A0A087XFV6_POEFO Loading...

SAFB-like, transcription modulator

AlphaFold DB , UniProt , Accession A0A087XFV6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 938 aa.

						>A0A087XFV6_POEFO|A0A087XFV6
MASGAISTDSKKISELRVVDLKSELKRRGLDTFGVKSVLLSRLKQAIEDEGGDPEYIPTPQSTDSSSRLSGKSRGKKSDSDLENTVEEDVSSKEVEEYESEKDVTDTDDGSRENSKPPPCEDSLAHSEPEPESETVAADADSEPDPEVDAEVDEDADADADPEPEAEAETEEAERDAETLSSSREAEDDHLSVSIQNEDAITLDVDGDDLLETGKHVKLPDPEAEKGTETCAETGQDDDMKDEDMEEDGTKEDEPTNKDAVMKAETEDKEKDSGKKGPSATGASGQAKSSSRDRDGKAAKDEKGISSSSRNVWVSGLSSNTKAADLKNLFGKYGKVLSAKVVTNARSPGSKCYGLVTMSSGTEVTRCISHLDCTELHGQQIYVERAKNDPFKKEPSKKEVEDKAGSSKSNKNTFTGTKLANKAELTHKKEEKKSDKLSDKDASKKQDSKSGSSSSDQESSKRDDRKRGETKSPAKSTDEDDPKGDGDFEKRPFRTGRYFNKPFMNPNFDRRPKWLIPPEEVQLLREKRQSFHNKGGEMVILPFDKFKEQKEQRMREQMERFHRAAELRRRREIAEQERRERERVRLMREREEREILLRERQRLEMERQKLERERLERERLERERIRIEQERRKEAERMAREREELRRQQEQLRFEQEKRNNLKRGREVEHGRREDPYWNGNKKMHPESEVRLNQGSNYNRQQNRFPNTNPRERGRFPDAGQQPNTFDRRNRFEGEPEAKKSRPAPHREGSGFDRYPKNYDAVHRPEPAPRGDTDRRDRDERRPPPMGARPPIPAMSHNRPPRDGGAGWKNDGGVNSSKGDMRGPMRMRDDRPGRDAGRSGFNNRGQPMGMNEQPFSSGRQVVVERHSRDQGLRKEWHGGSGSQVFSDNRRMGDGRGGMMATSSHSSSGLGRIVQITNNSISSGTVGGFKAFKGASRPF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43	Very low	46.4	Very low	250 Å²	250	116.8 Å²	116.8	100%	1.232	74%	0.738	S	S	*	*				0	135	0	-68.8	170.4	171.6	0	0	108.1
2	A	35.9	Very low	50	Low	103 Å²	103	113.1 Å²	113.1	85%	0.851	70%	0.703	S	S	*	*			trans	-163.7	96.4	170.9	0	0	0	0	0	108.1	G4	A2-G4 PolarHBondContact O-N 2.75Å
3	S	36.7	Very low	53	Low	128 Å²	128	104.9 Å²	104.9	90%	0.895	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-79	119.6	-179.7	-57.9	0	0	0	0	109.9	A5	S3-A5 PolarHBondContact O-N 3.42Å
4	G	33.3	Very low	55.7	Low	70 Å²	70	102.1 Å²	102.1	72%	0.722	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-71.6	117.5	172.7	0	0	0	0	0	110.4	A2 I6	A2-G4 PolarHBondContact O-N 2.75Å; G4-I6 PolarHBondContact O-N 3.24Å
5	A	35.5	Very low	58	Low	100 Å²	100	104.7 Å²	104.7	83%	0.826	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-67.4	123.4	178.1	0	0	0	0	0	110.8	S3	S3-A5 PolarHBondContact O-N 3.42Å
6	I	35.4	Very low	60.1	Low	137 Å²	137	100 Å²	100	70%	0.703	61%	0.609	S	S	*	*			trans	-92	105.2	170.2	-42.1	173.8	0	0	0	106.7	G4 T8	G4-I6 PolarHBondContact O-N 3.24Å; I6-T8 PolarHBondContact O-N 3.34Å
7	S	34.5	Very low	62	Low	108 Å²	108	103 Å²	103	76%	0.755	61%	0.606	S	S	*	*			trans	-68.3	103.5	169.8	-67.5	0	0	0	0	109.3
8	T	45.3	Very low	63.7	Low	94 Å²	94	100.4 Å²	100.4	58%	0.577	59%	0.592	S	S	*	*			trans	-75.4	129.9	161.9	44.9	0	0	0	0	108.4	I6 S10	I6-T8 PolarHBondContact O-N 3.34Å; T8-S10 PolarHBondContact O-N 2.81Å
9	D	53.8	Low	65.3	Low	118 Å²	118	100.6 Å²	100.6	63%	0.631	59%	0.594	S	S	*	*			trans	-75.9	64.8	178.3	-82.5	-23.9	0	0	0	110.9	K11 T59	D9-K11 PolarHBondContact O-N 3.09Å; D9-T59 WeakPolarHBondContact O-CG2 3.1Å
10	S	73.3	Confident	66.8	Low	59 Å²	59	97.6 Å²	97.6	41%	0.413	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-67.5	118.2	179.6	55.5	0	0	0	0	110.8	T8	T8-S10 PolarHBondContact O-N 2.81Å
11	K	83.4	Confident	68.1	Low	118 Å²	118	93 Å²	93	51%	0.513	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	132	-178.1	-73.3	163.8	-173	156.2	0	110.3	D9 I13 Y56 I57	D9-K11 PolarHBondContact O-N 3.09Å; K11-I13 PolarHBondContact O-N 3Å; K11-Y56 WeakPolarHBondContact O-CA 3.41Å; K11-I57 PolarHBondContact O-N 2.84Å
12	K	89.8	Confident	70.5	Confident	72 Å²	72	84.1 Å²	84.1	31%	0.313	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	128.3	178	-72.1	-172.5	174.7	-173.2	0	111.2	S14 E15 E55 Y56	K12-S14 PolarHBondContact O-N 3.1Å; K12-E15 HydrophobicContact CB-CB 4.34Å; K12-E15 HydrophobicContact CB-CG 3.96Å; K12-E15 PolarHBondContact O-N 3.13Å; K12-E15 VanDerWaalsContact O-N 3.1Å; K12-E55 CarbonylContact C-O 3.56Å; K12-E55 VanDerWaalsContact CA-O 3.31Å; K12-E55 WeakPolarHBondContact CA-O 3.41Å; K12-Y56 HydrophobicContact CD-CE1 4.3Å; K12-Y56 WeakPolarHBondContact CE-OH 3.17Å; K12-Y56 HydrophobicContact CG-CD1 3.9Å; K12-Y56 HydrophobicContact CG-CE1 3.42Å; K12-Y56 VanDerWaalsContact CG-CE1 3.42Å
13	I	89.1	Confident	73.3	Confident	7 Å²	7	82.7 Å²	82.7	4%	0.036	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-58.3	-38.4	178.9	-60	157.7	0	0	0	110.4	K11 E15 L16 L21 L40 L43 I47 P54 E55 I57	K11-I13 PolarHBondContact O-N 3Å; I13-E15 VanDerWaalsContact C-N 3.29Å; I13-E15 PolarHBondContact O-N 3.5Å; I13-L16 WeakPolarHBondContact O-CB 3.28Å; I13-L16 PolarHBondContact O-N 2.99Å; I13-L21 HydrophobicContact CG2-CD2 4.06Å; I13-L40 HydrophobicContact CG2-CD2 3.77Å; I13-L40 WeakPolarHBondContact O-CD2 3.44Å; I13-L43 HydrophobicContact CG2-CD2 4.01Å; I13-L43 HydrophobicContact CG2-CG 4.21Å; I13-I47 HydrophobicContact CD1-CD1 3.4Å; I13-I47 HydrophobicContact CG1-CD1 3.83Å; I13-P54 WeakPolarHBondContact CD1-O 3.34Å; I13-E55 WeakPolarHBondContact CG1-O 3.41Å; I13-E55 PolarHBondContact N-O 2.65Å; I13-I57 HydrophobicContact CG1-CD1 3.95Å; I13-I57 HydrophobicContact CG1-CG1 3.86Å
14	S	90.4	Very high	76	Confident	66 Å²	66	77.6 Å²	77.6	46%	0.462	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-62	-30.1	178.6	55.8	0	0	0	0	113.9	K12 K36	K12-S14 PolarHBondContact O-N 3.1Å; S14-K36 PolarHBondContact O-NZ 2.7Å
15	E	91.3	Very high	78.9	Confident	140 Å²	140	74.2 Å²	74.2	65%	0.654	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-80.6	-21.7	-179.7	-67.1	176.8	-168.2	0	0	112.9	K12 I13	K12-E15 HydrophobicContact CB-CB 4.34Å; K12-E15 HydrophobicContact CB-CG 3.96Å; K12-E15 PolarHBondContact O-N 3.13Å; K12-E15 VanDerWaalsContact O-N 3.1Å; I13-E15 VanDerWaalsContact C-N 3.29Å; I13-E15 PolarHBondContact O-N 3.5Å
16	L	90.5	Very high	81.8	Confident	30 Å²	30	77 Å²	77	16%	0.157	41%	0.407	C	S	.	.	S	Bend	trans	-58.6	145.6	177.6	-68.3	-167.7	0	0	0	112.7	I13 D20 L21 K36 I57	I13-L16 WeakPolarHBondContact O-CB 3.28Å; I13-L16 PolarHBondContact O-N 2.99Å; L16-D20 HydrophobicContact CB-CB 4.15Å; L16-D20 HydrophobicContact CD1-CB 4.36Å; L16-D20 HydrophobicContact CD2-CB 4.08Å; L16-D20 HydrophobicContact CG-CB 4.44Å; L16-L21 HydrophobicContact CB-CD2 3.75Å; L16-L21 HydrophobicContact CB-CG 3.84Å; L16-L21 HydrophobicContact CD1-CD2 3.92Å; L16-L21 HydrophobicContact CG-CD2 4.41Å; L16-K36 WeakPolarHBondContact O-CE 3.32Å; L16-K36 PolarHBondContact O-NZ 2.99Å; L16-I57 HydrophobicContact CD1-CD1 3.34Å; L16-I57 HydrophobicContact CG-CD1 4.33Å
17	R	92.8	Very high	84.5	Confident	151 Å²	151	77.1 Å²	77.1	57%	0.57	40%	0.399	S	S	*	.			trans	-84	163.7	174.9	-50.1	165.6	-61.5	157.6	11.3	109.1	V19 D20 L21	R17-V19 PolarHBondContact O-N 3.22Å; R17-V19 VanDerWaalsContact O-N 3.11Å; R17-D20 WeakPolarHBondContact CB-OD2 3.36Å; R17-D20 WeakPolarHBondContact CG-OD2 3.42Å; R17-D20 IonicContact CZ-OD1 2.71Å; R17-D20 IonicContact CZ-OD2 2.73Å; R17-D20 PolarHBondContact N-OD2 3.23Å; R17-D20 IonicContact NE-OD1 3.7Å; R17-D20 IonicContact NE-OD2 2.71Å; R17-D20 PolarHBondContact NE-OD2 3.37Å; R17-D20 IonicContact NH2-OD1 3.48Å; R17-D20 PolarHBondContact NH2-OD1 2.73Å; R17-D20 IonicContact NH2-OD2 3.07Å; R17-D20 PolarHBondContact NH2-OD2 3.47Å; R17-D20 PolarHBondContact O-N 2.74Å; R17-L21 WeakPolarHBondContact O-CG 3.17Å; R17-L21 PolarHBondContact O-N 3.21Å
18	V	93.1	Very high	87.2	Confident	57 Å²	57	74.2 Å²	74.2	35%	0.345	37%	0.371	S	S	.	.	H	α-helix	trans	-56.2	-31.6	-179.9	173.3	0	0	0	0	112.9	K22 K36 L39	V18-K22 HydrophobicContact CG1-CD 4.06Å; V18-K22 VanDerWaalsContact CG1-CE 3.41Å; V18-K22 WeakPolarHBondContact O-CB 3.39Å; V18-K22 WeakPolarHBondContact O-CD 3.24Å; V18-K22 WeakPolarHBondContact O-CG 3.22Å; V18-K22 PolarHBondContact O-N 2.77Å; V18-K22 VanDerWaalsContact O-N 3.13Å; V18-K36 HydrophobicContact CG2-CB 3.71Å; V18-K36 HydrophobicContact CG2-CD 4.31Å; V18-K36 HydrophobicContact CG2-CG 3.93Å; V18-L39 HydrophobicContact CG1-CD1 3.95Å
19	V	94.1	Very high	89.5	Confident	104 Å²	104	73.1 Å²	73.1	63%	0.63	38%	0.379	S	S	*	.	H	α-helix	trans	-66.3	-47.9	174	-178	0	0	0	0	110.9	R17 K22 S23	R17-V19 PolarHBondContact O-N 3.22Å; R17-V19 VanDerWaalsContact O-N 3.11Å; V19-K22 PolarHBondContact O-N 2.85Å; V19-S23 PolarHBondContact O-N 3.49Å; V19-S23 PolarHBondContact O-OG 3.34Å
20	D	94.2	Very high	91.4	Very high	40 Å²	40	70.6 Å²	70.6	21%	0.214	37%	0.365	C	S	.	.	H	α-helix	trans	-67.6	-40.3	-175.2	-42.2	-45.5	0	0	0	110.8	L16 R17 S23 E24	L16-D20 HydrophobicContact CB-CB 4.15Å; L16-D20 HydrophobicContact CD1-CB 4.36Å; L16-D20 HydrophobicContact CD2-CB 4.08Å; L16-D20 HydrophobicContact CG-CB 4.44Å; R17-D20 WeakPolarHBondContact CB-OD2 3.36Å; R17-D20 WeakPolarHBondContact CG-OD2 3.42Å; R17-D20 IonicContact CZ-OD1 2.71Å; R17-D20 IonicContact CZ-OD2 2.73Å; R17-D20 PolarHBondContact N-OD2 3.23Å; R17-D20 IonicContact NE-OD1 3.7Å; R17-D20 IonicContact NE-OD2 2.71Å; R17-D20 PolarHBondContact NE-OD2 3.37Å; R17-D20 IonicContact NH2-OD1 3.48Å; R17-D20 PolarHBondContact NH2-OD1 2.73Å; R17-D20 IonicContact NH2-OD2 3.07Å; R17-D20 PolarHBondContact NH2-OD2 3.47Å; R17-D20 PolarHBondContact O-N 2.74Å; D20-S23 VanDerWaalsContact CA-OG 3.31Å; D20-S23 WeakPolarHBondContact CA-OG 3.44Å; D20-S23 PolarHBondContact O-N 3.39Å; D20-S23 PolarHBondContact O-OG 2.83Å; D20-E24 PolarHBondContact O-N 2.93Å
21	L	94.3	Very high	92.4	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-60.5	-43.3	171.4	-67.5	172.6	0	0	0	112.4	I13 L16 R17 E24 L25 K36 L39 L40 L43	I13-L21 HydrophobicContact CG2-CD2 4.06Å; L16-L21 HydrophobicContact CB-CD2 3.75Å; L16-L21 HydrophobicContact CB-CG 3.84Å; L16-L21 HydrophobicContact CD1-CD2 3.92Å; L16-L21 HydrophobicContact CG-CD2 4.41Å; R17-L21 WeakPolarHBondContact O-CG 3.17Å; R17-L21 PolarHBondContact O-N 3.21Å; L21-E24 PolarHBondContact O-N 2.97Å; L21-L25 WeakPolarHBondContact O-CB 3.48Å; L21-L25 WeakPolarHBondContact O-CG 3.24Å; L21-L25 PolarHBondContact O-N 3.02Å; L21-K36 HydrophobicContact CD1-CD 4.31Å; L21-K36 HydrophobicContact CD1-CG 3.69Å; L21-L39 HydrophobicContact CB-CB 4.3Å; L21-L39 HydrophobicContact CD1-CB 4.31Å; L21-L40 HydrophobicContact CD1-CD2 3.82Å; L21-L40 HydrophobicContact CD1-CG 3.95Å; L21-L40 HydrophobicContact CD2-CD2 3.81Å; L21-L40 HydrophobicContact CG-CD2 4.47Å; L21-L43 HydrophobicContact CD2-CD2 3.58Å
22	K	94.9	Very high	93	Very high	65 Å²	65	67.3 Å²	67.3	28%	0.283	35%	0.35	S	S	.	.	H	α-helix	trans	-67.6	-35.5	177.4	-74.4	171.3	-175.7	-87	0	112	V18 V19 K26 T32 L39	V18-K22 HydrophobicContact CG1-CD 4.06Å; V18-K22 VanDerWaalsContact CG1-CE 3.41Å; V18-K22 WeakPolarHBondContact O-CB 3.39Å; V18-K22 WeakPolarHBondContact O-CD 3.24Å; V18-K22 WeakPolarHBondContact O-CG 3.22Å; V18-K22 PolarHBondContact O-N 2.77Å; V18-K22 VanDerWaalsContact O-N 3.13Å; V19-K22 PolarHBondContact O-N 2.85Å; K22-K26 WeakPolarHBondContact O-CB 3.47Å; K22-K26 PolarHBondContact O-N 3.17Å; K22-T32 HydrophobicContact CB-CG2 4.43Å; K22-T32 PolarHBondContact NZ-O 3.31Å; K22-T32 WeakPolarHBondContact O-CG2 3.4Å; K22-L39 HydrophobicContact CG-CD1 3.99Å; K22-L39 HydrophobicContact CG-CD2 4.47Å
23	S	94.2	Very high	93.1	Very high	73 Å²	73	71.3 Å²	71.3	51%	0.51	37%	0.367	S	S	.	.	H	α-helix	trans	-67.6	-37.8	173.2	43.3	0	0	0	0	112.4	V19 D20 K26 R27	V19-S23 PolarHBondContact O-N 3.49Å; V19-S23 PolarHBondContact O-OG 3.34Å; D20-S23 VanDerWaalsContact CA-OG 3.31Å; D20-S23 WeakPolarHBondContact CA-OG 3.44Å; D20-S23 PolarHBondContact O-N 3.39Å; D20-S23 PolarHBondContact O-OG 2.83Å; S23-K26 PolarHBondContact O-N 3.48Å; S23-R27 WeakPolarHBondContact O-CB 3.39Å; S23-R27 PolarHBondContact O-N 3.2Å
24	E	93.4	Very high	93.3	Very high	20 Å²	20	73.1 Å²	73.1	9%	0.093	39%	0.388	C	S	.	.	H	α-helix	trans	-71.3	-47.1	179.3	-171	57.9	-143.8	0	0	111.9	D20 L21 K26 R27 R28 L43 I57	D20-E24 PolarHBondContact O-N 2.93Å; L21-E24 PolarHBondContact O-N 2.97Å; E24-K26 VanDerWaalsContact C-N 3.28Å; E24-K26 PolarHBondContact O-N 2.82Å; E24-R27 WeakPolarHBondContact O-CB 3.4Å; E24-R27 PolarHBondContact O-N 3.43Å; E24-R27 VanDerWaalsContact O-N 3.08Å; E24-R27 IonicContact OE1-CZ 2.73Å; E24-R27 VanDerWaalsContact OE1-CZ 3.32Å; E24-R27 IonicContact OE1-NE 3.54Å; E24-R27 PolarHBondContact OE1-NE 2.86Å; E24-R27 VanDerWaalsContact OE1-NE 3.07Å; E24-R27 IonicContact OE1-NH2 3.08Å; E24-R27 PolarHBondContact OE1-NH2 3.17Å; E24-R27 IonicContact OE2-CZ 2.86Å; E24-R27 VanDerWaalsContact OE2-CZ 3.24Å; E24-R27 IonicContact OE2-NE 2.83Å; E24-R27 PolarHBondContact OE2-NE 3.49Å; E24-R27 VanDerWaalsContact OE2-NE 3.08Å; E24-R27 IonicContact OE2-NH2 2.74Å; E24-R27 PolarHBondContact OE2-NH2 3.36Å; E24-R28 WeakPolarHBondContact O-CD 3.42Å; E24-R28 PolarHBondContact O-N 2.93Å; E24-R28 VanDerWaalsContact O-N 3.11Å; E24-R28 IonicContact OE1-CZ 3.62Å; E24-R28 IonicContact OE1-NE 2.6Å; E24-R28 PolarHBondContact OE1-NE 2.96Å; E24-R28 IonicContact OE1-NH2 2.68Å; E24-L43 HydrophobicContact CB-CD1 4.23Å; E24-L43 HydrophobicContact CB-CD2 3.86Å; E24-L43 HydrophobicContact CG-CD1 3.48Å; E24-L43 VanDerWaalsContact CG-CD1 3.48Å; E24-L43 HydrophobicContact CG-CD2 3.74Å; E24-L43 HydrophobicContact CG-CG 4.27Å; E24-I57 HydrophobicContact CG-CD1 4.22Å
25	L	94.3	Very high	93.4	Very high	0 Å²	0	75 Å²	75	0%	0	40%	0.396	C	S	.	.	H	α-helix	trans	-56	-43.4	171.5	-74.8	166.7	0	0	0	111.6	L21 R27 R28 G29 L30 T32 L39 R42 L43	L21-L25 WeakPolarHBondContact O-CB 3.48Å; L21-L25 WeakPolarHBondContact O-CG 3.24Å; L21-L25 PolarHBondContact O-N 3.02Å; L25-R27 VanDerWaalsContact C-N 3.35Å; L25-R27 PolarHBondContact O-N 2.87Å; L25-R28 CarbonylContact O-C 3.18Å; L25-R28 WeakPolarHBondContact O-CA 3.48Å; L25-R28 PolarHBondContact O-N 2.98Å; L25-R28 VanDerWaalsContact O-N 3.13Å; L25-G29 PolarHBondContact O-N 3.21Å; L25-G29 VanDerWaalsContact O-N 3.16Å; L25-L30 HydrophobicContact CB-CB 4.32Å; L25-L30 HydrophobicContact CD2-CB 3.89Å; L25-L30 HydrophobicContact CD2-CD1 3.92Å; L25-L30 PolarHBondContact O-N 2.95Å; L25-T32 HydrophobicContact CB-CG2 4.32Å; L25-L39 HydrophobicContact CD1-CB 3.88Å; L25-L39 HydrophobicContact CD1-CD2 3.49Å; L25-L39 VanDerWaalsContact CD1-CD2 3.49Å; L25-L39 HydrophobicContact CD1-CG 4.28Å; L25-R42 HydrophobicContact CD2-CB 4.01Å; L25-R42 HydrophobicContact CD2-CG 3.7Å; L25-L43 HydrophobicContact CD2-CB 3.9Å; L25-L43 HydrophobicContact CD2-CD1 4.48Å; L25-L43 HydrophobicContact CG-CB 4.15Å
26	K	95.6	Very high	93.6	Very high	157 Å²	157	71.6 Å²	71.6	68%	0.683	38%	0.379	S	S	*	.	H	α-helix	trans	-64.9	-35.9	176.1	-172.2	175.4	179.1	-176.1	0	113	K22 S23 E24 R28 G29 T32	K22-K26 WeakPolarHBondContact O-CB 3.47Å; K22-K26 PolarHBondContact O-N 3.17Å; S23-K26 PolarHBondContact O-N 3.48Å; E24-K26 VanDerWaalsContact C-N 3.28Å; E24-K26 PolarHBondContact O-N 2.82Å; K26-R28 PolarHBondContact O-N 2.89Å; K26-G29 PolarHBondContact O-N 3.12Å; K26-G29 VanDerWaalsContact O-N 3.12Å; K26-T32 HydrophobicContact CB-CG2 3.92Å
27	R	92.6	Very high	93.7	Very high	141 Å²	141	73.5 Å²	73.5	53%	0.532	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-32.2	174.2	-177.7	167.7	74.4	149.6	3.9	111.5	S23 E24 L25	S23-R27 WeakPolarHBondContact O-CB 3.39Å; S23-R27 PolarHBondContact O-N 3.2Å; E24-R27 WeakPolarHBondContact O-CB 3.4Å; E24-R27 PolarHBondContact O-N 3.43Å; E24-R27 VanDerWaalsContact O-N 3.08Å; E24-R27 IonicContact OE1-CZ 2.73Å; E24-R27 VanDerWaalsContact OE1-CZ 3.32Å; E24-R27 IonicContact OE1-NE 3.54Å; E24-R27 PolarHBondContact OE1-NE 2.86Å; E24-R27 VanDerWaalsContact OE1-NE 3.07Å; E24-R27 IonicContact OE1-NH2 3.08Å; E24-R27 PolarHBondContact OE1-NH2 3.17Å; E24-R27 IonicContact OE2-CZ 2.86Å; E24-R27 VanDerWaalsContact OE2-CZ 3.24Å; E24-R27 IonicContact OE2-NE 2.83Å; E24-R27 PolarHBondContact OE2-NE 3.49Å; E24-R27 VanDerWaalsContact OE2-NE 3.08Å; E24-R27 IonicContact OE2-NH2 2.74Å; E24-R27 PolarHBondContact OE2-NH2 3.36Å; L25-R27 VanDerWaalsContact C-N 3.35Å; L25-R27 PolarHBondContact O-N 2.87Å
28	R	91.8	Very high	93.9	Very high	46 Å²	46	69.5 Å²	69.5	17%	0.174	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	4.9	176.4	-65.6	154.2	176.4	-92.4	-13.6	114	E24 L25 K26 L30 A46 I47 E50	E24-R28 WeakPolarHBondContact O-CD 3.42Å; E24-R28 PolarHBondContact O-N 2.93Å; E24-R28 VanDerWaalsContact O-N 3.11Å; E24-R28 IonicContact OE1-CZ 3.62Å; E24-R28 IonicContact OE1-NE 2.6Å; E24-R28 PolarHBondContact OE1-NE 2.96Å; E24-R28 IonicContact OE1-NH2 2.68Å; L25-R28 CarbonylContact O-C 3.18Å; L25-R28 WeakPolarHBondContact O-CA 3.48Å; L25-R28 PolarHBondContact O-N 2.98Å; L25-R28 VanDerWaalsContact O-N 3.13Å; K26-R28 PolarHBondContact O-N 2.89Å; R28-L30 HydrophobicContact CB-CD1 3.96Å; R28-L30 HydrophobicContact CB-CG 4.18Å; R28-L30 PolarHBondContact O-N 3.09Å; R28-A46 PolarHBondContact NH1-O 3.36Å; R28-I47 VanDerWaalsContact NH1-CG1 3.32Å; R28-E50 VanDerWaalsContact CZ-CD 3.48Å; R28-E50 IonicContact CZ-OE1 3.76Å; R28-E50 IonicContact CZ-OE2 2.73Å; R28-E50 IonicContact NE-OE1 2.57Å; R28-E50 IonicContact NH1-OE1 3.33Å; R28-E50 PolarHBondContact NH1-OE1 3.08Å; R28-E50 IonicContact NH1-OE2 2.84Å; R28-E50 PolarHBondContact NH1-OE2 3.2Å; R28-E50 IonicContact NH2-OE1 2.76Å; R28-E50 IonicContact NH2-OE2 3.17Å; R28-E50 PolarHBondContact NH2-OE2 2.88Å
29	G	92.6	Very high	94	Very high	72 Å²	72	66.8 Å²	66.8	74%	0.742	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	6.5	-178.3	0	0	0	0	0	115.6	L25 K26	L25-G29 PolarHBondContact O-N 3.21Å; L25-G29 VanDerWaalsContact O-N 3.16Å; K26-G29 PolarHBondContact O-N 3.12Å; K26-G29 VanDerWaalsContact O-N 3.12Å
30	L	93.4	Very high	94	Very high	65 Å²	65	63.8 Å²	63.8	34%	0.34	35%	0.351	S	S	.	.			trans	-89.1	158.2	-171.4	-65.8	169.5	0	0	0	113.4	L25 R28 T32 A46	L25-L30 HydrophobicContact CB-CB 4.32Å; L25-L30 HydrophobicContact CD2-CB 3.89Å; L25-L30 HydrophobicContact CD2-CD1 3.92Å; L25-L30 PolarHBondContact O-N 2.95Å; R28-L30 HydrophobicContact CB-CD1 3.96Å; R28-L30 HydrophobicContact CB-CG 4.18Å; R28-L30 PolarHBondContact O-N 3.09Å; L30-T32 PolarHBondContact O-N 3.18Å; L30-A46 HydrophobicContact CD1-CB 3.32Å
31	D	94.2	Very high	94	Very high	69 Å²	69	65.8 Å²	65.8	37%	0.369	37%	0.368	S	S	.	.			trans	-55.1	134.2	177.3	172.7	38.8	0	0	0	111.8	F33 R42	D31-F33 WeakPolarHBondContact OD1-CB 3.46Å; D31-F33 VanDerWaalsContact OD1-CD2 3.32Å; D31-F33 WeakPolarHBondContact OD1-CD2 3.4Å; D31-F33 PolarHBondContact OD1-N 3.26Å; D31-R42 WeakPolarHBondContact O-CD 3.39Å; D31-R42 PolarHBondContact O-NH1 3.08Å; D31-R42 IonicContact OD2-CZ 3.36Å; D31-R42 IonicContact OD2-NH1 3.16Å; D31-R42 PolarHBondContact OD2-NH1 3.16Å; D31-R42 IonicContact OD2-NH2 3.79Å; D31-R42 PolarHBondContact OD2-NH2 3.45Å
32	T	95.7	Very high	94.1	Very high	38 Å²	38	69.1 Å²	69.1	23%	0.233	38%	0.38	C	S	.	.			trans	-105.8	-1.4	179.9	65.6	0	0	0	0	113.1	K22 L25 K26 L30 L39	K22-T32 HydrophobicContact CB-CG2 4.43Å; K22-T32 PolarHBondContact NZ-O 3.31Å; K22-T32 WeakPolarHBondContact O-CG2 3.4Å; L25-T32 HydrophobicContact CB-CG2 4.32Å; K26-T32 HydrophobicContact CB-CG2 3.92Å; L30-T32 PolarHBondContact O-N 3.18Å; T32-L39 WeakPolarHBondContact O-CD2 3.49Å
33	F	92.4	Very high	94	Very high	157 Å²	157	66 Å²	66	69%	0.689	37%	0.367	S	S	*	.			trans	-80.2	154.7	173.6	-68.1	-80.5	0	0	0	111.9	D31 L39 R42	D31-F33 WeakPolarHBondContact OD1-CB 3.46Å; D31-F33 VanDerWaalsContact OD1-CD2 3.32Å; D31-F33 WeakPolarHBondContact OD1-CD2 3.4Å; D31-F33 PolarHBondContact OD1-N 3.26Å; F33-L39 WeakPolarHBondContact O-CD2 3.3Å; F33-R42 PolarHBondContact O-NH1 3.46Å
34	G	92.8	Very high	94	Very high	45 Å²	45	66.7 Å²	66.7	46%	0.464	36%	0.361	S	S	.	.	S	Bend	trans	120.7	173.5	-176.3	0	0	0	0	0	115.3
35	V	93.5	Very high	94.1	Very high	105 Å²	105	70.4 Å²	70.4	64%	0.636	38%	0.378	S	S	*	.			trans	-82.2	162.6	173.9	-179.1	0	0	0	0	109.6	S37 V38 L39	V35-S37 PolarHBondContact O-N 2.86Å; V35-S37 VanDerWaalsContact O-N 3.1Å; V35-V38 PolarHBondContact O-N 3.06Å; V35-L39 WeakPolarHBondContact O-CG 3.5Å; V35-L39 PolarHBondContact O-N 3.03Å; V35-L39 VanDerWaalsContact O-N 3.13Å
36	K	94.3	Very high	94	Very high	69 Å²	69	70.8 Å²	70.8	30%	0.3	38%	0.381	S	S	.	.	H	α-helix	trans	-48.6	-42.7	-177.9	-170.1	178.8	170.9	-179.7	0	112.8	S14 L16 V18 L21 L39 L40	S14-K36 PolarHBondContact O-NZ 2.7Å; L16-K36 WeakPolarHBondContact O-CE 3.32Å; L16-K36 PolarHBondContact O-NZ 2.99Å; V18-K36 HydrophobicContact CG2-CB 3.71Å; V18-K36 HydrophobicContact CG2-CD 4.31Å; V18-K36 HydrophobicContact CG2-CG 3.93Å; L21-K36 HydrophobicContact CD1-CD 4.31Å; L21-K36 HydrophobicContact CD1-CG 3.69Å; K36-L39 PolarHBondContact O-N 2.91Å; K36-L40 HydrophobicContact CD-CD1 4.42Å; K36-L40 HydrophobicContact CG-CD1 4.08Å; K36-L40 HydrophobicContact CG-CG 4.14Å; K36-L40 WeakPolarHBondContact O-CB 3.43Å; K36-L40 VanDerWaalsContact O-CG 3.26Å; K36-L40 WeakPolarHBondContact O-CG 3.34Å; K36-L40 PolarHBondContact O-N 3.22Å
37	S	94.5	Very high	93.8	Very high	70 Å²	70	63.3 Å²	63.3	49%	0.49	35%	0.349	S	S	.	.	H	α-helix	trans	-58.1	-49.8	177.4	44.1	0	0	0	0	113.1	V35 L39 L40 S41	V35-S37 PolarHBondContact O-N 2.86Å; V35-S37 VanDerWaalsContact O-N 3.1Å; S37-L39 VanDerWaalsContact C-N 3.29Å; S37-L39 PolarHBondContact O-N 2.84Å; S37-L40 WeakPolarHBondContact O-CB 3.37Å; S37-L40 PolarHBondContact O-N 3.17Å; S37-S41 PolarHBondContact O-N 3.36Å; S37-S41 PolarHBondContact O-OG 2.78Å
38	V	95.6	Very high	93.7	Very high	66 Å²	66	61.4 Å²	61.4	40%	0.4	35%	0.346	S	S	.	.	H	α-helix	trans	-60.4	-40.7	178.3	-176.8	0	0	0	0	111.2	V35 S41 R42	V35-V38 PolarHBondContact O-N 3.06Å; V38-S41 PolarHBondContact O-N 3.43Å; V38-R42 VanDerWaalsContact O-CB 3.31Å; V38-R42 WeakPolarHBondContact O-CB 3.48Å; V38-R42 PolarHBondContact O-N 2.8Å
39	L	95.6	Very high	93.7	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-69.9	-35.7	178	-59.5	169	0	0	0	112.2	V18 L21 K22 L25 T32 F33 V35 K36 S37 L43	V18-L39 HydrophobicContact CG1-CD1 3.95Å; L21-L39 HydrophobicContact CB-CB 4.3Å; L21-L39 HydrophobicContact CD1-CB 4.31Å; K22-L39 HydrophobicContact CG-CD1 3.99Å; K22-L39 HydrophobicContact CG-CD2 4.47Å; L25-L39 HydrophobicContact CD1-CB 3.88Å; L25-L39 HydrophobicContact CD1-CD2 3.49Å; L25-L39 VanDerWaalsContact CD1-CD2 3.49Å; L25-L39 HydrophobicContact CD1-CG 4.28Å; T32-L39 WeakPolarHBondContact O-CD2 3.49Å; F33-L39 WeakPolarHBondContact O-CD2 3.3Å; V35-L39 WeakPolarHBondContact O-CG 3.5Å; V35-L39 PolarHBondContact O-N 3.03Å; V35-L39 VanDerWaalsContact O-N 3.13Å; K36-L39 PolarHBondContact O-N 2.91Å; S37-L39 VanDerWaalsContact C-N 3.29Å; S37-L39 PolarHBondContact O-N 2.84Å; L39-L43 VanDerWaalsContact O-CB 3.25Å; L39-L43 WeakPolarHBondContact O-CB 3.47Å; L39-L43 PolarHBondContact O-N 3.44Å; L39-L43 VanDerWaalsContact O-N 3.1Å
40	L	94.9	Very high	93.4	Very high	42 Å²	42	67 Å²	67	22%	0.22	36%	0.358	C	S	.	.	H	α-helix	trans	-64.2	-50.9	171.9	-75	171	0	0	0	111	I13 L21 K36 S37 R42 L43 K44	I13-L40 HydrophobicContact CG2-CD2 3.77Å; I13-L40 WeakPolarHBondContact O-CD2 3.44Å; L21-L40 HydrophobicContact CD1-CD2 3.82Å; L21-L40 HydrophobicContact CD1-CG 3.95Å; L21-L40 HydrophobicContact CD2-CD2 3.81Å; L21-L40 HydrophobicContact CG-CD2 4.47Å; K36-L40 HydrophobicContact CD-CD1 4.42Å; K36-L40 HydrophobicContact CG-CD1 4.08Å; K36-L40 HydrophobicContact CG-CG 4.14Å; K36-L40 WeakPolarHBondContact O-CB 3.43Å; K36-L40 VanDerWaalsContact O-CG 3.26Å; K36-L40 WeakPolarHBondContact O-CG 3.34Å; K36-L40 PolarHBondContact O-N 3.22Å; S37-L40 WeakPolarHBondContact O-CB 3.37Å; S37-L40 PolarHBondContact O-N 3.17Å; L40-R42 PolarHBondContact O-N 3.15Å; L40-L43 PolarHBondContact O-N 2.87Å; L40-K44 WeakPolarHBondContact O-CB 3.31Å; L40-K44 PolarHBondContact O-N 2.87Å
