F750 HydrophobicContact CB-CZ 4.29Å; H708-F750 AromaticContact CD2-CD2 3.91Å; H708-F750 AromaticContact CD2-CE2 3.44Å; H708-F750 VanDerWaalsContact CD2-CE2 3.44Å; H708-F750 WeakPolarHBondContact CD2-CE2 3.25Å; H708-F750 AromaticContact CG-CE2 3.92Å
709	T	76.6	Confident	77.1	Confident	1 Å²	1	41 Å²	41	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-69.4	-33.2	178.1	-58.1	0	0	0	0	112	R661 L664 S705 I706 I707 N713	R661-T709 HydrophobicContact CG-CG2 3.46Å; R661-T709 VanDerWaalsContact CG-CG2 3.46Å; R661-T709 PolarHBondContact NE-OG1 3.32Å; L664-T709 HydrophobicContact CD1-CG2 3.77Å; S705-T709 VanDerWaalsContact O-CB 3.3Å; S705-T709 WeakPolarHBondContact O-CB 3.43Å; S705-T709 PolarHBondContact O-N 3.26Å; S705-T709 PolarHBondContact O-OG1 2.99Å; I706-T709 PolarHBondContact O-N 2.88Å; I706-T709 VanDerWaalsContact O-N 3.14Å; I707-T709 VanDerWaalsContact C-N 3.3Å; I707-T709 PolarHBondContact O-N 2.81Å; T709-N713 PolarHBondContact O-N 2.84Å; T709-N713 PolarHBondContact O-ND2 3.49Å
710	M	77.2	Confident	77.3	Confident	4 Å²	4	41 Å²	41	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-70.1	-36	173.8	-72.4	-176.9	170.8	0	0	111.7	T629 V689 I706 I707 N713 L715 V716	T629-M710 HydrophobicContact CG2-CE 3.97Å; V689-M710 HydrophobicContact CG2-CE 3.59Å; V689-M710 HydrophobicContact CG2-SD 3.86Å; I706-M710 HydrophobicContact CG2-CE 4.11Å; I706-M710 HydrophobicContact CG2-SD 4.34Å; I706-M710 WeakPolarHBondContact O-CG 3.23Å; I706-M710 PolarHBondContact O-N 3.03Å; I707-M710 PolarHBondContact O-N 3.19Å; I707-M710 VanDerWaalsContact O-N 3.14Å; M710-N713 PolarHBondContact O-N 3.39Å; M710-L715 HydrophobicContact CB-CB 4.47Å; M710-L715 WeakPolarHBondContact O-CB 3.33Å; M710-L715 PolarHBondContact O-N 2.78Å; M710-V716 HydrophobicContact CB-CG2 3.91Å
711	Y	80.6	Confident	77.3	Confident	66 Å²	66	39.2 Å²	39.2	26%	0.259	21%	0.209	S	C	.	.	H	α-helix	trans	-63.6	-49.8	171.8	-175.1	-104.9	0	0	0	111.3	I707 H708 N713 D714 V716 E718 I721 W753 L754	I707-Y711 WeakPolarHBondContact O-CB 3.5Å; I707-Y711 PolarHBondContact O-N 2.95Å; H708-Y711 WeakPolarHBondContact O-CB 3.47Å; H708-Y711 PolarHBondContact O-N 3.14Å; Y711-N713 PolarHBondContact O-N 3.04Å; Y711-D714 PolarHBondContact O-N 2.94Å; Y711-V716 WeakPolarHBondContact CD2-O 3.37Å; Y711-E718 HydrophobicContact CE2-CB 4.38Å; Y711-I721 HydrophobicContact CD2-CD1 3.77Å; Y711-I721 HydrophobicContact CE2-CD1 4.39Å; Y711-I721 HydrophobicContact CG-CD1 4.45Å; Y711-W753 HydrophobicContact CE1-CH2 4.46Å; Y711-W753 HydrophobicContact CE1-CZ3 4.4Å; Y711-L754 HydrophobicContact CE1-CD2 4.17Å; Y711-L754 HydrophobicContact CE2-CD2 4.32Å
712	D	79	Confident	77.4	Confident	84 Å²	84	39.9 Å²	39.9	45%	0.449	20%	0.203	S	C	.	.	H	α-helix	trans	-58.5	-22.6	177.7	-66.9	-27.6	0	0	0	114.2	H708	H708-D712 IonicContact CE1-OD1 3.55Å; H708-D712 PolarHBondContact CE1-OD1 2.87Å; H708-D712 IonicContact CE1-OD2 2.65Å; H708-D712 PolarHBondContact CE1-OD2 3.48Å; H708-D712 VanDerWaalsContact ND1-CG 3.31Å; H708-D712 IonicContact ND1-OD1 3.18Å; H708-D712 PolarHBondContact ND1-OD1 2.76Å; H708-D712 IonicContact ND1-OD2 3.25Å; H708-D712 PolarHBondContact ND1-OD2 3.04Å; H708-D712 PolarHBondContact O-N 2.91Å
713	N	71.9	Confident	77.7	Confident	28 Å²	28	43.1 Å²	43.1	15%	0.15	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	13.6	-178.4	-76.3	-72.2	0	0	0	113.2	N668 T709 M710 Y711 L715	N668-N713 PolarHBondContact ND2-O 2.92Å; T709-N713 PolarHBondContact O-N 2.84Å; T709-N713 PolarHBondContact O-ND2 3.49Å; M710-N713 PolarHBondContact O-N 3.39Å; Y711-N713 PolarHBondContact O-N 3.04Å; N713-L715 HydrophobicContact CB-CD1 4.44Å; N713-L715 HydrophobicContact CB-CG 4.42Å; N713-L715 PolarHBondContact O-N 3.05Å; N713-L715 VanDerWaalsContact O-N 3.17Å
714	D	75	Confident	77.8	Confident	143 Å²	143	43.2 Å²	43.2	77%	0.765	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	57	24	-178.5	-57.1	-42.5	0	0	0	114.2	Y711	Y711-D714 PolarHBondContact O-N 2.94Å
715	L	73.3	Confident	77.6	Confident	16 Å²	16	42.7 Å²	42.7	8%	0.084	21%	0.212	C	C	.	.	S	Bend	trans	-83.2	-25.3	177.7	-72.3	172.7	0	0	0	112.4	L664 N668 L671 Y685 M710 N713	L664-L715 HydrophobicContact CD2-CD1 3.85Å; N668-L715 WeakPolarHBondContact OD1-CD2 3.45Å; L671-L715 HydrophobicContact CB-CD2 4.18Å; L671-L715 HydrophobicContact CD1-CD1 4.05Å; L671-L715 HydrophobicContact CD1-CD2 4.48Å; Y685-L715 HydrophobicContact CD2-CB 4.43Å; Y685-L715 HydrophobicContact CE2-CD2 4.26Å; M710-L715 HydrophobicContact CB-CB 4.47Å; M710-L715 WeakPolarHBondContact O-CB 3.33Å; M710-L715 PolarHBondContact O-N 2.78Å; N713-L715 HydrophobicContact CB-CD1 4.44Å; N713-L715 HydrophobicContact CB-CG 4.42Å; N713-L715 PolarHBondContact O-N 3.05Å; N713-L715 VanDerWaalsContact O-N 3.17Å