41	S	94.1	Very high	93	Very high	81 Å²	81	67.3 Å²	67.3	57%	0.566	38%	0.377	S	S	*	.	H	α-helix	trans	-61.6	-44.6	-179.4	-62.3	0	0	0	0	112.1	S37 V38 L43 K44 Q45	S37-S41 PolarHBondContact O-N 3.36Å; S37-S41 PolarHBondContact O-OG 2.78Å; V38-S41 PolarHBondContact O-N 3.43Å; S41-L43 VanDerWaalsContact C-N 3.32Å; S41-L43 PolarHBondContact O-N 3.24Å; S41-K44 PolarHBondContact O-N 3.23Å; S41-Q45 WeakPolarHBondContact O-CB 3.36Å; S41-Q45 PolarHBondContact O-N 3.06Å
42	R	95.2	Very high	92.5	Very high	70 Å²	70	65.4 Å²	65.4	26%	0.264	37%	0.374	S	S	.	.	H	α-helix	trans	-64.3	-36.6	177.5	-171.7	-177.2	-68	142.8	-9.8	112.4	L25 D31 F33 V38 L40 A46	L25-R42 HydrophobicContact CD2-CB 4.01Å; L25-R42 HydrophobicContact CD2-CG 3.7Å; D31-R42 WeakPolarHBondContact O-CD 3.39Å; D31-R42 PolarHBondContact O-NH1 3.08Å; D31-R42 IonicContact OD2-CZ 3.36Å; D31-R42 IonicContact OD2-NH1 3.16Å; D31-R42 PolarHBondContact OD2-NH1 3.16Å; D31-R42 IonicContact OD2-NH2 3.79Å; D31-R42 PolarHBondContact OD2-NH2 3.45Å; F33-R42 PolarHBondContact O-NH1 3.46Å; V38-R42 VanDerWaalsContact O-CB 3.31Å; V38-R42 WeakPolarHBondContact O-CB 3.48Å; V38-R42 PolarHBondContact O-N 2.8Å; L40-R42 PolarHBondContact O-N 3.15Å; R42-A46 WeakPolarHBondContact O-CB 3.35Å; R42-A46 PolarHBondContact O-N 3.28Å; R42-A46 VanDerWaalsContact O-N 3.11Å
43	L	93.9	Very high	92	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-76.5	-35.8	177.2	-179.8	54.4	0	0	0	112.1	I13 L21 E24 L25 L39 L40 S41 A46 I47 I57	I13-L43 HydrophobicContact CG2-CD2 4.01Å; I13-L43 HydrophobicContact CG2-CG 4.21Å; L21-L43 HydrophobicContact CD2-CD2 3.58Å; E24-L43 HydrophobicContact CB-CD1 4.23Å; E24-L43 HydrophobicContact CB-CD2 3.86Å; E24-L43 HydrophobicContact CG-CD1 3.48Å; E24-L43 VanDerWaalsContact CG-CD1 3.48Å; E24-L43 HydrophobicContact CG-CD2 3.74Å; E24-L43 HydrophobicContact CG-CG 4.27Å; L25-L43 HydrophobicContact CD2-CB 3.9Å; L25-L43 HydrophobicContact CD2-CD1 4.48Å; L25-L43 HydrophobicContact CG-CB 4.15Å; L39-L43 VanDerWaalsContact O-CB 3.25Å; L39-L43 WeakPolarHBondContact O-CB 3.47Å; L39-L43 PolarHBondContact O-N 3.44Å; L39-L43 VanDerWaalsContact O-N 3.1Å; L40-L43 PolarHBondContact O-N 2.87Å; S41-L43 VanDerWaalsContact C-N 3.32Å; S41-L43 PolarHBondContact O-N 3.24Å; L43-A46 PolarHBondContact O-N 3.04Å; L43-I47 HydrophobicContact CD1-CD1 3.92Å; L43-I47 HydrophobicContact CD1-CG1 4.24Å; L43-I47 HydrophobicContact CG-CD1 3.97Å; L43-I47 WeakPolarHBondContact O-CD1 3.41Å; L43-I47 VanDerWaalsContact O-CG1 3.3Å; L43-I47 WeakPolarHBondContact O-CG1 3.39Å; L43-I47 PolarHBondContact O-N 2.89Å; L43-I47 VanDerWaalsContact O-N 3.1Å; L43-I57 HydrophobicContact CD2-CD1 4.1Å
44	K	93.8	Very high	91.7	Very high	87 Å²	87	63.7 Å²	63.7	38%	0.378	37%	0.373	S	S	.	.	H	α-helix	trans	-57.7	-53.9	171.4	175.4	166.6	-172.3	-170.9	0	110.2	L40 S41 A46 I47 E48 P54	L40-K44 WeakPolarHBondContact O-CB 3.31Å; L40-K44 PolarHBondContact O-N 2.87Å; S41-K44 PolarHBondContact O-N 3.23Å; K44-A46 VanDerWaalsContact C-N 3.32Å; K44-A46 PolarHBondContact O-N 2.91Å; K44-I47 PolarHBondContact O-N 2.82Å; K44-E48 PolarHBondContact O-N 3.24Å; K44-P54 HydrophobicContact CD-CB 4.38Å; K44-P54 WeakPolarHBondContact CD-O 3.3Å; K44-P54 WeakPolarHBondContact CE-O 3.42Å; K44-P54 HydrophobicContact CG-CB 3.89Å; K44-P54 VanDerWaalsContact CG-O 3.3Å; K44-P54 WeakPolarHBondContact CG-O 3.31Å
45	Q	94.6	Very high	91.3	Very high	99 Å²	99	67 Å²	67	46%	0.463	38%	0.376	S	S	.	.	H	α-helix	trans	-54.2	-49	177	-169	65.4	58.3	0	0	111	S41 I47 E48 D49	S41-Q45 WeakPolarHBondContact O-CB 3.36Å; S41-Q45 PolarHBondContact O-N 3.06Å; Q45-I47 PolarHBondContact O-N 3.07Å; Q45-I47 VanDerWaalsContact O-N 3.15Å; Q45-E48 CarbonylContact O-C 3.57Å; Q45-E48 WeakPolarHBondContact O-CA 3.43Å; Q45-E48 WeakPolarHBondContact O-CB 3.06Å; Q45-E48 PolarHBondContact O-N 2.7Å; Q45-D49 PolarHBondContact NE2-OD1 3.29Å; Q45-D49 WeakPolarHBondContact O-CB 3.4Å; Q45-D49 PolarHBondContact O-N 3.1Å
46	A	92.4	Very high	91	Very high	7 Å²	7	65.6 Å²	65.6	6%	0.058	36%	0.36	C	S	.	.	H	α-helix	trans	-62.1	-23.8	179.2	0	0	0	0	0	115.1	R28 L30 R42 L43 K44 E50	R28-A46 PolarHBondContact NH1-O 3.36Å; L30-A46 HydrophobicContact CD1-CB 3.32Å; R42-A46 WeakPolarHBondContact O-CB 3.35Å; R42-A46 PolarHBondContact O-N 3.28Å; R42-A46 VanDerWaalsContact O-N 3.11Å; L43-A46 PolarHBondContact O-N 3.04Å; K44-A46 VanDerWaalsContact C-N 3.32Å; K44-A46 PolarHBondContact O-N 2.91Å; A46-E50 WeakPolarHBondContact O-CB 3.39Å; A46-E50 VanDerWaalsContact O-CD 3.31Å; A46-E50 WeakPolarHBondContact O-CG 3.37Å; A46-E50 PolarHBondContact O-N 3.1Å
47	I	91.9	Very high	90.4	Very high	1 Å²	1	63 Å²	63	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-83.8	-37.1	174.8	-68.8	163.6	0	0	0	110	I13 R28 L43 K44 Q45 E50 G51 G52 D53 I57	I13-I47 HydrophobicContact CD1-CD1 3.4Å; I13-I47 HydrophobicContact CG1-CD1 3.83Å; R28-I47 VanDerWaalsContact NH1-CG1 3.32Å; L43-I47 HydrophobicContact CD1-CD1 3.92Å; L43-I47 HydrophobicContact CD1-CG1 4.24Å; L43-I47 HydrophobicContact CG-CD1 3.97Å; L43-I47 WeakPolarHBondContact O-CD1 3.41Å; L43-I47 VanDerWaalsContact O-CG1 3.3Å; L43-I47 WeakPolarHBondContact O-CG1 3.39Å; L43-I47 PolarHBondContact O-N 2.89Å; L43-I47 VanDerWaalsContact O-N 3.1Å; K44-I47 PolarHBondContact O-N 2.82Å; Q45-I47 PolarHBondContact O-N 3.07Å; Q45-I47 VanDerWaalsContact O-N 3.15Å; I47-E50 CarbonylContact O-C 3.15Å; I47-E50 PolarHBondContact O-N 2.74Å; I47-G51 PolarHBondContact O-N 2.84Å; I47-G52 PolarHBondContact O-N 3.18Å; I47-D53 WeakPolarHBondContact CG2-O 3.35Å; I47-I57 HydrophobicContact CD1-CG1 3.63Å
48	E	90.9	Very high	89.1	Confident	101 Å²	101	63.5 Å²	63.5	47%	0.472	35%	0.351	S	S	.	.	H	α-helix	trans	-63.5	-45.1	173.4	-148.3	161.7	148.5	0	0	111.2	K44 Q45 E50 G51 P54	K44-E48 PolarHBondContact O-N 3.24Å; Q45-E48 CarbonylContact O-C 3.57Å; Q45-E48 WeakPolarHBondContact O-CA 3.43Å; Q45-E48 WeakPolarHBondContact O-CB 3.06Å; Q45-E48 PolarHBondContact O-N 2.7Å; E48-E50 VanDerWaalsContact C-N 3.28Å; E48-E50 PolarHBondContact O-N 2.76Å; E48-G51 PolarHBondContact O-N 2.82Å; E48-P54 HydrophobicContact CB-CB 4.14Å; E48-P54 HydrophobicContact CG-CB 4.15Å; E48-P54 HydrophobicContact CG-CG 4.43Å; E48-P54 WeakPolarHBondContact OE2-CB 3.43Å
49	D	90.8	Very high	87.4	Confident	116 Å²	116	62.9 Å²	62.9	62%	0.62	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-28.8	174.5	-56.9	-21.5	0	0	0	112.5	Q45 G51	Q45-D49 PolarHBondContact NE2-OD1 3.29Å; Q45-D49 WeakPolarHBondContact O-CB 3.4Å; Q45-D49 PolarHBondContact O-N 3.1Å; D49-G51 VanDerWaalsContact C-N 3.31Å
50	E	88.1	Confident	85.3	Confident	118 Å²	118	67.7 Å²	67.7	55%	0.551	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-3.2	172.8	-80.2	170.8	-156.7	0	0	113.1	R28 A46 I47 E48 G52	R28-E50 VanDerWaalsContact CZ-CD 3.48Å; R28-E50 IonicContact CZ-OE1 3.76Å; R28-E50 IonicContact CZ-OE2 2.73Å; R28-E50 IonicContact NE-OE1 2.57Å; R28-E50 IonicContact NH1-OE1 3.33Å; R28-E50 PolarHBondContact NH1-OE1 3.08Å; R28-E50 IonicContact NH1-OE2 2.84Å; R28-E50 PolarHBondContact NH1-OE2 3.2Å; R28-E50 IonicContact NH2-OE1 2.76Å; R28-E50 IonicContact NH2-OE2 3.17Å; R28-E50 PolarHBondContact NH2-OE2 2.88Å; A46-E50 WeakPolarHBondContact O-CB 3.39Å; A46-E50 VanDerWaalsContact O-CD 3.31Å; A46-E50 WeakPolarHBondContact O-CG 3.37Å; A46-E50 PolarHBondContact O-N 3.1Å; I47-E50 CarbonylContact O-C 3.15Å; I47-E50 PolarHBondContact O-N 2.74Å; E48-E50 VanDerWaalsContact C-N 3.28Å; E48-E50 PolarHBondContact O-N 2.76Å; E50-G52 VanDerWaalsContact C-N 3.35Å
51	G	84.3	Confident	82.5	Confident	72 Å²	72	72.8 Å²	72.8	74%	0.742	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	20.7	-177.5	0	0	0	0	0	115	I47 E48 D49	I47-G51 PolarHBondContact O-N 2.84Å; E48-G51 PolarHBondContact O-N 2.82Å; D49-G51 VanDerWaalsContact C-N 3.31Å
52	G	83.6	Confident	79.5	Confident	29 Å²	29	74.7 Å²	74.7	30%	0.299	42%	0.415	S	S	.	.	S	Bend	trans	-98.1	166.8	176.4	0	0	0	0	0	113.7	I47 E50 P54	I47-G52 PolarHBondContact O-N 3.18Å; E50-G52 VanDerWaalsContact C-N 3.35Å; G52-P54 VanDerWaalsContact O-CD 3.29Å; G52-P54 WeakPolarHBondContact O-CD 3.33Å; G52-P54 VanDerWaalsContact O-N 3.17Å
53	D	85.8	Confident	76.5	Confident	119 Å²	119	77.6 Å²	77.6	64%	0.636	44%	0.44	S	S	*	.			trans	-60.4	113.4	178.3	-75.9	-42.3	0	0	0	111.6	I47 E55 Y56	I47-D53 WeakPolarHBondContact CG2-O 3.35Å; D53-E55 PolarHBondContact O-N 2.87Å; D53-Y56 HydrophobicContact CB-CD2 4.31Å; D53-Y56 PolarHBondContact O-N 2.78Å
54	P	84.6	Confident	73.5	Confident	41 Å²	41	85.9 Å²	85.9	27%	0.266	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	17.3	-168.6	36.5	-40.3	0	0	0	113.5	I13 K44 E48 G52	I13-P54 WeakPolarHBondContact CD1-O 3.34Å; K44-P54 HydrophobicContact CD-CB 4.38Å; K44-P54 WeakPolarHBondContact CD-O 3.3Å; K44-P54 WeakPolarHBondContact CE-O 3.42Å; K44-P54 HydrophobicContact CG-CB 3.89Å; K44-P54 VanDerWaalsContact CG-O 3.3Å; K44-P54 WeakPolarHBondContact CG-O 3.31Å; E48-P54 HydrophobicContact CB-CB 4.14Å; E48-P54 HydrophobicContact CG-CB 4.15Å; E48-P54 HydrophobicContact CG-CG 4.43Å; E48-P54 WeakPolarHBondContact OE2-CB 3.43Å; G52-P54 VanDerWaalsContact O-CD 3.29Å; G52-P54 WeakPolarHBondContact O-CD 3.33Å; G52-P54 VanDerWaalsContact O-N 3.17Å
55	E	85.4	Confident	70.6	Confident	114 Å²	114	87 Å²	87	53%	0.533	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-14.8	164.8	-65.9	-136.2	142.6	0	0	113.7	K12 I13 D53	K12-E55 CarbonylContact C-O 3.56Å; K12-E55 VanDerWaalsContact CA-O 3.31Å; K12-E55 WeakPolarHBondContact CA-O 3.41Å; I13-E55 WeakPolarHBondContact CG1-O 3.41Å; I13-E55 PolarHBondContact N-O 2.65Å; D53-E55 PolarHBondContact O-N 2.87Å
56	Y	86.3	Confident	67.5	Low	76 Å²	76	88 Å²	88	30%	0.298	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	143.3	-168.7	-66.2	-88.4	0	0	0	113.1	K11 K12 D53	K11-Y56 WeakPolarHBondContact O-CA 3.41Å; K12-Y56 HydrophobicContact CD-CE1 4.3Å; K12-Y56 WeakPolarHBondContact CE-OH 3.17Å; K12-Y56 HydrophobicContact CG-CD1 3.9Å; K12-Y56 HydrophobicContact CG-CE1 3.42Å; K12-Y56 VanDerWaalsContact CG-CE1 3.42Å; D53-Y56 HydrophobicContact CB-CD2 4.31Å; D53-Y56 PolarHBondContact O-N 2.78Å
57	I	82.6	Confident	64.6	Low	13 Å²	13	93.2 Å²	93.2	7%	0.067	56%	0.557	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-99	124.4	173.7	-68.6	151.5	0	0	0	110.1	K11 I13 L16 E24 L43 I47 T59	K11-I57 PolarHBondContact O-N 2.84Å; I13-I57 HydrophobicContact CG1-CD1 3.95Å; I13-I57 HydrophobicContact CG1-CG1 3.86Å; L16-I57 HydrophobicContact CD1-CD1 3.34Å; L16-I57 HydrophobicContact CG-CD1 4.33Å; E24-I57 HydrophobicContact CG-CD1 4.22Å; L43-I57 HydrophobicContact CD2-CD1 4.1Å; I47-I57 HydrophobicContact CD1-CG1 3.63Å; I57-T59 PolarHBondContact O-N 3.41Å
58	P	67.6	Low	61.8	Low	81 Å²	81	103.7 Å²	103.7	53%	0.526	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-69.4	126.9	171	27.9	-32.9	0	0	0	110.6
59	T	60.1	Low	59.3	Low	53 Å²	53	107 Å²	107	33%	0.325	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-88.2	119.5	174.5	53.2	0	0	0	0	110.4	D9 I57 Q61	D9-T59 WeakPolarHBondContact O-CG2 3.1Å; I57-T59 PolarHBondContact O-N 3.41Å; T59-Q61 PolarHBondContact O-N 2.81Å
60	P	49.9	Very low	56.4	Low	102 Å²	102	107.7 Å²	107.7	66%	0.662	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-68.3	130.4	176.5	27.8	-33.6	0	0	0	110.8
61	Q	36.3	Very low	53.7	Low	149 Å²	149	104.9 Å²	104.9	70%	0.696	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-74.8	131.5	172.9	-71.6	-177.2	-16.8	0	0	110.5	T59	T59-Q61 PolarHBondContact O-N 2.81Å
62	S	32.5	Very low	51.2	Low	121 Å²	121	111.7 Å²	111.7	85%	0.846	64%	0.642	S	S	*	*			trans	-86.6	107.3	175.3	55.1	0	0	0	0	111.2
63	T	31.5	Very low	48.6	Very low	130 Å²	130	115.9 Å²	115.9	80%	0.798	67%	0.667	S	S	*	*			trans	-100.8	98.5	172.4	54.4	0	0	0	0	111
64	D	29.9	Very low	46.1	Very low	175 Å²	175	122 Å²	122	94%	0.936	68%	0.681	S	S	*	*			trans	-81.5	125.3	170.6	-116.7	-32.8	0	0	0	110.4
65	S	33.4	Very low	43.4	Very low	110 Å²	110	123.8 Å²	123.8	77%	0.769	71%	0.707	S	S	*	*			trans	-139.7	113.9	170.9	67.8	0	0	0	0	111.2
66	S	30.4	Very low	40.8	Very low	119 Å²	119	127.6 Å²	127.6	83%	0.832	72%	0.722	S	S	*	*			trans	-83.5	129.6	-177.3	-169	0	0	0	0	112.3
67	S	31.4	Very low	38.4	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	74%	0.742	S	S	*	*			trans	-128.4	143.2	163.2	63.1	0	0	0	0	110.4
68	R	32.9	Very low	35.8	Very low	221 Å²	221	137 Å²	137	83%	0.834	78%	0.779	S	S	*	*			trans	-118.5	156.5	-178.1	-64.7	177.9	168.9	176.3	-4	111.6
69	L	37.8	Very low	34	Very low	170 Å²	170	139.8 Å²	139.8	89%	0.89	79%	0.79	S	S	*	*			trans	77.4	104.4	161.1	-48.1	-175.9	0	0	0	118.6
70	S	29.8	Very low	32.5	Very low	132 Å²	132	142.5 Å²	142.5	92%	0.923	81%	0.811	S	S	*	*				-149.8	178.7	118.1	73	0	0	0	0	109.1
71	G	31.4	Very low	31.6	Very low	58 Å²	58	145 Å²	145	60%	0.598	82%	0.819	S	S	*	*			trans	175.9	171.1	177.9	0	0	0	0	0	115.3
72	K	31.5	Very low	31.3	Very low	215 Å²	215	146.3 Å²	146.3	94%	0.935	83%	0.829	S	S	*	*			trans	74.1	149.6	-151.4	-64.9	115.2	174.5	-177.8	0	111.2
73	S	30.6	Very low	31.5	Very low	117 Å²	117	148.4 Å²	148.4	82%	0.818	83%	0.826	S	S	*	*			cis	-115.1	-160.4	20.1	64.9	0	0	0	0	115.1
74	R	32.6	Very low	31.3	Very low	248 Å²	248	149 Å²	149	94%	0.936	82%	0.824	S	S	*	*			trans	-120.8	140.1	-174.8	-57.6	164.3	84.7	-178.9	8.4	109
75	G	27.5	Very low	31.3	Very low	79 Å²	79	145.8 Å²	145.8	81%	0.814	81%	0.811	S	S	*	*			trans	-141.9	150.8	166.4	0	0	0	0	0	109.7
76	K	31.9	Very low	31.5	Very low	194 Å²	194	146.1 Å²	146.1	84%	0.843	81%	0.808	S	S	*	*			trans	-155.4	114.5	-173.5	-177.1	-176.6	178.1	-173.6	0	112.3
77	K	34.2	Very low	31.8	Very low	166 Å²	166	147.5 Å²	147.5	72%	0.722	80%	0.801	S	S	*	*			trans	56.4	118.8	163.4	-80	-177.7	151	-71.8	0	118.3	D79	K77-D79 IonicContact NZ-OD2 3.48Å; K77-D79 PolarHBondContact NZ-OD2 3.4Å
78	S	28.7	Very low	32	Very low	120 Å²	120	150 Å²	150	84%	0.839	80%	0.8	S	S	*	*			trans	-155.1	121.3	135.7	47.6	0	0	0	0	107.9
79	D	29.8	Very low	31.9	Very low	140 Å²	140	146.4 Å²	146.4	75%	0.749	80%	0.798	S	S	*	*			trans	-95.9	129.8	172.1	-54.7	-79.1	0	0	0	107.4	K77	K77-D79 IonicContact NZ-OD2 3.48Å; K77-D79 PolarHBondContact NZ-OD2 3.4Å
80	S	29.5	Very low	31.5	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	79%	0.788	S	S	*	*			trans	-173.2	120.6	161.3	56	0	0	0	0	109.9
81	D	30.2	Very low	31.3	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	78%	0.779	S	S	*	*			trans	-73.5	161.2	-178.5	-46.4	-89.3	0	0	0	113.1
82	L	29.8	Very low	31.2	Very low	175 Å²	175	144.3 Å²	144.3	92%	0.916	78%	0.783	S	S	*	*			trans	-164	100.7	138.1	-108.4	171.6	0	0	0	109
83	E	37.5	Very low	31.2	Very low	166 Å²	166	141.3 Å²	141.3	78%	0.776	77%	0.77	S	S	*	*			trans	-87.8	151.2	161.4	-68.1	-165.3	155.3	0	0	110.3
84	N	27.4	Very low	31	Very low	142 Å²	142	142 Å²	142	76%	0.759	76%	0.76	S	S	*	*				-175.9	124.2	128.9	-96.4	-12.4	0	0	0	108.1
85	T	30	Very low	30.8	Very low	107 Å²	107	137.1 Å²	137.1	66%	0.656	76%	0.757	S	S	*	*				74.4	-175.9	70	66.7	0	0	0	0	113.8
86	V	36.3	Very low	31	Very low	117 Å²	117	138.7 Å²	138.7	71%	0.709	74%	0.743	S	S	*	*			trans	79.5	110.6	-173.8	177.4	0	0	0	0	114.6
87	E	37.1	Very low	31.1	Very low	149 Å²	149	138.6 Å²	138.6	70%	0.696	75%	0.746	S	S	*	*			cis	-140	149.4	-11.1	-53.5	-65.2	20.8	0	0	107.6
88	E	35.2	Very low	31.1	Very low	169 Å²	169	138.9 Å²	138.9	79%	0.79	74%	0.744	S	S	*	*				66.7	137.8	81.3	-51	-151.2	124.7	0	0	120.1
89	D	31	Very low	31.5	Very low	146 Å²	146	140.2 Å²	140.2	78%	0.781	74%	0.737	S	S	*	*				178.9	135.9	116.1	-112.9	-13.2	0	0	0	110.6
90	V	29.8	Very low	31.7	Very low	115 Å²	115	137.7 Å²	137.7	70%	0.697	73%	0.73	S	S	*	*			cis	-146.7	151.2	-5.4	-142.1	0	0	0	0	110.3
91	S	24.7	Very low	32.2	Very low	103 Å²	103	139.1 Å²	139.1	72%	0.72	72%	0.724	S	S	*	*			trans	40.1	131.5	136.2	-169.9	0	0	0	0	120.9
92	S	30.1	Very low	32.5	Very low	97 Å²	97	139.8 Å²	139.8	68%	0.678	72%	0.72	S	S	*	*			cis	-150.2	-179.6	16.3	-105.4	0	0	0	0	110.8
93	K	30.6	Very low	32.4	Very low	153 Å²	153	138.6 Å²	138.6	67%	0.665	72%	0.715	S	S	*	*			cis	61.8	146.8	48.3	-112.9	-160	149.8	-149.2	0	112.8
94	E	27.3	Very low	32.2	Very low	130 Å²	130	136.6 Å²	136.6	61%	0.607	71%	0.713	S	S	*	*			cis	-135.7	144.3	9.6	-64.2	-170.5	132.1	0	0	114.7
95	V	28.5	Very low	32.5	Very low	146 Å²	146	135.4 Å²	135.4	89%	0.885	71%	0.711	S	S	*	*			trans	-135.1	138.8	142.3	177.3	0	0	0	0	105.9
96	E	32.4	Very low	32.7	Very low	112 Å²	112	136.4 Å²	136.4	52%	0.523	71%	0.713	S	S	.	*			trans	-93.4	140.3	-173	-74.6	-81.6	-142.8	0	0	113.1
97	E	33.7	Very low	32.8	Very low	193 Å²	193	136.2 Å²	136.2	90%	0.902	71%	0.712	S	S	*	*			trans	-146.5	116.4	153.3	-166.7	160.2	-147.9	0	0	110.9
98	Y	33.9	Very low	32.6	Very low	171 Å²	171	136.4 Å²	136.4	67%	0.671	72%	0.718	S	S	*	*			trans	-93.1	151.7	177.5	-93.1	-114.2	0	0	0	108.9
99	E	36.1	Very low	32.4	Very low	149 Å²	149	135.6 Å²	135.6	70%	0.696	72%	0.719	S	S	*	*			cis	-169.8	178.7	2.1	-154	-171.5	-136.9	0	0	109.6
100	S	34	Very low	32.4	Very low	86 Å²	86	131.1 Å²	131.1	60%	0.601	71%	0.708	S	S	*	*			trans	74.5	134.4	140.3	-83.2	0	0	0	0	120.3
101	E	40.6	Very low	32.7	Very low	140 Å²	140	131 Å²	131	65%	0.654	71%	0.711	S	S	*	*			cis	-148.1	151.8	2.6	-59	-163.4	99.8	0	0	113.6
102	K	36.7	Very low	33.2	Very low	170 Å²	170	135.7 Å²	135.7	74%	0.739	71%	0.714	S	S	*	*			trans	47.8	137.9	136.6	-61.9	159.4	-167.1	161.1	0	120.1
103	D	27.5	Very low	33.5	Very low	150 Å²	150	137.2 Å²	137.2	80%	0.802	71%	0.71	S	S	*	*				-151.3	160.7	53.5	-121.5	-19.2	0	0	0	115.8
104	V	34.1	Very low	33.5	Very low	123 Å²	123	135.9 Å²	135.9	75%	0.745	71%	0.71	S	S	*	*			trans	-75.7	159	178.1	-77.3	0	0	0	0	113
105	T	33.6	Very low	33.9	Very low	117 Å²	117	135.2 Å²	135.2	72%	0.718	72%	0.72	S	S	*	*				-179.1	166	66.4	45.8	0	0	0	0	108.9
106	D	33.8	Very low	34.1	Very low	129 Å²	129	138 Å²	138	69%	0.69	72%	0.72	S	S	*	*			cis	-168.6	154.2	-3.8	-114.2	-32.2	0	0	0	110.9
107	T	37.4	Very low	35	Very low	112 Å²	112	138.1 Å²	138.1	69%	0.687	73%	0.73	S	S	*	*			trans	54.9	160.4	153	59.4	0	0	0	0	120.8
108	D	33.6	Very low	35.6	Very low	153 Å²	153	134.7 Å²	134.7	82%	0.818	73%	0.725	S	S	*	*			cis	-177.2	173.2	-19.3	-87.6	-10.3	0	0	0	105
109	D	30.2	Very low	36.8	Very low	152 Å²	152	132.2 Å²	132.2	81%	0.813	73%	0.73	S	S	*	*			cis	-166.9	156.1	-29.7	174.5	73.8	0	0	0	104.1
110	G	33	Very low	36.5	Very low	53 Å²	53	131.4 Å²	131.4	55%	0.546	74%	0.739	S	S	.	*			cis	162.1	-163.4	0.9	0	0	0	0	0	109.5
111	S	34.3	Very low	36.8	Very low	111 Å²	111	136.4 Å²	136.4	78%	0.776	75%	0.753	S	S	*	*			trans	64.9	148.9	167.5	-76.1	0	0	0	0	119.1
112	R	35.2	Very low	36.2	Very low	203 Å²	203	137.1 Å²	137.1	77%	0.766	76%	0.761	S	S	*	*			cis	-169.9	154.7	-17.3	-143.5	171.7	98.4	167.6	5.7	111.7
113	E	37.7	Very low	36	Very low	128 Å²	128	133.6 Å²	133.6	60%	0.598	76%	0.758	S	S	*	*			trans	71.6	158.2	161.3	-44.8	-164	168.8	0	0	119.1
114	N	30.9	Very low	36.2	Very low	126 Å²	126	133.9 Å²	133.9	67%	0.674	76%	0.759	S	S	*	*			cis	-157.7	149.8	11.9	-144.4	-24.1	0	0	0	117.1
115	S	35.7	Very low	36	Very low	116 Å²	116	132.8 Å²	132.8	81%	0.811	76%	0.763	S	S	*	*			trans	72.9	168.9	149.4	72.8	0	0	0	0	123.3
116	K	32.4	Very low	35.7	Very low	205 Å²	205	135.6 Å²	135.6	89%	0.891	77%	0.767	S	S	*	*			trans	-147.9	159.1	-154.6	-171.9	168.2	-179.4	169.9	0	113.1
117	P	51.2	Low	35.6	Very low	113 Å²	113	135 Å²	135	73%	0.734	77%	0.773	S	S	*	*			trans	-108.9	179.2	-164.8	41.8	-36.2	0	0	0	117.4
118	P	45.1	Very low	35.2	Very low	121 Å²	121	138.2 Å²	138.2	79%	0.786	78%	0.78	S	S	*	*			trans	-116.9	169.1	177.9	41.4	-31.4	0	0	0	116.9
119	P	60.3	Low	36.3	Very low	120 Å²	120	135.9 Å²	135.9	78%	0.779	77%	0.773	S	S	*	*			trans	-119.9	-174.1	178.4	44	-33.2	0	0	0	114.7
120	C	28.2	Very low	36.4	Very low	132 Å²	132	136.6 Å²	136.6	89%	0.892	77%	0.772	S	S	*	*			trans	174.3	177.2	140.5	-92.6	0	0	0	0	114.9
121	E	41.9	Very low	37.7	Very low	190 Å²	190	138.4 Å²	138.4	89%	0.888	77%	0.774	S	S	*	*			trans	-133.8	-177.3	-166	-53.8	178.5	148.8	0	0	114
122	D	27.7	Very low	37.7	Very low	156 Å²	156	141.5 Å²	141.5	83%	0.834	78%	0.776	S	S	*	*			trans	87.7	-179.9	153.8	-137.3	-11.2	0	0	0	121.8
123	S	33	Very low	37.7	Very low	95 Å²	95	137.6 Å²	137.6	66%	0.664	78%	0.78	S	S	*	*			trans	-128.9	-179.8	-133.4	-51	0	0	0	0	119.5
124	L	30.6	Very low	37.3	Very low	157 Å²	157	139 Å²	139	82%	0.822	79%	0.786	S	S	*	*			trans	85.3	137.5	153.9	-72.4	167.1	0	0	0	123.1
125	A	29.4	Very low	37.3	Very low	100 Å²	100	138.5 Å²	138.5	83%	0.826	79%	0.788	S	S	*	*			trans	-164	155.9	151.8	0	0	0	0	0	111.7
126	H	28.7	Very low	37.1	Very low	175 Å²	175	138.7 Å²	138.7	81%	0.81	78%	0.784	S	S	*	*			trans	-126.1	161.6	-173	-79.2	-108.5	0	0	0	114.2
127	S	31.1	Very low	37.2	Very low	116 Å²	116	133.6 Å²	133.6	81%	0.811	78%	0.78	S	S	*	*			trans	-170.1	133.9	137	58.4	0	0	0	0	114.4
128	E	29.2	Very low	36.4	Very low	181 Å²	181	132.1 Å²	132.1	85%	0.846	78%	0.777	S	S	*	*			trans	-99.1	-150.4	165.9	-61.4	-173.9	118.4	0	0	109.4
129	P	55.9	Low	35.8	Very low	103 Å²	103	134 Å²	134	67%	0.669	78%	0.781	S	S	*	*			cis	-148.9	-167.3	-3.1	40.8	-17	0	0	0	118.8
130	E	33.2	Very low	34.6	Very low	168 Å²	168	132.5 Å²	132.5	79%	0.785	78%	0.779	S	S	*	*			trans	87.2	151.5	151.8	-69.6	-47	85.1	0	0	123.5
131	P	60.1	Low	34.6	Very low	90 Å²	90	133.7 Å²	133.7	58%	0.584	78%	0.776	S	S	*	*			trans	-146	-157.6	-134	42.7	-18.6	0	0	0	118.4
132	E	34.6	Very low	34.8	Very low	176 Å²	176	129.9 Å²	129.9	82%	0.822	77%	0.77	S	S	*	*			trans	68.7	118.9	160.7	-66.7	179.9	-117.8	0	0	120.9
133	S	34.6	Very low	35.6	Very low	121 Å²	121	131.2 Å²	131.2	85%	0.846	77%	0.772	S	S	*	*				165.6	-179.8	91	49.7	0	0	0	0	109.1
134	E	29.6	Very low	36.9	Very low	157 Å²	157	132.5 Å²	132.5	73%	0.734	78%	0.778	S	S	*	*			cis	-152.2	-140.2	6.7	-153.1	-125.8	-98.6	0	0	111.4
135	T	30.3	Very low	37.3	Very low	117 Å²	117	132.2 Å²	132.2	72%	0.718	78%	0.777	S	S	*	*			trans	-132.1	-164.8	-172.6	41.7	0	0	0	0	113.1
136	V	32.3	Very low	38.7	Very low	119 Å²	119	132.3 Å²	132.3	72%	0.721	77%	0.769	S	S	*	*			cis	-156.1	170.7	20.3	-70.5	0	0	0	0	113.2
137	A	33.2	Very low	39.2	Very low	99 Å²	99	132 Å²	132	82%	0.818	77%	0.768	S	S	*	*			trans	68	150.9	148.5	0	0	0	0	0	121.3
138	A	36.1	Very low	39.8	Very low	81 Å²	81	132.4 Å²	132.4	67%	0.669	77%	0.766	S	S	*	*			cis	-166.9	152	-7.1	0	0	0	0	0	113.1
139	D	31.3	Very low	40.2	Very low	162 Å²	162	131.1 Å²	131.1	87%	0.866	77%	0.765	S	S	*	*			trans	41.9	154.9	144.5	-55.3	-61.6	0	0	0	122.3
140	A	35.1	Very low	39.6	Very low	88 Å²	88	130 Å²	130	73%	0.727	76%	0.763	S	S	*	*			cis	-149.7	-166.2	1.5	0	0	0	0	0	108.4
141	D	28.8	Very low	40.1	Very low	156 Å²	156	130.3 Å²	130.3	83%	0.834	77%	0.765	S	S	*	*			cis	-157.4	-163.7	-0.6	-145.5	-40.8	0	0	0	110.2
142	S	46.6	Very low	39.2	Very low	110 Å²	110	132 Å²	132	77%	0.769	77%	0.773	S	S	*	*			trans	-122.2	177.8	-171.3	-47.9	0	0	0	0	117.9
143	E	44.4	Very low	39.4	Very low	185 Å²	185	130.1 Å²	130.1	86%	0.864	77%	0.769	S	S	*	*			trans	-39.9	166.7	167.8	-74.7	176.3	-179.8	0	0	117.4
144	P	59.1	Low	39.7	Very low	121 Å²	121	133 Å²	133	79%	0.786	77%	0.769	S	S	*	*			cis	-146.1	-175.6	29.7	43	-21.8	0	0	0	119.6
145	D	40	Very low	40.4	Very low	152 Å²	152	132.8 Å²	132.8	81%	0.813	77%	0.773	S	S	*	*			trans	-49.6	170.6	163.3	-83.2	-46	0	0	0	115.8
146	P	59.3	Low	41	Very low	102 Å²	102	130.8 Å²	130.8	66%	0.662	77%	0.768	S	S	*	*			cis	-149.5	-176.3	29.4	45	-24.4	0	0	0	120.3
147	E	38.9	Very low	41.3	Very low	168 Å²	168	132.5 Å²	132.5	79%	0.785	77%	0.774	S	S	*	*			trans	77	129.4	143.9	-88.2	170.9	-144.6	0	0	123.9
148	V	43.1	Very low	41.9	Very low	125 Å²	125	131.6 Å²	131.6	76%	0.758	77%	0.766	S	S	*	*			trans	56.4	150.6	156.1	-53.4	0	0	0	0	119.1
149	D	37.7	Very low	41.9	Very low	154 Å²	154	135.7 Å²	135.7	82%	0.824	78%	0.777	S	S	*	*			cis	-136	176.9	13	-87.1	-51.6	0	0	0	108.1