716	V	75.4	Confident	77.3	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.225	C	C	.	.	S	Bend	trans	-134.9	125.7	-177.3	-178.9	0	0	0	0	108.1	L686 M710 Y711 D720 I721	L686-V716 HydrophobicContact CD1-CG1 3.64Å; L686-V716 HydrophobicContact CD2-CG1 4.15Å; L686-V716 HydrophobicContact CD2-CG2 4.32Å; L686-V716 HydrophobicContact CG-CG1 3.88Å; L686-V716 HydrophobicContact CG-CG2 4.2Å; M710-V716 HydrophobicContact CB-CG2 3.91Å; Y711-V716 WeakPolarHBondContact CD2-O 3.37Å; V716-D720 HydrophobicContact CG1-CB 4.16Å; V716-I721 HydrophobicContact CG1-CD1 4.1Å; V716-I721 HydrophobicContact CG1-CG1 3.54Å
717	L	80.7	Confident	77	Confident	108 Å²	108	50.2 Å²	50.2	57%	0.565	25%	0.248	S	C	*	.			trans	-89.1	159.8	176	-61.9	174.4	0	0	0	111.1	D719 D720 I721	L717-D719 VanDerWaalsContact C-N 3.34Å; L717-D719 PolarHBondContact O-N 2.9Å; L717-D720 WeakPolarHBondContact O-CB 3.42Å; L717-D720 PolarHBondContact O-N 2.92Å; L717-I721 PolarHBondContact O-N 2.85Å
718	E	77.1	Confident	76.5	Confident	34 Å²	34	50.3 Å²	50.3	16%	0.159	25%	0.249	C	C	.	.	H	α-helix	trans	-56.6	-45	179	-180	149.3	-152.1	0	0	112.8	Y711 D720 I721 W722 E758	Y711-E718 HydrophobicContact CE2-CB 4.38Å; E718-D720 PolarHBondContact O-N 3.27Å; E718-D720 VanDerWaalsContact O-N 3.16Å; E718-I721 WeakPolarHBondContact O-CB 3.39Å; E718-I721 PolarHBondContact O-N 3.38Å; E718-W722 VanDerWaalsContact CG-CD1 3.47Å; E718-W722 VanDerWaalsContact CG-NE1 3.28Å; E718-W722 PolarHBondContact O-N 3.37Å; E718-W722 PolarHBondContact OE1-NE1 3.36Å; E718-E758 VanDerWaalsContact OE1-CD 3.25Å; E718-E758 WeakPolarHBondContact OE1-CG 3.3Å
719	D	77.7	Confident	75.8	Confident	119 Å²	119	50.8 Å²	50.8	64%	0.636	26%	0.257	S	S	*	.	H	α-helix	trans	-53.9	-36.1	173.8	-73.9	-26.5	0	0	0	113.3	L717 W723	L717-D719 VanDerWaalsContact C-N 3.34Å; L717-D719 PolarHBondContact O-N 2.9Å; D719-W723 VanDerWaalsContact O-CB 3.29Å; D719-W723 WeakPolarHBondContact O-CB 3.46Å; D719-W723 PolarHBondContact O-N 3.08Å
720	D	79.4	Confident	75.1	Confident	9 Å²	9	52.1 Å²	52.1	5%	0.048	26%	0.264	C	S	.	.	H	α-helix	trans	-75.1	-31.6	179.5	-73.2	-30.1	0	0	0	111.8	G682 R683 V716 L717 E718 W724	G682-D720 WeakPolarHBondContact CA-OD2 3.37Å; G682-D720 PolarHBondContact N-OD2 2.75Å; R683-D720 HydrophobicContact CG-CB 3.94Å; R683-D720 VanDerWaalsContact CG-OD1 3.28Å; R683-D720 WeakPolarHBondContact CG-OD1 3.38Å; R683-D720 IonicContact CZ-OD1 2.7Å; R683-D720 IonicContact NE-OD1 2.8Å; R683-D720 PolarHBondContact NE-OD1 3.01Å; R683-D720 IonicContact NH2-OD1 3.63Å; V716-D720 HydrophobicContact CG1-CB 4.16Å; L717-D720 WeakPolarHBondContact O-CB 3.42Å; L717-D720 PolarHBondContact O-N 2.92Å; E718-D720 PolarHBondContact O-N 3.27Å; E718-D720 VanDerWaalsContact O-N 3.16Å; D720-W724 VanDerWaalsContact O-CB 3.23Å; D720-W724 WeakPolarHBondContact O-CB 3.35Å; D720-W724 PolarHBondContact O-N 2.86Å
721	I	77.4	Confident	74.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-69.9	-47.4	176.2	-62.6	171.4	0	0	0	110.1	L686 I707 Y711 V716 L717 E718 W724 K725 F750 F751 L754	L686-I721 HydrophobicContact CD1-CG1 4.1Å; I707-I721 HydrophobicContact CG2-CD1 4.5Å; Y711-I721 HydrophobicContact CD2-CD1 3.77Å; Y711-I721 HydrophobicContact CE2-CD1 4.39Å; Y711-I721 HydrophobicContact CG-CD1 4.45Å; V716-I721 HydrophobicContact CG1-CD1 4.1Å; V716-I721 HydrophobicContact CG1-CG1 3.54Å; L717-I721 PolarHBondContact O-N 2.85Å; E718-I721 WeakPolarHBondContact O-CB 3.39Å; E718-I721 PolarHBondContact O-N 3.38Å; I721-W724 PolarHBondContact O-N 2.74Å; I721-K725 WeakPolarHBondContact O-CB 3.17Å; I721-K725 PolarHBondContact O-N 3.32Å; I721-F750 HydrophobicContact CD1-CE1 4.26Å; I721-F751 HydrophobicContact CG2-CD1 4.08Å; I721-F751 HydrophobicContact CG2-CE1 3.61Å; I721-L754 HydrophobicContact CD1-CD1 4.07Å; I721-L754 HydrophobicContact CG2-CD1 4.08Å
722	W	78	Confident	73.1	Confident	53 Å²	53	57.9 Å²	57.9	20%	0.201	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-43.3	175.5	-69.8	117.4	0	0	0	111.3	E718 W724 K725 D726 L754 E755	E718-W722 VanDerWaalsContact CG-CD1 3.47Å; E718-W722 VanDerWaalsContact CG-NE1 3.28Å; E718-W722 PolarHBondContact O-N 3.37Å; E718-W722 PolarHBondContact OE1-NE1 3.36Å; W722-W724 PolarHBondContact O-N 2.82Å; W722-K725 HydrophobicContact CE3-CD 3.92Å; W722-K725 HydrophobicContact CZ3-CD 3.99Å; W722-K725 VanDerWaalsContact CZ3-NZ 3.34Å; W722-K725 WeakPolarHBondContact O-CB 3.35Å; W722-K725 PolarHBondContact O-N 3.14Å; W722-D726 PolarHBondContact O-N 3.48Å; W722-L754 HydrophobicContact CZ2-CB 4.49Å; W722-E755 HydrophobicContact CH2-CB 4.28Å; W722-E755 HydrophobicContact CZ2-CB 4.35Å