150	A	42.5	Very low	42.5	Very low	78 Å²	78	132.8 Å²	132.8	65%	0.645	78%	0.775	S	S	*	*			cis	-175.5	171.1	-6	0	0	0	0	0	105.7
151	E	45.3	Very low	43.4	Very low	176 Å²	176	135.8 Å²	135.8	82%	0.822	78%	0.779	S	S	*	*			cis	-169.5	164.1	-7.1	-109.6	175.5	133.3	0	0	107.3
152	V	40.2	Very low	45.2	Very low	125 Å²	125	133.1 Å²	133.1	76%	0.758	77%	0.77	S	S	*	*			trans	68.1	138.3	163.9	172.3	0	0	0	0	118.7
153	D	39.1	Very low	45	Very low	137 Å²	137	136.5 Å²	136.5	73%	0.733	77%	0.774	S	S	*	*			cis	-176.6	151.4	-25.7	-78.7	-28.8	0	0	0	103.9
154	E	41.4	Very low	46	Very low	181 Å²	181	132.3 Å²	132.3	85%	0.846	76%	0.763	S	S	*	*			cis	-127.7	163.8	-7	-56.1	175.3	99.5	0	0	106.3
155	D	43.6	Very low	44.7	Very low	152 Å²	152	135.4 Å²	135.4	81%	0.813	77%	0.767	S	S	*	*			cis	77.1	134.8	31.8	-70.7	-37.1	0	0	0	116
156	A	43.1	Very low	44.5	Very low	75 Å²	75	132.3 Å²	132.3	62%	0.62	76%	0.762	S	S	*	*			cis	-155.5	156.6	-4.6	0	0	0	0	0	114.6
157	D	39.4	Very low	43.2	Very low	156 Å²	156	136.5 Å²	136.5	83%	0.834	77%	0.773	S	S	*	*			trans	48	156.1	130.5	-67.6	-16.3	0	0	0	125.3
158	A	44.1	Very low	42.9	Very low	80 Å²	80	132.8 Å²	132.8	66%	0.661	77%	0.771	S	S	*	*			cis	-169.5	156.4	-21.4	0	0	0	0	0	113
159	D	37.9	Very low	42.4	Very low	166 Å²	166	135 Å²	135	89%	0.888	77%	0.773	S	S	*	*			trans	51.3	153.5	146.9	-106.3	-46.3	0	0	0	126.6
160	A	43.1	Very low	42	Very low	101 Å²	101	132.6 Å²	132.6	84%	0.835	76%	0.764	S	S	*	*			trans	73.9	152.7	160.7	0	0	0	0	0	121.8
161	D	54.3	Low	41.6	Very low	151 Å²	151	137 Å²	137	81%	0.807	77%	0.771	S	S	*	*			trans	-130.5	163.4	-164.4	-174.4	55.1	0	0	0	109.2
162	P	66.9	Low	41.1	Very low	100 Å²	100	135.8 Å²	135.8	65%	0.649	77%	0.765	S	S	*	*			cis	-128.1	178.2	-3.4	17.3	9.4	0	0	0	116.2
163	E	41.3	Very low	40.8	Very low	181 Å²	181	133.3 Å²	133.3	85%	0.846	76%	0.758	S	S	*	*			trans	11.9	158	151.2	-87.6	-166.5	-143.8	0	0	123.9
164	P	64.6	Low	40.7	Very low	97 Å²	97	132.9 Å²	132.9	63%	0.63	75%	0.752	S	S	*	*			cis	-144.4	-171.4	-12.4	39.5	-18.3	0	0	0	117.2
165	E	32.7	Very low	40.3	Very low	187 Å²	187	133.4 Å²	133.4	87%	0.874	75%	0.746	S	S	*	*			trans	87.6	148.6	149.4	-81.1	-165.3	-147.5	0	0	124.9
166	A	35.1	Very low	39.6	Very low	86 Å²	86	133.5 Å²	133.5	71%	0.711	75%	0.747	S	S	*	*			trans	86.8	91.5	150.2	0	0	0	0	0	123.9
167	E	32.2	Very low	39.1	Very low	190 Å²	190	133.8 Å²	133.8	89%	0.888	75%	0.749	S	S	*	*				61.8	146.4	126.4	-62.1	-167.2	-178.3	0	0	125.6
168	A	33.5	Very low	39	Very low	91 Å²	91	134.4 Å²	134.4	75%	0.752	75%	0.747	S	S	*	*			trans	71.1	146.2	145.4	0	0	0	0	0	120.7
169	E	31.6	Very low	38.1	Very low	171 Å²	171	136.4 Å²	136.4	80%	0.799	75%	0.751	S	S	*	*			cis	-166.8	-176.8	-22.8	-144.5	176.7	-141.8	0	0	109.7
170	T	29.3	Very low	37.7	Very low	103 Å²	103	136.5 Å²	136.5	63%	0.632	75%	0.751	S	S	*	*			trans	67	117.7	159.7	52.8	0	0	0	0	120
171	E	34.6	Very low	36.9	Very low	170 Å²	170	136.8 Å²	136.8	79%	0.794	75%	0.746	S	S	*	*				90.6	154.9	92.3	-74.7	-174.2	-176.3	0	0	113.6
172	E	34.2	Very low	35.5	Very low	151 Å²	151	134.7 Å²	134.7	71%	0.706	74%	0.743	S	S	*	*			cis	-159	-175.5	-0.5	-120.7	-80.4	168.9	0	0	109.6
173	A	34.9	Very low	34	Very low	74 Å²	74	135.1 Å²	135.1	61%	0.612	75%	0.749	S	S	*	*			trans	75.6	150.3	151	0	0	0	0	0	121.7
174	E	36.2	Very low	33.5	Very low	127 Å²	127	137.6 Å²	137.6	59%	0.593	75%	0.75	S	S	*	*			cis	-167	148.1	-14.2	-109	173.9	-174.3	0	0	113.4
175	R	33.8	Very low	32	Very low	193 Å²	193	141.4 Å²	141.4	73%	0.728	76%	0.76	S	S	*	*			trans	64.3	159	144.9	-69.1	172.8	-165.6	125.3	27.2	119.5
176	D	29.7	Very low	32.4	Very low	154 Å²	154	136.6 Å²	136.6	82%	0.824	75%	0.752	S	S	*	*			cis	-152.5	-178.5	39.1	-132.7	-30.8	0	0	0	117.5
177	A	31	Very low	32.6	Very low	80 Å²	80	141.2 Å²	141.2	66%	0.661	76%	0.759	S	S	*	*			trans	-42.5	149	-173.5	0	0	0	0	0	119.6
178	E	37.2	Very low	32.8	Very low	169 Å²	169	138.8 Å²	138.8	79%	0.79	75%	0.752	S	S	*	*			cis	89.2	120.6	39.9	-85.4	-76.7	-169.2	0	0	116.6
179	T	27.2	Very low	33.2	Very low	122 Å²	122	141.8 Å²	141.8	75%	0.748	76%	0.755	S	S	*	*			trans	153.1	130.3	133.4	45.5	0	0	0	0	118.5
180	L	28.2	Very low	33.5	Very low	169 Å²	169	142.5 Å²	142.5	89%	0.885	76%	0.758	S	S	*	*			trans	77	159.9	142.6	-68.4	169.7	0	0	0	123.7
181	S	27	Very low	33.8	Very low	106 Å²	106	145.8 Å²	145.8	74%	0.741	77%	0.771	S	S	*	*			trans	-133.5	151.2	-154.9	58.8	0	0	0	0	115.2
182	S	24.7	Very low	33.6	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	77%	0.766	S	S	*	*			trans	170.9	143.2	147.9	-175.9	0	0	0	0	109.4
183	S	34.5	Very low	33.6	Very low	109 Å²	109	141.5 Å²	141.5	76%	0.762	77%	0.77	S	S	*	*			cis	96.3	65.6	15.1	-52.8	0	0	0	0	117.6
184	R	32	Very low	33.3	Very low	233 Å²	233	142.5 Å²	142.5	88%	0.879	77%	0.773	S	S	*	*			trans	-167.8	146.3	156.1	-116.1	-179.5	168.5	138.7	-2.8	110.1
185	E	33.3	Very low	33.4	Very low	178 Å²	178	144.2 Å²	144.2	83%	0.832	79%	0.785	S	S	*	*			cis	67	137	24.6	-64.7	-176.5	174.7	0	0	114.5
186	A	40.5	Very low	33.3	Very low	85 Å²	85	141.5 Å²	141.5	70%	0.702	78%	0.78	S	S	*	*			cis	-163.4	-173.1	-8.6	0	0	0	0	0	106.4
187	E	38.6	Very low	33.7	Very low	184 Å²	184	141.7 Å²	141.7	86%	0.86	78%	0.781	S	S	*	*			cis	-115.1	-118.6	6.8	-66	172.6	80.9	0	0	110.2
188	D	36	Very low	34.4	Very low	139 Å²	139	144.7 Å²	144.7	74%	0.743	78%	0.782	S	S	*	*			cis	-161.4	-173	-3.7	-155	-15.1	0	0	0	109.1
189	D	43.6	Very low	34.6	Very low	153 Å²	153	145 Å²	145	82%	0.818	79%	0.789	S	S	*	*			trans	55.6	69.3	171.4	-85.3	-11.8	0	0	0	117.9
190	H	37	Very low	35.2	Very low	187 Å²	187	143.7 Å²	143.7	87%	0.866	79%	0.79	S	S	*	*			trans	-76.1	130.9	153.8	-63.8	-77.5	0	0	0	111.4
191	L	35.1	Very low	35.6	Very low	171 Å²	171	143.4 Å²	143.4	90%	0.895	79%	0.788	S	S	*	*			trans	-165.8	153.8	143.3	-108.6	162.7	0	0	0	113.6
192	S	30	Very low	36	Very low	98 Å²	98	143.1 Å²	143.1	69%	0.685	78%	0.782	S	S	*	*			trans	-78.8	143.2	-170.4	53.2	0	0	0	0	115.6
193	V	35.4	Very low	36.7	Very low	133 Å²	133	145.5 Å²	145.5	81%	0.806	79%	0.785	S	S	*	*			trans	-136.3	134.7	145.7	-177.9	0	0	0	0	110.5
194	S	28.7	Very low	36.8	Very low	96 Å²	96	145.6 Å²	145.6	67%	0.671	78%	0.777	S	S	*	*			trans	-65.3	154.9	179	-47.2	0	0	0	0	113.7	Q196	S194-Q196 PolarHBondContact O-N 3.3Å
195	I	37.7	Very low	37.2	Very low	163 Å²	163	141.3 Å²	141.3	84%	0.836	78%	0.777	S	S	*	*			trans	-69.1	112.6	151.6	-61.8	176.4	0	0	0	106.6
196	Q	32.3	Very low	37.5	Very low	136 Å²	136	140.1 Å²	140.1	64%	0.636	78%	0.776	S	S	*	*			trans	-79.8	143.7	174.6	-75.2	178.3	-118.9	0	0	110.9	S194 E198	S194-Q196 PolarHBondContact O-N 3.3Å; Q196-E198 PolarHBondContact NE2-OE1 2.99Å
197	N	38	Very low	37.3	Very low	158 Å²	158	139.2 Å²	139.2	85%	0.845	78%	0.775	S	S	*	*			trans	-93.5	109.6	172.4	-43.8	-66.3	0	0	0	108.8
198	E	44.5	Very low	37.3	Very low	143 Å²	143	138.4 Å²	138.4	67%	0.668	78%	0.776	S	S	*	*			trans	-163.5	90.4	163.1	42.7	-140.1	138.7	0	0	112.4	Q196	Q196-E198 PolarHBondContact NE2-OE1 2.99Å
199	D	42.3	Very low	37.4	Very low	176 Å²	176	138.9 Å²	138.9	94%	0.941	78%	0.779	S	S	*	*			trans	-166.7	73	140.7	-112.6	-13.6	0	0	0	109
200	A	40.3	Very low	37.1	Very low	94 Å²	94	138.5 Å²	138.5	78%	0.777	78%	0.776	S	S	*	*			trans	-133.5	92.7	-178.7	0	0	0	0	0	110.9
201	I	36.7	Very low	37.1	Very low	162 Å²	162	137.6 Å²	137.6	83%	0.831	78%	0.777	S	S	*	*			trans	-168	136.3	170.8	-94.3	139.4	0	0	0	106.5
202	T	33.8	Very low	37	Very low	100 Å²	100	138.3 Å²	138.3	61%	0.613	78%	0.776	S	S	*	*			cis	-149.2	148.7	-27.9	38	0	0	0	0	107.1
203	L	40.7	Very low	37.4	Very low	158 Å²	158	139.5 Å²	139.5	83%	0.827	78%	0.779	S	S	*	*			trans	-153	70.5	149	-91	-167.6	0	0	0	109.2
204	D	36.7	Very low	37.3	Very low	110 Å²	110	136 Å²	136	59%	0.588	77%	0.769	S	S	*	*				51.2	79.3	122.3	-40.1	-17	0	0	0	115.8
205	V	40.2	Very low	37.8	Very low	143 Å²	143	141.3 Å²	141.3	87%	0.867	78%	0.781	S	S	*	*			trans	-114.3	84	151.2	179.8	0	0	0	0	106.5	G207	V205-G207 PolarHBondContact O-N 3.27Å
206	D	39.8	Very low	37.5	Very low	153 Å²	153	141.1 Å²	141.1	82%	0.818	78%	0.776	S	S	*	*			trans	-63.8	123.3	170.4	-66.8	-50.6	0	0	0	109
207	G	37	Very low	37.5	Very low	66 Å²	66	139.6 Å²	139.6	68%	0.68	78%	0.775	S	S	*	*			trans	-83.4	178.1	172.5	0	0	0	0	0	112.2	V205 D209	V205-G207 PolarHBondContact O-N 3.27Å; G207-D209 PolarHBondContact O-N 2.94Å
208	D	38	Very low	37.2	Very low	167 Å²	167	141.4 Å²	141.4	89%	0.893	78%	0.776	S	S	*	*	S	Bend	trans	-58.4	117.9	168.1	-66.1	-68.3	0	0	0	110.8
209	D	37.5	Very low	36.7	Very low	150 Å²	150	142.2 Å²	142.2	80%	0.802	78%	0.784	S	S	*	*				-177.4	120.7	128.7	-103.8	-23.9	0	0	0	111.8	G207	G207-D209 PolarHBondContact O-N 2.94Å
210	L	37.1	Very low	36.7	Very low	144 Å²	144	139.7 Å²	139.7	75%	0.754	78%	0.777	S	S	*	*				168.2	106	129.6	-112.9	81.5	0	0	0	110.5
211	L	37.1	Very low	36.1	Very low	168 Å²	168	142.3 Å²	142.3	88%	0.88	78%	0.778	S	S	*	*			trans	-163	71.4	130.7	-93.3	-156.3	0	0	0	110.8
212	E	33.9	Very low	36.8	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.874	77%	0.765	S	S	*	*			trans	-146.7	72.4	145.1	-162.1	140.3	-120.2	0	0	112
213	T	38.8	Very low	36.7	Very low	123 Å²	123	142.8 Å²	142.8	76%	0.755	78%	0.777	S	S	*	*			trans	-75.1	113.5	158.8	56.5	0	0	0	0	107.9
214	G	33.4	Very low	36.3	Very low	58 Å²	58	139.1 Å²	139.1	60%	0.598	77%	0.77	S	S	*	*			cis	114.7	106.6	13.6	0	0	0	0	0	109.9
215	K	37.3	Very low	36.2	Very low	209 Å²	209	141 Å²	141	91%	0.909	78%	0.775	S	S	*	*			trans	-168.1	124.7	172.8	-103.3	139.3	-173.3	172.3	0	113.8
216	H	31.7	Very low	35.6	Very low	159 Å²	159	143 Å²	143	74%	0.736	77%	0.772	S	S	*	*				72.5	88.7	129.7	-160.8	-90.3	0	0	0	122.2
217	V	33.7	Very low	35.1	Very low	103 Å²	103	138.6 Å²	138.6	62%	0.624	76%	0.762	S	S	*	*				71.9	134.3	126.2	175.3	0	0	0	0	121.1
218	K	31.1	Very low	34.7	Very low	196 Å²	196	141.3 Å²	141.3	85%	0.852	77%	0.766	S	S	*	*			trans	84.5	144.6	163.3	-115.2	82.3	174.4	-170.4	0	118.6
219	L	33.9	Very low	34.3	Very low	161 Å²	161	140.7 Å²	140.7	84%	0.843	76%	0.757	S	S	*	*			trans	-80.6	166.5	161.5	-55.2	166.7	0	0	0	108.9
220	P	43.1	Very low	33.6	Very low	123 Å²	123	139.5 Å²	139.5	80%	0.799	76%	0.756	S	S	*	*			cis	-136.9	-159.3	12.8	42.2	-21.5	0	0	0	115.1
221	D	26.9	Very low	33.1	Very low	148 Å²	148	138.7 Å²	138.7	79%	0.791	76%	0.761	S	S	*	*			trans	-49.5	168.8	161.6	-138	18.7	0	0	0	113.9
222	P	52.2	Low	32.7	Very low	88 Å²	88	134.8 Å²	134.8	57%	0.571	75%	0.753	S	S	*	*			cis	-137.5	-162.7	-0.5	45.1	-26.8	0	0	0	114.9
223	E	31	Very low	32.4	Very low	185 Å²	185	134.9 Å²	134.9	86%	0.864	75%	0.753	S	S	*	*			trans	63.4	170.8	158.5	-71.9	174.5	-178.3	0	0	117.5
224	A	32.7	Very low	31.9	Very low	80 Å²	80	134.9 Å²	134.9	66%	0.661	75%	0.753	S	S	*	*			cis	-165.7	169.8	-40.3	0	0	0	0	0	108.4
225	E	33	Very low	31.7	Very low	149 Å²	149	134.9 Å²	134.9	70%	0.696	75%	0.754	S	S	*	*			trans	65.7	134.9	170.6	-56.8	-131.1	97.6	0	0	117.1
226	K	29.1	Very low	31.6	Very low	187 Å²	187	132.5 Å²	132.5	81%	0.813	75%	0.745	S	S	*	*				43.4	135.1	92.2	-47.8	177.5	-166	142.6	0	114.7
227	G	28.7	Very low	31.7	Very low	59 Å²	59	131.2 Å²	131.2	61%	0.608	74%	0.744	S	S	*	*			cis	164.6	-163.2	0.2	0	0	0	0	0	110.8
228	T	28.1	Very low	31.9	Very low	124 Å²	124	133.5 Å²	133.5	76%	0.761	75%	0.753	S	S	*	*			trans	60.5	164.9	154.8	64	0	0	0	0	117.7
229	E	29.4	Very low	32	Very low	153 Å²	153	130.4 Å²	130.4	72%	0.715	75%	0.746	S	S	*	*			cis	-149.5	135.5	-12.3	28.2	-136.1	120	0	0	113.8
230	T	24.4	Very low	31.9	Very low	126 Å²	126	130.5 Å²	130.5	77%	0.773	74%	0.744	S	S	*	*			trans	47.8	138.1	132.2	71.2	0	0	0	0	124.8
231	C	25.3	Very low	31.4	Very low	127 Å²	127	131.3 Å²	131.3	86%	0.858	74%	0.735	S	S	*	*				-177.2	157.4	120.9	-102.4	0	0	0	0	111.3
232	A	28.7	Very low	31.5	Very low	85 Å²	85	130.7 Å²	130.7	70%	0.702	73%	0.731	S	S	*	*			cis	-178.4	127.9	-48.9	0	0	0	0	0	110.1
233	E	28	Very low	30.4	Very low	189 Å²	189	132.8 Å²	132.8	88%	0.883	73%	0.734	S	S	*	*			trans	159.3	113.4	158.4	-97.2	-172.6	143.5	0	0	107
234	T	27.2	Very low	30.3	Very low	123 Å²	123	131 Å²	131	76%	0.755	73%	0.73	S	S	*	*			cis	79	134	35.4	-43.6	0	0	0	0	112.6
235	G	29.9	Very low	30.1	Very low	59 Å²	59	134.6 Å²	134.6	61%	0.608	74%	0.735	S	S	*	*			cis	-169.7	156.6	-2.1	0	0	0	0	0	110.3
236	Q	35.6	Very low	29.8	Very low	158 Å²	158	135 Å²	135	74%	0.738	74%	0.737	S	S	*	*				89.3	145.8	87.9	-74.4	-174.1	-89.4	0	0	114.5
237	D	32.9	Very low	29.6	Very low	132 Å²	132	134.1 Å²	134.1	71%	0.706	74%	0.736	S	S	*	*			cis	-134.8	-118.1	-8.5	-122.3	-8.1	0	0	0	114.9
238	D	38.3	Very low	29.3	Very low	151 Å²	151	139 Å²	139	81%	0.807	75%	0.747	S	S	*	*			cis	-167.5	-178.8	7.7	-154.2	-18.8	0	0	0	111
239	D	32.8	Very low	29.2	Very low	132 Å²	132	136.1 Å²	136.1	71%	0.706	74%	0.743	S	S	*	*			trans	67.1	132.7	179.2	-81.7	-36.7	0	0	0	118.7
240	M	32.5	Very low	29	Very low	163 Å²	163	134.3 Å²	134.3	80%	0.803	74%	0.743	S	S	*	*			cis	-167.6	159.3	-14.6	-144.5	-169.7	-138.2	0	0	111.3
241	K	32.3	Very low	29.1	Very low	139 Å²	139	136.3 Å²	136.3	60%	0.604	74%	0.74	S	S	*	*			trans	69.1	151.6	169.8	-74.9	-170.4	137.7	-71.8	0	118	E243	K241-E243 IonicContact NZ-OE1 3.56Å; K241-E243 PolarHBondContact NZ-OE1 3.04Å; K241-E243 IonicContact NZ-OE2 2.67Å; K241-E243 PolarHBondContact NZ-OE2 2.94Å
242	D	29.6	Very low	29.3	Very low	135 Å²	135	137.8 Å²	137.8	72%	0.722	74%	0.735	S	S	*	*			cis	-139.7	178.9	25.3	-107.9	-37.8	0	0	0	115.4
243	E	28.9	Very low	29.2	Very low	133 Å²	133	140.6 Å²	140.6	62%	0.621	74%	0.738	S	S	*	*			trans	-124	156.8	-174	-35.7	84.3	62.3	0	0	111.1	K241	K241-E243 IonicContact NZ-OE1 3.56Å; K241-E243 PolarHBondContact NZ-OE1 3.04Å; K241-E243 IonicContact NZ-OE2 2.67Å; K241-E243 PolarHBondContact NZ-OE2 2.94Å
244	D	28.7	Very low	29.1	Very low	147 Å²	147	138 Å²	138	79%	0.786	73%	0.726	S	S	*	*			cis	-164.8	179.7	-3.8	-157.6	-5.4	0	0	0	110.7
245	M	29.7	Very low	29.7	Very low	155 Å²	155	136.9 Å²	136.9	76%	0.764	72%	0.721	S	S	*	*			trans	74.3	125.8	152.5	-84.4	-170.9	150.3	0	0	124.6
246	E	26.7	Very low	29.5	Very low	157 Å²	157	139.1 Å²	139.1	73%	0.734	72%	0.723	S	S	*	*				41.1	149.4	103.5	-58.4	-65.1	-165.4	0	0	121
247	E	24.9	Very low	29	Very low	170 Å²	170	136.3 Å²	136.3	79%	0.794	71%	0.713	S	S	*	*			cis	-161.9	172.3	-7.4	-162.8	-177.4	178.5	0	0	108.9
248	D	22.1	Very low	28.9	Very low	160 Å²	160	139.2 Å²	139.2	86%	0.856	72%	0.719	S	S	*	*			trans	67.2	168.9	159.4	-162.3	23.9	0	0	0	118.4
249	G	25	Very low	28.3	Very low	65 Å²	65	138.5 Å²	138.5	67%	0.67	72%	0.715	S	S	*	*			trans	120.9	78.6	163.6	0	0	0	0	0	117.3
250	T	25.2	Very low	28.1	Very low	115 Å²	115	136.6 Å²	136.6	71%	0.706	72%	0.718	S	S	*	*			trans	-46.7	147.3	169.1	47.3	0	0	0	0	118.7
251	K	27.9	Very low	27.8	Very low	167 Å²	167	134.6 Å²	134.6	73%	0.726	72%	0.715	S	S	*	*			trans	72.6	165.1	139.8	-70.8	167.4	-179.6	-173.6	0	120.9
252	E	27.7	Very low	28.1	Very low	158 Å²	158	137.3 Å²	137.3	74%	0.738	73%	0.732	S	S	*	*			trans	69.5	134.9	156.9	-74.4	146.4	-131.5	0	0	115.6
253	D	27.4	Very low	28	Very low	145 Å²	145	139.6 Å²	139.6	78%	0.775	74%	0.736	S	S	*	*			cis	-159.3	-175.2	0.1	-138.7	-13.8	0	0	0	113.9
254	E	25.5	Very low	27.9	Very low	134 Å²	134	136.9 Å²	136.9	63%	0.626	74%	0.736	S	S	*	*			trans	-50.4	-177.9	151.4	-104.3	-101.2	126	0	0	112.5
255	P	39.6	Very low	27.8	Very low	99 Å²	99	137.4 Å²	137.4	64%	0.643	73%	0.734	S	S	*	*			cis	-131.6	-169.2	4.2	44.3	-26.8	0	0	0	113.1
256	T	25.6	Very low	28	Very low	106 Å²	106	135.4 Å²	135.4	65%	0.65	73%	0.73	S	S	*	*			cis	-150.9	140.9	2	-12.7	0	0	0	0	110
257	N	26	Very low	28.1	Very low	99 Å²	99	135.8 Å²	135.8	53%	0.529	73%	0.732	S	S	.	*			trans	8.3	139.1	146	-55.2	-75.8	0	0	0	119.2
258	K	30.1	Very low	28.5	Very low	193 Å²	193	133.4 Å²	133.4	84%	0.839	73%	0.725	S	S	*	*				-149.6	124.5	52.2	-72.2	140.1	-169.6	166.6	0	114.5
259	D	25.6	Very low	29.2	Very low	136 Å²	136	132.5 Å²	132.5	73%	0.727	71%	0.713	S	S	*	*			trans	33.3	137.5	136.3	-55.4	-74.1	0	0	0	122.8
260	A	29	Very low	29.7	Very low	92 Å²	92	136.6 Å²	136.6	76%	0.76	72%	0.715	S	S	*	*			trans	-96.4	-138.1	161.7	0	0	0	0	0	110.6
261	V	26.5	Very low	30.2	Very low	122 Å²	122	140.2 Å²	140.2	74%	0.739	72%	0.721	S	S	*	*			trans	81.9	103.5	167.5	-171.4	0	0	0	0	116.7	K263	V261-K263 HydrophobicContact CG1-CB 4.22Å
262	M	38.3	Very low	30.5	Very low	196 Å²	196	139 Å²	139	97%	0.966	72%	0.722	S	S	*	*			trans	-65.6	132.3	149.2	-76.4	-81.2	-165.7	0	0	109.6
263	K	28.2	Very low	30.8	Very low	183 Å²	183	136.6 Å²	136.6	80%	0.796	72%	0.723	S	S	*	*			trans	-151.2	148.1	167.6	-168.8	-179.1	178.4	-173.3	0	110.2	V261	V261-K263 HydrophobicContact CG1-CB 4.22Å
264	A	25.4	Very low	31.1	Very low	76 Å²	76	132.8 Å²	132.8	63%	0.628	72%	0.718	S	S	*	*			trans	69.3	144.7	166.7	0	0	0	0	0	115.7
265	E	28.5	Very low	31.7	Very low	158 Å²	158	135.8 Å²	135.8	74%	0.738	73%	0.729	S	S	*	*			cis	-159.9	165.5	-10.5	-120.6	148.1	-151.2	0	0	109.7
266	T	32.1	Very low	31.2	Very low	112 Å²	112	140.6 Å²	140.6	69%	0.687	74%	0.74	S	S	*	*			trans	50.8	149.3	154.6	57.1	0	0	0	0	120.1
267	E	30	Very low	31.6	Very low	166 Å²	166	139.3 Å²	139.3	78%	0.776	75%	0.747	S	S	*	*			cis	-156.9	171.3	-8.9	-120.4	159	166.7	0	0	108.5
268	D	34	Very low	32.6	Very low	120 Å²	120	140.4 Å²	140.4	64%	0.642	76%	0.76	S	S	*	*			trans	26	146.3	149.4	-91.1	20.8	0	0	0	121.8
269	K	35.2	Very low	32.5	Very low	141 Å²	141	137 Å²	137	61%	0.613	76%	0.76	S	S	*	*			cis	-176	169.4	-16	-132.5	-175.1	-142	129.6	0	107.8
270	E	36.6	Very low	32.8	Very low	151 Å²	151	134 Å²	134	71%	0.706	75%	0.754	S	S	*	*			trans	65	119.4	154	-75.6	175.2	-152.1	0	0	115.6
271	K	36.1	Very low	32.8	Very low	190 Å²	190	136.5 Å²	136.5	83%	0.826	76%	0.76	S	S	*	*				57.5	137.7	88.3	-72.8	-172.4	177.8	179.6	0	113.4
272	D	33.2	Very low	32.8	Very low	141 Å²	141	134 Å²	134	75%	0.754	76%	0.76	S	S	*	*			cis	-170.2	168.9	-8.8	178.5	25	0	0	0	107
273	S	33.8	Very low	32.3	Very low	108 Å²	108	129.5 Å²	129.5	76%	0.755	75%	0.753	S	S	*	*			trans	86.1	135	159.2	84.8	0	0	0	0	119.1
274	G	34.8	Very low	32.4	Very low	65 Å²	65	127 Å²	127	67%	0.67	76%	0.759	S	S	*	*				113.6	72.8	104.3	0	0	0	0	0	119.8
275	K	36.3	Very low	32.7	Very low	198 Å²	198	126.5 Å²	126.5	86%	0.861	76%	0.761	S	S	*	*			trans	61.2	118.6	136.3	-61.8	170.2	179.6	169.8	0	120.7
276	K	30.8	Very low	32.9	Very low	200 Å²	200	126.3 Å²	126.3	87%	0.87	76%	0.76	S	S	*	*				64.5	70.1	126.3	-58.9	-171.4	174.1	-169.8	0	121.5
277	G	32.7	Very low	32.9	Very low	78 Å²	78	124.3 Å²	124.3	80%	0.804	76%	0.755	S	S	*	*			trans	57	-159.5	146.3	0	0	0	0	0	118
278	P	48.3	Very low	33.1	Very low	123 Å²	123	123.2 Å²	123.2	80%	0.799	75%	0.748	S	S	*	*			cis	-129.6	168.3	-11.4	41.5	-27.2	0	0	0	115.4
279	S	28.1	Very low	33.1	Very low	120 Å²	120	122.1 Å²	122.1	84%	0.839	75%	0.749	S	S	*	*			trans	73.2	166.6	152.2	-150.8	0	0	0	0	121.1
280	A	31.4	Very low	32.9	Very low	74 Å²	74	119.8 Å²	119.8	61%	0.612	75%	0.751	S	S	*	*			trans	71.3	112.2	155.7	0	0	0	0	0	122.8
281	T	28.9	Very low	32.7	Very low	144 Å²	144	118 Å²	118	88%	0.883	76%	0.755	S	S	*	*			trans	69.7	150.9	137	58.9	0	0	0	0	121.5
282	G	26.1	Very low	32.6	Very low	71 Å²	71	118.4 Å²	118.4	73%	0.732	75%	0.751	S	S	*	*			trans	85.9	105.8	-177.3	0	0	0	0	0	111.7
283	A	28	Very low	32.5	Very low	100 Å²	100	119.1 Å²	119.1	83%	0.826	76%	0.755	S	S	*	*			cis	74.4	127.3	46.3	0	0	0	0	0	113.4
284	S	30.8	Very low	32.6	Very low	132 Å²	132	124.4 Å²	124.4	92%	0.923	76%	0.759	S	S	*	*			trans	68.5	143.4	-162.4	-151.7	0	0	0	0	113.4
285	G	30.4	Very low	32.5	Very low	65 Å²	65	129.3 Å²	129.3	67%	0.67	77%	0.769	S	S	*	*			cis	-159.5	-173	1.5	0	0	0	0	0	113.3
286	Q	33	Very low	32.3	Very low	154 Å²	154	123.5 Å²	123.5	72%	0.72	77%	0.766	S	S	*	*			trans	-60.4	158.9	175.5	-58	176.9	-22	0	0	110.6
287	A	31.3	Very low	32.4	Very low	70 Å²	70	123.9 Å²	123.9	58%	0.579	77%	0.768	S	S	*	*			cis	-169.8	141.1	41.8	0	0	0	0	0	116.5
288	K	36.2	Very low	32.2	Very low	143 Å²	143	124.9 Å²	124.9	62%	0.622	77%	0.768	S	S	*	*			trans	66	153.5	135.2	-60.3	159.8	-155.4	162.3	0	116.6
289	S	32.1	Very low	31.8	Very low	96 Å²	96	123.4 Å²	123.4	67%	0.671	77%	0.767	S	S	*	*			cis	-138.9	143.1	20.9	63	0	0	0	0	112.1
290	S	32	Very low	32.2	Very low	93 Å²	93	126.2 Å²	126.2	65%	0.65	76%	0.764	S	S	*	*				63	142.4	109.2	77.4	0	0	0	0	116.8
291	S	31.4	Very low	32.4	Very low	113 Å²	113	129 Å²	129	79%	0.79	77%	0.768	S	S	*	*			cis	-144.4	172	14.4	-158.2	0	0	0	0	113.4
292	R	34.2	Very low	32.6	Very low	199 Å²	199	130 Å²	130	75%	0.751	76%	0.763	S	S	*	*			trans	-93	150.4	152	-65.5	173.5	175	156.6	-1.4	108
293	D	31.8	Very low	33.3	Very low	156 Å²	156	136.3 Å²	136.3	83%	0.834	77%	0.77	S	S	*	*				-144	147.7	104.7	-80.6	-47.3	0	0	0	107.8
294	R	36.3	Very low	33.9	Very low	219 Å²	219	134 Å²	134	83%	0.826	76%	0.756	S	S	*	*			cis	79.4	41.8	32.1	-78.8	-82.7	-179.4	127.2	-3.3	115.7
295	D	33	Very low	34.4	Very low	167 Å²	167	134.7 Å²	134.7	89%	0.893	75%	0.748	S	S	*	*			trans	-51.8	154.2	147.1	-95.6	-58.1	0	0	0	113.2
296	G	31.9	Very low	35	Very low	77 Å²	77	135.5 Å²	135.5	79%	0.794	74%	0.743	S	S	*	*			trans	-77.8	172.6	-169.8	0	0	0	0	0	116.1
297	K	32.7	Very low	35.9	Very low	207 Å²	207	129.7 Å²	129.7	90%	0.9	72%	0.72	S	S	*	*			trans	-117.6	88.6	-178.1	-175.2	-169.3	172.6	-175.8	0	112.5
298	A	28.8	Very low	37.3	Very low	99 Å²	99	129.2 Å²	129.2	82%	0.818	71%	0.712	S	S	*	*			trans	-164.6	95.8	157.1	0	0	0	0	0	107.5
299	A	38.5	Very low	39.3	Very low	93 Å²	93	124.6 Å²	124.6	77%	0.769	70%	0.698	S	S	*	*			cis	73.4	77.8	45.2	0	0	0	0	0	114.4
300	K	36.8	Very low	42	Very low	179 Å²	179	123.6 Å²	123.6	78%	0.778	68%	0.679	S	S	*	*			trans	-157.1	147.8	143	-121.2	-174.4	164.3	-144.5	0	113.7
301	D	35.8	Very low	44.9	Very low	132 Å²	132	119.6 Å²	119.6	71%	0.706	65%	0.651	S	S	*	*	S	Bend	trans	56.3	54.7	152.5	-52.5	-30.7	0	0	0	119.3
302	E	33.9	Very low	47.8	Very low	166 Å²	166	114.2 Å²	114.2	78%	0.776	61%	0.613	S	S	*	*			trans	-134.9	86.1	154.8	-123.2	-54.6	142.5	0	0	109.5
303	K	40.8	Very low	50.7	Low	203 Å²	203	109 Å²	109	88%	0.883	59%	0.593	S	S	*	*			trans	-147.4	32	-173.7	-151.7	-173.6	177.4	-175.3	0	114.5
304	G	40.7	Very low	53.6	Low	51 Å²	51	101.5 Å²	101.5	53%	0.526	55%	0.553	S	S	.	*	S	Bend	trans	-86.1	-63.9	177.3	0	0	0	0	0	113.7
305	I	40.5	Very low	56.3	Low	147 Å²	147	92.5 Å²	92.5	75%	0.754	52%	0.524	S	S	*	.	S	Bend	trans	-109.2	-23.2	-148.1	-67.8	163.5	0	0	0	114.1	S307	I305-S307 VanDerWaalsContact C-N 3.33Å; I305-S307 PolarHBondContact O-N 3.35Å
306	S	43.3	Very low	59	Low	81 Å²	81	85.1 Å²	85.1	57%	0.566	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	44.8	-170.9	-157.8	0	0	0	0	115.5	R310	S306-R310 PolarHBondContact O-NE 2.68Å; S306-R310 VanDerWaalsContact O-NE 3.15Å; S306-R310 PolarHBondContact O-NH2 2.98Å
307	S	52.8	Low	61.8	Low	33 Å²	33	81.5 Å²	81.5	23%	0.231	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-37.6	172	62.5	0	0	0	0	114.2	I305 S309 R310	I305-S307 VanDerWaalsContact C-N 3.33Å; I305-S307 PolarHBondContact O-N 3.35Å; S307-S309 VanDerWaalsContact C-N 3.34Å; S307-S309 PolarHBondContact O-N 3.37Å; S307-R310 PolarHBondContact O-N 2.79Å
308	S	60.3	Low	64.5	Low	59 Å²	59	72.2 Å²	72.2	41%	0.413	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-62.4	-39.8	178.3	51.3	0	0	0	0	112.6	R310 N311	S308-R310 PolarHBondContact O-N 3.33Å; S308-N311 PolarHBondContact O-N 3.34Å
309	S	77.1	Confident	67.2	Low	46 Å²	46	70.4 Å²	70.4	32%	0.322	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-58.6	-20.1	179.2	58.6	0	0	0	0	114.9	S307 G361	S307-S309 VanDerWaalsContact C-N 3.34Å; S307-S309 PolarHBondContact O-N 3.37Å; S309-G361 WeakPolarHBondContact O-CA 3.42Å