723	W	81	Confident	72.2	Confident	69 Å²	69	57.1 Å²	57.1	26%	0.261	29%	0.294	S	S	.	.	H	α-helix	trans	-60.3	-45.4	174.3	-179.1	88.1	0	0	0	112.1	R683 D719 K725 D726 N727	R683-W723 HydrophobicContact CB-CE3 3.83Å; R683-W723 HydrophobicContact CB-CZ3 3.69Å; R683-W723 VanDerWaalsContact CD-CD2 3.45Å; R683-W723 HydrophobicContact CG-CD2 4.07Å; R683-W723 HydrophobicContact CG-CE3 3.47Å; R683-W723 VanDerWaalsContact CG-CE3 3.47Å; R683-W723 HydrophobicContact CG-CZ3 3.86Å; R683-W723 VanDerWaalsContact CZ-CG 3.43Å; R683-W723 VanDerWaalsContact NH1-CD1 3.33Å; D719-W723 VanDerWaalsContact O-CB 3.29Å; D719-W723 WeakPolarHBondContact O-CB 3.46Å; D719-W723 PolarHBondContact O-N 3.08Å; W723-K725 VanDerWaalsContact C-N 3.32Å; W723-K725 PolarHBondContact O-N 2.83Å; W723-D726 PolarHBondContact O-N 3.31Å; W723-N727 HydrophobicContact CD2-CB 4.08Å; W723-N727 HydrophobicContact CG-CB 4.36Å; W723-N727 HydrophobicContact CZ2-CB 4.01Å; W723-N727 WeakPolarHBondContact O-CA 3.29Å; W723-N727 WeakPolarHBondContact O-CB 3.33Å; W723-N727 PolarHBondContact O-N 3.16Å; W723-N727 PolarHBondContact O-ND2 3.07Å
724	W	79.2	Confident	71.5	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.008	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-38.1	-180	170.4	76.6	0	0	0	112	L686 E690 I707 D720 I721 W722 D726 S728 L743 R744 I747 F751	L686-W724 HydrophobicContact CB-CB 4.24Å; L686-W724 HydrophobicContact CB-CD2 4.11Å; L686-W724 HydrophobicContact CB-CG 3.75Å; L686-W724 HydrophobicContact CD1-CB 3.61Å; L686-W724 HydrophobicContact CD1-CD2 4.24Å; L686-W724 HydrophobicContact CD1-CE3 4.44Å; L686-W724 HydrophobicContact CD1-CG 3.88Å; L686-W724 HydrophobicContact CG-CG 4.43Å; E690-W724 HydrophobicContact CB-CZ2 3.97Å; E690-W724 HydrophobicContact CG-CZ2 4.11Å; E690-W724 PolarHBondContact OE2-NE1 2.9Å; I707-W724 HydrophobicContact CD1-CH2 4.01Å; I707-W724 HydrophobicContact CD1-CZ3 4.07Å; D720-W724 VanDerWaalsContact O-CB 3.23Å; D720-W724 WeakPolarHBondContact O-CB 3.35Å; D720-W724 PolarHBondContact O-N 2.86Å; I721-W724 PolarHBondContact O-N 2.74Å; W722-W724 PolarHBondContact O-N 2.82Å; W724-D726 VanDerWaalsContact C-N 3.28Å; W724-D726 PolarHBondContact O-N 3.21Å; W724-S728 WeakPolarHBondContact O-CB 3.39Å; W724-S728 PolarHBondContact O-N 2.79Å; W724-L743 HydrophobicContact CH2-CD2 3.46Å; W724-L743 VanDerWaalsContact CH2-CD2 3.46Å; W724-L743 HydrophobicContact CZ2-CD2 3.63Å; W724-R744 PolarHBondContact O-NH2 3.21Å; W724-I747 HydrophobicContact CH2-CD1 3.8Å; W724-I747 HydrophobicContact CZ3-CD1 4.25Å; W724-F751 HydrophobicContact CE3-CZ 4.43Å; W724-F751 HydrophobicContact CZ3-CE1 4.43Å; W724-F751 AromaticContact CZ3-CZ 3.88Å; W724-F751 HydrophobicContact CZ3-CZ 3.88Å
725	K	74.9	Confident	70.8	Confident	60 Å²	60	63.4 Å²	63.4	26%	0.261	33%	0.328	S	S	.	.	H	α-helix	trans	-57.3	-39.9	174.8	-178.5	-173.2	176.1	-177.3	0	112	I721 W722 W723 R744 F751	I721-K725 WeakPolarHBondContact O-CB 3.17Å; I721-K725 PolarHBondContact O-N 3.32Å; W722-K725 HydrophobicContact CE3-CD 3.92Å; W722-K725 HydrophobicContact CZ3-CD 3.99Å; W722-K725 VanDerWaalsContact CZ3-NZ 3.34Å; W722-K725 WeakPolarHBondContact O-CB 3.35Å; W722-K725 PolarHBondContact O-N 3.14Å; W723-K725 VanDerWaalsContact C-N 3.32Å; W723-K725 PolarHBondContact O-N 2.83Å; K725-R744 PolarHBondContact O-NH1 3.09Å; K725-R744 PolarHBondContact O-NH2 3.33Å; K725-F751 HydrophobicContact CB-CE1 4.49Å; K725-F751 HydrophobicContact CB-CZ 4.21Å; K725-F751 HydrophobicContact CD-CD2 4.21Å; K725-F751 HydrophobicContact CD-CE1 4.47Å; K725-F751 HydrophobicContact CD-CE2 4.17Å; K725-F751 HydrophobicContact CD-CG 4.39Å; K725-F751 HydrophobicContact CD-CZ 4.29Å; K725-F751 HydrophobicContact CG-CE2 4.17Å; K725-F751 HydrophobicContact CG-CZ 4.14Å
726	D	71.4	Confident	70.3	Confident	108 Å²	108	63.3 Å²	63.3	58%	0.578	33%	0.327	S	S	*	.	H	α-helix	trans	-99.3	-31.5	-174	-67.5	-20.4	0	0	0	113.6	W722 W723 W724	W722-D726 PolarHBondContact O-N 3.48Å; W723-D726 PolarHBondContact O-N 3.31Å; W724-D726 VanDerWaalsContact C-N 3.28Å; W724-D726 PolarHBondContact O-N 3.21Å