310	R	89.5	Confident	69.5	Low	76 Å²	76	71.6 Å²	71.6	29%	0.287	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-107.5	-6	-175.7	-69.3	-173.3	-71.6	143.8	-1.4	114.5	S306 S307 S308 M358 S359	S306-R310 PolarHBondContact O-NE 2.68Å; S306-R310 VanDerWaalsContact O-NE 3.15Å; S306-R310 PolarHBondContact O-NH2 2.98Å; S307-R310 PolarHBondContact O-N 2.79Å; S308-R310 PolarHBondContact O-N 3.33Å; R310-M358 PolarHBondContact O-N 3.36Å; R310-S359 WeakPolarHBondContact CD-O 3.28Å
311	N	92.1	Very high	72	Confident	9 Å²	9	63.3 Å²	63.3	5%	0.048	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	139.6	179.1	-72.3	-15.2	0	0	0	110.7	S308 V356 T357 A386	S308-N311 PolarHBondContact O-N 3.34Å; N311-V356 CarbonylContact C-O 3.56Å; N311-T357 WeakPolarHBondContact OD1-CB 3.12Å; N311-T357 VanDerWaalsContact OD1-CG2 3.31Å; N311-T357 WeakPolarHBondContact OD1-CG2 3.33Å; N311-T357 PolarHBondContact OD1-OG1 2.87Å; N311-A386 HydrophobicContact CB-CB 3.62Å; N311-A386 PolarHBondContact O-N 2.81Å
312	V	93.8	Very high	74.7	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.8	-179.1	-158.8	0	0	0	0	108.5	F330 L355 V356 M358 V364 V383 E384	V312-F330 HydrophobicContact CG1-CE1 4.05Å; V312-L355 WeakPolarHBondContact O-CA 3.08Å; V312-V356 HydrophobicContact CB-CB 4.39Å; V312-V356 PolarHBondContact N-O 3.2Å; V312-V356 PolarHBondContact O-N 2.84Å; V312-M358 HydrophobicContact CG2-CG 3.96Å; V312-V364 HydrophobicContact CG2-CB 4.19Å; V312-V364 HydrophobicContact CG2-CG1 3.82Å; V312-V364 HydrophobicContact CG2-CG2 3.66Å; V312-V383 HydrophobicContact CG1-CG1 3.43Å; V312-V383 VanDerWaalsContact CG1-CG1 3.43Å; V312-E384 CarbonylContact C-O 3.42Å; V312-E384 WeakPolarHBondContact CA-O 3.3Å; V312-E384 VanDerWaalsContact CG1-O 3.26Å; V312-E384 WeakPolarHBondContact CG1-O 3.33Å
313	W	93.8	Very high	77.4	Confident	88 Å²	88	57.8 Å²	57.8	33%	0.333	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	132.4	170.5	-177.7	-99.6	0	0	0	108.6	Y353 L355 E384 A386	W313-Y353 AromaticContact CE2-CD1 3.89Å; W313-Y353 HydrophobicContact CH2-CD1 4.41Å; W313-Y353 HydrophobicContact CH2-CG 4.24Å; W313-Y353 AromaticContact CZ2-CD1 3.44Å; W313-Y353 HydrophobicContact CZ2-CD1 3.44Å; W313-Y353 VanDerWaalsContact CZ2-CD1 3.44Å; W313-Y353 HydrophobicContact CZ2-CE1 4.21Å; W313-Y353 AromaticContact CZ2-CG 3.7Å; W313-Y353 HydrophobicContact CZ2-CG 3.7Å; W313-Y353 AromaticContact NE1-CD1 3.94Å; W313-L355 HydrophobicContact CE3-CD1 4.36Å; W313-E384 PolarHBondContact N-O 3.21Å; W313-E384 PolarHBondContact O-N 3.01Å; W313-A386 HydrophobicContact CB-CB 4.28Å
314	V	93.4	Very high	79.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.5	178.2	-164.8	0	0	0	0	108	L317 F330 Y353 G354 V356 I381 Y382 V383	V314-L317 HydrophobicContact CB-CD2 4.47Å; V314-L317 HydrophobicContact CG1-CD2 3.6Å; V314-L317 HydrophobicContact CG1-CG 4.23Å; V314-F330 HydrophobicContact CG1-CZ 4.46Å; V314-F330 HydrophobicContact CG2-CE1 4.34Å; V314-F330 HydrophobicContact CG2-CE2 3.92Å; V314-F330 HydrophobicContact CG2-CZ 3.51Å; V314-Y353 CarbonylContact O-C 3.56Å; V314-Y353 WeakPolarHBondContact O-CA 3.42Å; V314-G354 PolarHBondContact N-O 3.33Å; V314-G354 PolarHBondContact O-N 2.85Å; V314-V356 HydrophobicContact CG2-CG2 4.07Å; V314-I381 HydrophobicContact CG1-CB 4.21Å; V314-I381 HydrophobicContact CG1-CD1 4.21Å; V314-Y382 CarbonylContact C-O 3.57Å; V314-Y382 WeakPolarHBondContact CA-O 3.34Å; V314-V383 HydrophobicContact CG1-CG2 4.31Å
315	S	92.6	Very high	82.3	Confident	30 Å²	30	50.2 Å²	50.2	21%	0.21	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	169.1	178	69.7	0	0	0	0	110.6	L317 I381 Y382	S315-L317 VanDerWaalsContact C-N 3.29Å; S315-I381 CarbonylContact O-C 3.43Å; S315-I381 VanDerWaalsContact O-CA 3.3Å; S315-I381 WeakPolarHBondContact O-CA 3.44Å; S315-Y382 PolarHBondContact N-O 3.15Å; S315-Y382 PolarHBondContact O-N 3.23Å
316	G	89.4	Confident	84.8	Confident	11 Å²	11	43.2 Å²	43.2	11%	0.113	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.7	18.9	-172.5	0	0	0	0	0	113.5	S318 Q379	G316-S318 PolarHBondContact O-N 3.38Å; G316-Q379 WeakPolarHBondContact O-CG 3.25Å; G316-Q379 PolarHBondContact O-NE2 2.74Å
317	L	91.4	Very high	87.2	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	130.9	177.1	-57.1	-174.7	0	0	0	110.8	V314 S315 T321 L326 V341 C352 I381	V314-L317 HydrophobicContact CB-CD2 4.47Å; V314-L317 HydrophobicContact CG1-CD2 3.6Å; V314-L317 HydrophobicContact CG1-CG 4.23Å; S315-L317 VanDerWaalsContact C-N 3.29Å; L317-T321 HydrophobicContact CB-CG2 4.4Å; L317-T321 HydrophobicContact CD1-CG2 4.17Å; L317-T321 HydrophobicContact CD2-CG2 4.26Å; L317-L326 HydrophobicContact CD1-CD1 3.9Å; L317-L326 HydrophobicContact CD1-CD2 4.05Å; L317-L326 HydrophobicContact CD1-CG 4.43Å; L317-L326 HydrophobicContact CD2-CD2 3.92Å; L317-V341 HydrophobicContact CD1-CG2 4.4Å; L317-C352 HydrophobicContact CB-CB 3.96Å; L317-C352 WeakPolarHBondContact CB-O 3.47Å; L317-C352 PolarHBondContact N-O 3.38Å; L317-C352 WeakPolarHBondContact O-CB 3.26Å; L317-C352 PolarHBondContact O-N 3.36Å; L317-C352 VanDerWaalsContact O-N 3.16Å; L317-I381 HydrophobicContact CD2-CB 4.16Å; L317-I381 HydrophobicContact CD2-CG2 3.62Å
318	S	88.8	Confident	89.2	Confident	13 Å²	13	49 Å²	49	9%	0.091	27%	0.269	C	S	.	.			trans	-56.7	145.2	166.2	174.1	0	0	0	0	110.6	G316 N320 T321 H377	G316-S318 PolarHBondContact O-N 3.38Å; S318-N320 PolarHBondContact O-N 3.23Å; S318-N320 VanDerWaalsContact O-N 3.13Å; S318-T321 PolarHBondContact N-OG1 3.19Å; S318-T321 WeakPolarHBondContact O-CB 3.22Å; S318-T321 PolarHBondContact O-N 3.11Å; S318-T321 PolarHBondContact O-OG1 3.22Å; S318-H377 PolarHBondContact OG-O 2.9Å
319	S	86.5	Confident	90.7	Very high	60 Å²	60	47.6 Å²	47.6	42%	0.42	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.6	179.3	51.5	0	0	0	0	113.4	T321 P348	S319-T321 VanDerWaalsContact C-N 3.3Å; S319-T321 PolarHBondContact O-N 2.82Å; S319-P348 WeakPolarHBondContact CB-O 3.26Å
320	N	86.8	Confident	91.4	Very high	119 Å²	119	45.4 Å²	45.4	64%	0.636	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-11.2	175.5	-69.3	-28.8	0	0	0	113.9	S318 K322	S318-N320 PolarHBondContact O-N 3.23Å; S318-N320 VanDerWaalsContact O-N 3.13Å; N320-K322 PolarHBondContact O-N 3.1Å
321	T	89.2	Confident	91.5	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.031	25%	0.248	C	C	.	.			trans	-69	121.6	-174.6	-49.8	0	0	0	0	112.3	L317 S318 S319 D325 L326 L376	L317-T321 HydrophobicContact CB-CG2 4.4Å; L317-T321 HydrophobicContact CD1-CG2 4.17Å; L317-T321 HydrophobicContact CD2-CG2 4.26Å; S318-T321 PolarHBondContact N-OG1 3.19Å; S318-T321 WeakPolarHBondContact O-CB 3.22Å; S318-T321 PolarHBondContact O-N 3.11Å; S318-T321 PolarHBondContact O-OG1 3.22Å; S319-T321 VanDerWaalsContact C-N 3.3Å; S319-T321 PolarHBondContact O-N 2.82Å; T321-D325 HydrophobicContact CG2-CB 4.46Å; T321-L326 HydrophobicContact CG2-CD2 4.01Å; T321-L326 HydrophobicContact CG2-CG 4.21Å; T321-L376 HydrophobicContact CG2-CD2 3.59Å; T321-L376 WeakPolarHBondContact OG1-CD2 3.46Å
322	K	91.1	Very high	91.5	Very high	144 Å²	144	51 Å²	51	63%	0.626	28%	0.279	S	S	*	.			trans	-100.5	157.6	177.4	-68.3	166.7	-173.2	169.6	0	111.2	N320 A324 D325 L326	N320-K322 PolarHBondContact O-N 3.1Å; K322-A324 PolarHBondContact O-N 3.35Å; K322-D325 PolarHBondContact N-OD2 3.02Å; K322-D325 WeakPolarHBondContact O-CB 3.19Å; K322-D325 PolarHBondContact O-N 2.8Å; K322-L326 PolarHBondContact O-N 2.93Å
323	A	91.9	Very high	91.3	Very high	37 Å²	37	54.2 Å²	54.2	31%	0.306	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-24.1	176	0	0	0	0	0	113.1	K327 V341	A323-K327 WeakPolarHBondContact O-CB 3.43Å; A323-K327 PolarHBondContact O-N 2.97Å; A323-K327 VanDerWaalsContact O-N 3.08Å; A323-V341 HydrophobicContact CB-CG2 4.27Å
324	A	92.6	Very high	91.2	Very high	55 Å²	55	50.8 Å²	50.8	46%	0.455	28%	0.283	S	S	.	.	H	α-helix	trans	-65.1	-42.2	170.6	0	0	0	0	0	112	K322 K327 N328	K322-A324 PolarHBondContact O-N 3.35Å; A324-K327 WeakPolarHBondContact O-CB 3.5Å; A324-K327 PolarHBondContact O-N 3.5Å; A324-K327 VanDerWaalsContact O-N 3.15Å; A324-N328 WeakPolarHBondContact O-CB 3.35Å; A324-N328 PolarHBondContact O-N 2.8Å; A324-N328 PolarHBondContact O-ND2 3.45Å; A324-N328 PolarHBondContact O-OD1 3.04Å
325	D	92.6	Very high	91.1	Very high	41 Å²	41	58 Å²	58	22%	0.219	32%	0.315	C	S	.	.	H	α-helix	trans	-65.1	-45	-178.2	-44.8	-18.5	0	0	0	110.3	T321 K322 K327 N328 L329 H377	T321-D325 HydrophobicContact CG2-CB 4.46Å; K322-D325 PolarHBondContact N-OD2 3.02Å; K322-D325 WeakPolarHBondContact O-CB 3.19Å; K322-D325 PolarHBondContact O-N 2.8Å; D325-K327 VanDerWaalsContact C-N 3.34Å; D325-K327 PolarHBondContact O-N 3.27Å; D325-N328 PolarHBondContact O-N 3.36Å; D325-L329 WeakPolarHBondContact O-CB 3.46Å; D325-L329 PolarHBondContact O-N 2.85Å; D325-H377 IonicContact OD2-CD2 3.74Å; D325-H377 IonicContact OD2-CE1 3.82Å; D325-H377 IonicContact OD2-NE2 2.82Å; D325-H377 PolarHBondContact OD2-NE2 2.86Å
326	L	92.9	Very high	91.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.3	-44.4	171.4	-62.1	-173.9	0	0	0	111.7	L317 T321 K322 N328 L329 F330 A339 V341 V356	L317-L326 HydrophobicContact CD1-CD1 3.9Å; L317-L326 HydrophobicContact CD1-CD2 4.05Å; L317-L326 HydrophobicContact CD1-CG 4.43Å; L317-L326 HydrophobicContact CD2-CD2 3.92Å; T321-L326 HydrophobicContact CG2-CD2 4.01Å; T321-L326 HydrophobicContact CG2-CG 4.21Å; K322-L326 PolarHBondContact O-N 2.93Å; L326-N328 VanDerWaalsContact C-N 3.28Å; L326-N328 PolarHBondContact O-N 2.91Å; L326-L329 PolarHBondContact O-N 3.13Å; L326-F330 HydrophobicContact CD2-CE2 4.39Å; L326-F330 WeakPolarHBondContact O-CB 3.29Å; L326-F330 VanDerWaalsContact O-CD2 3.31Å; L326-F330 WeakPolarHBondContact O-CD2 3.3Å; L326-F330 PolarHBondContact O-N 3.33Å; L326-A339 HydrophobicContact CB-CB 4.34Å; L326-V341 HydrophobicContact CD1-CG2 3.67Å; L326-V341 HydrophobicContact CG-CG2 4.29Å; L326-V356 HydrophobicContact CB-CG2 4.22Å; L326-V356 HydrophobicContact CD1-CG2 4.09Å
327	K	93.4	Very high	91.3	Very high	121 Å²	121	61.3 Å²	61.3	53%	0.526	33%	0.328	S	S	.	.	H	α-helix	trans	-61.6	-37.4	178.1	-171.4	-178.7	179.1	-174.8	0	111.9	A323 A324 D325 G331 V336 A339	A323-K327 WeakPolarHBondContact O-CB 3.43Å; A323-K327 PolarHBondContact O-N 2.97Å; A323-K327 VanDerWaalsContact O-N 3.08Å; A324-K327 WeakPolarHBondContact O-CB 3.5Å; A324-K327 PolarHBondContact O-N 3.5Å; A324-K327 VanDerWaalsContact O-N 3.15Å; D325-K327 VanDerWaalsContact C-N 3.34Å; D325-K327 PolarHBondContact O-N 3.27Å; K327-G331 WeakPolarHBondContact O-CA 3.46Å; K327-G331 PolarHBondContact O-N 3.1Å; K327-V336 HydrophobicContact CB-CG1 4.47Å; K327-V336 HydrophobicContact CG-CB 4.09Å; K327-V336 HydrophobicContact CG-CG1 4.02Å; K327-A339 HydrophobicContact CB-CB 4.3Å
328	N	93.6	Very high	91.3	Very high	114 Å²	114	64.4 Å²	64.4	61%	0.61	35%	0.349	S	S	*	.	H	α-helix	trans	-74.1	-39.3	178.4	-66.9	-14.5	0	0	0	112.1	A324 D325 L326	A324-N328 WeakPolarHBondContact O-CB 3.35Å; A324-N328 PolarHBondContact O-N 2.8Å; A324-N328 PolarHBondContact O-ND2 3.45Å; A324-N328 PolarHBondContact O-OD1 3.04Å; D325-N328 PolarHBondContact O-N 3.36Å; L326-N328 VanDerWaalsContact C-N 3.28Å; L326-N328 PolarHBondContact O-N 2.91Å
329	L	91.9	Very high	91.5	Very high	29 Å²	29	64.9 Å²	64.9	15%	0.152	35%	0.354	C	S	.	.	H	α-helix	trans	-67.9	-56.6	178.1	-173.5	76.7	0	0	0	111.5	D325 L326 G331 K332 L371 L376 I381	D325-L329 WeakPolarHBondContact O-CB 3.46Å; D325-L329 PolarHBondContact O-N 2.85Å; L326-L329 PolarHBondContact O-N 3.13Å; L329-G331 PolarHBondContact O-N 3.1Å; L329-K332 WeakPolarHBondContact O-CB 3.48Å; L329-K332 PolarHBondContact O-N 3.49Å; L329-L371 HydrophobicContact CD1-CD2 3.82Å; L329-L371 HydrophobicContact CD2-CD1 3.97Å; L329-L371 HydrophobicContact CD2-CD2 3.87Å; L329-L371 HydrophobicContact CD2-CG 4.42Å; L329-L371 HydrophobicContact CG-CD1 3.87Å; L329-L371 HydrophobicContact CG-CD2 3.69Å; L329-L371 HydrophobicContact CG-CG 4.42Å; L329-L376 HydrophobicContact CB-CD1 4.5Å; L329-L376 HydrophobicContact CD2-CD1 3.82Å; L329-I381 HydrophobicContact CD2-CD1 3.58Å
330	F	93.1	Very high	91.8	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-68.3	-25.4	179.8	-74.8	-102.5	0	0	0	111.8	V312 V314 L326 K332 Y333 G334 V336 V356 M358 C367 L371 V383	V312-F330 HydrophobicContact CG1-CE1 4.05Å; V314-F330 HydrophobicContact CG1-CZ 4.46Å; V314-F330 HydrophobicContact CG2-CE1 4.34Å; V314-F330 HydrophobicContact CG2-CE2 3.92Å; V314-F330 HydrophobicContact CG2-CZ 3.51Å; L326-F330 HydrophobicContact CD2-CE2 4.39Å; L326-F330 WeakPolarHBondContact O-CB 3.29Å; L326-F330 VanDerWaalsContact O-CD2 3.31Å; L326-F330 WeakPolarHBondContact O-CD2 3.3Å; L326-F330 PolarHBondContact O-N 3.33Å; F330-K332 PolarHBondContact O-N 2.84Å; F330-K332 VanDerWaalsContact O-N 3.15Å; F330-Y333 PolarHBondContact O-N 2.86Å; F330-G334 PolarHBondContact O-N 3.33Å; F330-V336 HydrophobicContact CB-CG2 3.6Å; F330-V356 HydrophobicContact CB-CG1 4.19Å; F330-V356 HydrophobicContact CD1-CG1 4.25Å; F330-V356 HydrophobicContact CD2-CG2 4.37Å; F330-V356 HydrophobicContact CE2-CG2 4.47Å; F330-V356 HydrophobicContact CG-CG1 4.12Å; F330-M358 HydrophobicContact CB-CE 4.4Å; F330-M358 HydrophobicContact CB-SD 4.12Å; F330-M358 HydrophobicContact CD1-SD 4.27Å; F330-C367 HydrophobicContact CD1-CB 3.79Å; F330-C367 HydrophobicContact CE1-CB 3.82Å; F330-L371 HydrophobicContact CD1-CD1 3.89Å; F330-L371 HydrophobicContact CD2-CD1 3.94Å; F330-L371 HydrophobicContact CE1-CD1 3.91Å; F330-L371 HydrophobicContact CE2-CD1 3.97Å; F330-L371 HydrophobicContact CG-CD1 3.9Å; F330-L371 HydrophobicContact CZ-CD1 3.94Å; F330-V383 HydrophobicContact CE1-CG1 3.76Å; F330-V383 HydrophobicContact CZ-CG1 3.83Å; F330-V383 HydrophobicContact CZ-CG2 4Å
331	G	91.9	Very high	92.1	Very high	42 Å²	42	62.2 Å²	62.2	43%	0.433	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.1	172.8	0	0	0	0	0	114.9	K327 L329 Y333 G334	K327-G331 WeakPolarHBondContact O-CA 3.46Å; K327-G331 PolarHBondContact O-N 3.1Å; L329-G331 PolarHBondContact O-N 3.1Å; G331-Y333 VanDerWaalsContact C-N 3.33Å; G331-G334 CarbonylContact C-O 3.55Å; G331-G334 WeakPolarHBondContact CA-O 3.35Å
332	K	91.3	Very high	92	Very high	160 Å²	160	65.3 Å²	65.3	70%	0.696	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-25.5	174.2	-62.1	177.6	-179	-179.4	0	113.3	L329 F330	L329-K332 WeakPolarHBondContact O-CB 3.48Å; L329-K332 PolarHBondContact O-N 3.49Å; F330-K332 PolarHBondContact O-N 2.84Å; F330-K332 VanDerWaalsContact O-N 3.15Å
333	Y	89.9	Confident	91.7	Very high	69 Å²	69	62.2 Å²	62.2	27%	0.271	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	-9.2	-170.4	-58.5	-86.7	0	0	0	113.5	F330 G331 R366 H370 L371	F330-Y333 PolarHBondContact O-N 2.86Å; G331-Y333 VanDerWaalsContact C-N 3.33Å; Y333-R366 PolarHBondContact O-NH2 2.99Å; Y333-H370 HydrophobicContact CD1-CB 3.94Å; Y333-H370 AromaticContact CD1-CD2 3.79Å; Y333-H370 HydrophobicContact CE1-CB 3.33Å; Y333-H370 AromaticContact CE1-CD2 3.68Å; Y333-H370 AromaticContact CE1-CG 3.71Å; Y333-L371 HydrophobicContact CD2-CD1 3.79Å; Y333-L371 HydrophobicContact CD2-CD2 4.26Å; Y333-L371 HydrophobicContact CD2-CG 3.98Å; Y333-L371 HydrophobicContact CE2-CD1 3.98Å; Y333-L371 HydrophobicContact CE2-CD2 3.57Å; Y333-L371 HydrophobicContact CE2-CG 3.75Å
334	G	90.6	Very high	91.2	Very high	15 Å²	15	64 Å²	64	16%	0.155	35%	0.349	C	S	.	.	S	Bend	trans	179.7	176.9	176.9	0	0	0	0	0	112.7	F330 G331 V336 M358 E363	F330-G334 PolarHBondContact O-N 3.33Å; G331-G334 CarbonylContact C-O 3.55Å; G331-G334 WeakPolarHBondContact CA-O 3.35Å; G334-V336 PolarHBondContact O-N 2.72Å; G334-M358 VanDerWaalsContact C-CE 3.41Å; G334-M358 VanDerWaalsContact CA-CE 3.46Å; G334-E363 WeakPolarHBondContact CA-OE2 3.38Å
335	K	92.6	Very high	90.1	Very high	152 Å²	152	66.4 Å²	66.4	66%	0.661	37%	0.368	S	S	*	.			trans	-90.4	101.7	179.6	172.5	-178.2	177.3	177.6	0	109.5	L337 S359 E363	K335-L337 PolarHBondContact O-N 2.97Å; K335-S359 WeakPolarHBondContact CB-OG 3.32Å; K335-S359 PolarHBondContact O-N 3.27Å; K335-S359 PolarHBondContact O-OG 3.41Å; K335-E363 PolarHBondContact N-OE2 3.27Å
336	V	94.3	Very high	88.9	Confident	17 Å²	17	75.3 Å²	75.3	10%	0.103	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	115.8	173.6	-179.3	0	0	0	0	110.1	K327 F330 G334 S338 A339 V356 M358	K327-V336 HydrophobicContact CB-CG1 4.47Å; K327-V336 HydrophobicContact CG-CB 4.09Å; K327-V336 HydrophobicContact CG-CG1 4.02Å; F330-V336 HydrophobicContact CB-CG2 3.6Å; G334-V336 PolarHBondContact O-N 2.72Å; V336-S338 WeakPolarHBondContact CG1-O 3.31Å; V336-A339 HydrophobicContact CG1-CB 4.13Å; V336-V356 HydrophobicContact CG1-CG1 3.84Å; V336-V356 HydrophobicContact CG2-CG1 4.18Å; V336-M358 HydrophobicContact CG2-CE 3.98Å; V336-M358 HydrophobicContact CG2-SD 3.81Å
337	L	92.2	Very high	87.6	Confident	93 Å²	93	78.1 Å²	78.1	49%	0.487	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-37.4	173.1	-62.4	-176.5	0	0	0	111.7	K335 T357	K335-L337 PolarHBondContact O-N 2.97Å; L337-T357 HydrophobicContact CB-CG2 4.26Å; L337-T357 HydrophobicContact CD1-CG2 4.28Å; L337-T357 PolarHBondContact N-O 2.91Å
338	S	89.9	Confident	85.9	Confident	66 Å²	66	78 Å²	78	46%	0.462	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	146.3	178.4	-172	0	0	0	0	110.4	V336 V356 T357	V336-S338 WeakPolarHBondContact CG1-O 3.31Å; S338-V356 CarbonylContact O-C 3.59Å; S338-V356 WeakPolarHBondContact O-CA 3.45Å; S338-T357 PolarHBondContact N-O 2.76Å; S338-T357 PolarHBondContact O-N 3.42Å
339	A	93.9	Very high	84.4	Confident	23 Å²	23	76.1 Å²	76.1	19%	0.19	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	132.2	169.8	0	0	0	0	0	108.6	L326 K327 V336 V356	L326-A339 HydrophobicContact CB-CB 4.34Å; K327-A339 HydrophobicContact CB-CB 4.3Å; V336-A339 HydrophobicContact CG1-CB 4.13Å; A339-V356 HydrophobicContact CB-CG2 4.36Å
340	K	92.4	Very high	83.3	Confident	92 Å²	92	76.3 Å²	76.3	40%	0.4	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	125.4	179.8	-179.8	173.6	-179	172.7	0	109.2	G354 L355 F391	K340-G354 CarbonylContact O-C 3.57Å; K340-G354 WeakPolarHBondContact O-CA 3.25Å; K340-L355 PolarHBondContact N-O 2.92Å; K340-L355 PolarHBondContact O-N 2.77Å; K340-F391 HydrophobicContact CD-CE2 4.21Å; K340-F391 HydrophobicContact CD-CZ 4.38Å
341	V	92.4	Very high	82.5	Confident	32 Å²	32	83.3 Å²	83.3	19%	0.194	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	139	167.8	-178.7	0	0	0	0	108.5	L317 A323 L326 T343 C352 Y353	L317-V341 HydrophobicContact CD1-CG2 4.4Å; A323-V341 HydrophobicContact CB-CG2 4.27Å; L326-V341 HydrophobicContact CD1-CG2 3.67Å; L326-V341 HydrophobicContact CG-CG2 4.29Å; V341-T343 HydrophobicContact CG1-CG2 3.83Å; V341-C352 HydrophobicContact CG1-CB 4.4Å; V341-Y353 CarbonylContact C-O 3.58Å; V341-Y353 WeakPolarHBondContact CA-O 3.42Å
342	V	88.6	Confident	82.3	Confident	69 Å²	69	81.5 Å²	81.5	42%	0.418	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	108.1	171.1	-178.8	0	0	0	0	106.9	Y353	V342-Y353 PolarHBondContact N-O 2.82Å; V342-Y353 PolarHBondContact O-N 2.92Å; V342-Y353 VanDerWaalsContact O-N 3.09Å
343	T	84.7	Confident	82.3	Confident	80 Å²	80	78.3 Å²	78.3	49%	0.491	44%	0.436	S	S	.	.			trans	-97.6	151.3	172.7	65.7	0	0	0	0	109.3	V341 A345 C352	V341-T343 HydrophobicContact CG1-CG2 3.83Å; T343-A345 PolarHBondContact O-N 3.33Å; T343-C352 HydrophobicContact CG2-CB 4.34Å; T343-C352 VanDerWaalsContact CG2-SG 3.57Å
344	N	80.1	Confident	82.5	Confident	75 Å²	75	75 Å²	75	40%	0.401	42%	0.424	S	S	.	.			trans	-80.6	100.8	175.8	179.1	13.7	0	0	0	110.2	R346 S347 S350	N344-R346 PolarHBondContact O-N 2.6Å; N344-R346 WeakPolarHBondContact OD1-CB 3.43Å; N344-R346 PolarHBondContact OD1-N 2.96Å; N344-R346 VanDerWaalsContact OD1-N 3.12Å; N344-S347 CarbonylContact O-C 3.58Å; N344-S347 PolarHBondContact O-N 2.94Å; N344-S347 VanDerWaalsContact O-N 3.09Å; N344-S350 WeakPolarHBondContact CB-OG 3.47Å; N344-S350 PolarHBondContact ND2-OG 3.35Å
345	A	69.2	Low	82.6	Confident	104 Å²	104	75.2 Å²	75.2	86%	0.86	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.6	179.1	0	0	0	0	0	114.5	T343	T343-A345 PolarHBondContact O-N 3.33Å
346	R	68.8	Low	82.7	Confident	228 Å²	228	68 Å²	68	86%	0.86	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-17.7	179.3	-158.2	174	-173.5	-170.2	0.5	113.9	N344	N344-R346 PolarHBondContact O-N 2.6Å; N344-R346 WeakPolarHBondContact OD1-CB 3.43Å; N344-R346 PolarHBondContact OD1-N 2.96Å; N344-R346 VanDerWaalsContact OD1-N 3.12Å
347	S	65.4	Low	82.7	Confident	60 Å²	60	68.6 Å²	68.6	42%	0.42	39%	0.393	S	S	.	.			trans	-157.7	101.4	179.8	-52.1	0	0	0	0	110	N344 G349 S350	N344-S347 CarbonylContact O-C 3.58Å; N344-S347 PolarHBondContact O-N 2.94Å; N344-S347 VanDerWaalsContact O-N 3.09Å; S347-G349 PolarHBondContact O-N 2.84Å; S347-G349 VanDerWaalsContact O-N 3.1Å; S347-S350 WeakPolarHBondContact O-CB 3.31Å; S347-S350 PolarHBondContact O-N 3.21Å; S347-S350 PolarHBondContact O-OG 2.83Å
348	P	57.3	Low	82.9	Confident	119 Å²	119	64.1 Å²	64.1	77%	0.773	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-13.2	-166.7	24.8	-34.1	0	0	0	115.6	S319 S350	S319-P348 WeakPolarHBondContact CB-O 3.26Å; P348-S350 VanDerWaalsContact C-N 3.34Å
349	G	61.3	Low	82.9	Confident	73 Å²	73	63 Å²	63	75%	0.753	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	5.5	170.1	0	0	0	0	0	115.2	S347	S347-G349 PolarHBondContact O-N 2.84Å; S347-G349 VanDerWaalsContact O-N 3.1Å
350	S	68.8	Low	82.9	Confident	34 Å²	34	63.8 Å²	63.8	24%	0.238	37%	0.366	C	S	.	.	S	Bend	trans	-69.9	150.2	-179.6	-55.4	0	0	0	0	112.5	N344 S347 P348 C352	N344-S350 WeakPolarHBondContact CB-OG 3.47Å; N344-S350 PolarHBondContact ND2-OG 3.35Å; S347-S350 WeakPolarHBondContact O-CB 3.31Å; S347-S350 PolarHBondContact O-N 3.21Å; S347-S350 PolarHBondContact O-OG 2.83Å; P348-S350 VanDerWaalsContact C-N 3.34Å; S350-C352 PolarHBondContact O-N 3.13Å; S350-C352 PolarHBondContact O-SG 2.85Å
351	K	77.8	Confident	82.8	Confident	147 Å²	147	60.3 Å²	60.3	64%	0.639	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-49.6	123.7	168	-62.6	-177.9	-179.4	-176.9	0	110.3	Y353	K351-Y353 WeakPolarHBondContact O-CE2 3.19Å
352	C	87.3	Confident	82.7	Confident	3 Å²	3	63 Å²	63	2%	0.02	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	155.3	-178.9	-67.4	0	0	0	0	111.2	L317 V341 T343 S350	L317-C352 HydrophobicContact CB-CB 3.96Å; L317-C352 WeakPolarHBondContact CB-O 3.47Å; L317-C352 PolarHBondContact N-O 3.38Å; L317-C352 WeakPolarHBondContact O-CB 3.26Å; L317-C352 PolarHBondContact O-N 3.36Å; L317-C352 VanDerWaalsContact O-N 3.16Å; V341-C352 HydrophobicContact CG1-CB 4.4Å; T343-C352 HydrophobicContact CG2-CB 4.34Å; T343-C352 VanDerWaalsContact CG2-SG 3.57Å; S350-C352 PolarHBondContact O-N 3.13Å; S350-C352 PolarHBondContact O-SG 2.85Å
353	Y	91.8	Very high	82.9	Confident	93 Å²	93	60.7 Å²	60.7	37%	0.365	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	142.6	-176.1	-59.7	-83	0	0	0	111	W313 V314 V341 V342 K351	W313-Y353 AromaticContact CE2-CD1 3.89Å; W313-Y353 HydrophobicContact CH2-CD1 4.41Å; W313-Y353 HydrophobicContact CH2-CG 4.24Å; W313-Y353 AromaticContact CZ2-CD1 3.44Å; W313-Y353 HydrophobicContact CZ2-CD1 3.44Å; W313-Y353 VanDerWaalsContact CZ2-CD1 3.44Å; W313-Y353 HydrophobicContact CZ2-CE1 4.21Å; W313-Y353 AromaticContact CZ2-CG 3.7Å; W313-Y353 HydrophobicContact CZ2-CG 3.7Å; W313-Y353 AromaticContact NE1-CD1 3.94Å; V314-Y353 CarbonylContact O-C 3.56Å; V314-Y353 WeakPolarHBondContact O-CA 3.42Å; V341-Y353 CarbonylContact C-O 3.58Å; V341-Y353 WeakPolarHBondContact CA-O 3.42Å; V342-Y353 PolarHBondContact N-O 2.82Å; V342-Y353 PolarHBondContact O-N 2.92Å; V342-Y353 VanDerWaalsContact O-N 3.09Å; K351-Y353 WeakPolarHBondContact O-CE2 3.19Å