727	N	71	Confident	69.7	Low	93 Å²	93	64 Å²	64	50%	0.497	33%	0.332	S	S	.	.	H	α-helix	trans	-124.3	13	-163.4	-57.7	-71.2	0	0	0	115.2	W723	W723-N727 HydrophobicContact CD2-CB 4.08Å; W723-N727 HydrophobicContact CG-CB 4.36Å; W723-N727 HydrophobicContact CZ2-CB 4.01Å; W723-N727 WeakPolarHBondContact O-CA 3.29Å; W723-N727 WeakPolarHBondContact O-CB 3.33Å; W723-N727 PolarHBondContact O-N 3.16Å; W723-N727 PolarHBondContact O-ND2 3.07Å
728	S	69.8	Low	68.9	Low	2 Å²	2	66.6 Å²	66.6	1%	0.014	34%	0.341	C	S	.	.			trans	-58	127.8	178	-176.4	0	0	0	0	111.8	E690 W724 L730 L731	E690-S728 WeakPolarHBondContact OE2-CB 3.33Å; E690-S728 PolarHBondContact OE2-OG 3.43Å; W724-S728 WeakPolarHBondContact O-CB 3.39Å; W724-S728 PolarHBondContact O-N 2.79Å; S728-L730 PolarHBondContact O-N 3.27Å; S728-L731 VanDerWaalsContact O-CB 3.31Å; S728-L731 WeakPolarHBondContact O-CB 3.32Å; S728-L731 WeakPolarHBondContact O-CD1 3.28Å; S728-L731 WeakPolarHBondContact O-CG 3.41Å; S728-L731 PolarHBondContact O-N 3.28Å; S728-L731 VanDerWaalsContact O-N 3.09Å
729	P	64.5	Low	68.3	Low	67 Å²	67	70.4 Å²	70.4	44%	0.435	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-62.4	-24.3	178.9	23.9	-31.5	0	0	0	112.7	L731 L732	P729-L731 PolarHBondContact O-N 2.84Å; P729-L731 VanDerWaalsContact O-N 3.17Å; P729-L732 WeakPolarHBondContact O-CB 3.44Å; P729-L732 PolarHBondContact O-N 2.65Å; P729-L732 VanDerWaalsContact O-N 3.11Å
730	L	63.8	Low	67.7	Low	28 Å²	28	64.7 Å²	64.7	15%	0.147	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-69.5	-6.2	176.3	-64	170.8	0	0	0	113.6	E690 D691 S728 L732 T740	E690-L730 HydrophobicContact CB-CD1 4.09Å; E690-L730 HydrophobicContact CG-CD1 3.95Å; D691-L730 HydrophobicContact CB-CD1 4.03Å; S728-L730 PolarHBondContact O-N 3.27Å; L730-L732 VanDerWaalsContact C-N 3.33Å; L730-T740 HydrophobicContact CB-CG2 4.35Å
731	L	58.8	Low	67.2	Low	39 Å²	39	71.5 Å²	71.5	20%	0.204	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-74.3	-24.6	169.4	-70.5	168.4	0	0	0	113.7	S728 P729 D733 R744	S728-L731 VanDerWaalsContact O-CB 3.31Å; S728-L731 WeakPolarHBondContact O-CB 3.32Å; S728-L731 WeakPolarHBondContact O-CD1 3.28Å; S728-L731 WeakPolarHBondContact O-CG 3.41Å; S728-L731 PolarHBondContact O-N 3.28Å; S728-L731 VanDerWaalsContact O-N 3.09Å; P729-L731 PolarHBondContact O-N 2.84Å; P729-L731 VanDerWaalsContact O-N 3.17Å; L731-D733 VanDerWaalsContact C-N 3.33Å; L731-R744 VanDerWaalsContact CD1-NH2 3.27Å; L731-R744 VanDerWaalsContact CG-NH2 3.26Å
732	L	56.9	Low	66.9	Low	153 Å²	153	73.4 Å²	73.4	80%	0.801	37%	0.365	S	S	*	.	S	Bend	trans	-88.4	-8.1	-176.6	-63	167.5	0	0	0	111.9	P729 L730	P729-L732 WeakPolarHBondContact O-CB 3.44Å; P729-L732 PolarHBondContact O-N 2.65Å; P729-L732 VanDerWaalsContact O-N 3.11Å; L730-L732 VanDerWaalsContact C-N 3.33Å
733	D	60	Low	66.7	Low	67 Å²	67	71 Å²	71	36%	0.358	36%	0.356	S	S	.	.			trans	-85.5	110.4	177.4	-164.1	-20.4	0	0	0	110.4	L731 D735 I736 S737	L731-D733 VanDerWaalsContact C-N 3.33Å; D733-D735 PolarHBondContact O-N 3.45Å; D733-D735 VanDerWaalsContact O-N 3.16Å; D733-D735 PolarHBondContact OD1-N 2.81Å; D733-I736 PolarHBondContact O-N 3.44Å; D733-S737 VanDerWaalsContact O-CB 3.25Å; D733-S737 WeakPolarHBondContact O-CB 3.2Å; D733-S737 PolarHBondContact O-N 2.76Å
734	D	57.3	Low	66.3	Low	147 Å²	147	69.4 Å²	69.4	79%	0.786	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-29.6	-175.2	-77.9	-31.2	0	0	0	112.3	S737	D734-S737 PolarHBondContact O-OG 3.01Å
735	D	59	Low	66	Low	156 Å²	156	75.3 Å²	75.3	83%	0.834	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-22.8	-175.4	-75	-23.5	0	0	0	113.6	D733	D733-D735 PolarHBondContact O-N 3.45Å; D733-D735 VanDerWaalsContact O-N 3.16Å; D733-D735 PolarHBondContact OD1-N 2.81Å
736	I	63.3	Low	65.9	Low	15 Å²	15	77.1 Å²	77.1	8%	0.077	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-16.4	-171.1	-51.8	174.6	0	0	0	111.8	C694 D733 E738 K739 T740	C694-I736 HydrophobicContact CB-CG2 3.64Å; C694-I736 WeakPolarHBondContact SG-CG2 3.11Å; D733-I736 PolarHBondContact O-N 3.44Å; I736-E738 VanDerWaalsContact C-N 3.3Å; I736-E738 PolarHBondContact O-N 2.9Å; I736-E738 VanDerWaalsContact O-N 3.12Å; I736-K739 PolarHBondContact O-N 2.88Å; I736-T740 HydrophobicContact CG2-CG2 3.9Å; I736-T740 PolarHBondContact O-N 2.82Å; I736-T740 VanDerWaalsContact O-N 3.14Å; I736-T740 PolarHBondContact O-OG1 2.81Å
737	S	61.6	Low	66.1	Low	14 Å²	14	72 Å²	72	10%	0.098	36%	0.358	C	S	.	.	H	α-helix	trans	-53.6	-33.7	-175.3	67.1	0	0	0	0	115.9	D733 D734 T740 R741	D733-S737 VanDerWaalsContact O-CB 3.25Å; D733-S737 WeakPolarHBondContact O-CB 3.2Å; D733-S737 PolarHBondContact O-N 2.76Å; D734-S737 PolarHBondContact O-OG 3.01Å; S737-T740 VanDerWaalsContact CA-OG1 3.29Å; S737-T740 WeakPolarHBondContact CA-OG1 3.27Å; S737-T740 PolarHBondContact O-OG1 2.86Å; S737-R741 WeakPolarHBondContact O-CB 3.29Å; S737-R741 VanDerWaalsContact O-CG 3.29Å; S737-R741 WeakPolarHBondContact O-CG 3.5Å; S737-R741 PolarHBondContact O-N 3.02Å; S737-R741 VanDerWaalsContact O-N 3.16Å
738	E	64.8	Low	66.2	Low	164 Å²	164	72.7 Å²	72.7	77%	0.766	36%	0.357	S	S	*	.	H	α-helix	trans	-69.7	-39.4	178.8	-69.8	-170	166.9	0	0	111.9	I736 S742	I736-E738 VanDerWaalsContact C-N 3.3Å; I736-E738 PolarHBondContact O-N 2.9Å; I736-E738 VanDerWaalsContact O-N 3.12Å; E738-S742 PolarHBondContact O-N 3.2Å; E738-S742 VanDerWaalsContact O-N 3.14Å
739	K	64.2	Low	66.5	Low	113 Å²	113	76.1 Å²	76.1	49%	0.491	38%	0.379	S	S	.	.	H	α-helix	trans	-75.2	-38.3	179.6	-73.6	-176.5	177	175.6	0	111.7	C694 I736 S742 L743	C694-K739 HydrophobicContact CB-CD 4.42Å; C694-K739 WeakPolarHBondContact O-CD 3.36Å; C694-K739 PolarHBondContact O-NZ 2.82Å; I736-K739 PolarHBondContact O-N 2.88Å; K739-S742 WeakPolarHBondContact CA-OG 3.47Å; K739-S742 PolarHBondContact O-N 3.3Å; K739-S742 PolarHBondContact O-OG 3.47Å; K739-L743 PolarHBondContact O-N 2.82Å
740	T	65.8	Low	67.1	Low	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.9	-39.8	176.8	52.9	0	0	0	0	111.5	E690 L730 I736 S737 S742 L743 R744	E690-T740 HydrophobicContact CG-CG2 3.73Å; E690-T740 VanDerWaalsContact OE1-CB 3.27Å; E690-T740 WeakPolarHBondContact OE1-CB 3.46Å; E690-T740 VanDerWaalsContact OE1-CG2 3.32Å; E690-T740 WeakPolarHBondContact OE1-CG2 3.38Å; L730-T740 HydrophobicContact CB-CG2 4.35Å; I736-T740 HydrophobicContact CG2-CG2 3.9Å; I736-T740 PolarHBondContact O-N 2.82Å; I736-T740 VanDerWaalsContact O-N 3.14Å; I736-T740 PolarHBondContact O-OG1 2.81Å; S737-T740 VanDerWaalsContact CA-OG1 3.29Å; S737-T740 WeakPolarHBondContact CA-OG1 3.27Å; S737-T740 PolarHBondContact O-OG1 2.86Å; T740-S742 PolarHBondContact O-N 3.45Å; T740-L743 WeakPolarHBondContact O-CB 3.26Å; T740-L743 PolarHBondContact O-N 2.95Å; T740-R744 WeakPolarHBondContact O-CG 3.37Å; T740-R744 PolarHBondContact O-N 2.84Å; T740-R744 VanDerWaalsContact O-N 3.13Å
741	R	69.1	Low	67.7	Low	152 Å²	152	72 Å²	72	57%	0.574	35%	0.353	S	S	*	.	H	α-helix	trans	-60.7	-44.9	170.3	-73.7	178	-171.1	163.2	8.2	112	S737 L743 R744 E745	S737-R741 WeakPolarHBondContact O-CB 3.29Å; S737-R741 VanDerWaalsContact O-CG 3.29Å; S737-R741 WeakPolarHBondContact O-CG 3.5Å; S737-R741 PolarHBondContact O-N 3.02Å; S737-R741 VanDerWaalsContact O-N 3.16Å; R741-L743 VanDerWaalsContact C-N 3.29Å; R741-L743 PolarHBondContact O-N 2.87Å; R741-R744 PolarHBondContact O-N 2.93Å; R741-E745 WeakPolarHBondContact O-CG 3.44Å; R741-E745 PolarHBondContact O-N 2.92Å; R741-E745 VanDerWaalsContact O-N 3.08Å
742	S	71.3	Confident	68.5	Low	40 Å²	40	74.1 Å²	74.1	28%	0.28	37%	0.365	S	S	.	.	H	α-helix	trans	-64.5	-31.5	178.2	77.4	0	0	0	0	113.4	F700 E738 K739 T740 E745 K746	F700-S742 VanDerWaalsContact CZ-OG 3.26Å; F700-S742 WeakPolarHBondContact CZ-OG 3.21Å; E738-S742 PolarHBondContact O-N 3.2Å; E738-S742 VanDerWaalsContact O-N 3.14Å; K739-S742 WeakPolarHBondContact CA-OG 3.47Å; K739-S742 PolarHBondContact O-N 3.3Å; K739-S742 PolarHBondContact O-OG 3.47Å; T740-S742 PolarHBondContact O-N 3.45Å; S742-E745 PolarHBondContact O-N 2.88Å; S742-K746 PolarHBondContact O-N 2.8Å
743	L	72.5	Confident	69.7	Low	1 Å²	1	72.1 Å²	72.1	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-66.2	-44.6	174.5	-173.2	120.9	0	0	0	110.9	A693 F700 W724 K739 T740 R741 E745 K746 I747	A693-L743 HydrophobicContact CB-CD1 3.39Å; F700-L743 HydrophobicContact CD2-CB 4.4Å; F700-L743 HydrophobicContact CD2-CD1 3.73Å; F700-L743 HydrophobicContact CE2-CB 3.75Å; F700-L743 HydrophobicContact CE2-CD1 3.96Å; F700-L743 HydrophobicContact CE2-CG 4.36Å; W724-L743 HydrophobicContact CH2-CD2 3.46Å; W724-L743 VanDerWaalsContact CH2-CD2 3.46Å; W724-L743 HydrophobicContact CZ2-CD2 3.63Å; K739-L743 PolarHBondContact O-N 2.82Å; T740-L743 WeakPolarHBondContact O-CB 3.26Å; T740-L743 PolarHBondContact O-N 2.95Å; R741-L743 VanDerWaalsContact C-N 3.29Å; R741-L743 PolarHBondContact O-N 2.87Å; L743-E745 VanDerWaalsContact C-N 3.33Å; L743-E745 PolarHBondContact O-N 2.89Å; L743-K746 WeakPolarHBondContact O-CB 3.2Å; L743-K746 PolarHBondContact O-N 3.03Å; L743-K746 VanDerWaalsContact O-N 3.14Å; L743-I747 HydrophobicContact CD2-CD1 3.43Å; L743-I747 VanDerWaalsContact CD2-CD1 3.43Å; L743-I747 HydrophobicContact CG-CD1 3.72Å; L743-I747 WeakPolarHBondContact O-CD1 3.39Å; L743-I747 WeakPolarHBondContact O-CG1 3.23Å; L743-I747 PolarHBondContact O-N 2.89Å