354	G	92.8	Very high	83.3	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.01	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.3	176.7	0	0	0	0	0	111.6	V314 K340	V314-G354 PolarHBondContact N-O 3.33Å; V314-G354 PolarHBondContact O-N 2.85Å; K340-G354 CarbonylContact O-C 3.57Å; K340-G354 WeakPolarHBondContact O-CA 3.25Å
355	L	93.9	Very high	83.9	Confident	18 Å²	18	56.1 Å²	56.1	9%	0.094	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120.5	162.9	-173.7	70.6	0	0	0	107.9	V312 W313 K340 A386 P390 F391	V312-L355 WeakPolarHBondContact O-CA 3.08Å; W313-L355 HydrophobicContact CE3-CD1 4.36Å; K340-L355 PolarHBondContact N-O 2.92Å; K340-L355 PolarHBondContact O-N 2.77Å; L355-A386 HydrophobicContact CD1-CB 3.99Å; L355-P390 HydrophobicContact CD2-CG 4.13Å; L355-F391 HydrophobicContact CD2-CD2 4.38Å; L355-F391 HydrophobicContact CD2-CE2 4.46Å
356	V	94.5	Very high	85	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	129.8	-178.4	-174.8	0	0	0	0	108.9	N311 V312 V314 L326 F330 V336 S338 A339 M358	N311-V356 CarbonylContact C-O 3.56Å; V312-V356 HydrophobicContact CB-CB 4.39Å; V312-V356 PolarHBondContact N-O 3.2Å; V312-V356 PolarHBondContact O-N 2.84Å; V314-V356 HydrophobicContact CG2-CG2 4.07Å; L326-V356 HydrophobicContact CB-CG2 4.22Å; L326-V356 HydrophobicContact CD1-CG2 4.09Å; F330-V356 HydrophobicContact CB-CG1 4.19Å; F330-V356 HydrophobicContact CD1-CG1 4.25Å; F330-V356 HydrophobicContact CD2-CG2 4.37Å; F330-V356 HydrophobicContact CE2-CG2 4.47Å; F330-V356 HydrophobicContact CG-CG1 4.12Å; V336-V356 HydrophobicContact CG1-CG1 3.84Å; V336-V356 HydrophobicContact CG2-CG1 4.18Å; S338-V356 CarbonylContact O-C 3.59Å; S338-V356 WeakPolarHBondContact O-CA 3.45Å; A339-V356 HydrophobicContact CB-CG2 4.36Å; V356-M358 HydrophobicContact CG1-SD 3.85Å
357	T	94.3	Very high	86.1	Confident	30 Å²	30	46.4 Å²	46.4	18%	0.184	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.9	175.2	-57.3	0	0	0	0	109.1	N311 L337 S338	N311-T357 WeakPolarHBondContact OD1-CB 3.12Å; N311-T357 VanDerWaalsContact OD1-CG2 3.31Å; N311-T357 WeakPolarHBondContact OD1-CG2 3.33Å; N311-T357 PolarHBondContact OD1-OG1 2.87Å; L337-T357 HydrophobicContact CB-CG2 4.26Å; L337-T357 HydrophobicContact CD1-CG2 4.28Å; L337-T357 PolarHBondContact N-O 2.91Å; S338-T357 PolarHBondContact N-O 2.76Å; S338-T357 PolarHBondContact O-N 3.42Å
358	M	94.8	Very high	87.4	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	166.6	176.5	-55	-53.7	-67.3	0	0	111.3	R310 V312 F330 G334 V336 V356 E363 V364	R310-M358 PolarHBondContact O-N 3.36Å; V312-M358 HydrophobicContact CG2-CG 3.96Å; F330-M358 HydrophobicContact CB-CE 4.4Å; F330-M358 HydrophobicContact CB-SD 4.12Å; F330-M358 HydrophobicContact CD1-SD 4.27Å; G334-M358 VanDerWaalsContact C-CE 3.41Å; G334-M358 VanDerWaalsContact CA-CE 3.46Å; V336-M358 HydrophobicContact CG2-CE 3.98Å; V336-M358 HydrophobicContact CG2-SD 3.81Å; V356-M358 HydrophobicContact CG1-SD 3.85Å; M358-E363 HydrophobicContact CB-CB 4.07Å; M358-E363 HydrophobicContact CE-CB 4.2Å; M358-E363 HydrophobicContact CG-CB 4.43Å; M358-V364 HydrophobicContact CB-CG2 3.9Å; M358-V364 HydrophobicContact CG-CG2 3.74Å
359	S	91.9	Very high	89.1	Confident	42 Å²	42	44 Å²	44	29%	0.294	26%	0.256	S	S	.	.	S	Bend	trans	-72	-33.6	174.7	39.9	0	0	0	0	113.4	R310 K335 E363	R310-S359 WeakPolarHBondContact CD-O 3.28Å; K335-S359 WeakPolarHBondContact CB-OG 3.32Å; K335-S359 PolarHBondContact O-N 3.27Å; K335-S359 PolarHBondContact O-OG 3.41Å; S359-E363 PolarHBondContact N-OE2 2.86Å; S359-E363 PolarHBondContact OG-OE1 3.37Å; S359-E363 PolarHBondContact OG-OE2 3.1Å
360	S	92.1	Very high	90.4	Very high	40 Å²	40	45.7 Å²	45.7	28%	0.28	24%	0.244	S	C	.	.			trans	-130.9	149	-179.3	-179.8	0	0	0	0	113.1	T362 E363 V364	S360-T362 PolarHBondContact O-N 2.81Å; S360-T362 PolarHBondContact OG-N 3.25Å; S360-T362 PolarHBondContact OG-OG1 3.12Å; S360-E363 WeakPolarHBondContact CB-OE1 3.12Å; S360-E363 PolarHBondContact N-OE1 2.99Å; S360-E363 WeakPolarHBondContact O-CB 3.5Å; S360-E363 PolarHBondContact O-N 2.95Å; S360-E363 VanDerWaalsContact O-N 3.15Å; S360-V364 PolarHBondContact O-N 3.28Å
361	G	90.9	Very high	91.5	Very high	18 Å²	18	44.3 Å²	44.3	19%	0.186	23%	0.234	C	C	.	.	H	α-helix	trans	-69.2	-15	173.4	0	0	0	0	0	114	S309 T365 R385	S309-G361 WeakPolarHBondContact O-CA 3.42Å; G361-T365 PolarHBondContact O-N 3.39Å; G361-T365 PolarHBondContact O-OG1 3.04Å; G361-T365 VanDerWaalsContact O-OG1 3.11Å; G361-R385 PolarHBondContact O-NH1 3.45Å; G361-R385 VanDerWaalsContact O-NH1 3.08Å
362	T	89.8	Confident	92.2	Very high	89 Å²	89	40.5 Å²	40.5	55%	0.546	22%	0.22	S	C	.	.	H	α-helix	trans	-80.1	-27.7	170.9	57.6	0	0	0	0	112.6	S360 R366	S360-T362 PolarHBondContact O-N 2.81Å; S360-T362 PolarHBondContact OG-N 3.25Å; S360-T362 PolarHBondContact OG-OG1 3.12Å; T362-R366 PolarHBondContact O-N 3.2Å
363	E	92.9	Very high	92.2	Very high	21 Å²	21	43.8 Å²	43.8	10%	0.098	24%	0.242	C	C	.	.	H	α-helix	trans	-68.4	-42.5	167.8	-63.1	159.2	-129.6	0	0	110	G334 K335 M358 S359 S360 T365 R366 C367	G334-E363 WeakPolarHBondContact CA-OE2 3.38Å; K335-E363 PolarHBondContact N-OE2 3.27Å; M358-E363 HydrophobicContact CB-CB 4.07Å; M358-E363 HydrophobicContact CE-CB 4.2Å; M358-E363 HydrophobicContact CG-CB 4.43Å; S359-E363 PolarHBondContact N-OE2 2.86Å; S359-E363 PolarHBondContact OG-OE1 3.37Å; S359-E363 PolarHBondContact OG-OE2 3.1Å; S360-E363 WeakPolarHBondContact CB-OE1 3.12Å; S360-E363 PolarHBondContact N-OE1 2.99Å; S360-E363 WeakPolarHBondContact O-CB 3.5Å; S360-E363 PolarHBondContact O-N 2.95Å; S360-E363 VanDerWaalsContact O-N 3.15Å; E363-T365 VanDerWaalsContact C-N 3.29Å; E363-T365 PolarHBondContact O-N 3.33Å; E363-R366 PolarHBondContact O-N 3.45Å; E363-R366 VanDerWaalsContact O-N 3.1Å; E363-C367 PolarHBondContact O-N 3.33Å; E363-C367 PolarHBondContact O-SG 3.04Å
364	V	93.2	Very high	92.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-54.9	-43.4	174.2	175	0	0	0	0	111.8	V312 M358 S360 R366 C367 I368 R385	V312-V364 HydrophobicContact CG2-CB 4.19Å; V312-V364 HydrophobicContact CG2-CG1 3.82Å; V312-V364 HydrophobicContact CG2-CG2 3.66Å; M358-V364 HydrophobicContact CB-CG2 3.9Å; M358-V364 HydrophobicContact CG-CG2 3.74Å; S360-V364 PolarHBondContact O-N 3.28Å; V364-R366 PolarHBondContact O-N 3.45Å; V364-C367 PolarHBondContact O-N 3.47Å; V364-I368 HydrophobicContact CG1-CD1 3.8Å; V364-I368 HydrophobicContact CG1-CG1 4.49Å; V364-I368 WeakPolarHBondContact O-CG1 3.42Å; V364-I368 PolarHBondContact O-N 3.15Å; V364-R385 HydrophobicContact CG1-CG 3.95Å
365	T	93.3	Very high	92	Very high	59 Å²	59	48.1 Å²	48.1	36%	0.362	27%	0.269	S	S	.	.	H	α-helix	trans	-56.8	-49.6	175.7	-40.5	0	0	0	0	111.4	G361 E363 C367 I368 S369 R385	G361-T365 PolarHBondContact O-N 3.39Å; G361-T365 PolarHBondContact O-OG1 3.04Å; G361-T365 VanDerWaalsContact O-OG1 3.11Å; E363-T365 VanDerWaalsContact C-N 3.29Å; E363-T365 PolarHBondContact O-N 3.33Å; T365-C367 VanDerWaalsContact C-N 3.35Å; T365-C367 PolarHBondContact O-N 3.04Å; T365-I368 PolarHBondContact O-N 2.78Å; T365-S369 PolarHBondContact O-N 2.99Å; T365-S369 PolarHBondContact O-OG 3.19Å; T365-R385 PolarHBondContact OG1-NH2 2.99Å
366	R	92.2	Very high	91.6	Very high	128 Å²	128	48.1 Å²	48.1	48%	0.483	27%	0.269	S	S	.	.	H	α-helix	trans	-67.5	-33.5	-178.9	-67.9	-178.1	-66.8	167.6	4.4	112.8	Y333 T362 E363 V364 H370	Y333-R366 PolarHBondContact O-NH2 2.99Å; T362-R366 PolarHBondContact O-N 3.2Å; E363-R366 PolarHBondContact O-N 3.45Å; E363-R366 VanDerWaalsContact O-N 3.1Å; V364-R366 PolarHBondContact O-N 3.45Å; R366-H370 WeakPolarHBondContact O-CB 3.4Å; R366-H370 PolarHBondContact O-CD2 3.3Å; R366-H370 PolarHBondContact O-N 3.38Å
367	C	91.8	Very high	91.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-46.7	172.8	-62.3	0	0	0	0	110.7	F330 E363 V364 T365 H370 L371	F330-C367 HydrophobicContact CD1-CB 3.79Å; F330-C367 HydrophobicContact CE1-CB 3.82Å; E363-C367 PolarHBondContact O-N 3.33Å; E363-C367 PolarHBondContact O-SG 3.04Å; V364-C367 PolarHBondContact O-N 3.47Å; T365-C367 VanDerWaalsContact C-N 3.35Å; T365-C367 PolarHBondContact O-N 3.04Å; C367-H370 PolarHBondContact O-N 3.08Å; C367-L371 WeakPolarHBondContact O-CA 3.27Å; C367-L371 WeakPolarHBondContact O-CB 3.34Å; C367-L371 PolarHBondContact O-N 3.02Å
368	I	93.6	Very high	90.8	Very high	41 Å²	41	54.5 Å²	54.5	21%	0.21	31%	0.313	C	S	.	.	H	α-helix	trans	-62.2	-49.1	178.1	-65.4	165.1	0	0	0	110.2	V364 T365 H370 D372 V383 R385	V364-I368 HydrophobicContact CG1-CD1 3.8Å; V364-I368 HydrophobicContact CG1-CG1 4.49Å; V364-I368 WeakPolarHBondContact O-CG1 3.42Å; V364-I368 PolarHBondContact O-N 3.15Å; T365-I368 PolarHBondContact O-N 2.78Å; I368-H370 PolarHBondContact O-N 3.04Å; I368-H370 VanDerWaalsContact O-N 3.11Å; I368-D372 WeakPolarHBondContact O-CB 3.44Å; I368-D372 PolarHBondContact O-N 3.39Å; I368-V383 HydrophobicContact CG1-CG1 3.96Å; I368-R385 HydrophobicContact CD1-CB 4.38Å; I368-R385 HydrophobicContact CD1-CG 3.4Å
369	S	92.9	Very high	90.4	Very high	87 Å²	87	57.6 Å²	57.6	61%	0.608	33%	0.328	S	S	*	.	H	α-helix	trans	-66.2	-11.4	-178.8	-59.5	0	0	0	0	116	T365	T365-S369 PolarHBondContact O-N 2.99Å; T365-S369 PolarHBondContact O-OG 3.19Å
370	H	88.9	Confident	90.4	Very high	109 Å²	109	60.6 Å²	60.6	51%	0.505	34%	0.337	S	S	.	.	H	α-helix	trans	-130.8	-11.7	-176.4	-63.9	-54.1	0	0	0	115.4	Y333 R366 C367 I368 T374	Y333-H370 HydrophobicContact CD1-CB 3.94Å; Y333-H370 AromaticContact CD1-CD2 3.79Å; Y333-H370 HydrophobicContact CE1-CB 3.33Å; Y333-H370 AromaticContact CE1-CD2 3.68Å; Y333-H370 AromaticContact CE1-CG 3.71Å; R366-H370 WeakPolarHBondContact O-CB 3.4Å; R366-H370 PolarHBondContact O-CD2 3.3Å; R366-H370 PolarHBondContact O-N 3.38Å; C367-H370 PolarHBondContact O-N 3.08Å; I368-H370 PolarHBondContact O-N 3.04Å; I368-H370 VanDerWaalsContact O-N 3.11Å; H370-T374 WeakPolarHBondContact O-CG2 3.44Å
371	L	91.1	Very high	90.5	Very high	4 Å²	4	58.7 Å²	58.7	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-118.5	-13.7	178.6	-63.3	177.5	0	0	0	113.5	L329 F330 Y333 C367 T374 V383	L329-L371 HydrophobicContact CD1-CD2 3.82Å; L329-L371 HydrophobicContact CD2-CD1 3.97Å; L329-L371 HydrophobicContact CD2-CD2 3.87Å; L329-L371 HydrophobicContact CD2-CG 4.42Å; L329-L371 HydrophobicContact CG-CD1 3.87Å; L329-L371 HydrophobicContact CG-CD2 3.69Å; L329-L371 HydrophobicContact CG-CG 4.42Å; F330-L371 HydrophobicContact CD1-CD1 3.89Å; F330-L371 HydrophobicContact CD2-CD1 3.94Å; F330-L371 HydrophobicContact CE1-CD1 3.91Å; F330-L371 HydrophobicContact CE2-CD1 3.97Å; F330-L371 HydrophobicContact CG-CD1 3.9Å; F330-L371 HydrophobicContact CZ-CD1 3.94Å; Y333-L371 HydrophobicContact CD2-CD1 3.79Å; Y333-L371 HydrophobicContact CD2-CD2 4.26Å; Y333-L371 HydrophobicContact CD2-CG 3.98Å; Y333-L371 HydrophobicContact CE2-CD1 3.98Å; Y333-L371 HydrophobicContact CE2-CD2 3.57Å; Y333-L371 HydrophobicContact CE2-CG 3.75Å; C367-L371 WeakPolarHBondContact O-CA 3.27Å; C367-L371 WeakPolarHBondContact O-CB 3.34Å; C367-L371 PolarHBondContact O-N 3.02Å; L371-T374 PolarHBondContact O-N 2.97Å; L371-T374 PolarHBondContact O-OG1 3.11Å; L371-V383 HydrophobicContact CB-CG2 3.97Å; L371-V383 WeakPolarHBondContact O-CG2 3.45Å
372	D	91.9	Very high	90.6	Very high	68 Å²	68	62.8 Å²	62.8	36%	0.364	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	141	170.2	-167.9	50.2	0	0	0	110.7	I368 T374 Y382 V383	I368-D372 WeakPolarHBondContact O-CB 3.44Å; I368-D372 PolarHBondContact O-N 3.39Å; D372-T374 PolarHBondContact O-N 2.85Å; D372-T374 VanDerWaalsContact O-N 3.1Å; D372-Y382 WeakPolarHBondContact OD1-CA 3.34Å; D372-V383 HydrophobicContact CB-CB 4.17Å; D372-V383 PolarHBondContact OD1-N 3Å
373	C	87.6	Confident	90.8	Very high	71 Å²	71	58.8 Å²	58.8	48%	0.48	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	11.2	-172.7	-56.2	0	0	0	0	116	I381	C373-I381 VanDerWaalsContact CA-O 3.31Å; C373-I381 WeakPolarHBondContact CA-O 3.19Å; C373-I381 PolarHBondContact N-O 2.77Å
374	T	89.3	Confident	90.8	Very high	42 Å²	42	61.8 Å²	61.8	26%	0.258	32%	0.324	S	S	.	.			trans	-79.8	155.3	176.9	61.5	0	0	0	0	112.6	H370 L371 D372 Q380 I381	H370-T374 WeakPolarHBondContact O-CG2 3.44Å; L371-T374 PolarHBondContact O-N 2.97Å; L371-T374 PolarHBondContact O-OG1 3.11Å; D372-T374 PolarHBondContact O-N 2.85Å; D372-T374 VanDerWaalsContact O-N 3.1Å; T374-Q380 CarbonylContact O-C 3.6Å; T374-Q380 WeakPolarHBondContact O-CA 3.43Å; T374-I381 PolarHBondContact O-N 2.83Å
375	E	91.1	Very high	90.7	Very high	143 Å²	143	66.5 Å²	66.5	67%	0.668	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.2	133.8	179.2	-162.2	-175.2	147.1	0	0	112.2	G378 Q379	E375-G378 VanDerWaalsContact OE1-CA 3.28Å; E375-G378 WeakPolarHBondContact OE1-CA 3.26Å; E375-Q379 WeakPolarHBondContact CA-O 3.43Å
376	L	86.4	Confident	90.4	Very high	18 Å²	18	64 Å²	64	9%	0.094	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	125.1	172.8	-176.9	145.3	0	0	0	110	T321 L329 G378 Q379 I381	T321-L376 HydrophobicContact CG2-CD2 3.59Å; T321-L376 WeakPolarHBondContact OG1-CD2 3.46Å; L329-L376 HydrophobicContact CB-CD1 4.5Å; L329-L376 HydrophobicContact CD2-CD1 3.82Å; L376-G378 VanDerWaalsContact C-N 3.33Å; L376-G378 PolarHBondContact O-N 2.73Å; L376-Q379 PolarHBondContact N-O 3.41Å; L376-Q379 PolarHBondContact O-N 3.1Å; L376-I381 HydrophobicContact CB-CG2 3.84Å
377	H	85.4	Confident	89.4	Confident	100 Å²	100	65.8 Å²	65.8	46%	0.463	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	45.7	-177.6	-59	-41.4	0	0	0	114.2	S318 D325	S318-H377 PolarHBondContact OG-O 2.9Å; D325-H377 IonicContact OD2-CD2 3.74Å; D325-H377 IonicContact OD2-CE1 3.82Å; D325-H377 IonicContact OD2-NE2 2.82Å; D325-H377 PolarHBondContact OD2-NE2 2.86Å
378	G	85.2	Confident	87.6	Confident	64 Å²	64	72.3 Å²	72.3	66%	0.66	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	10.8	177.7	0	0	0	0	0	115.3	E375 L376	E375-G378 VanDerWaalsContact OE1-CA 3.28Å; E375-G378 WeakPolarHBondContact OE1-CA 3.26Å; L376-G378 VanDerWaalsContact C-N 3.33Å; L376-G378 PolarHBondContact O-N 2.73Å
379	Q	87.3	Confident	85.8	Confident	66 Å²	66	72.6 Å²	72.6	31%	0.308	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	138.2	-176.5	-165	174.3	-13.3	0	0	112.2	G316 E375 L376 I381	G316-Q379 WeakPolarHBondContact O-CG 3.25Å; G316-Q379 PolarHBondContact O-NE2 2.74Å; E375-Q379 WeakPolarHBondContact CA-O 3.43Å; L376-Q379 PolarHBondContact N-O 3.41Å; L376-Q379 PolarHBondContact O-N 3.1Å; Q379-I381 PolarHBondContact O-N 3.36Å
380	Q	92.2	Very high	83.8	Confident	105 Å²	105	72.3 Å²	72.3	49%	0.491	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.4	173.1	-71.3	-178.6	-1.3	0	0	111.2	T374 Y382	T374-Q380 CarbonylContact O-C 3.6Å; T374-Q380 WeakPolarHBondContact O-CA 3.43Å; Q380-Y382 PolarHBondContact OE1-OH 2.83Å
381	I	93.5	Very high	81.9	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.373	C	S	.	.			trans	-98.7	143.9	175	77.9	177.1	0	0	0	110.1	V314 S315 L317 L329 C373 T374 L376 Q379 V383	V314-I381 HydrophobicContact CG1-CB 4.21Å; V314-I381 HydrophobicContact CG1-CD1 4.21Å; S315-I381 CarbonylContact O-C 3.43Å; S315-I381 VanDerWaalsContact O-CA 3.3Å; S315-I381 WeakPolarHBondContact O-CA 3.44Å; L317-I381 HydrophobicContact CD2-CB 4.16Å; L317-I381 HydrophobicContact CD2-CG2 3.62Å; L329-I381 HydrophobicContact CD2-CD1 3.58Å; C373-I381 VanDerWaalsContact CA-O 3.31Å; C373-I381 WeakPolarHBondContact CA-O 3.19Å; C373-I381 PolarHBondContact N-O 2.77Å; T374-I381 PolarHBondContact O-N 2.83Å; L376-I381 HydrophobicContact CB-CG2 3.84Å; Q379-I381 PolarHBondContact O-N 3.36Å; I381-V383 HydrophobicContact CD1-CG2 4.22Å; I381-V383 HydrophobicContact CG1-CG2 4.17Å
382	Y	93.5	Very high	79.5	Confident	103 Å²	103	77.7 Å²	77.7	40%	0.404	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135	173.9	-54.1	-77.2	0	0	0	110.1	V314 S315 D372 Q380	V314-Y382 CarbonylContact C-O 3.57Å; V314-Y382 WeakPolarHBondContact CA-O 3.34Å; S315-Y382 PolarHBondContact N-O 3.15Å; S315-Y382 PolarHBondContact O-N 3.23Å; D372-Y382 WeakPolarHBondContact OD1-CA 3.34Å; Q380-Y382 PolarHBondContact OE1-OH 2.83Å
383	V	93.9	Very high	77.1	Confident	5 Å²	5	84.4 Å²	84.4	3%	0.03	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	107.9	-164.6	-174.7	0	0	0	0	109.6	V312 V314 F330 I368 L371 D372 I381	V312-V383 HydrophobicContact CG1-CG1 3.43Å; V312-V383 VanDerWaalsContact CG1-CG1 3.43Å; V314-V383 HydrophobicContact CG1-CG2 4.31Å; F330-V383 HydrophobicContact CE1-CG1 3.76Å; F330-V383 HydrophobicContact CZ-CG1 3.83Å; F330-V383 HydrophobicContact CZ-CG2 4Å; I368-V383 HydrophobicContact CG1-CG1 3.96Å; L371-V383 HydrophobicContact CB-CG2 3.97Å; L371-V383 WeakPolarHBondContact O-CG2 3.45Å; D372-V383 HydrophobicContact CB-CB 4.17Å; D372-V383 PolarHBondContact OD1-N 3Å; I381-V383 HydrophobicContact CD1-CG2 4.22Å; I381-V383 HydrophobicContact CG1-CG2 4.17Å
384	E	92.3	Very high	74.6	Confident	85 Å²	85	88 Å²	88	40%	0.397	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	154.7	-176.2	-157.1	-171.7	177.3	0	0	111.4	V312 W313 A386 K387	V312-E384 CarbonylContact C-O 3.42Å; V312-E384 WeakPolarHBondContact CA-O 3.3Å; V312-E384 VanDerWaalsContact CG1-O 3.26Å; V312-E384 WeakPolarHBondContact CG1-O 3.33Å; W313-E384 PolarHBondContact N-O 3.21Å; W313-E384 PolarHBondContact O-N 3.01Å; E384-A386 PolarHBondContact O-N 3.02Å; E384-K387 WeakPolarHBondContact OE1-CE 3.45Å; E384-K387 IonicContact OE1-NZ 2.66Å; E384-K387 PolarHBondContact OE1-NZ 3.4Å
385	R	91.4	Very high	71.9	Confident	98 Å²	98	91.4 Å²	91.4	37%	0.37	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	129.1	164.4	-65.5	-163.9	-171.7	-93.1	-2.6	109	G361 V364 T365 I368 K387	G361-R385 PolarHBondContact O-NH1 3.45Å; G361-R385 VanDerWaalsContact O-NH1 3.08Å; V364-R385 HydrophobicContact CG1-CG 3.95Å; T365-R385 PolarHBondContact OG1-NH2 2.99Å; I368-R385 HydrophobicContact CD1-CB 4.38Å; I368-R385 HydrophobicContact CD1-CG 3.4Å; R385-K387 PolarHBondContact O-N 2.66Å
386	A	85.8	Confident	69.1	Low	6 Å²	6	90 Å²	90	5%	0.05	46%	0.457	C	S	.	.			trans	-69	103.6	178.9	0	0	0	0	0	110.4	N311 W313 L355 E384 N388	N311-A386 HydrophobicContact CB-CB 3.62Å; N311-A386 PolarHBondContact O-N 2.81Å; W313-A386 HydrophobicContact CB-CB 4.28Å; L355-A386 HydrophobicContact CD1-CB 3.99Å; E384-A386 PolarHBondContact O-N 3.02Å; A386-N388 PolarHBondContact O-N 3.2Å; A386-N388 VanDerWaalsContact O-N 3.12Å
387	K	72.2	Confident	66.5	Low	166 Å²	166	98.8 Å²	98.8	72%	0.722	50%	0.495	S	S	*	.	S	Bend	trans	-65.6	-10.3	-177.8	-74.8	164.4	172.8	162.9	0	114.3	E384 R385	E384-K387 WeakPolarHBondContact OE1-CE 3.45Å; E384-K387 IonicContact OE1-NZ 2.66Å; E384-K387 PolarHBondContact OE1-NZ 3.4Å; R385-K387 PolarHBondContact O-N 2.66Å
388	N	53.8	Low	64	Low	138 Å²	138	103 Å²	103	74%	0.738	51%	0.512	S	S	*	.	S	Bend	trans	-154.8	161.6	170.2	-112.4	-64.9	0	0	0	111.7	A386 P390	A386-N388 PolarHBondContact O-N 3.2Å; A386-N388 VanDerWaalsContact O-N 3.12Å; N388-P390 WeakPolarHBondContact O-CD 3.39Å
389	D	55.6	Low	61.4	Low	46 Å²	46	108.4 Å²	108.4	25%	0.246	52%	0.52	C	S	.	.			trans	-99.4	105.9	172.5	-177.5	-18.4	0	0	0	109.6	F391	D389-F391 PolarHBondContact O-N 3.13Å; D389-F391 VanDerWaalsContact O-N 3.12Å; D389-F391 PolarHBondContact OD1-N 3.34Å
390	P	51.2	Low	58.8	Low	81 Å²	81	111.8 Å²	111.8	53%	0.526	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-1.1	-173.9	29.6	-34.9	0	0	0	114.4	L355 N388	L355-P390 HydrophobicContact CD2-CG 4.13Å; N388-P390 WeakPolarHBondContact O-CD 3.39Å
391	F	48.9	Very low	55.7	Low	122 Å²	122	115.8 Å²	115.8	54%	0.535	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110	-4.3	-179.1	-67.7	-73.4	0	0	0	114.5	K340 L355 D389 K393	K340-F391 HydrophobicContact CD-CE2 4.21Å; K340-F391 HydrophobicContact CD-CZ 4.38Å; L355-F391 HydrophobicContact CD2-CD2 4.38Å; L355-F391 HydrophobicContact CD2-CE2 4.46Å; D389-F391 PolarHBondContact O-N 3.13Å; D389-F391 VanDerWaalsContact O-N 3.12Å; D389-F391 PolarHBondContact OD1-N 3.34Å; F391-K393 PolarHBondContact O-N 2.95Å; F391-K393 VanDerWaalsContact O-N 3.08Å
392	K	41.7	Very low	52.9	Low	105 Å²	105	123.3 Å²	123.3	46%	0.457	60%	0.604	S	S	.	*			trans	-78.9	85.5	169.7	-80.4	-164.8	175.8	-169.1	0	112.4	E394	K392-E394 VanDerWaalsContact C-N 3.34Å; K392-E394 PolarHBondContact O-N 2.99Å; K392-E394 VanDerWaalsContact O-N 3.16Å
393	K	40.3	Very low	50.2	Low	209 Å²	209	127.6 Å²	127.6	91%	0.909	63%	0.625	S	S	*	*			trans	-77.6	82.9	158.4	-72.6	-173.9	176.7	-178	0	110	F391	F391-K393 PolarHBondContact O-N 2.95Å; F391-K393 VanDerWaalsContact O-N 3.08Å
394	E	34.8	Very low	47.1	Very low	145 Å²	145	132.4 Å²	132.4	68%	0.678	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-70.2	147.6	162.4	-70	-66.1	157.4	0	0	110	K392	K392-E394 VanDerWaalsContact C-N 3.34Å; K392-E394 PolarHBondContact O-N 2.99Å; K392-E394 VanDerWaalsContact O-N 3.16Å
395	P	33.7	Very low	44	Very low	114 Å²	114	131.7 Å²	131.7	74%	0.74	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-69.7	145.5	-177.7	28.1	-33.9	0	0	0	112.5
396	S	31.3	Very low	40.9	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-63.9	130.5	-169.7	56.4	0	0	0	0	114.6
397	K	33.3	Very low	38.1	Very low	203 Å²	203	137.3 Å²	137.3	88%	0.883	73%	0.734	S	S	*	*			trans	-112.3	122.9	146.9	-70.6	-178.2	179.3	176.6	0	108	E399	K397-E399 PolarHBondContact O-N 2.76Å
398	K	31.2	Very low	35.9	Very low	188 Å²	188	138.3 Å²	138.3	82%	0.817	74%	0.739	S	S	*	*			trans	-64.7	119.1	169.5	-63.6	169.5	-174.8	169.1	0	106.9
399	E	31.2	Very low	34.5	Very low	178 Å²	178	136.7 Å²	136.7	83%	0.832	74%	0.738	S	S	*	*				59.1	102	81.8	-71	-170.1	167.2	0	0	113	K397	K397-E399 PolarHBondContact O-N 2.76Å
400	V	33	Very low	33.1	Very low	138 Å²	138	142.1 Å²	142.1	84%	0.836	77%	0.767	S	S	*	*				-142.4	114	126.3	-179.5	0	0	0	0	107
401	E	27.4	Very low	32.1	Very low	189 Å²	189	146.6 Å²	146.6	88%	0.883	78%	0.778	S	S	*	*			trans	-157.4	127.7	145.2	-157	165.9	-126.3	0	0	108.9
402	D	34.7	Very low	31.1	Very low	157 Å²	157	146.6 Å²	146.6	84%	0.84	78%	0.784	S	S	*	*			trans	-94.2	162.2	-173.7	-93.4	-62.5	0	0	0	113.3
403	K	35.9	Very low	30.5	Very low	194 Å²	194	147.3 Å²	147.3	84%	0.843	80%	0.797	S	S	*	*			trans	-103.5	141.8	-163.2	-64.9	173.1	-175.4	160.2	0	115.1
404	A	28.3	Very low	29.9	Very low	106 Å²	106	146.1 Å²	146.1	88%	0.876	79%	0.792	S	S	*	*			trans	-141.7	158	140.6	0	0	0	0	0	108.6
405	G	27.5	Very low	29.6	Very low	69 Å²	69	145.1 Å²	145.1	71%	0.711	80%	0.796	S	S	*	*			cis	164.5	52	-0.9	0	0	0	0	0	115.9
406	S	27	Very low	29.3	Very low	114 Å²	114	142.7 Å²	142.7	80%	0.797	79%	0.792	S	S	*	*			trans	63.3	141.5	155.4	-160.7	0	0	0	0	121.6
407	S	26.5	Very low	29.3	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	80%	0.796	S	S	*	*			trans	67.3	155.1	163.5	78.4	0	0	0	0	117
408	K	26.7	Very low	29.1	Very low	187 Å²	187	143.4 Å²	143.4	81%	0.813	79%	0.793	S	S	*	*			cis	-150.9	143.4	15.9	-159	168.3	-173.6	168.7	0	112.2
409	S	24.9	Very low	29.1	Very low	103 Å²	103	141.1 Å²	141.1	72%	0.72	79%	0.789	S	S	*	*			trans	50.8	131.8	157.4	59.1	0	0	0	0	122
410	N	26.1	Very low	29.1	Very low	161 Å²	161	136.7 Å²	136.7	86%	0.861	78%	0.783	S	S	*	*				-156.7	164.1	123.8	-123.6	-35.6	0	0	0	116.2
411	K	29.8	Very low	28.9	Very low	175 Å²	175	138.6 Å²	138.6	76%	0.761	79%	0.789	S	S	*	*			trans	-71.8	178.4	-178.7	-80.9	179.9	159.9	-178.7	0	114
412	N	28	Very low	29.1	Very low	121 Å²	121	137.5 Å²	137.5	65%	0.647	78%	0.781	S	S	*	*			cis	-165.4	174.9	18.7	-140.9	15.9	0	0	0	113.9
413	T	27.9	Very low	28.8	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	78%	0.775	S	S	*	*			trans	64	149.1	150.1	42.3	0	0	0	0	121