744	R	72.8	Confident	70.4	Confident	36 Å²	36	69 Å²	69	14%	0.136	33%	0.33	C	S	.	.	H	α-helix	trans	-63.9	-37.4	176.5	-67.7	171.6	-174.4	-160	-10.1	112.6	E690 W724 K725 L731 T740 R741 K746 I747 K748	E690-R744 IonicContact OE1-NH2 2.92Å; W724-R744 PolarHBondContact O-NH2 3.21Å; K725-R744 PolarHBondContact O-NH1 3.09Å; K725-R744 PolarHBondContact O-NH2 3.33Å; L731-R744 VanDerWaalsContact CD1-NH2 3.27Å; L731-R744 VanDerWaalsContact CG-NH2 3.26Å; T740-R744 WeakPolarHBondContact O-CG 3.37Å; T740-R744 PolarHBondContact O-N 2.84Å; T740-R744 VanDerWaalsContact O-N 3.13Å; R741-R744 PolarHBondContact O-N 2.93Å; R744-K746 VanDerWaalsContact C-N 3.28Å; R744-K746 PolarHBondContact O-N 3.17Å; R744-I747 PolarHBondContact O-N 3.26Å; R744-K748 WeakPolarHBondContact O-CG 3.43Å; R744-K748 PolarHBondContact O-N 2.7Å
745	E	73.3	Confident	71.1	Confident	126 Å²	126	66.5 Å²	66.5	59%	0.589	31%	0.314	S	S	*	.	H	α-helix	trans	-62.7	-35.4	174	-68.5	-169	151.3	0	0	112.9	R741 S742 L743 K748	R741-E745 WeakPolarHBondContact O-CG 3.44Å; R741-E745 PolarHBondContact O-N 2.92Å; R741-E745 VanDerWaalsContact O-N 3.08Å; S742-E745 PolarHBondContact O-N 2.88Å; L743-E745 VanDerWaalsContact C-N 3.33Å; L743-E745 PolarHBondContact O-N 2.89Å; E745-K748 WeakPolarHBondContact O-CB 3.1Å; E745-K748 IonicContact OE1-NZ 3.65Å
746	K	72.5	Confident	71.7	Confident	99 Å²	99	64.7 Å²	64.7	43%	0.43	30%	0.3	S	S	.	.	H	α-helix	trans	-70.8	-33.8	173.3	-86.4	-169	172.4	-174.8	0	113.5	F700 S742 L743 R744 K748 P749	F700-K746 HydrophobicContact CD1-CD 4.45Å; F700-K746 HydrophobicContact CE1-CD 3.79Å; F700-K746 VanDerWaalsContact CE1-NZ 3.3Å; F700-K746 HydrophobicContact CZ-CD 4.14Å; S742-K746 PolarHBondContact O-N 2.8Å; L743-K746 WeakPolarHBondContact O-CB 3.2Å; L743-K746 PolarHBondContact O-N 3.03Å; L743-K746 VanDerWaalsContact O-N 3.14Å; R744-K746 VanDerWaalsContact C-N 3.28Å; R744-K746 PolarHBondContact O-N 3.17Å; K746-K748 VanDerWaalsContact C-N 3.33Å; K746-P749 VanDerWaalsContact O-CD 3.25Å; K746-P749 WeakPolarHBondContact O-CD 3.26Å
747	I	76	Confident	71.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-84	-10.4	-178.1	-62.1	159.2	0	0	0	111.4	M704 I707 W724 L743 R744 P749 F750 F751	M704-I747 HydrophobicContact CB-CG1 4.28Å; I707-I747 HydrophobicContact CD1-CD1 3.53Å; I707-I747 HydrophobicContact CD1-CG1 4.4Å; W724-I747 HydrophobicContact CH2-CD1 3.8Å; W724-I747 HydrophobicContact CZ3-CD1 4.25Å; L743-I747 HydrophobicContact CD2-CD1 3.43Å; L743-I747 VanDerWaalsContact CD2-CD1 3.43Å; L743-I747 HydrophobicContact CG-CD1 3.72Å; L743-I747 WeakPolarHBondContact O-CD1 3.39Å; L743-I747 WeakPolarHBondContact O-CG1 3.23Å; L743-I747 PolarHBondContact O-N 2.89Å; R744-I747 PolarHBondContact O-N 3.26Å; I747-P749 VanDerWaalsContact C-N 3.31Å; I747-P749 VanDerWaalsContact O-N 3.1Å; I747-F750 HydrophobicContact CG2-CB 4Å; I747-F750 HydrophobicContact CG2-CD1 4.04Å; I747-F750 HydrophobicContact CG2-CG 4.5Å; I747-F750 WeakPolarHBondContact O-CA 3.18Å; I747-F750 VanDerWaalsContact O-CB 3.3Å; I747-F750 WeakPolarHBondContact O-CB 3.32Å; I747-F750 PolarHBondContact O-N 3.49Å; I747-F751 HydrophobicContact CB-CE2 4.08Å; I747-F751 HydrophobicContact CB-CZ 4.23Å; I747-F751 HydrophobicContact CG2-CD1 4.28Å; I747-F751 HydrophobicContact CG2-CD2 4.26Å; I747-F751 HydrophobicContact CG2-CE1 3.83Å; I747-F751 HydrophobicContact CG2-CE2 3.82Å; I747-F751 HydrophobicContact CG2-CG 4.48Å; I747-F751 HydrophobicContact CG2-CZ 3.6Å; I747-F751 PolarHBondContact O-N 2.84Å
748	K	73.5	Confident	71.6	Confident	108 Å²	108	68.7 Å²	68.7	47%	0.47	32%	0.322	S	S	.	.	H	α-helix	trans	-41.1	-47.8	175.1	-79	175.6	-177.6	172.7	0	114.7	R744 E745 K746 F750 F751 D752	R744-K748 WeakPolarHBondContact O-CG 3.43Å; R744-K748 PolarHBondContact O-N 2.7Å; E745-K748 WeakPolarHBondContact O-CB 3.1Å; E745-K748 IonicContact OE1-NZ 3.65Å; K746-K748 VanDerWaalsContact C-N 3.33Å; K748-F750 PolarHBondContact O-N 2.78Å; K748-F750 VanDerWaalsContact O-N 3.17Å; K748-F751 PolarHBondContact O-N 2.8Å; K748-F751 VanDerWaalsContact O-N 3.07Å; K748-D752 VanDerWaalsContact O-CG 3.23Å; K748-D752 PolarHBondContact O-N 3.17Å
749	P	76.3	Confident	70.9	Confident	74 Å²	74	66.9 Å²	66.9	48%	0.481	31%	0.314	S	S	.	.	H	α-helix	trans	-63	-24	178.9	-20.4	33.3	0	0	0	114.5	M704 K746 I747 W753	M704-P749 HydrophobicContact CE-CB 4.08Å; K746-P749 VanDerWaalsContact O-CD 3.25Å; K746-P749 WeakPolarHBondContact O-CD 3.26Å; I747-P749 VanDerWaalsContact C-N 3.31Å; I747-P749 VanDerWaalsContact O-N 3.1Å; P749-W753 WeakPolarHBondContact O-CB 3.12Å; P749-W753 PolarHBondContact O-N 3.15Å