414	F	29	Very low	28.4	Very low	184 Å²	184	131.2 Å²	131.2	81%	0.807	77%	0.765	S	S	*	*			cis	-164.3	177.4	-13.2	-177.5	-116.7	0	0	0	110.2
415	T	28	Very low	28.4	Very low	124 Å²	124	132.5 Å²	132.5	76%	0.761	76%	0.756	S	S	*	*			trans	71.6	141.8	-177.3	79.1	0	0	0	0	116.5
416	G	27	Very low	28.3	Very low	64 Å²	64	135.6 Å²	135.6	66%	0.66	76%	0.761	S	S	*	*			cis	-173.6	162.2	-9.2	0	0	0	0	0	115.5
417	T	31.1	Very low	28.4	Very low	143 Å²	143	138.9 Å²	138.9	88%	0.877	76%	0.763	S	S	*	*			trans	64.3	126.3	159.8	49.2	0	0	0	0	124.3
418	K	30	Very low	28.5	Very low	188 Å²	188	143.1 Å²	143.1	82%	0.817	77%	0.768	S	S	*	*			trans	99.7	125.1	133	-99	-162.3	166.1	-176	0	123.4
419	L	31.2	Very low	28.6	Very low	139 Å²	139	142 Å²	142	73%	0.728	76%	0.763	S	S	*	*			trans	74	103.7	146.4	-60	-179.1	0	0	0	122.8
420	A	30.3	Very low	28.8	Very low	86 Å²	86	143.8 Å²	143.8	71%	0.711	76%	0.76	S	S	*	*				48.5	130.1	116.3	0	0	0	0	0	122.4
421	N	30.3	Very low	28.9	Very low	178 Å²	178	142.1 Å²	142.1	95%	0.952	75%	0.748	S	S	*	*				-155.1	170.8	120.6	-114.7	-30.7	0	0	0	113
422	K	30.9	Very low	29	Very low	166 Å²	166	140.6 Å²	140.6	72%	0.722	74%	0.741	S	S	*	*			trans	-131.5	128.7	-163.9	178.5	-149.8	173.3	-154.2	0	112.8	E424	K422-E424 WeakPolarHBondContact CE-OE1 3.3Å; K422-E424 IonicContact NZ-OE1 2.75Å; K422-E424 PolarHBondContact NZ-OE1 3.32Å
423	A	29.3	Very low	29.2	Very low	87 Å²	87	143.9 Å²	143.9	72%	0.719	75%	0.749	S	S	*	*			trans	-154.8	126	156	0	0	0	0	0	106.6
424	E	27	Very low	29.2	Very low	132 Å²	132	143.2 Å²	143.2	62%	0.617	75%	0.749	S	S	*	*				55.6	131.9	66.8	-50.5	-68.5	166.8	0	0	111.3	K422	K422-E424 WeakPolarHBondContact CE-OE1 3.3Å; K422-E424 IonicContact NZ-OE1 2.75Å; K422-E424 PolarHBondContact NZ-OE1 3.32Å
425	L	28.5	Very low	29.2	Very low	132 Å²	132	140 Å²	140	69%	0.691	74%	0.741	S	S	*	*			cis	165.8	139.3	-8.9	173.9	75.5	0	0	0	103.6
426	T	25.7	Very low	29.3	Very low	135 Å²	135	142.1 Å²	142.1	83%	0.828	74%	0.739	S	S	*	*			trans	165.7	156.5	137.6	35.6	0	0	0	0	113.7
427	H	28.3	Very low	29.6	Very low	182 Å²	182	144.7 Å²	144.7	84%	0.843	74%	0.737	S	S	*	*			trans	-123.4	151.7	176.3	-67.2	-111	0	0	0	111.4
428	K	29.2	Very low	29.6	Very low	199 Å²	199	143.1 Å²	143.1	87%	0.865	73%	0.733	S	S	*	*			trans	-167.6	136	143.3	-99.3	165.4	179.5	178.4	0	107.2
429	K	29.2	Very low	29.6	Very low	163 Å²	163	139.7 Å²	139.7	71%	0.709	72%	0.723	S	S	*	*				81.5	125.6	51.6	-172	171.8	-171	-178	0	110.1
430	E	27.5	Very low	29.7	Very low	140 Å²	140	140.7 Å²	140.7	65%	0.654	72%	0.721	S	S	*	*			cis	-166.6	-178.8	5.5	-134.2	167.2	-152.1	0	0	111.9
431	E	28.4	Very low	29.6	Very low	127 Å²	127	142.8 Å²	142.8	59%	0.593	72%	0.721	S	S	*	*			trans	52.5	163.8	148.5	-65.3	-58.8	82	0	0	121.8
432	K	32.7	Very low	29.7	Very low	143 Å²	143	138.6 Å²	138.6	62%	0.622	71%	0.711	S	S	*	*				-167.9	134.1	-50.9	-129	-158.5	-147.8	87.7	0	109.9
433	K	31.1	Very low	29.8	Very low	189 Å²	189	136 Å²	136	82%	0.822	71%	0.714	S	S	*	*			trans	63.1	165.5	167	-54.3	-178.7	174.1	179.7	0	115
434	S	28	Very low	29.9	Very low	106 Å²	106	140.6 Å²	140.6	74%	0.741	72%	0.718	S	S	*	*			cis	-149.3	176.6	9.8	76.1	0	0	0	0	109.2
435	D	28.6	Very low	30.1	Very low	118 Å²	118	142.8 Å²	142.8	63%	0.631	73%	0.725	S	S	*	*			cis	-160.6	163.6	-11.7	-128.4	36.3	0	0	0	108.9
436	K	30.4	Very low	30.3	Very low	167 Å²	167	143.2 Å²	143.2	73%	0.726	72%	0.723	S	S	*	*				44.8	145	110.9	-75.6	-171.7	149.7	-171.5	0	118.9
437	L	34	Very low	30.5	Very low	118 Å²	118	141.1 Å²	141.1	62%	0.618	71%	0.707	S	S	*	*			cis	-159.8	146.2	10.9	-124.5	-176.8	0	0	0	113.3	D439	L437-D439 VanDerWaalsContact CD2-OD2 3.26Å; L437-D439 WeakPolarHBondContact CD2-OD2 3.44Å
438	S	31	Very low	30.8	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	69%	0.688	S	S	*	*			trans	176.7	119.8	136.3	53.3	0	0	0	0	108.7
439	D	31	Very low	31	Very low	115 Å²	115	133.7 Å²	133.7	62%	0.615	68%	0.681	S	S	*	*				66.9	131.5	50.9	-79.3	-47.6	0	0	0	114.1	L437	L437-D439 VanDerWaalsContact CD2-OD2 3.26Å; L437-D439 WeakPolarHBondContact CD2-OD2 3.44Å
440	K	32.3	Very low	31.1	Very low	160 Å²	160	128.5 Å²	128.5	70%	0.696	67%	0.665	S	S	*	*			cis	-169.5	176.8	-6.9	-147	178.1	174.2	-177.3	0	113.5
441	D	27.9	Very low	31	Very low	130 Å²	130	123.2 Å²	123.2	70%	0.695	65%	0.648	S	S	*	*			trans	66.2	141.6	158	-61	-40.7	0	0	0	118.3
442	A	33.4	Very low	31	Very low	91 Å²	91	122.1 Å²	122.1	75%	0.752	65%	0.654	S	S	*	*			cis	97.2	131.7	27.2	0	0	0	0	0	114.4
443	S	32.1	Very low	30.8	Very low	111 Å²	111	120.9 Å²	120.9	78%	0.776	66%	0.664	S	S	*	*			cis	-139.7	-98.4	-3.6	34.7	0	0	0	0	115.8
444	K	30.7	Very low	30.7	Very low	184 Å²	184	117.1 Å²	117.1	80%	0.8	66%	0.661	S	S	*	*			cis	-167.2	74	-6.2	-158	170.3	-173.1	177.8	0	115.4
445	K	32.6	Very low	30.7	Very low	178 Å²	178	116.3 Å²	116.3	77%	0.774	66%	0.655	S	S	*	*			trans	70.8	169.4	174.2	-62.4	-171.8	174.6	-175.7	0	116.6
446	Q	32.2	Very low	30.6	Very low	140 Å²	140	117 Å²	117	65%	0.654	66%	0.659	S	S	*	*			cis	-142.9	-157.4	10	-145.9	146.7	-25.3	0	0	114.2	R494	Q446-R494 PolarHBondContact O-NE 3.34Å; Q446-R494 PolarHBondContact O-NH2 3.12Å
447	D	30	Very low	30.6	Very low	91 Å²	91	116.9 Å²	116.9	49%	0.487	66%	0.661	S	S	.	*			trans	-142.3	170.4	-147.7	-51	-81.6	0	0	0	116.3	R494	D447-R494 VanDerWaalsContact OD1-CD 3.3Å; D447-R494 WeakPolarHBondContact OD1-CD 3.18Å; D447-R494 IonicContact OD1-NE 3.6Å; D447-R494 PolarHBondContact OD1-NE 3.02Å
448	S	33.3	Very low	30.2	Very low	64 Å²	64	118.6 Å²	118.6	45%	0.448	67%	0.666	S	S	.	*				159.3	91.9	113.9	54.5	0	0	0	0	121.1	R491 P492	S448-R491 CarbonylContact O-C 3.53Å; S448-R491 WeakPolarHBondContact O-CA 3.32Å; S448-P492 CarbonylContact C-O 3.58Å; S448-P492 WeakPolarHBondContact CA-O 3.44Å; S448-P492 PolarHBondContact N-O 2.78Å
449	K	35	Very low	30	Very low	162 Å²	162	118 Å²	118	70%	0.704	66%	0.662	S	S	*	*			trans	90.5	161.7	152.8	-132.5	77	176.1	-168	0	124.7	R491 P492 F493	K449-R491 WeakPolarHBondContact O-CA 3.48Å; K449-P492 PolarHBondContact N-O 2.71Å; K449-P492 CarbonylContact O-C 2.83Å; K449-P492 WeakPolarHBondContact O-CA 3.42Å; K449-F493 VanDerWaalsContact N-N 3.19Å; K449-F493 PolarHBondContact O-N 3.08Å
450	S	29.9	Very low	30	Very low	53 Å²	53	117.5 Å²	117.5	37%	0.371	67%	0.667	S	S	.	*			trans	49	138.4	155.2	48.6	0	0	0	0	122.2	K490 R491 F493	S450-K490 PolarHBondContact OG-O 3.11Å; S450-R491 WeakPolarHBondContact O-CG 3.39Å; S450-R491 PolarHBondContact O-NE 2.95Å; S450-R491 VanDerWaalsContact OG-CG 3.31Å; S450-R491 WeakPolarHBondContact OG-CG 3.37Å; S450-F493 VanDerWaalsContact O-CE2 3.23Å; S450-F493 WeakPolarHBondContact O-CE2 3.4Å
451	G	27.1	Very low	29.9	Very low	29 Å²	29	119.2 Å²	119.2	30%	0.299	68%	0.675	S	S	.	*			cis	171	128.6	0.6	0	0	0	0	0	107.6	R491	G451-R491 PolarHBondContact O-NH2 3.43Å
452	S	28	Very low	30.1	Very low	105 Å²	105	123.9 Å²	123.9	73%	0.734	68%	0.683	S	S	*	*				76.6	97.6	82.2	64.7	0	0	0	0	114.3
453	S	29	Very low	30	Very low	117 Å²	117	127.1 Å²	127.1	82%	0.818	69%	0.687	S	S	*	*				87.5	148.5	99.1	65.6	0	0	0	0	114
454	S	27.8	Very low	29.9	Very low	109 Å²	109	127 Å²	127	76%	0.762	68%	0.678	S	S	*	*			cis	-151.9	-173	15.2	52.6	0	0	0	0	113.7
455	S	28.5	Very low	30	Very low	89 Å²	89	127 Å²	127	62%	0.622	67%	0.673	S	S	*	*			trans	-16.9	153.8	166.1	57.7	0	0	0	0	119.7
456	D	26.2	Very low	30	Very low	134 Å²	134	126.6 Å²	126.6	72%	0.717	67%	0.671	S	S	*	*				-162.4	177.1	71.3	-102.3	-58.7	0	0	0	118.8
457	Q	30.9	Very low	29.7	Very low	163 Å²	163	131.3 Å²	131.3	76%	0.762	68%	0.683	S	S	*	*			trans	-0.3	160.1	154.6	-71.1	-175.8	-34.3	0	0	120.9
458	E	25.1	Very low	29.6	Very low	154 Å²	154	130.4 Å²	130.4	72%	0.72	70%	0.695	S	S	*	*			cis	-177.3	172.3	-13.5	175.6	170.5	165.5	0	0	107.4
459	S	27.8	Very low	29.5	Very low	99 Å²	99	136.5 Å²	136.5	69%	0.692	72%	0.716	S	S	*	*			trans	107	120.1	143.4	84.7	0	0	0	0	122
460	S	30.7	Very low	29.2	Very low	104 Å²	104	134 Å²	134	73%	0.727	72%	0.715	S	S	*	*				83.6	158.7	128.9	85.5	0	0	0	0	123.1
461	K	30	Very low	29.3	Very low	197 Å²	197	140.2 Å²	140.2	86%	0.857	74%	0.735	S	S	*	*			trans	66.7	112.8	165.7	-74.3	179.4	176.5	174.7	0	120.1
462	R	30.8	Very low	29.4	Very low	228 Å²	228	144.3 Å²	144.3	86%	0.86	76%	0.759	S	S	*	*			trans	-65.3	145.2	136.3	-59.2	172.7	178.1	168.6	-1.5	108.2
463	D	31.7	Very low	30.3	Very low	159 Å²	159	145 Å²	145	85%	0.85	76%	0.761	S	S	*	*				-171.9	-170.4	113.4	-99.5	-26.5	0	0	0	112.6
464	D	30.8	Very low	30.2	Very low	109 Å²	109	143.6 Å²	143.6	58%	0.583	76%	0.757	S	S	*	*			trans	-87.7	164.2	-140.9	-132.3	-40.7	0	0	0	118.2
465	R	32.3	Very low	30.2	Very low	184 Å²	184	148.3 Å²	148.3	69%	0.694	76%	0.764	S	S	*	*			trans	68.8	107.1	148.5	-75.1	145.3	-145.4	-168.9	16.6	123.9
466	K	32	Very low	30.1	Very low	169 Å²	169	149 Å²	149	74%	0.735	77%	0.769	S	S	*	*				79.5	123.4	113.4	-74.3	178.5	-178	169.8	0	122.4
467	R	26.1	Very low	30.1	Very low	238 Å²	238	147.9 Å²	147.9	90%	0.898	77%	0.767	S	S	*	*			trans	68.1	151.8	152.6	-56.3	171.9	-173.6	-78.9	6.8	116
468	G	28.1	Very low	30	Very low	72 Å²	72	146.3 Å²	146.3	74%	0.742	76%	0.764	S	S	*	*			cis	-119.6	-150.1	-23.8	0	0	0	0	0	108
469	E	30.9	Very low	30.4	Very low	192 Å²	192	147.4 Å²	147.4	90%	0.897	77%	0.769	S	S	*	*			cis	-155.1	-168	-15.9	-167.4	144.4	126.6	0	0	106.9
470	T	30	Very low	30.4	Very low	110 Å²	110	149.8 Å²	149.8	68%	0.675	77%	0.774	S	S	*	*			trans	-84.8	136.3	-166.1	51.8	0	0	0	0	116.7
471	K	31.5	Very low	30.5	Very low	184 Å²	184	152 Å²	152	80%	0.8	78%	0.778	S	S	*	*			trans	72.3	117.1	143.4	-64.4	161.9	-175.5	176	0	119.5
472	S	29.1	Very low	31.5	Very low	114 Å²	114	147.5 Å²	147.5	80%	0.797	77%	0.768	S	S	*	*				11.1	153	118.8	-42.7	0	0	0	0	119.6
473	P	46.8	Very low	31.6	Very low	119 Å²	119	146 Å²	146	77%	0.773	77%	0.768	S	S	*	*			cis	-148.3	160.8	29.2	42.7	-23	0	0	0	120.2
474	A	26.4	Very low	31.4	Very low	89 Å²	89	141.3 Å²	141.3	74%	0.736	76%	0.757	S	S	*	*			trans	52.3	135.7	133.5	0	0	0	0	0	125.4
475	K	28.6	Very low	31.5	Very low	207 Å²	207	144.3 Å²	144.3	90%	0.9	77%	0.774	S	S	*	*			trans	64.8	110	139.4	-75.5	-175.6	171.8	-169.4	0	122
476	S	26.3	Very low	31.4	Very low	104 Å²	104	139.1 Å²	139.1	73%	0.727	78%	0.777	S	S	*	*				177.7	130.7	127	52.3	0	0	0	0	107.9
477	T	27.2	Very low	31.4	Very low	110 Å²	110	138.6 Å²	138.6	68%	0.675	78%	0.782	S	S	*	*				57.4	125	61.7	65.5	0	0	0	0	114
478	D	27.9	Very low	31.5	Very low	131 Å²	131	135.2 Å²	135.2	70%	0.701	77%	0.774	S	S	*	*			cis	-159.9	159	-6	-92.6	-34.6	0	0	0	111.4
479	E	32.8	Very low	31.8	Very low	177 Å²	177	137.8 Å²	137.8	83%	0.827	77%	0.767	S	S	*	*			trans	60.2	174	146	-67.8	-176.9	153.1	0	0	124.6
480	D	28.7	Very low	32	Very low	148 Å²	148	135.6 Å²	135.6	79%	0.791	75%	0.754	S	S	*	*			trans	76.5	80.9	173.3	-64.3	-26.4	0	0	0	121.9
481	D	32.3	Very low	32.1	Very low	152 Å²	152	138.2 Å²	138.2	81%	0.813	75%	0.752	S	S	*	*				30.5	164.6	113.1	-93.8	-55.6	0	0	0	122.1
482	P	50.7	Low	32.8	Very low	102 Å²	102	133.1 Å²	133.1	66%	0.662	74%	0.738	S	S	*	*			cis	-143	172.3	25	45.5	-26.7	0	0	0	120.2
483	K	33.4	Very low	33	Very low	196 Å²	196	134.2 Å²	134.2	85%	0.852	73%	0.728	S	S	*	*			trans	79.4	139.9	155.7	-73	167	-178.5	178.9	0	119.3
484	G	28.7	Very low	32.3	Very low	61 Å²	61	136.4 Å²	136.4	63%	0.629	72%	0.721	S	S	*	*			cis	-179.7	173.2	-3.8	0	0	0	0	0	115.7
485	D	31.3	Very low	32.6	Very low	172 Å²	172	138.5 Å²	138.5	92%	0.92	73%	0.725	S	S	*	*			trans	54.5	121.8	160.5	-46.1	-27.3	0	0	0	119.6
486	G	31.8	Very low	32.5	Very low	74 Å²	74	132.6 Å²	132.6	76%	0.763	72%	0.723	S	S	*	*			cis	175.8	177.3	-5.5	0	0	0	0	0	115.8
487	D	30.4	Very low	33.5	Very low	158 Å²	158	139.2 Å²	139.2	85%	0.845	73%	0.732	S	S	*	*			trans	83.3	145.1	157.4	-114.8	-34.4	0	0	0	124.7
488	F	29.6	Very low	33.9	Very low	168 Å²	168	144.7 Å²	144.7	74%	0.737	74%	0.742	S	S	*	*			trans	63	72.5	160.4	-108.9	-92.8	0	0	0	125.1
489	E	34.2	Very low	33.9	Very low	125 Å²	125	146.4 Å²	146.4	58%	0.584	74%	0.743	S	S	*	*				63.5	117.7	124.2	-60.9	-142.3	125.2	0	0	125.6
490	K	34.3	Very low	33.8	Very low	146 Å²	146	146.1 Å²	146.1	64%	0.635	75%	0.747	S	S	*	*			trans	96.7	131.3	131.5	-71.8	166.2	-176.5	152.4	0	123	S450	S450-K490 PolarHBondContact OG-O 3.11Å
491	R	32.7	Very low	34.1	Very low	165 Å²	165	146.2 Å²	146.2	62%	0.623	74%	0.741	S	S	*	*			trans	-159.3	167.1	-173.8	-80.9	-176.3	160.8	134.9	-4.2	109.2	S448 K449 S450 G451	S448-R491 CarbonylContact O-C 3.53Å; S448-R491 WeakPolarHBondContact O-CA 3.32Å; K449-R491 WeakPolarHBondContact O-CA 3.48Å; S450-R491 WeakPolarHBondContact O-CG 3.39Å; S450-R491 PolarHBondContact O-NE 2.95Å; S450-R491 VanDerWaalsContact OG-CG 3.31Å; S450-R491 WeakPolarHBondContact OG-CG 3.37Å; G451-R491 PolarHBondContact O-NH2 3.43Å
492	P	45.6	Very low	34.3	Very low	78 Å²	78	144.5 Å²	144.5	51%	0.506	74%	0.738	S	S	.	*			cis	-126.8	148.4	9.6	40.8	-25.5	0	0	0	117.9	S448 K449	S448-P492 CarbonylContact C-O 3.58Å; S448-P492 WeakPolarHBondContact CA-O 3.44Å; S448-P492 PolarHBondContact N-O 2.78Å; K449-P492 PolarHBondContact N-O 2.71Å; K449-P492 CarbonylContact O-C 2.83Å; K449-P492 WeakPolarHBondContact O-CA 3.42Å
493	F	33.3	Very low	33.3	Very low	136 Å²	136	149 Å²	149	60%	0.596	75%	0.747	S	S	*	*			trans	19	149.6	155.2	-71.8	-103.1	0	0	0	124.1	K449 S450	K449-F493 VanDerWaalsContact N-N 3.19Å; K449-F493 PolarHBondContact O-N 3.08Å; S450-F493 VanDerWaalsContact O-CE2 3.23Å; S450-F493 WeakPolarHBondContact O-CE2 3.4Å
494	R	32.1	Very low	33.5	Very low	165 Å²	165	147.1 Å²	147.1	62%	0.623	74%	0.744	S	S	*	*			trans	-156.5	119.2	140	-113.5	-176.8	-141.7	-90.2	-1.7	116	Q446 D447	Q446-R494 PolarHBondContact O-NE 3.34Å; Q446-R494 PolarHBondContact O-NH2 3.12Å; D447-R494 VanDerWaalsContact OD1-CD 3.3Å; D447-R494 WeakPolarHBondContact OD1-CD 3.18Å; D447-R494 IonicContact OD1-NE 3.6Å; D447-R494 PolarHBondContact OD1-NE 3.02Å
495	T	32.3	Very low	33.8	Very low	134 Å²	134	150.2 Å²	150.2	82%	0.822	75%	0.746	S	S	*	*			trans	28	128.8	144.2	55.5	0	0	0	0	122.9
496	G	27.6	Very low	34.4	Very low	82 Å²	82	147 Å²	147	85%	0.845	73%	0.734	S	S	*	*			trans	-179.9	100.4	154.4	0	0	0	0	0	114.5
497	R	47.6	Very low	35	Very low	243 Å²	243	148.6 Å²	148.6	92%	0.917	73%	0.725	S	S	*	*			trans	-86.3	121.1	167.2	-62.1	-176.6	-168.1	-153.5	3.2	109.2
498	Y	33.9	Very low	35.7	Very low	225 Å²	225	149.6 Å²	149.6	88%	0.882	72%	0.722	S	S	*	*			trans	-169.6	164	145.2	-109.4	-71.5	0	0	0	109.7
499	F	29.6	Very low	36.7	Very low	168 Å²	168	148.9 Å²	148.9	74%	0.737	73%	0.726	S	S	*	*			trans	58.4	86.7	179.8	-80.4	-94.7	0	0	0	117.1	K501	F499-K501 HydrophobicContact CD1-CD 4.38Å; F499-K501 HydrophobicContact CE1-CD 4.49Å
500	N	30.7	Very low	37.5	Very low	171 Å²	171	153.5 Å²	153.5	91%	0.914	74%	0.738	S	S	*	*			trans	-91.7	112.4	140	-100.9	-32.9	0	0	0	108.6
501	K	34.4	Very low	38.2	Very low	150 Å²	150	154 Å²	154	65%	0.652	74%	0.736	S	S	*	*			trans	-125.7	126.8	162.9	-135.6	85	171.1	-171.9	0	104.9	F499 F503	F499-K501 HydrophobicContact CD1-CD 4.38Å; F499-K501 HydrophobicContact CE1-CD 4.49Å; K501-F503 PolarHBondContact O-N 2.75Å
502	P	35.6	Very low	39.2	Very low	116 Å²	116	149.4 Å²	149.4	75%	0.753	73%	0.728	S	S	*	*			trans	-68.2	110.9	-179.6	26.9	-32.8	0	0	0	109.7
503	F	30.5	Very low	39.7	Very low	196 Å²	196	153.1 Å²	153.1	86%	0.86	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-66.2	135.3	167.1	-94.6	-100.2	0	0	0	109.3	K501	K501-F503 PolarHBondContact O-N 2.75Å
504	M	37.6	Very low	40.9	Very low	157 Å²	157	157.3 Å²	157.3	77%	0.773	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-70	130.3	166	-63.7	-65.8	97.2	0	0	108.5	P506	M504-P506 WeakPolarHBondContact O-CD 3.42Å
505	N	34.6	Very low	41.9	Very low	126 Å²	126	155 Å²	155	67%	0.674	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-80.6	116.3	-173.6	-169.6	-5.9	0	0	0	110.3	N507	N505-N507 PolarHBondContact O-N 3.12Å; N505-N507 PolarHBondContact OD1-ND2 2.95Å
506	P	45	Very low	43.3	Very low	105 Å²	105	151.1 Å²	151.1	68%	0.682	72%	0.721	S	S	*	*			trans	-80	21	-166.9	33.8	-38.4	0	0	0	114.9	M504 F508	M504-P506 WeakPolarHBondContact O-CD 3.42Å; P506-F508 PolarHBondContact O-N 3.36Å
507	N	43.8	Very low	45.2	Very low	107 Å²	107	150.5 Å²	150.5	57%	0.572	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	21.6	-165.6	-81.2	-63.9	0	0	0	115.9	N505	N505-N507 PolarHBondContact O-N 3.12Å; N505-N507 PolarHBondContact OD1-ND2 2.95Å
508	F	45.2	Very low	45.9	Very low	178 Å²	178	143.7 Å²	143.7	78%	0.781	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-24.7	171.5	-103.1	-91.4	0	0	0	113.3	P506 R510	P506-F508 PolarHBondContact O-N 3.36Å; F508-R510 PolarHBondContact O-N 2.96Å
509	D	49.5	Very low	47.2	Very low	154 Å²	154	140 Å²	140	82%	0.824	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	28.2	-175.5	-69.5	-51.8	0	0	0	114.8
510	R	51.4	Low	48.7	Very low	221 Å²	221	137 Å²	137	83%	0.834	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	12	172.7	-74.5	-165.4	175.5	-155.4	0.3	115	F508	F508-R510 PolarHBondContact O-N 2.96Å
511	R	49.9	Very low	50.3	Low	156 Å²	156	131.6 Å²	131.6	59%	0.589	64%	0.642	S	S	*	*	S	Bend	trans	-81.1	128.7	160.8	-88	-176.7	156.2	-155.2	-6.3	110.1
512	P	54	Low	51.6	Low	70 Å²	70	131 Å²	131	46%	0.455	64%	0.641	S	S	.	*			trans	-66.5	139.1	174.9	29	-34.4	0	0	0	110.4	W514 L515	P512-W514 HydrophobicContact CB-CZ2 4.41Å; P512-W514 PolarHBondContact O-N 2.82Å; P512-L515 PolarHBondContact O-N 3.4Å; P512-L515 VanDerWaalsContact O-N 3.1Å
513	K	56	Low	52.5	Low	156 Å²	156	130.7 Å²	130.7	68%	0.678	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-72.3	-9.2	-156.2	-159.6	154.7	-172.7	161	0	115.9	L515	K513-L515 VanDerWaalsContact C-N 3.32Å
514	W	56.8	Low	53.8	Low	223 Å²	223	126.5 Å²	126.5	85%	0.845	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-83.1	-1	173.7	26.8	88.2	0	0	0	114.1	P512	P512-W514 HydrophobicContact CB-CZ2 4.41Å; P512-W514 PolarHBondContact O-N 2.82Å
515	L	53.9	Low	54.8	Low	117 Å²	117	127.5 Å²	127.5	61%	0.613	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-109.9	24.6	178.6	-117.4	74.2	0	0	0	114	P512 K513	P512-L515 PolarHBondContact O-N 3.4Å; P512-L515 VanDerWaalsContact O-N 3.1Å; K513-L515 VanDerWaalsContact C-N 3.32Å
516	I	60.8	Low	55.7	Low	52 Å²	52	127.5 Å²	127.5	27%	0.267	61%	0.61	S	S	.	*	S	Bend	trans	-120.1	123	179.3	-54.9	179.8	0	0	0	108.5	E520 V521	I516-E520 HydrophobicContact CG2-CB 3.96Å; I516-E520 HydrophobicContact CG2-CG 4.19Å; I516-E520 WeakPolarHBondContact CG2-OE2 3.42Å; I516-V521 HydrophobicContact CB-CG2 4.16Å; I516-V521 HydrophobicContact CG2-CG2 3.61Å
517	P	67.9	Low	56	Low	70 Å²	70	129.8 Å²	129.8	46%	0.455	61%	0.609	S	S	.	*			trans	-58.9	146	176.8	-24.9	35.3	0	0	0	112.5	E519 E520 V521	P517-E519 VanDerWaalsContact C-N 3.27Å; P517-E519 PolarHBondContact O-N 3.28Å; P517-E519 VanDerWaalsContact O-N 3.15Å; P517-E520 PolarHBondContact O-N 2.88Å; P517-E520 VanDerWaalsContact O-N 3.13Å; P517-V521 PolarHBondContact O-N 3.41Å
518	P	63.8	Low	56.2	Low	100 Å²	100	133.3 Å²	133.3	65%	0.649	61%	0.614	S	S	*	*	H	α-helix	trans	-55.7	-36	-174.5	-28.6	36.2	0	0	0	115	V521 Q522	P518-V521 PolarHBondContact O-N 3.3Å; P518-Q522 PolarHBondContact O-N 3.04Å
519	E	60.4	Low	56.4	Low	148 Å²	148	130.9 Å²	130.9	69%	0.692	61%	0.606	S	S	*	*	H	α-helix	trans	-65.6	-39.4	-179.8	-60.8	174.9	130.4	0	0	112.4	P517 V521 Q522 L523	P517-E519 VanDerWaalsContact C-N 3.27Å; P517-E519 PolarHBondContact O-N 3.28Å; P517-E519 VanDerWaalsContact O-N 3.15Å; E519-V521 VanDerWaalsContact C-N 3.26Å; E519-V521 PolarHBondContact O-N 2.96Å; E519-Q522 PolarHBondContact O-N 2.84Å; E519-Q522 VanDerWaalsContact O-N 3.12Å; E519-L523 PolarHBondContact O-N 3.05Å
520	E	60	Low	56.2	Low	105 Å²	105	127.9 Å²	127.9	49%	0.491	60%	0.596	S	S	.	*	H	α-helix	trans	-66.7	-31.2	178.3	-168.5	173.3	-146.5	0	0	111.1	I516 P517 L524	I516-E520 HydrophobicContact CG2-CB 3.96Å; I516-E520 HydrophobicContact CG2-CG 4.19Å; I516-E520 WeakPolarHBondContact CG2-OE2 3.42Å; P517-E520 PolarHBondContact O-N 2.88Å; P517-E520 VanDerWaalsContact O-N 3.13Å; E520-L524 WeakPolarHBondContact O-CB 3.16Å; E520-L524 PolarHBondContact O-N 2.63Å; E520-L524 VanDerWaalsContact O-N 3.1Å
521	V	65.6	Low	55.8	Low	56 Å²	56	125.3 Å²	125.3	34%	0.339	59%	0.592	S	S	.	*	H	α-helix	trans	-71.2	-33.7	173.3	-174.2	0	0	0	0	112.1	I516 P517 P518 E519 R525	I516-V521 HydrophobicContact CB-CG2 4.16Å; I516-V521 HydrophobicContact CG2-CG2 3.61Å; P517-V521 PolarHBondContact O-N 3.41Å; P518-V521 PolarHBondContact O-N 3.3Å; E519-V521 VanDerWaalsContact C-N 3.26Å; E519-V521 PolarHBondContact O-N 2.96Å; V521-R525 PolarHBondContact O-N 3.3Å; V521-R525 VanDerWaalsContact O-N 3.14Å
522	Q	60.4	Low	55.7	Low	137 Å²	137	124.8 Å²	124.8	64%	0.64	60%	0.596	S	S	*	*	H	α-helix	trans	-69.8	-50.1	176.1	-68.9	-179.3	8.2	0	0	111.1	P518 E519 L524 R525 E526	P518-Q522 PolarHBondContact O-N 3.04Å; E519-Q522 PolarHBondContact O-N 2.84Å; E519-Q522 VanDerWaalsContact O-N 3.12Å; Q522-L524 VanDerWaalsContact C-N 3.26Å; Q522-L524 PolarHBondContact O-N 3.15Å; Q522-R525 WeakPolarHBondContact O-CB 3.46Å; Q522-R525 PolarHBondContact O-N 3.21Å; Q522-E526 PolarHBondContact O-N 3.31Å
523	L	54.9	Low	55.6	Low	110 Å²	110	128.7 Å²	128.7	58%	0.576	61%	0.613	S	S	*	*	H	α-helix	trans	-55.2	-40.3	174.6	-77.9	164.7	0	0	0	112.1	E519 K527	E519-L523 PolarHBondContact O-N 3.05Å; L523-K527 WeakPolarHBondContact O-CB 3.38Å; L523-K527 PolarHBondContact O-N 3.28Å
524	L	59.3	Low	55.5	Low	109 Å²	109	130 Å²	130	57%	0.571	62%	0.619	S	S	*	*	H	α-helix	trans	-71.6	-27.4	177.9	-164	66.5	0	0	0	113.2	E520 Q522 R528	E520-L524 WeakPolarHBondContact O-CB 3.16Å; E520-L524 PolarHBondContact O-N 2.63Å; E520-L524 VanDerWaalsContact O-N 3.1Å; Q522-L524 VanDerWaalsContact C-N 3.26Å; Q522-L524 PolarHBondContact O-N 3.15Å; L524-R528 WeakPolarHBondContact O-CG 3.47Å
525	R	56.6	Low	55.1	Low	177 Å²	177	123.8 Å²	123.8	67%	0.668	62%	0.624	S	S	*	*	H	α-helix	trans	-72.1	-50.9	172.8	178.5	-179.8	-70.7	-149.2	-1	111	V521 Q522 K527 R528 Q529	V521-R525 PolarHBondContact O-N 3.3Å; V521-R525 VanDerWaalsContact O-N 3.14Å; Q522-R525 WeakPolarHBondContact O-CB 3.46Å; Q522-R525 PolarHBondContact O-N 3.21Å; R525-K527 VanDerWaalsContact C-N 3.33Å; R525-K527 PolarHBondContact O-N 2.92Å; R525-R528 PolarHBondContact O-N 3.08Å; R525-Q529 PolarHBondContact O-N 2.8Å; R525-Q529 VanDerWaalsContact O-N 3.08Å
526	E	53.9	Low	54.8	Low	127 Å²	127	120.9 Å²	120.9	59%	0.593	62%	0.621	S	S	*	*	H	α-helix	trans	-57.8	-45.9	179.5	-176.2	175.3	-134.5	0	0	111.4	Q522 R528 Q529 S530	Q522-E526 PolarHBondContact O-N 3.31Å; E526-R528 PolarHBondContact O-N 3.31Å; E526-R528 VanDerWaalsContact O-N 3.16Å; E526-Q529 PolarHBondContact O-N 2.82Å; E526-S530 PolarHBondContact O-N 3.05Å
527	K	52.8	Low	54.4	Low	152 Å²	152	127.1 Å²	127.1	66%	0.661	65%	0.65	S	S	*	*	H	α-helix	trans	-63.5	-19.5	176.7	-161.6	168.1	-170.1	170	0	114	L523 R525 F531	L523-K527 WeakPolarHBondContact O-CB 3.38Å; L523-K527 PolarHBondContact O-N 3.28Å; R525-K527 VanDerWaalsContact C-N 3.33Å; R525-K527 PolarHBondContact O-N 2.92Å; K527-F531 WeakPolarHBondContact O-CD2 3.48Å
528	R	47.9	Very low	53.3	Low	181 Å²	181	131.8 Å²	131.8	68%	0.683	67%	0.667	S	S	*	*	H	α-helix	trans	-89.4	-28.5	170.3	-71.5	-171.9	74.1	-161.9	1.6	113.5	L524 R525 E526 H532	L524-R528 WeakPolarHBondContact O-CG 3.47Å; R525-R528 PolarHBondContact O-N 3.08Å; E526-R528 PolarHBondContact O-N 3.31Å; E526-R528 VanDerWaalsContact O-N 3.16Å; R528-H532 PolarHBondContact O-ND1 3.11Å