750	F	75.6	Confident	70.2	Confident	3 Å²	3	68.5 Å²	68.5	1%	0.013	32%	0.323	C	S	.	.	H	α-helix	trans	-80.4	-37	174.7	-179.6	-112.6	0	0	0	111.2	M704 I707 H708 I721 I747 K748 W753 L754	M704-F750 HydrophobicContact CE-CB 3.63Å; M704-F750 HydrophobicContact CG-CB 3.92Å; M704-F750 HydrophobicContact SD-CB 4.5Å; I707-F750 HydrophobicContact CG2-CD1 4.31Å; I707-F750 HydrophobicContact CG2-CE1 3.72Å; I707-F750 HydrophobicContact CG2-CZ 4.46Å; H708-F750 HydrophobicContact CB-CD2 4.44Å; H708-F750 HydrophobicContact CB-CE2 3.9Å; H708-F750 HydrophobicContact CB-CZ 4.29Å; H708-F750 AromaticContact CD2-CD2 3.91Å; H708-F750 AromaticContact CD2-CE2 3.44Å; H708-F750 VanDerWaalsContact CD2-CE2 3.44Å; H708-F750 WeakPolarHBondContact CD2-CE2 3.25Å; H708-F750 AromaticContact CG-CE2 3.92Å; I721-F750 HydrophobicContact CD1-CE1 4.26Å; I747-F750 HydrophobicContact CG2-CB 4Å; I747-F750 HydrophobicContact CG2-CD1 4.04Å; I747-F750 HydrophobicContact CG2-CG 4.5Å; I747-F750 WeakPolarHBondContact O-CA 3.18Å; I747-F750 VanDerWaalsContact O-CB 3.3Å; I747-F750 WeakPolarHBondContact O-CB 3.32Å; I747-F750 PolarHBondContact O-N 3.49Å; K748-F750 PolarHBondContact O-N 2.78Å; K748-F750 VanDerWaalsContact O-N 3.17Å; F750-W753 AromaticContact CD2-CE3 3.84Å; F750-W753 HydrophobicContact CD2-CE3 3.84Å; F750-W753 HydrophobicContact CD2-CZ3 4.33Å; F750-W753 AromaticContact CE2-CE3 3.61Å; F750-W753 HydrophobicContact CE2-CE3 3.61Å; F750-W753 AromaticContact CE2-CZ3 3.63Å; F750-W753 HydrophobicContact CE2-CZ3 3.63Å; F750-W753 HydrophobicContact CZ-CE3 4.48Å; F750-W753 HydrophobicContact CZ-CZ3 4.31Å; F750-W753 PolarHBondContact O-N 2.72Å; F750-L754 HydrophobicContact CD1-CD1 4.02Å; F750-L754 HydrophobicContact CE1-CD1 3.56Å; F750-L754 HydrophobicContact CE1-CG 4.25Å; F750-L754 HydrophobicContact CZ-CD1 3.92Å; F750-L754 HydrophobicContact CZ-CD2 4.37Å; F750-L754 HydrophobicContact CZ-CG 4.17Å; F750-L754 PolarHBondContact O-N 3.01Å
751	F	76.2	Confident	69.4	Low	4 Å²	4	74.3 Å²	74.3	2%	0.018	36%	0.355	C	S	.	.	H	α-helix	trans	-64.7	-43.4	172.3	-59.6	-44.8	0	0	0	111.5	I721 W724 K725 I747 K748 W753 L754 E755	I721-F751 HydrophobicContact CG2-CD1 4.08Å; I721-F751 HydrophobicContact CG2-CE1 3.61Å; W724-F751 HydrophobicContact CE3-CZ 4.43Å; W724-F751 HydrophobicContact CZ3-CE1 4.43Å; W724-F751 AromaticContact CZ3-CZ 3.88Å; W724-F751 HydrophobicContact CZ3-CZ 3.88Å; K725-F751 HydrophobicContact CB-CE1 4.49Å; K725-F751 HydrophobicContact CB-CZ 4.21Å; K725-F751 HydrophobicContact CD-CD2 4.21Å; K725-F751 HydrophobicContact CD-CE1 4.47Å; K725-F751 HydrophobicContact CD-CE2 4.17Å; K725-F751 HydrophobicContact CD-CG 4.39Å; K725-F751 HydrophobicContact CD-CZ 4.29Å; K725-F751 HydrophobicContact CG-CE2 4.17Å; K725-F751 HydrophobicContact CG-CZ 4.14Å; I747-F751 HydrophobicContact CB-CE2 4.08Å; I747-F751 HydrophobicContact CB-CZ 4.23Å; I747-F751 HydrophobicContact CG2-CD1 4.28Å; I747-F751 HydrophobicContact CG2-CD2 4.26Å; I747-F751 HydrophobicContact CG2-CE1 3.83Å; I747-F751 HydrophobicContact CG2-CE2 3.82Å; I747-F751 HydrophobicContact CG2-CG 4.48Å; I747-F751 HydrophobicContact CG2-CZ 3.6Å; I747-F751 PolarHBondContact O-N 2.84Å; K748-F751 PolarHBondContact O-N 2.8Å; K748-F751 VanDerWaalsContact O-N 3.07Å; F751-W753 PolarHBondContact O-N 3.05Å; F751-L754 PolarHBondContact O-N 2.86Å; F751-E755 PolarHBondContact O-N 2.86Å
752	D	76.8	Confident	68.4	Low	85 Å²	85	73 Å²	73	46%	0.455	36%	0.359	S	S	.	.	H	α-helix	trans	-63	-28.9	176.5	-58.4	-17.4	0	0	0	111.6	K748 Q756	K748-D752 VanDerWaalsContact O-CG 3.23Å; K748-D752 PolarHBondContact O-N 3.17Å; D752-Q756 VanDerWaalsContact O-CG 3.26Å; D752-Q756 WeakPolarHBondContact O-CG 3.28Å; D752-Q756 PolarHBondContact O-N 3.05Å
753	W	81.8	Confident	67.3	Low	111 Å²	111	77.9 Å²	77.9	42%	0.42	38%	0.382	S	S	.	.	H	α-helix	trans	-76.2	-40.2	175	173.4	75.6	0	0	0	112.6	Y711 P749 F750 F751 Q756 A757	Y711-W753 HydrophobicContact CE1-CH2 4.46Å; Y711-W753 HydrophobicContact CE1-CZ3 4.4Å; P749-W753 WeakPolarHBondContact O-CB 3.12Å; P749-W753 PolarHBondContact O-N 3.15Å; F750-W753 AromaticContact CD2-CE3 3.84Å; F750-W753 HydrophobicContact CD2-CE3 3.84Å; F750-W753 HydrophobicContact CD2-CZ3 4.33Å; F750-W753 AromaticContact CE2-CE3 3.61Å; F750-W753 HydrophobicContact CE2-CE3 3.61Å; F750-W753 AromaticContact CE2-CZ3 3.63Å; F750-W753 HydrophobicContact CE2-CZ3 3.63Å; F750-W753 HydrophobicContact CZ-CE3 4.48Å; F750-W753 HydrophobicContact CZ-CZ3 4.31Å; F750-W753 PolarHBondContact O-N 2.72Å; F751-W753 PolarHBondContact O-N 3.05Å; W753-Q756 PolarHBondContact O-N 3.02Å; W753-A757 WeakPolarHBondContact O-CB 3.42Å; W753-A757 PolarHBondContact O-N 3.25Å