529	Q	49.2	Very low	52.7	Low	128 Å²	128	132.7 Å²	132.7	60%	0.598	67%	0.671	S	S	*	*	H	α-helix	trans	-69.9	-36.9	174	-71.9	176.8	-66.3	0	0	111.7	R525 E526 F531 H532	R525-Q529 PolarHBondContact O-N 2.8Å; R525-Q529 VanDerWaalsContact O-N 3.08Å; E526-Q529 PolarHBondContact O-N 2.82Å; Q529-F531 PolarHBondContact O-N 3.21Å; Q529-H532 PolarHBondContact O-N 3.16Å; Q529-H532 VanDerWaalsContact O-N 3.1Å
530	S	44.3	Very low	52.7	Low	90 Å²	90	132.9 Å²	132.9	63%	0.629	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52	-28.2	177.8	-173.1	0	0	0	0	114.7	E526	E526-S530 PolarHBondContact O-N 3.05Å
531	F	43.6	Very low	52.8	Low	167 Å²	167	132.4 Å²	132.4	73%	0.732	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-8.8	-178.2	-81.2	-81.8	0	0	0	116	K527 Q529	K527-F531 WeakPolarHBondContact O-CD2 3.48Å; Q529-F531 PolarHBondContact O-N 3.21Å
532	H	48	Very low	53.2	Low	146 Å²	146	133.2 Å²	133.2	68%	0.676	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	-18.2	-172.5	-72.7	84.2	0	0	0	114.8	R528 Q529 K534	R528-H532 PolarHBondContact O-ND1 3.11Å; Q529-H532 PolarHBondContact O-N 3.16Å; Q529-H532 VanDerWaalsContact O-N 3.1Å; H532-K534 PolarHBondContact O-N 3.01Å
533	N	51.3	Low	53.4	Low	152 Å²	152	134.7 Å²	134.7	81%	0.813	69%	0.686	S	S	*	*			trans	-96.1	70.6	-178.7	-72.8	-5.5	0	0	0	112.4
534	K	53.7	Low	54.5	Low	184 Å²	184	134.7 Å²	134.7	80%	0.8	69%	0.687	S	S	*	*			trans	-133.1	44.7	166.4	-69.9	-162.8	176.3	-171.3	0	113.2	H532 G536	H532-K534 PolarHBondContact O-N 3.01Å; K534-G536 PolarHBondContact O-N 3.43Å
535	G	49.1	Very low	55.5	Low	92 Å²	92	135.6 Å²	135.6	95%	0.948	69%	0.686	S	S	*	*			trans	-77.3	27.4	160.8	0	0	0	0	0	113.4
536	G	46.8	Very low	56.4	Low	55 Å²	55	133.2 Å²	133.2	57%	0.567	68%	0.681	S	S	*	*	S	Bend	trans	-100.2	132.9	179.5	0	0	0	0	0	110.4	K534 M538	K534-G536 PolarHBondContact O-N 3.43Å; G536-M538 PolarHBondContact O-N 3.27Å; G536-M538 VanDerWaalsContact O-N 3.08Å
537	E	52.3	Low	57.7	Low	184 Å²	184	132.6 Å²	132.6	86%	0.86	68%	0.676	S	S	*	*			trans	-44.3	107.2	-175.9	-171.2	168.9	-155.6	0	0	113.5	V539	E537-V539 PolarHBondContact O-N 3.1Å
538	M	45.1	Very low	59	Low	167 Å²	167	130.2 Å²	130.2	82%	0.823	67%	0.667	S	S	*	*			trans	-74	88.1	175.1	-79	-80	-68.6	0	0	109.3	G536 I540	G536-M538 PolarHBondContact O-N 3.27Å; G536-M538 VanDerWaalsContact O-N 3.08Å; M538-I540 WeakPolarHBondContact O-CG1 3.31Å; M538-I540 PolarHBondContact O-N 2.96Å
539	V	52.5	Low	60.6	Low	120 Å²	120	124.9 Å²	124.9	73%	0.727	65%	0.65	S	S	*	*			trans	-58.4	102.2	169.8	179.9	0	0	0	0	108.7	E537 L541	E537-V539 PolarHBondContact O-N 3.1Å; V539-L541 PolarHBondContact O-N 3Å
540	I	59.2	Low	62.2	Low	152 Å²	152	125.7 Å²	125.7	78%	0.779	65%	0.652	S	S	*	*			trans	-70.5	101	-177.2	-55.3	-177.8	0	0	0	107.9	M538	M538-I540 WeakPolarHBondContact O-CG1 3.31Å; M538-I540 PolarHBondContact O-N 2.96Å
541	L	61.5	Low	64	Low	94 Å²	94	125.5 Å²	125.5	49%	0.492	64%	0.641	S	S	.	*			trans	-53.3	128.3	167.4	-76.4	172.1	0	0	0	108.7	V539 F543	V539-L541 PolarHBondContact O-N 3Å; L541-F543 PolarHBondContact O-N 3.14Å
542	P	73.9	Confident	65.9	Low	74 Å²	74	121.4 Å²	121.4	48%	0.481	62%	0.624	S	S	.	*			trans	-48.9	140.9	-177.6	-32	36	0	0	0	112.6	D544 K545 F546	P542-D544 PolarHBondContact O-N 3.2Å; P542-K545 WeakPolarHBondContact O-CB 3.44Å; P542-K545 PolarHBondContact O-N 2.7Å; P542-F546 PolarHBondContact O-N 3.13Å
543	F	65.5	Low	67.6	Low	168 Å²	168	120.7 Å²	120.7	74%	0.737	62%	0.615	S	S	*	*	H	α-helix	trans	-51.5	-36.7	-168.8	-172	-101	0	0	0	113	L541 K545 F546 K547	L541-F543 PolarHBondContact O-N 3.14Å; F543-K545 PolarHBondContact O-N 3.35Å; F543-F546 PolarHBondContact O-N 3.35Å; F543-K547 WeakPolarHBondContact O-CB 3.28Å; F543-K547 PolarHBondContact O-N 3.01Å
544	D	78.4	Confident	69	Low	110 Å²	110	118.3 Å²	118.3	59%	0.588	60%	0.601	S	S	*	*	H	α-helix	trans	-62.6	-39.9	176.9	-54.6	-66.7	0	0	0	113.1	P542 F546 K547 E548	P542-D544 PolarHBondContact O-N 3.2Å; D544-F546 VanDerWaalsContact C-N 3.3Å; D544-F546 PolarHBondContact O-N 2.87Å; D544-K547 PolarHBondContact O-N 3.31Å; D544-E548 VanDerWaalsContact O-CB 3.24Å; D544-E548 WeakPolarHBondContact O-CB 3.45Å; D544-E548 PolarHBondContact O-N 3.38Å
545	K	79.5	Confident	70.7	Confident	128 Å²	128	116.7 Å²	116.7	56%	0.557	59%	0.59	S	S	*	*	H	α-helix	trans	-67.3	-32.1	174.9	-64.1	-169.5	177.5	-174.7	0	111.8	P542 F543 Q549	P542-K545 WeakPolarHBondContact O-CB 3.44Å; P542-K545 PolarHBondContact O-N 2.7Å; F543-K545 PolarHBondContact O-N 3.35Å; K545-Q549 VanDerWaalsContact O-CB 3.24Å; K545-Q549 WeakPolarHBondContact O-CB 3.33Å; K545-Q549 PolarHBondContact O-N 3.48Å
546	F	75.9	Confident	72.6	Confident	126 Å²	126	116.2 Å²	116.2	55%	0.553	56%	0.563	S	S	*	*	H	α-helix	trans	-75.2	-37.3	176	-149	-80.6	0	0	0	111.9	P542 F543 D544 K550	P542-F546 PolarHBondContact O-N 3.13Å; F543-F546 PolarHBondContact O-N 3.35Å; D544-F546 VanDerWaalsContact C-N 3.3Å; D544-F546 PolarHBondContact O-N 2.87Å; F546-K550 WeakPolarHBondContact O-CB 3.18Å; F546-K550 PolarHBondContact O-N 3.01Å; F546-K550 VanDerWaalsContact O-N 3.07Å
547	K	80.4	Confident	74.6	Confident	115 Å²	115	119.3 Å²	119.3	50%	0.5	56%	0.562	S	S	.	*	H	α-helix	trans	-64	-46.5	171.2	-178.5	-173.5	172.7	-167.5	0	111.1	F543 D544 K550 E551	F543-K547 WeakPolarHBondContact O-CB 3.28Å; F543-K547 PolarHBondContact O-N 3.01Å; D544-K547 PolarHBondContact O-N 3.31Å; K547-K550 WeakPolarHBondContact O-CB 3.08Å; K547-K550 PolarHBondContact O-N 3.11Å; K547-E551 PolarHBondContact O-N 3.46Å
548	E	81.3	Confident	76.3	Confident	101 Å²	101	115.7 Å²	115.7	47%	0.472	55%	0.547	S	S	.	.	H	α-helix	trans	-62.6	-49.5	177	-171.2	-172.5	-177.4	0	0	111.3	D544 K550 E551 Q552	D544-E548 VanDerWaalsContact O-CB 3.24Å; D544-E548 WeakPolarHBondContact O-CB 3.45Å; D544-E548 PolarHBondContact O-N 3.38Å; E548-K550 PolarHBondContact O-N 3.34Å; E548-E551 CarbonylContact O-C 3.59Å; E548-E551 WeakPolarHBondContact O-CA 3.38Å; E548-E551 PolarHBondContact O-N 2.93Å; E548-Q552 HydrophobicContact CG-CG 4.31Å; E548-Q552 WeakPolarHBondContact O-CG 3.44Å; E548-Q552 PolarHBondContact O-N 2.73Å; E548-Q552 PolarHBondContact OE1-NE2 3.46Å
549	Q	81.6	Confident	78.4	Confident	70 Å²	70	112 Å²	112	33%	0.327	53%	0.528	S	S	.	.	H	α-helix	trans	-59.7	-32.5	176.4	-173.9	-179.9	100	0	0	112.1	K545 R553	K545-Q549 VanDerWaalsContact O-CB 3.24Å; K545-Q549 WeakPolarHBondContact O-CB 3.33Å; K545-Q549 PolarHBondContact O-N 3.48Å; Q549-R553 WeakPolarHBondContact O-CB 3.33Å; Q549-R553 VanDerWaalsContact O-CG 3.3Å; Q549-R553 WeakPolarHBondContact O-CG 3.46Å; Q549-R553 PolarHBondContact O-N 3.22Å
550	K	83.1	Confident	80.2	Confident	145 Å²	145	113.9 Å²	113.9	63%	0.63	52%	0.522	S	S	*	.	H	α-helix	trans	-70.5	-40.9	173.5	-174.1	-178.9	177.7	-174.2	0	111.8	F546 K547 E548 M554	F546-K550 WeakPolarHBondContact O-CB 3.18Å; F546-K550 PolarHBondContact O-N 3.01Å; F546-K550 VanDerWaalsContact O-N 3.07Å; K547-K550 WeakPolarHBondContact O-CB 3.08Å; K547-K550 PolarHBondContact O-N 3.11Å; E548-K550 PolarHBondContact O-N 3.34Å; K550-M554 WeakPolarHBondContact O-CG 3.21Å; K550-M554 PolarHBondContact O-N 2.95Å
551	E	81.7	Confident	81.7	Confident	85 Å²	85	113.4 Å²	113.4	40%	0.397	51%	0.514	S	S	.	.	H	α-helix	trans	-65.7	-45.1	172.8	-80.3	-170.1	-147.3	0	0	112.6	K547 E548 R553 M554 R555	K547-E551 PolarHBondContact O-N 3.46Å; E548-E551 CarbonylContact O-C 3.59Å; E548-E551 WeakPolarHBondContact O-CA 3.38Å; E548-E551 PolarHBondContact O-N 2.93Å; E551-R553 VanDerWaalsContact C-N 3.34Å; E551-R553 PolarHBondContact O-N 3.08Å; E551-M554 CarbonylContact O-C 3.56Å; E551-M554 WeakPolarHBondContact O-CA 3.12Å; E551-M554 WeakPolarHBondContact O-CB 3.16Å; E551-M554 PolarHBondContact O-N 2.88Å; E551-R555 WeakPolarHBondContact O-CG 3.4Å; E551-R555 PolarHBondContact O-N 2.93Å; E551-R555 IonicContact OE2-CZ 3.75Å; E551-R555 IonicContact OE2-NE 3.98Å; E551-R555 IonicContact OE2-NH2 2.74Å; E551-R555 PolarHBondContact OE2-NH2 3.07Å
552	Q	82.8	Confident	83.1	Confident	82 Å²	82	115 Å²	115	38%	0.383	52%	0.519	S	S	.	.	H	α-helix	trans	-57	-47.3	176	-70.5	173.5	-1.1	0	0	110.6	E548 M554 R555 E556	E548-Q552 HydrophobicContact CG-CG 4.31Å; E548-Q552 WeakPolarHBondContact O-CG 3.44Å; E548-Q552 PolarHBondContact O-N 2.73Å; E548-Q552 PolarHBondContact OE1-NE2 3.46Å; Q552-M554 VanDerWaalsContact C-N 3.32Å; Q552-M554 PolarHBondContact O-N 3.08Å; Q552-R555 PolarHBondContact O-N 3.07Å; Q552-E556 PolarHBondContact O-N 3.44Å
553	R	83.3	Confident	83.9	Confident	130 Å²	130	118.5 Å²	118.5	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-61	-35.5	173.3	-75.7	176.5	179.1	137.9	7.5	113.7	Q549 E551 Q557	Q549-R553 WeakPolarHBondContact O-CB 3.33Å; Q549-R553 VanDerWaalsContact O-CG 3.3Å; Q549-R553 WeakPolarHBondContact O-CG 3.46Å; Q549-R553 PolarHBondContact O-N 3.22Å; E551-R553 VanDerWaalsContact C-N 3.34Å; E551-R553 PolarHBondContact O-N 3.08Å; R553-Q557 WeakPolarHBondContact O-CB 3.4Å; R553-Q557 VanDerWaalsContact O-CG 3.3Å; R553-Q557 WeakPolarHBondContact O-CG 3.42Å; R553-Q557 PolarHBondContact O-N 3.32Å
554	M	82.6	Confident	85.1	Confident	102 Å²	102	113.1 Å²	113.1	50%	0.502	51%	0.509	S	S	.	.	H	α-helix	trans	-69.8	-41.1	173.9	-74.7	-59.7	-52.6	0	0	111.9	K550 E551 Q552 Q557 M558	K550-M554 WeakPolarHBondContact O-CG 3.21Å; K550-M554 PolarHBondContact O-N 2.95Å; E551-M554 CarbonylContact O-C 3.56Å; E551-M554 WeakPolarHBondContact O-CA 3.12Å; E551-M554 WeakPolarHBondContact O-CB 3.16Å; E551-M554 PolarHBondContact O-N 2.88Å; Q552-M554 VanDerWaalsContact C-N 3.32Å; Q552-M554 PolarHBondContact O-N 3.08Å; M554-Q557 PolarHBondContact O-N 3.37Å; M554-M558 VanDerWaalsContact O-CG 3.28Å; M554-M558 WeakPolarHBondContact O-CG 3.16Å; M554-M558 PolarHBondContact O-N 3.16Å
555	R	87.9	Confident	85.8	Confident	151 Å²	151	110 Å²	110	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-61.2	-48.5	174.5	-66.4	172.3	-155.6	174.3	7.2	110.2	E551 Q552 Q557 M558 E559	E551-R555 WeakPolarHBondContact O-CG 3.4Å; E551-R555 PolarHBondContact O-N 2.93Å; E551-R555 IonicContact OE2-CZ 3.75Å; E551-R555 IonicContact OE2-NE 3.98Å; E551-R555 IonicContact OE2-NH2 2.74Å; E551-R555 PolarHBondContact OE2-NH2 3.07Å; Q552-R555 PolarHBondContact O-N 3.07Å; R555-Q557 VanDerWaalsContact C-N 3.35Å; R555-Q557 PolarHBondContact O-N 3.25Å; R555-M558 PolarHBondContact O-N 2.66Å; R555-E559 WeakPolarHBondContact O-CB 3.31Å; R555-E559 PolarHBondContact O-N 2.93Å
556	E	88.9	Confident	86.4	Confident	81 Å²	81	110.4 Å²	110.4	38%	0.379	50%	0.503	S	S	.	.	H	α-helix	trans	-57.6	-41.8	173.6	-77.2	-176.6	-121.7	0	0	113.1	Q552 E559 R560	Q552-E556 PolarHBondContact O-N 3.44Å; E556-E559 PolarHBondContact O-N 3.31Å; E556-R560 WeakPolarHBondContact O-CB 3.44Å; E556-R560 WeakPolarHBondContact O-CD 3.35Å; E556-R560 WeakPolarHBondContact O-CG 3.49Å; E556-R560 PolarHBondContact O-N 2.85Å; E556-R560 IonicContact OE2-CZ 2.75Å; E556-R560 IonicContact OE2-NE 2.65Å; E556-R560 IonicContact OE2-NH2 3.39Å; E556-R560 PolarHBondContact OE2-NH2 2.98Å
557	Q	89.6	Confident	87.2	Confident	120 Å²	120	109.1 Å²	109.1	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-67.4	-41.4	178.2	-78.1	-179.9	19.1	0	0	111.9	R553 M554 R555 E559 F561	R553-Q557 WeakPolarHBondContact O-CB 3.4Å; R553-Q557 VanDerWaalsContact O-CG 3.3Å; R553-Q557 WeakPolarHBondContact O-CG 3.42Å; R553-Q557 PolarHBondContact O-N 3.32Å; M554-Q557 PolarHBondContact O-N 3.37Å; R555-Q557 VanDerWaalsContact C-N 3.35Å; R555-Q557 PolarHBondContact O-N 3.25Å; Q557-E559 VanDerWaalsContact C-N 3.34Å; Q557-F561 WeakPolarHBondContact O-CB 3.35Å; Q557-F561 PolarHBondContact O-N 3.34Å
558	M	86.8	Confident	87.6	Confident	108 Å²	108	112.9 Å²	112.9	53%	0.532	51%	0.512	S	S	.	.	H	α-helix	trans	-66.2	-36.7	174.4	-67.5	-65.2	-73.9	0	0	111.6	M554 R555 F561 H562	M554-M558 VanDerWaalsContact O-CG 3.28Å; M554-M558 WeakPolarHBondContact O-CG 3.16Å; M554-M558 PolarHBondContact O-N 3.16Å; R555-M558 PolarHBondContact O-N 2.66Å; M558-F561 PolarHBondContact O-N 2.94Å; M558-H562 PolarHBondContact O-CD2 3.07Å; M558-H562 PolarHBondContact O-N 2.82Å
559	E	90.7	Very high	88.1	Confident	91 Å²	91	116.2 Å²	116.2	43%	0.425	52%	0.52	S	S	.	.	H	α-helix	trans	-68.4	-46.4	176	-158.1	-148.5	153.6	0	0	111.6	R555 E556 Q557 F561 H562 R563	R555-E559 WeakPolarHBondContact O-CB 3.31Å; R555-E559 PolarHBondContact O-N 2.93Å; E556-E559 PolarHBondContact O-N 3.31Å; Q557-E559 VanDerWaalsContact C-N 3.34Å; E559-F561 VanDerWaalsContact C-N 3.26Å; E559-F561 PolarHBondContact O-N 3.23Å; E559-H562 PolarHBondContact O-N 3.15Å; E559-H562 VanDerWaalsContact O-N 3.13Å; E559-R563 VanDerWaalsContact CD-NH2 3.29Å; E559-R563 WeakPolarHBondContact O-CG 3.36Å; E559-R563 PolarHBondContact O-N 3.12Å; E559-R563 IonicContact OE1-CZ 3.27Å; E559-R563 IonicContact OE1-NE 2.76Å; E559-R563 PolarHBondContact OE1-NE 3.15Å; E559-R563 IonicContact OE1-NH2 2.87Å; E559-R563 PolarHBondContact OE1-NH2 2.91Å; E559-R563 IonicContact OE2-NH2 3.14Å; E559-R563 PolarHBondContact OE2-NH2 3.37Å
560	R	89.5	Confident	88.4	Confident	159 Å²	159	121.9 Å²	121.9	60%	0.6	54%	0.539	S	S	*	.	H	α-helix	trans	-58.6	-38.9	172.7	-69.8	165.5	-163.2	-135.3	9.6	111.1	E556 A564	E556-R560 WeakPolarHBondContact O-CB 3.44Å; E556-R560 WeakPolarHBondContact O-CD 3.35Å; E556-R560 WeakPolarHBondContact O-CG 3.49Å; E556-R560 PolarHBondContact O-N 2.85Å; E556-R560 IonicContact OE2-CZ 2.75Å; E556-R560 IonicContact OE2-NE 2.65Å; E556-R560 IonicContact OE2-NH2 3.39Å; E556-R560 PolarHBondContact OE2-NH2 2.98Å; R560-A564 VanDerWaalsContact O-CB 3.25Å; R560-A564 WeakPolarHBondContact O-CB 3.28Å; R560-A564 PolarHBondContact O-N 3.31Å
561	F	91.6	Very high	88.8	Confident	141 Å²	141	124 Å²	124	62%	0.618	54%	0.542	S	S	*	.	H	α-helix	trans	-65.3	-44	173.7	-176.5	-95.9	0	0	0	112	Q557 M558 E559 A564 A565	Q557-F561 WeakPolarHBondContact O-CB 3.35Å; Q557-F561 PolarHBondContact O-N 3.34Å; M558-F561 PolarHBondContact O-N 2.94Å; E559-F561 VanDerWaalsContact C-N 3.26Å; E559-F561 PolarHBondContact O-N 3.23Å; F561-A564 PolarHBondContact O-N 3.46Å; F561-A565 WeakPolarHBondContact O-CB 3.38Å; F561-A565 PolarHBondContact O-N 3.15Å
562	H	89.8	Confident	89.2	Confident	128 Å²	128	124.5 Å²	124.5	59%	0.593	55%	0.545	S	S	*	.	H	α-helix	trans	-61.4	-49.3	174.5	-97	-85.5	0	0	0	112.3	M558 E559 A564 A565 E566	M558-H562 PolarHBondContact O-CD2 3.07Å; M558-H562 PolarHBondContact O-N 2.82Å; E559-H562 PolarHBondContact O-N 3.15Å; E559-H562 VanDerWaalsContact O-N 3.13Å; H562-A564 VanDerWaalsContact C-N 3.29Å; H562-A564 PolarHBondContact O-N 3.13Å; H562-A565 PolarHBondContact O-N 3.44Å; H562-E566 WeakPolarHBondContact O-CB 3.47Å; H562-E566 PolarHBondContact O-N 3.06Å
563	R	91	Very high	89.6	Confident	148 Å²	148	125 Å²	125	56%	0.558	55%	0.549	S	S	*	.	H	α-helix	trans	-59.4	-39.4	175.8	-62.7	-168.3	-151.5	169.2	7.5	111.5	E559 L567	E559-R563 VanDerWaalsContact CD-NH2 3.29Å; E559-R563 WeakPolarHBondContact O-CG 3.36Å; E559-R563 PolarHBondContact O-N 3.12Å; E559-R563 IonicContact OE1-CZ 3.27Å; E559-R563 IonicContact OE1-NE 2.76Å; E559-R563 PolarHBondContact OE1-NE 3.15Å; E559-R563 IonicContact OE1-NH2 2.87Å; E559-R563 PolarHBondContact OE1-NH2 2.91Å; E559-R563 IonicContact OE2-NH2 3.14Å; E559-R563 PolarHBondContact OE2-NH2 3.37Å; R563-L567 WeakPolarHBondContact O-CB 3.44Å; R563-L567 VanDerWaalsContact O-CG 3.27Å; R563-L567 WeakPolarHBondContact O-CG 3.41Å; R563-L567 PolarHBondContact O-N 3.2Å
564	A	91.3	Very high	89.9	Confident	55 Å²	55	121.3 Å²	121.3	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-68.4	-40.2	176.4	0	0	0	0	0	113	R560 F561 H562 R568	R560-A564 VanDerWaalsContact O-CB 3.25Å; R560-A564 WeakPolarHBondContact O-CB 3.28Å; R560-A564 PolarHBondContact O-N 3.31Å; F561-A564 PolarHBondContact O-N 3.46Å; H562-A564 VanDerWaalsContact C-N 3.29Å; H562-A564 PolarHBondContact O-N 3.13Å; A564-R568 WeakPolarHBondContact O-CB 3.43Å; A564-R568 PolarHBondContact O-N 3.16Å
565	A	92.3	Very high	90.2	Very high	45 Å²	45	121.1 Å²	121.1	37%	0.372	55%	0.545	S	S	.	.	H	α-helix	trans	-66.6	-38.9	175.1	0	0	0	0	0	111.9	F561 H562 R568 R569	F561-A565 WeakPolarHBondContact O-CB 3.38Å; F561-A565 PolarHBondContact O-N 3.15Å; H562-A565 PolarHBondContact O-N 3.44Å; A565-R568 WeakPolarHBondContact O-CB 3.46Å; A565-R568 PolarHBondContact O-N 2.89Å; A565-R569 WeakPolarHBondContact O-CB 3.49Å; A565-R569 PolarHBondContact O-N 3.36Å
566	E	92.3	Very high	90.4	Very high	136 Å²	136	118.9 Å²	118.9	64%	0.636	54%	0.541	S	S	*	.	H	α-helix	trans	-68.4	-41.8	175.5	-175.5	164.5	-144	0	0	112.1	H562 R568 R569 R570	H562-E566 WeakPolarHBondContact O-CB 3.47Å; H562-E566 PolarHBondContact O-N 3.06Å; E566-R568 VanDerWaalsContact C-N 3.29Å; E566-R568 PolarHBondContact O-N 3.1Å; E566-R569 PolarHBondContact O-N 2.82Å; E566-R570 WeakPolarHBondContact O-CB 3.21Å; E566-R570 PolarHBondContact O-N 3.4Å
567	L	92.4	Very high	90.5	Very high	99 Å²	99	119.2 Å²	119.2	52%	0.518	54%	0.542	S	S	.	.	H	α-helix	trans	-60.8	-37.5	170.7	-75.3	170.1	0	0	0	112.1	R563 R571	R563-L567 WeakPolarHBondContact O-CB 3.44Å; R563-L567 VanDerWaalsContact O-CG 3.27Å; R563-L567 WeakPolarHBondContact O-CG 3.41Å; R563-L567 PolarHBondContact O-N 3.2Å; L567-R571 VanDerWaalsContact O-CG 3.28Å; L567-R571 WeakPolarHBondContact O-CG 3.34Å; L567-R571 PolarHBondContact O-N 3.12Å
568	R	89.6	Confident	90.5	Very high	193 Å²	193	121.1 Å²	121.1	73%	0.728	54%	0.544	S	S	*	.	H	α-helix	trans	-64.4	-48.9	173.4	-175.7	176.9	-179.8	162.3	1.5	111.4	A564 A565 E566 R570 R571 E572	A564-R568 WeakPolarHBondContact O-CB 3.43Å; A564-R568 PolarHBondContact O-N 3.16Å; A565-R568 WeakPolarHBondContact O-CB 3.46Å; A565-R568 PolarHBondContact O-N 2.89Å; E566-R568 VanDerWaalsContact C-N 3.29Å; E566-R568 PolarHBondContact O-N 3.1Å; R568-R570 VanDerWaalsContact C-N 3.32Å; R568-R570 PolarHBondContact O-N 3.33Å; R568-R571 PolarHBondContact O-N 2.85Å; R568-E572 PolarHBondContact O-N 2.84Å
569	R	91.9	Very high	90.8	Very high	171 Å²	171	121.5 Å²	121.5	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-59.6	-40	176.4	-171	-175.9	-177.3	-154.5	2.1	112	A565 E566 E572 I573	A565-R569 WeakPolarHBondContact O-CB 3.49Å; A565-R569 PolarHBondContact O-N 3.36Å; E566-R569 PolarHBondContact O-N 2.82Å; R569-E572 PolarHBondContact O-N 3.1Å; R569-I573 HydrophobicContact CG-CD1 4.07Å; R569-I573 VanDerWaalsContact O-CG1 3.28Å; R569-I573 WeakPolarHBondContact O-CG1 3.4Å; R569-I573 PolarHBondContact O-N 3.34Å
570	R	87.1	Confident	90.7	Very high	190 Å²	190	123 Å²	123	72%	0.717	55%	0.547	S	S	*	.	H	α-helix	trans	-68.5	-36.2	178	-170.3	171.9	179.4	175.7	-1.6	112.6	E566 R568 A574	E566-R570 WeakPolarHBondContact O-CB 3.21Å; E566-R570 PolarHBondContact O-N 3.4Å; R568-R570 VanDerWaalsContact C-N 3.32Å; R568-R570 PolarHBondContact O-N 3.33Å; R570-A574 PolarHBondContact O-N 3.12Å; R570-A574 VanDerWaalsContact O-N 3.15Å
571	R	92	Very high	90.5	Very high	188 Å²	188	123.2 Å²	123.2	71%	0.709	55%	0.548	S	S	*	.	H	α-helix	trans	-65.5	-44.5	170.6	-72	169.9	-175.3	-170.5	1.2	111.4	L567 R568 A574 E575	L567-R571 VanDerWaalsContact O-CG 3.28Å; L567-R571 WeakPolarHBondContact O-CG 3.34Å; L567-R571 PolarHBondContact O-N 3.12Å; R568-R571 PolarHBondContact O-N 2.85Å; R571-A574 PolarHBondContact O-N 3.11Å; R571-E575 WeakPolarHBondContact O-CB 3.4Å; R571-E575 PolarHBondContact O-N 2.78Å
572	E	90.6	Very high	90.5	Very high	97 Å²	97	121 Å²	121	45%	0.453	54%	0.539	S	S	.	.	H	α-helix	trans	-61.7	-44.3	178	-175.1	175.2	179.1	0	0	112.1	R568 R569 E575 Q576	R568-E572 PolarHBondContact O-N 2.84Å; R569-E572 PolarHBondContact O-N 3.1Å; E572-E575 PolarHBondContact O-N 3.01Å; E572-Q576 WeakPolarHBondContact O-CB 3.5Å; E572-Q576 WeakPolarHBondContact O-CG 3.3Å; E572-Q576 PolarHBondContact O-N 3.36Å
573	I	89.9	Confident	90.6	Very high	91 Å²	91	123.7 Å²	123.7	47%	0.467	54%	0.544	S	S	.	.	H	α-helix	trans	-60.6	-46.6	174.6	-69.9	164.1	0	0	0	111.1	R569 E575 Q576 E577	R569-I573 HydrophobicContact CG-CD1 4.07Å; R569-I573 VanDerWaalsContact O-CG1 3.28Å; R569-I573 WeakPolarHBondContact O-CG1 3.4Å; R569-I573 PolarHBondContact O-N 3.34Å; I573-E575 VanDerWaalsContact C-N 3.28Å; I573-E575 PolarHBondContact O-N 2.84Å; I573-Q576 PolarHBondContact O-N 2.94Å; I573-E577 WeakPolarHBondContact O-CB 3.3Å; I573-E577 PolarHBondContact O-N 3.41Å
574	A	90	Very high	90.7	Very high	54 Å²	54	121 Å²	121	45%	0.446	54%	0.544	S	S	.	.	H	α-helix	trans	-64.8	-31.7	178.1	0	0	0	0	0	112.9	R570 R571 R578	R570-A574 PolarHBondContact O-N 3.12Å; R570-A574 VanDerWaalsContact O-N 3.15Å; R571-A574 PolarHBondContact O-N 3.11Å; A574-R578 WeakPolarHBondContact O-CB 3.4Å; A574-R578 PolarHBondContact O-N 2.7Å
575	E	89.9	Confident	90.7	Very high	97 Å²	97	127.4 Å²	127.4	45%	0.453	56%	0.556	S	S	.	*	H	α-helix	trans	-76.4	-36.4	176.4	-156.2	-160	-161.8	0	0	112.2	R571 E572 I573 R579	R571-E575 WeakPolarHBondContact O-CB 3.4Å; R571-E575 PolarHBondContact O-N 2.78Å; E572-E575 PolarHBondContact O-N 3.01Å; I573-E575 VanDerWaalsContact C-N 3.28Å; I573-E575 PolarHBondContact O-N 2.84Å; E575-R579 WeakPolarHBondContact O-CG 3.46Å; E575-R579 PolarHBondContact O-N 3.5Å; E575-R579 VanDerWaalsContact O-N 3.12Å; E575-R579 IonicContact OE1-CZ 3.29Å; E575-R579 IonicContact OE1-NH1 3.14Å; E575-R579 IonicContact OE1-NH2 2.67Å; E575-R579 PolarHBondContact OE1-NH2 3.39Å; E575-R579 IonicContact OE2-CZ 3.25Å; E575-R579 IonicContact OE2-NH1 2.65Å; E575-R579 PolarHBondContact OE2-NH1 2.85Å; E575-R579 IonicContact OE2-NH2 3.32Å; E575-R579 PolarHBondContact OE2-NH2 3.24Å; E575-R579 VanDerWaalsContact OE2-NH2 3.11Å
576	Q	91.9	Very high	90.7	Very high	105 Å²	105	130.9 Å²	130.9	49%	0.491	57%	0.568	S	S	.	*	H	α-helix	trans	-64.2	-47.1	169.6	-72.3	178.9	13.6	0	0	110.8	E572 I573 R578 R579 E580	E572-Q576 WeakPolarHBondContact O-CB 3.5Å; E572-Q576 WeakPolarHBondContact O-CG 3.3Å; E572-Q576 PolarHBondContact O-N 3.36Å; I573-Q576 PolarHBondContact O-N 2.94Å; Q576-R578 VanDerWaalsContact C-N 3.3Å; Q576-R578 PolarHBondContact O-N 3.36Å; Q576-R579 PolarHBondContact O-N 3.45Å; Q576-R579 VanDerWaalsContact O-N 3.1Å; Q576-E580 WeakPolarHBondContact O-CB 3.27Å; Q576-E580 PolarHBondContact O-N 2.98Å
577	E	89.6	Confident	90.5	Very high	87 Å²	87	129 Å²	129	41%	0.407	56%	0.56	S	S	.	*	H	α-helix	trans	-59.2	-40.2	176.4	-167.9	-168.8	179.7	0	0	111.4	I573 E580 R581	I573-E577 WeakPolarHBondContact O-CB 3.3Å; I573-E577 PolarHBondContact O-N 3.41Å; E577-E580 PolarHBondContact O-N 3.4Å; E577-R581 HydrophobicContact CG-CG 4.47Å; E577-R581 WeakPolarHBondContact O-CB 3.39Å; E577-R581 WeakPolarHBondContact O-CG 3.36Å; E577-R581 PolarHBondContact O-N 2.87Å; E577-R581 IonicContact OE1-CZ 3.43Å; E577-R581 VanDerWaalsContact OE1-CZ 3.25Å; E577-R581 IonicContact OE1-NE 2.71Å; E577-R581 PolarHBondContact OE1-NE 2.98Å; E577-R581 IonicContact OE1-NH2 2.78Å; E577-R581 PolarHBondContact OE1-NH2 2.83Å; E577-R581 IonicContact OE2-NH2 3.57Å
578	R	90.3	Very high	90.4	Very high	161 Å²	161	131.9 Å²	131.9	61%	0.608	56%	0.564	S	S	*	*	H	α-helix	trans	-59.5	-49.3	172.8	-179.6	-177.2	164	-177.9	-6	111.7	A574 Q576 E580 R581 E582	A574-R578 WeakPolarHBondContact O-CB 3.4Å; A574-R578 PolarHBondContact O-N 2.7Å; Q576-R578 VanDerWaalsContact C-N 3.3Å; Q576-R578 PolarHBondContact O-N 3.36Å; R578-E580 VanDerWaalsContact C-N 3.27Å; R578-E580 PolarHBondContact O-N 2.92Å; R578-R581 PolarHBondContact O-N 2.76Å; R578-E582 IonicContact CZ-OE1 3.84Å; R578-E582 VanDerWaalsContact CZ-OE1 3.27Å; R578-E582 IonicContact NE-OE1 2.74Å; R578-E582 PolarHBondContact NE-OE1 2.92Å; R578-E582 IonicContact NH2-OE1 3.17Å; R578-E582 PolarHBondContact NH2-OE1 3.1Å; R578-E582 WeakPolarHBondContact O-CG 3.15Å; R578-E582 PolarHBondContact O-N 2.96Å