754	L	75.3	Confident	66.1	Low	1 Å²	1	85 Å²	85	1%	0.005	42%	0.42	C	S	.	.	H	α-helix	trans	-62.1	-46.3	174.4	-77.8	170.2	0	0	0	111.1	Y711 I721 W722 F750 F751 Q756 A757 E758	Y711-L754 HydrophobicContact CE1-CD2 4.17Å; Y711-L754 HydrophobicContact CE2-CD2 4.32Å; I721-L754 HydrophobicContact CD1-CD1 4.07Å; I721-L754 HydrophobicContact CG2-CD1 4.08Å; W722-L754 HydrophobicContact CZ2-CB 4.49Å; F750-L754 HydrophobicContact CD1-CD1 4.02Å; F750-L754 HydrophobicContact CE1-CD1 3.56Å; F750-L754 HydrophobicContact CE1-CG 4.25Å; F750-L754 HydrophobicContact CZ-CD1 3.92Å; F750-L754 HydrophobicContact CZ-CD2 4.37Å; F750-L754 HydrophobicContact CZ-CG 4.17Å; F750-L754 PolarHBondContact O-N 3.01Å; F751-L754 PolarHBondContact O-N 2.86Å; L754-Q756 VanDerWaalsContact C-N 3.3Å; L754-Q756 PolarHBondContact O-N 3.04Å; L754-A757 WeakPolarHBondContact O-CB 3.46Å; L754-A757 PolarHBondContact O-N 3.04Å; L754-E758 PolarHBondContact O-N 3.1Å
755	E	72.2	Confident	64.4	Low	95 Å²	95	94.6 Å²	94.6	44%	0.444	47%	0.466	S	S	.	.	H	α-helix	trans	-62.5	-35.1	178.8	-163.7	169.3	-165.9	0	0	112.1	W722 F751 E759	W722-E755 HydrophobicContact CH2-CB 4.28Å; W722-E755 HydrophobicContact CZ2-CB 4.35Å; F751-E755 PolarHBondContact O-N 2.86Å; E755-E759 WeakPolarHBondContact O-CG 3.15Å; E755-E759 PolarHBondContact O-N 3.05Å
756	Q	70.6	Confident	63.9	Low	118 Å²	118	93 Å²	93	55%	0.551	46%	0.46	S	S	*	.	H	α-helix	trans	-73.5	-29.8	173.8	-76.1	169.7	18.2	0	0	113.5	D752 W753 L754 E760	D752-Q756 VanDerWaalsContact O-CG 3.26Å; D752-Q756 WeakPolarHBondContact O-CG 3.28Å; D752-Q756 PolarHBondContact O-N 3.05Å; W753-Q756 PolarHBondContact O-N 3.02Å; L754-Q756 VanDerWaalsContact C-N 3.3Å; L754-Q756 PolarHBondContact O-N 3.04Å; Q756-E760 PolarHBondContact O-N 2.91Å
757	A	65.5	Low	63.5	Low	33 Å²	33	92.7 Å²	92.7	27%	0.273	46%	0.462	S	S	.	.	H	α-helix	trans	-73.7	-37.7	177.2	0	0	0	0	0	111.3	W753 L754 E760 D761	W753-A757 WeakPolarHBondContact O-CB 3.42Å; W753-A757 PolarHBondContact O-N 3.25Å; L754-A757 WeakPolarHBondContact O-CB 3.46Å; L754-A757 PolarHBondContact O-N 3.04Å; A757-E760 PolarHBondContact O-N 3.24Å; A757-D761 PolarHBondContact O-N 2.9Å
758	E	57.4	Low	62.8	Low	79 Å²	79	97.8 Å²	97.8	37%	0.369	49%	0.487	S	S	.	.	H	α-helix	trans	-62.6	-42.9	170.9	-76.1	-174.1	152.8	0	0	111.6	E718 L754 E760 D761 D762	E718-E758 VanDerWaalsContact OE1-CD 3.25Å; E718-E758 WeakPolarHBondContact OE1-CG 3.3Å; L754-E758 PolarHBondContact O-N 3.1Å; E758-E760 VanDerWaalsContact C-N 3.33Å; E758-E760 PolarHBondContact O-N 3.03Å; E758-D761 PolarHBondContact O-N 3.14Å; E758-D762 PolarHBondContact O-N 3.32Å; E758-D762 VanDerWaalsContact O-N 3.15Å
759	E	51.4	Low	62.1	Low	127 Å²	127	97.2 Å²	97.2	59%	0.593	49%	0.488	S	S	*	.	H	α-helix	trans	-65.8	-29.8	178.4	-75.5	-176.1	170.3	0	0	113.5	E755 D763	E755-E759 WeakPolarHBondContact O-CG 3.15Å; E755-E759 PolarHBondContact O-N 3.05Å; E759-D763 PolarHBondContact O-N 3.32Å
760	E	49.1	Very low	61.3	Low	146 Å²	146	98.7 Å²	98.7	68%	0.682	49%	0.489	S	S	*	.	H	α-helix	trans	-76.8	-32.1	175.7	-78.6	-173.9	171.6	0	0	113	Q756 A757 E758	Q756-E760 PolarHBondContact O-N 2.91Å; A757-E760 PolarHBondContact O-N 3.24Å; E758-E760 VanDerWaalsContact C-N 3.33Å; E758-E760 PolarHBondContact O-N 3.03Å
761	D	48	Very low	60.3	Low	123 Å²	123	105.1 Å²	105.1	66%	0.658	52%	0.52	S	S	*	.	H	α-helix	trans	-76.4	-31.1	177.2	-80.7	-24.7	0	0	0	112.3	A757 E758	A757-D761 PolarHBondContact O-N 2.9Å; E758-D761 PolarHBondContact O-N 3.14Å
762	D	47.9	Very low	59.2	Low	123 Å²	123	112.3 Å²	112.3	66%	0.658	56%	0.556	S	S	*	*	H	α-helix	trans	-74.4	-22.3	175.2	-87.4	-13.9	0	0	0	113.4	E758	E758-D762 PolarHBondContact O-N 3.32Å; E758-D762 VanDerWaalsContact O-N 3.15Å
763	D	49.3	Very low	57.8	Low	143 Å²	143	114.4 Å²	114.4	77%	0.765	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-9.7	178.4	-91.6	-16.9	0	0	0	113.4	E759	E759-D763 PolarHBondContact O-N 3.32Å
764	D	47.7	Very low	55.8	Low	151 Å²	151	114.7 Å²	114.7	81%	0.807	58%	0.576	S	S	*	*			trans	-103.5	4.6	179	-89.5	-19.8	0	0	0	114.4
765	E	35.5	Very low	54	Low	237 Å²	237	125 Å²	125	100%	1.107	63%	0.628	S	S	*	*			trans	-96	0	165.8	-74.9	-159.9	159.2	0	0	113.6

Retrieved 765 of 765 residues in 227.9 ms (Link to these results)

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