579	R	92.8	Very high	90.5	Very high	115 Å²	115	125.9 Å²	125.9	43%	0.434	55%	0.545	S	S	.	.	H	α-helix	trans	-63.2	-34	178.3	-70	177.4	-176.6	109.1	2.9	112.2	E575 Q576 R583	E575-R579 WeakPolarHBondContact O-CG 3.46Å; E575-R579 PolarHBondContact O-N 3.5Å; E575-R579 VanDerWaalsContact O-N 3.12Å; E575-R579 IonicContact OE1-CZ 3.29Å; E575-R579 IonicContact OE1-NH1 3.14Å; E575-R579 IonicContact OE1-NH2 2.67Å; E575-R579 PolarHBondContact OE1-NH2 3.39Å; E575-R579 IonicContact OE2-CZ 3.25Å; E575-R579 IonicContact OE2-NH1 2.65Å; E575-R579 PolarHBondContact OE2-NH1 2.85Å; E575-R579 IonicContact OE2-NH2 3.32Å; E575-R579 PolarHBondContact OE2-NH2 3.24Å; E575-R579 VanDerWaalsContact OE2-NH2 3.11Å; Q576-R579 PolarHBondContact O-N 3.45Å; Q576-R579 VanDerWaalsContact O-N 3.1Å; R579-R583 VanDerWaalsContact O-CG 3.27Å; R579-R583 WeakPolarHBondContact O-CG 3.4Å; R579-R583 PolarHBondContact O-N 3.05Å
580	E	89.7	Confident	90.5	Very high	124 Å²	124	125.5 Å²	125.5	58%	0.579	54%	0.543	S	S	*	.	H	α-helix	trans	-70	-46.5	175.5	-173.2	170.5	-159.1	0	0	111.6	Q576 E577 R578 E582 R583 V584	Q576-E580 WeakPolarHBondContact O-CB 3.27Å; Q576-E580 PolarHBondContact O-N 2.98Å; E577-E580 PolarHBondContact O-N 3.4Å; R578-E580 VanDerWaalsContact C-N 3.27Å; R578-E580 PolarHBondContact O-N 2.92Å; E580-E582 VanDerWaalsContact C-N 3.29Å; E580-E582 PolarHBondContact O-N 3.21Å; E580-R583 WeakPolarHBondContact O-CB 3.26Å; E580-R583 PolarHBondContact O-N 2.98Å; E580-R583 VanDerWaalsContact O-N 3.1Å; E580-V584 HydrophobicContact CG-CG2 4.5Å; E580-V584 WeakPolarHBondContact O-CG2 3.32Å; E580-V584 PolarHBondContact O-N 3.07Å
581	R	84.5	Confident	90.7	Very high	163 Å²	163	121 Å²	121	62%	0.615	53%	0.53	S	S	*	.	H	α-helix	trans	-57.3	-40.8	172.3	-70.5	166.4	177.3	-149	7.1	111.9	E577 R578 R585	E577-R581 HydrophobicContact CG-CG 4.47Å; E577-R581 WeakPolarHBondContact O-CB 3.39Å; E577-R581 WeakPolarHBondContact O-CG 3.36Å; E577-R581 PolarHBondContact O-N 2.87Å; E577-R581 IonicContact OE1-CZ 3.43Å; E577-R581 VanDerWaalsContact OE1-CZ 3.25Å; E577-R581 IonicContact OE1-NE 2.71Å; E577-R581 PolarHBondContact OE1-NE 2.98Å; E577-R581 IonicContact OE1-NH2 2.78Å; E577-R581 PolarHBondContact OE1-NH2 2.83Å; E577-R581 IonicContact OE2-NH2 3.57Å; R578-R581 PolarHBondContact O-N 2.76Å; R581-R585 WeakPolarHBondContact O-CB 3.04Å; R581-R585 PolarHBondContact O-N 2.8Å
582	E	91	Very high	90.5	Very high	95 Å²	95	116.7 Å²	116.7	44%	0.444	52%	0.518	S	S	.	.	H	α-helix	trans	-65.5	-40.1	174.4	-73.9	172.5	-176.9	0	0	112.1	R578 E580 L586	R578-E582 IonicContact CZ-OE1 3.84Å; R578-E582 VanDerWaalsContact CZ-OE1 3.27Å; R578-E582 IonicContact NE-OE1 2.74Å; R578-E582 PolarHBondContact NE-OE1 2.92Å; R578-E582 IonicContact NH2-OE1 3.17Å; R578-E582 PolarHBondContact NH2-OE1 3.1Å; R578-E582 WeakPolarHBondContact O-CG 3.15Å; R578-E582 PolarHBondContact O-N 2.96Å; E580-E582 VanDerWaalsContact C-N 3.29Å; E580-E582 PolarHBondContact O-N 3.21Å; E582-L586 PolarHBondContact O-N 2.84Å
583	R	93.6	Very high	90.6	Very high	184 Å²	184	119.3 Å²	119.3	69%	0.694	52%	0.524	S	S	*	.	H	α-helix	trans	-65.7	-45.1	173.7	-75.7	168.9	176.3	-175.8	-1.5	113	R579 E580 R585 L586 M587	R579-R583 VanDerWaalsContact O-CG 3.27Å; R579-R583 WeakPolarHBondContact O-CG 3.4Å; R579-R583 PolarHBondContact O-N 3.05Å; E580-R583 WeakPolarHBondContact O-CB 3.26Å; E580-R583 PolarHBondContact O-N 2.98Å; E580-R583 VanDerWaalsContact O-N 3.1Å; R583-R585 VanDerWaalsContact C-N 3.33Å; R583-R585 PolarHBondContact O-N 3.41Å; R583-L586 PolarHBondContact O-N 2.72Å; R583-M587 PolarHBondContact O-N 3.22Å
584	V	91.3	Very high	90.8	Very high	90 Å²	90	118.9 Å²	118.9	55%	0.545	52%	0.52	S	S	.	.	H	α-helix	trans	-63.5	-40.1	177.9	171	0	0	0	0	110.6	E580 M587 R588	E580-V584 HydrophobicContact CG-CG2 4.5Å; E580-V584 WeakPolarHBondContact O-CG2 3.32Å; E580-V584 PolarHBondContact O-N 3.07Å; V584-M587 PolarHBondContact O-N 2.75Å; V584-R588 PolarHBondContact O-N 3.45Å
585	R	92.3	Very high	91	Very high	190 Å²	190	121.2 Å²	121.2	72%	0.717	52%	0.524	S	S	*	.	H	α-helix	trans	-59.8	-45.9	172.4	-177.7	-179.9	177.3	-176.8	0.4	111.8	R581 R583 R588 E589	R581-R585 WeakPolarHBondContact O-CB 3.04Å; R581-R585 PolarHBondContact O-N 2.8Å; R583-R585 VanDerWaalsContact C-N 3.33Å; R583-R585 PolarHBondContact O-N 3.41Å; R585-R588 PolarHBondContact O-N 3.39Å; R585-E589 WeakPolarHBondContact O-CB 3.28Å; R585-E589 PolarHBondContact O-N 3.04Å
586	L	91.9	Very high	91.2	Very high	118 Å²	118	121.6 Å²	121.6	62%	0.618	53%	0.528	S	S	*	.	H	α-helix	trans	-67.8	-34.2	-179.8	-171.6	66.2	0	0	0	112.8	E582 R583 R590	E582-L586 PolarHBondContact O-N 2.84Å; R583-L586 PolarHBondContact O-N 2.72Å; L586-R590 WeakPolarHBondContact O-CB 3.4Å; L586-R590 PolarHBondContact O-N 3.1Å
587	M	89.3	Confident	91.3	Very high	96 Å²	96	121.2 Å²	121.2	47%	0.473	53%	0.529	S	S	.	.	H	α-helix	trans	-65.4	-50.3	171.9	-78.2	-61.5	-58	0	0	111.5	R583 V584 E589 R590 E591	R583-M587 PolarHBondContact O-N 3.22Å; V584-M587 PolarHBondContact O-N 2.75Å; M587-E589 VanDerWaalsContact C-N 3.32Å; M587-E589 PolarHBondContact O-N 3.45Å; M587-R590 WeakPolarHBondContact O-CB 3.26Å; M587-R590 PolarHBondContact O-N 3.18Å; M587-R590 VanDerWaalsContact O-N 3.09Å; M587-E591 WeakPolarHBondContact O-CG 3.39Å; M587-E591 PolarHBondContact O-N 3.35Å
588	R	89.1	Confident	91.4	Very high	160 Å²	160	124 Å²	124	60%	0.604	54%	0.536	S	S	*	.	H	α-helix	trans	-57.3	-44.8	174.7	172.1	174.1	-73.9	-163.5	-2.7	111.8	V584 R585 R590 E591 E592	V584-R588 PolarHBondContact O-N 3.45Å; R585-R588 PolarHBondContact O-N 3.39Å; R588-R590 VanDerWaalsContact C-N 3.27Å; R588-R590 PolarHBondContact O-N 2.89Å; R588-E591 PolarHBondContact O-N 3.09Å; R588-E592 VanDerWaalsContact CD-OE1 3.26Å; R588-E592 WeakPolarHBondContact CD-OE1 3.39Å; R588-E592 HydrophobicContact CG-CG 4.12Å; R588-E592 WeakPolarHBondContact CG-OE1 3.36Å; R588-E592 WeakPolarHBondContact O-CB 3.4Å; R588-E592 VanDerWaalsContact O-CG 3.3Å; R588-E592 WeakPolarHBondContact O-CG 3.13Å; R588-E592 PolarHBondContact O-N 3.38Å
589	E	91.4	Very high	91.5	Very high	68 Å²	68	121.3 Å²	121.3	32%	0.318	53%	0.53	S	S	.	.	H	α-helix	trans	-62.7	-35.3	178.3	-171.5	-177.5	168.7	0	0	111.9	R585 M587 R593	R585-E589 WeakPolarHBondContact O-CB 3.28Å; R585-E589 PolarHBondContact O-N 3.04Å; M587-E589 VanDerWaalsContact C-N 3.32Å; M587-E589 PolarHBondContact O-N 3.45Å; E589-R593 WeakPolarHBondContact O-CB 3.23Å; E589-R593 VanDerWaalsContact O-CD 3.29Å; E589-R593 WeakPolarHBondContact O-CD 3.1Å; E589-R593 WeakPolarHBondContact O-CG 3.47Å; E589-R593 PolarHBondContact O-N 3.36Å; E589-R593 IonicContact OE1-CZ 2.74Å; E589-R593 IonicContact OE1-NE 2.67Å; E589-R593 PolarHBondContact OE1-NE 2.91Å; E589-R593 IonicContact OE1-NH2 3.47Å; E589-R593 PolarHBondContact OE1-NH2 2.81Å
590	R	91.8	Very high	91.4	Very high	162 Å²	162	123.6 Å²	123.6	61%	0.611	54%	0.539	S	S	*	.	H	α-helix	trans	-67.8	-43.7	173	-179.7	-179	174	179.6	-1.2	111.9	L586 M587 R588 R593 E594	L586-R590 WeakPolarHBondContact O-CB 3.4Å; L586-R590 PolarHBondContact O-N 3.1Å; M587-R590 WeakPolarHBondContact O-CB 3.26Å; M587-R590 PolarHBondContact O-N 3.18Å; M587-R590 VanDerWaalsContact O-N 3.09Å; R588-R590 VanDerWaalsContact C-N 3.27Å; R588-R590 PolarHBondContact O-N 2.89Å; R590-R593 PolarHBondContact O-N 2.73Å; R590-E594 WeakPolarHBondContact O-CB 3.44Å; R590-E594 PolarHBondContact O-N 2.93Å
591	E	90.9	Very high	91.7	Very high	97 Å²	97	123.6 Å²	123.6	45%	0.453	54%	0.539	S	S	.	.	H	α-helix	trans	-63	-46.3	177	-70.9	157.3	-165.5	0	0	111.1	M587 R588 R593 E594 I595	M587-E591 WeakPolarHBondContact O-CG 3.39Å; M587-E591 PolarHBondContact O-N 3.35Å; R588-E591 PolarHBondContact O-N 3.09Å; E591-R593 PolarHBondContact O-N 2.95Å; E591-E594 PolarHBondContact O-N 3.04Å; E591-E594 VanDerWaalsContact O-N 3.1Å; E591-I595 VanDerWaalsContact O-CG1 3.28Å; E591-I595 WeakPolarHBondContact O-CG1 3.46Å; E591-I595 PolarHBondContact O-N 3.11Å
592	E	88.6	Confident	92.2	Very high	97 Å²	97	124.7 Å²	124.7	45%	0.453	54%	0.543	S	S	.	.	H	α-helix	trans	-58	-45.2	174	-73.9	168.9	179.6	0	0	111.5	R588 E594 I595 L596	R588-E592 VanDerWaalsContact CD-OE1 3.26Å; R588-E592 WeakPolarHBondContact CD-OE1 3.39Å; R588-E592 HydrophobicContact CG-CG 4.12Å; R588-E592 WeakPolarHBondContact CG-OE1 3.36Å; R588-E592 WeakPolarHBondContact O-CB 3.4Å; R588-E592 VanDerWaalsContact O-CG 3.3Å; R588-E592 WeakPolarHBondContact O-CG 3.13Å; R588-E592 PolarHBondContact O-N 3.38Å; E592-E594 VanDerWaalsContact C-N 3.33Å; E592-E594 PolarHBondContact O-N 2.89Å; E592-I595 PolarHBondContact O-N 3.02Å; E592-L596 WeakPolarHBondContact O-CB 3.43Å; E592-L596 VanDerWaalsContact O-CG 3.26Å; E592-L596 WeakPolarHBondContact O-CG 3.29Å; E592-L596 PolarHBondContact O-N 2.66Å
593	R	93.1	Very high	92.4	Very high	152 Å²	152	124.8 Å²	124.8	57%	0.574	55%	0.546	S	S	*	.	H	α-helix	trans	-62.5	-37.3	173.7	-72.2	164.5	-178.9	-137.8	7.3	112.6	E589 R590 E591 L597	E589-R593 WeakPolarHBondContact O-CB 3.23Å; E589-R593 VanDerWaalsContact O-CD 3.29Å; E589-R593 WeakPolarHBondContact O-CD 3.1Å; E589-R593 WeakPolarHBondContact O-CG 3.47Å; E589-R593 PolarHBondContact O-N 3.36Å; E589-R593 IonicContact OE1-CZ 2.74Å; E589-R593 IonicContact OE1-NE 2.67Å; E589-R593 PolarHBondContact OE1-NE 2.91Å; E589-R593 IonicContact OE1-NH2 3.47Å; E589-R593 PolarHBondContact OE1-NH2 2.81Å; R590-R593 PolarHBondContact O-N 2.73Å; E591-R593 PolarHBondContact O-N 2.95Å; R593-L597 WeakPolarHBondContact O-CB 3.31Å; R593-L597 VanDerWaalsContact O-CG 3.28Å; R593-L597 WeakPolarHBondContact O-CG 3.5Å; R593-L597 PolarHBondContact O-N 3.36Å
594	E	92.8	Very high	92.3	Very high	81 Å²	81	120.4 Å²	120.4	38%	0.379	53%	0.534	S	S	.	.	H	α-helix	trans	-72.4	-37.9	178.8	-158.1	-179.7	112.6	0	0	111.9	R590 E591 E592 L597 R598	R590-E594 WeakPolarHBondContact O-CB 3.44Å; R590-E594 PolarHBondContact O-N 2.93Å; E591-E594 PolarHBondContact O-N 3.04Å; E591-E594 VanDerWaalsContact O-N 3.1Å; E592-E594 VanDerWaalsContact C-N 3.33Å; E592-E594 PolarHBondContact O-N 2.89Å; E594-L597 PolarHBondContact O-N 3.33Å; E594-R598 PolarHBondContact O-N 2.91Å; E594-R598 IonicContact OE1-CZ 2.7Å; E594-R598 IonicContact OE1-NH1 3.07Å; E594-R598 PolarHBondContact OE1-NH1 2.9Å; E594-R598 IonicContact OE1-NH2 3.19Å; E594-R598 PolarHBondContact OE1-NH2 3.4Å
595	I	94.9	Very high	92.3	Very high	103 Å²	103	121.8 Å²	121.8	53%	0.528	54%	0.536	S	S	.	.	H	α-helix	trans	-62.3	-49.8	171.6	-69	163	0	0	0	110.1	E591 E592 L597 R598 E599	E591-I595 VanDerWaalsContact O-CG1 3.28Å; E591-I595 WeakPolarHBondContact O-CG1 3.46Å; E591-I595 PolarHBondContact O-N 3.11Å; E592-I595 PolarHBondContact O-N 3.02Å; I595-L597 PolarHBondContact O-N 2.93Å; I595-R598 PolarHBondContact O-N 3.38Å; I595-R598 VanDerWaalsContact O-N 3.11Å; I595-E599 WeakPolarHBondContact O-CB 3.38Å; I595-E599 PolarHBondContact O-N 2.83Å
596	L	94.3	Very high	92.2	Very high	105 Å²	105	117.4 Å²	117.4	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-60.6	-32.1	176.9	-73.2	167.2	0	0	0	112.7	E592 R600	E592-L596 WeakPolarHBondContact O-CB 3.43Å; E592-L596 VanDerWaalsContact O-CG 3.26Å; E592-L596 WeakPolarHBondContact O-CG 3.29Å; E592-L596 PolarHBondContact O-N 2.66Å; L596-R600 WeakPolarHBondContact O-CB 3.38Å; L596-R600 PolarHBondContact O-N 3.03Å
597	L	94.6	Very high	92.3	Very high	98 Å²	98	119.7 Å²	119.7	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-71.2	-41.4	173.3	-76.7	168.6	0	0	0	112.5	R593 E594 I595 R600 Q601	R593-L597 WeakPolarHBondContact O-CB 3.31Å; R593-L597 VanDerWaalsContact O-CG 3.28Å; R593-L597 WeakPolarHBondContact O-CG 3.5Å; R593-L597 PolarHBondContact O-N 3.36Å; E594-L597 PolarHBondContact O-N 3.33Å; I595-L597 PolarHBondContact O-N 2.93Å; L597-R600 PolarHBondContact O-N 3.25Å; L597-Q601 WeakPolarHBondContact O-CG 3.45Å; L597-Q601 PolarHBondContact O-N 2.89Å
598	R	91.6	Very high	92.5	Very high	146 Å²	146	118.4 Å²	118.4	55%	0.551	52%	0.516	S	S	*	.	H	α-helix	trans	-63.7	-43.7	172.9	-72.6	-176.5	178.1	98.1	8.9	111.7	E594 I595 Q601 R602	E594-R598 PolarHBondContact O-N 2.91Å; E594-R598 IonicContact OE1-CZ 2.7Å; E594-R598 IonicContact OE1-NH1 3.07Å; E594-R598 PolarHBondContact OE1-NH1 2.9Å; E594-R598 IonicContact OE1-NH2 3.19Å; E594-R598 PolarHBondContact OE1-NH2 3.4Å; I595-R598 PolarHBondContact O-N 3.38Å; I595-R598 VanDerWaalsContact O-N 3.11Å; R598-Q601 PolarHBondContact O-N 2.87Å; R598-R602 WeakPolarHBondContact O-CB 3.2Å; R598-R602 PolarHBondContact O-N 3.49Å
599	E	91.6	Very high	92.9	Very high	104 Å²	104	117.4 Å²	117.4	49%	0.486	52%	0.516	S	S	.	.	H	α-helix	trans	-62	-46.6	176.1	-177.2	174.8	-140.6	0	0	111.2	I595 Q601 R602 L603	I595-E599 WeakPolarHBondContact O-CB 3.38Å; I595-E599 PolarHBondContact O-N 2.83Å; E599-Q601 VanDerWaalsContact C-N 3.34Å; E599-Q601 PolarHBondContact O-N 3.28Å; E599-R602 WeakPolarHBondContact O-CB 3.48Å; E599-R602 PolarHBondContact O-N 3.45Å; E599-L603 HydrophobicContact CG-CD1 4.01Å; E599-L603 HydrophobicContact CG-CG 4.44Å; E599-L603 WeakPolarHBondContact O-CG 3.42Å; E599-L603 PolarHBondContact O-N 3Å
600	R	91.7	Very high	92.7	Very high	162 Å²	162	118.8 Å²	118.8	61%	0.611	53%	0.526	S	S	*	.	H	α-helix	trans	-57.6	-44.7	174.3	179.3	-179.9	167.3	-168.6	-4.9	112.1	L596 L597 L603 E604	L596-R600 WeakPolarHBondContact O-CB 3.38Å; L596-R600 PolarHBondContact O-N 3.03Å; L597-R600 PolarHBondContact O-N 3.25Å; R600-L603 PolarHBondContact O-N 3.45Å; R600-E604 VanDerWaalsContact O-CB 3.29Å; R600-E604 WeakPolarHBondContact O-CB 3.37Å; R600-E604 PolarHBondContact O-N 3.18Å
601	Q	95.1	Very high	92.8	Very high	125 Å²	125	115.8 Å²	115.8	58%	0.584	52%	0.519	S	S	*	.	H	α-helix	trans	-63.1	-40.6	176.9	-75.5	174.8	-3.7	0	0	112	L597 R598 E599 E604 M605	L597-Q601 WeakPolarHBondContact O-CG 3.45Å; L597-Q601 PolarHBondContact O-N 2.89Å; R598-Q601 PolarHBondContact O-N 2.87Å; E599-Q601 VanDerWaalsContact C-N 3.34Å; E599-Q601 PolarHBondContact O-N 3.28Å; Q601-E604 PolarHBondContact O-N 3Å; Q601-M605 WeakPolarHBondContact O-CG 3.39Å; Q601-M605 PolarHBondContact O-N 3.4Å
602	R	96.1	Very high	92.8	Very high	186 Å²	186	118.2 Å²	118.2	70%	0.702	52%	0.523	S	S	*	.	H	α-helix	trans	-61.5	-48.5	174.2	175.8	179.8	170.3	173.5	-2.5	111.6	R598 E599 E604 M605 E606	R598-R602 WeakPolarHBondContact O-CB 3.2Å; R598-R602 PolarHBondContact O-N 3.49Å; E599-R602 WeakPolarHBondContact O-CB 3.48Å; E599-R602 PolarHBondContact O-N 3.45Å; R602-E604 VanDerWaalsContact C-N 3.31Å; R602-E604 PolarHBondContact O-N 3.32Å; R602-M605 PolarHBondContact O-N 2.71Å; R602-E606 WeakPolarHBondContact O-CB 3.28Å; R602-E606 PolarHBondContact O-N 3.26Å
603	L	93.4	Very high	93	Very high	97 Å²	97	116.4 Å²	116.4	51%	0.508	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-32.9	178	-69.9	172	0	0	0	112.4	E599 R600 R607	E599-L603 HydrophobicContact CG-CD1 4.01Å; E599-L603 HydrophobicContact CG-CG 4.44Å; E599-L603 WeakPolarHBondContact O-CG 3.42Å; E599-L603 PolarHBondContact O-N 3Å; R600-L603 PolarHBondContact O-N 3.45Å; L603-R607 VanDerWaalsContact O-CB 3.25Å; L603-R607 WeakPolarHBondContact O-CB 3.34Å; L603-R607 PolarHBondContact O-N 2.83Å
604	E	93.3	Very high	93	Very high	92 Å²	92	118 Å²	118	43%	0.43	52%	0.521	S	S	.	.	H	α-helix	trans	-68.7	-42	174.6	-175.9	157.6	-132.4	0	0	111.9	R600 Q601 R602 R607 Q608	R600-E604 VanDerWaalsContact O-CB 3.29Å; R600-E604 WeakPolarHBondContact O-CB 3.37Å; R600-E604 PolarHBondContact O-N 3.18Å; Q601-E604 PolarHBondContact O-N 3Å; R602-E604 VanDerWaalsContact C-N 3.31Å; R602-E604 PolarHBondContact O-N 3.32Å; E604-R607 PolarHBondContact O-N 3.46Å; E604-Q608 WeakPolarHBondContact O-CG 3.25Å; E604-Q608 PolarHBondContact O-N 2.87Å
605	M	89.4	Confident	93	Very high	119 Å²	119	119.3 Å²	119.3	59%	0.586	53%	0.53	S	S	*	.	H	α-helix	trans	-66.1	-39	172.8	-72.1	-66.2	-70.8	0	0	112.5	Q601 R602 Q608 K609	Q601-M605 WeakPolarHBondContact O-CG 3.39Å; Q601-M605 PolarHBondContact O-N 3.4Å; R602-M605 PolarHBondContact O-N 2.71Å; M605-Q608 PolarHBondContact O-N 2.71Å; M605-K609 PolarHBondContact O-N 2.94Å
606	E	91.6	Very high	92.9	Very high	98 Å²	98	120.3 Å²	120.3	46%	0.458	53%	0.533	S	S	.	.	H	α-helix	trans	-66.4	-43	175	-175.9	158.6	-152.6	0	0	111.6	R602 K609 L610	R602-E606 WeakPolarHBondContact O-CB 3.28Å; R602-E606 PolarHBondContact O-N 3.26Å; E606-K609 WeakPolarHBondContact O-CB 3.29Å; E606-K609 PolarHBondContact O-N 2.91Å; E606-K609 VanDerWaalsContact O-N 3.17Å; E606-L610 HydrophobicContact CG-CD1 4.39Å; E606-L610 WeakPolarHBondContact O-CG 3.41Å; E606-L610 PolarHBondContact O-N 3.27Å
607	R	93.1	Very high	92.3	Very high	166 Å²	166	122.8 Å²	122.8	63%	0.626	54%	0.535	S	S	*	.	H	α-helix	trans	-58.4	-48.2	171.9	178.8	-176.7	165.4	-154.9	-9.3	111.7	L603 E604 K609 L610 E611	L603-R607 VanDerWaalsContact O-CB 3.25Å; L603-R607 WeakPolarHBondContact O-CB 3.34Å; L603-R607 PolarHBondContact O-N 2.83Å; E604-R607 PolarHBondContact O-N 3.46Å; R607-K609 VanDerWaalsContact C-N 3.26Å; R607-K609 PolarHBondContact O-N 3.2Å; R607-L610 PolarHBondContact O-N 3.41Å; R607-E611 WeakPolarHBondContact O-CB 3.45Å; R607-E611 PolarHBondContact O-N 3.35Å
608	Q	94.7	Very high	92.1	Very high	68 Å²	68	121.4 Å²	121.4	32%	0.318	53%	0.526	S	S	.	.	H	α-helix	trans	-60.7	-35.3	176.4	-75.3	-176.4	29.5	0	0	112.4	E604 M605 R612	E604-Q608 WeakPolarHBondContact O-CG 3.25Å; E604-Q608 PolarHBondContact O-N 2.87Å; M605-Q608 PolarHBondContact O-N 2.71Å; Q608-R612 VanDerWaalsContact O-CG 3.31Å; Q608-R612 WeakPolarHBondContact O-CG 3.44Å; Q608-R612 PolarHBondContact O-N 3Å; Q608-R612 VanDerWaalsContact O-N 3.09Å
609	K	96.2	Very high	92.1	Very high	139 Å²	139	122.9 Å²	122.9	60%	0.604	53%	0.531	S	S	*	.	H	α-helix	trans	-65.8	-48.3	175.3	-173.7	-174.7	174.7	-172.3	0	111.2	M605 E606 R607 E611 R612 E613	M605-K609 PolarHBondContact O-N 2.94Å; E606-K609 WeakPolarHBondContact O-CB 3.29Å; E606-K609 PolarHBondContact O-N 2.91Å; E606-K609 VanDerWaalsContact O-N 3.17Å; R607-K609 VanDerWaalsContact C-N 3.26Å; R607-K609 PolarHBondContact O-N 3.2Å; K609-E611 VanDerWaalsContact C-N 3.29Å; K609-E611 PolarHBondContact O-N 3.34Å; K609-R612 PolarHBondContact O-N 2.89Å; K609-E613 WeakPolarHBondContact O-CB 3.4Å; K609-E613 PolarHBondContact O-N 2.89Å
610	L	88.9	Confident	92.1	Very high	98 Å²	98	122.6 Å²	122.6	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-64.3	-32.5	177.5	-68.8	171	0	0	0	112.5	E606 R607 R614	E606-L610 HydrophobicContact CG-CD1 4.39Å; E606-L610 WeakPolarHBondContact O-CG 3.41Å; E606-L610 PolarHBondContact O-N 3.27Å; R607-L610 PolarHBondContact O-N 3.41Å; L610-R614 VanDerWaalsContact O-CB 3.26Å; L610-R614 WeakPolarHBondContact O-CB 3.41Å; L610-R614 PolarHBondContact O-N 3.43Å
611	E	92.4	Very high	92	Very high	99 Å²	99	120.2 Å²	120.2	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-68.6	-40.4	175	-170.3	163.3	-119.7	0	0	112	R607 K609 R614 L615	R607-E611 WeakPolarHBondContact O-CB 3.45Å; R607-E611 PolarHBondContact O-N 3.35Å; K609-E611 VanDerWaalsContact C-N 3.29Å; K609-E611 PolarHBondContact O-N 3.34Å; E611-R614 PolarHBondContact O-N 2.86Å; E611-L615 WeakPolarHBondContact O-CG 3.31Å; E611-L615 PolarHBondContact O-N 3.17Å; E611-L615 VanDerWaalsContact O-N 3.07Å
612	R	92.3	Very high	91.7	Very high	147 Å²	147	122.2 Å²	122.2	56%	0.555	53%	0.53	S	S	*	.	H	α-helix	trans	-64.5	-47.3	170.9	-69.2	169.4	-168.2	131.4	13.8	111.6	Q608 K609 R614 L615 E616	Q608-R612 VanDerWaalsContact O-CG 3.31Å; Q608-R612 WeakPolarHBondContact O-CG 3.44Å; Q608-R612 PolarHBondContact O-N 3Å; Q608-R612 VanDerWaalsContact O-N 3.09Å; K609-R612 PolarHBondContact O-N 2.89Å; R612-R614 VanDerWaalsContact C-N 3.26Å; R612-R614 PolarHBondContact O-N 3.09Å; R612-L615 PolarHBondContact O-N 3.36Å; R612-E616 WeakPolarHBondContact O-CB 3.45Å; R612-E616 PolarHBondContact O-N 2.9Å
613	E	91	Very high	91.4	Very high	59 Å²	59	117.8 Å²	117.8	28%	0.276	52%	0.518	S	S	.	.	H	α-helix	trans	-60.6	-34.6	176.8	-170.5	-176.8	136.7	0	0	111.9	K609 R617	K609-E613 WeakPolarHBondContact O-CB 3.4Å; K609-E613 PolarHBondContact O-N 2.89Å; E613-R617 WeakPolarHBondContact O-CB 3.26Å; E613-R617 WeakPolarHBondContact O-CG 3.44Å; E613-R617 PolarHBondContact O-N 3.48Å; E613-R617 IonicContact OE1-CZ 3.62Å; E613-R617 IonicContact OE1-NH1 3.72Å; E613-R617 PolarHBondContact OE1-NH1 3.27Å; E613-R617 IonicContact OE1-NH2 3.84Å; E613-R617 PolarHBondContact OE1-NH2 3.45Å
614	R	95.1	Very high	91.4	Very high	186 Å²	186	121.5 Å²	121.5	70%	0.702	53%	0.525	S	S	*	.	H	α-helix	trans	-67	-47.1	173.7	-179.2	180	177.5	176.9	0.9	112.1	L610 E611 R612 E616 R617 E618	L610-R614 VanDerWaalsContact O-CB 3.26Å; L610-R614 WeakPolarHBondContact O-CB 3.41Å; L610-R614 PolarHBondContact O-N 3.43Å; E611-R614 PolarHBondContact O-N 2.86Å; R612-R614 VanDerWaalsContact C-N 3.26Å; R612-R614 PolarHBondContact O-N 3.09Å; R614-E616 VanDerWaalsContact C-N 3.3Å; R614-E616 PolarHBondContact O-N 2.88Å; R614-R617 PolarHBondContact O-N 3.31Å; R614-E618 WeakPolarHBondContact O-CB 3.43Å; R614-E618 PolarHBondContact O-N 3.07Å
615	L	91.4	Very high	91.3	Very high	108 Å²	108	121.1 Å²	121.1	57%	0.565	53%	0.525	S	S	*	.	H	α-helix	trans	-65.7	-34.8	177.4	-71.6	169.4	0	0	0	112	E611 R612 E618 R619	E611-L615 WeakPolarHBondContact O-CG 3.31Å; E611-L615 PolarHBondContact O-N 3.17Å; E611-L615 VanDerWaalsContact O-N 3.07Å; R612-L615 PolarHBondContact O-N 3.36Å; L615-E618 PolarHBondContact O-N 3.49Å; L615-R619 WeakPolarHBondContact O-CB 3.36Å; L615-R619 PolarHBondContact O-N 2.9Å
616	E	92.6	Very high	91.5	Very high	125 Å²	125	124.1 Å²	124.1	58%	0.584	53%	0.53	S	S	*	.	H	α-helix	trans	-67.2	-45.7	173.3	-176	168.4	-144.9	0	0	111.8	R612 R614 E618 R619 L620	R612-E616 WeakPolarHBondContact O-CB 3.45Å; R612-E616 PolarHBondContact O-N 2.9Å; R614-E616 VanDerWaalsContact C-N 3.3Å; R614-E616 PolarHBondContact O-N 2.88Å; E616-E618 VanDerWaalsContact C-N 3.34Å; E616-E618 PolarHBondContact O-N 2.96Å; E616-R619 WeakPolarHBondContact O-CB 3.34Å; E616-R619 PolarHBondContact O-N 2.94Å; E616-L620 HydrophobicContact CG-CD1 4.17Å; E616-L620 WeakPolarHBondContact O-CB 3.48Å; E616-L620 WeakPolarHBondContact O-CG 3.49Å; E616-L620 PolarHBondContact O-N 3.48Å
617	R	82.6	Confident	91.4	Very high	157 Å²	157	124.2 Å²	124.2	59%	0.592	53%	0.533	S	S	*	.	H	α-helix	trans	-58.5	-43.6	171.2	-80.7	-169.4	-179.6	108.1	14.4	112.3	E613 R614 R619 L620 E621	E613-R617 WeakPolarHBondContact O-CB 3.26Å; E613-R617 WeakPolarHBondContact O-CG 3.44Å; E613-R617 PolarHBondContact O-N 3.48Å; E613-R617 IonicContact OE1-CZ 3.62Å; E613-R617 IonicContact OE1-NH1 3.72Å; E613-R617 PolarHBondContact OE1-NH1 3.27Å; E613-R617 IonicContact OE1-NH2 3.84Å; E613-R617 PolarHBondContact OE1-NH2 3.45Å; R614-R617 PolarHBondContact O-N 3.31Å; R617-R619 VanDerWaalsContact C-N 3.34Å; R617-R619 PolarHBondContact O-N 2.91Å; R617-L620 PolarHBondContact O-N 3.35Å; R617-E621 VanDerWaalsContact O-CB 3.29Å; R617-E621 WeakPolarHBondContact O-CB 3.44Å; R617-E621 PolarHBondContact O-N 3.42Å
618	E	90.1	Very high	91.2	Very high	69 Å²	69	120.8 Å²	120.8	32%	0.322	52%	0.523	S	S	.	.	H	α-helix	trans	-64.9	-38.8	178.6	-167.7	-175.1	163.3	0	0	111.7	R614 L615 E616 E621 R622	R614-E618 WeakPolarHBondContact O-CB 3.43Å; R614-E618 PolarHBondContact O-N 3.07Å; L615-E618 PolarHBondContact O-N 3.49Å; E616-E618 VanDerWaalsContact C-N 3.34Å; E616-E618 PolarHBondContact O-N 2.96Å; E618-E621 PolarHBondContact O-N 2.83Å; E618-R622 WeakPolarHBondContact O-CB 3.34Å; E618-R622 WeakPolarHBondContact O-CD 3.39Å; E618-R622 WeakPolarHBondContact O-CG 3.46Å; E618-R622 PolarHBondContact O-N 3.15Å; E618-R622 IonicContact OE1-CZ 3.25Å; E618-R622 IonicContact OE1-NE 3.07Å; E618-R622 PolarHBondContact OE1-NE 3.39Å; E618-R622 IonicContact OE1-NH2 2.66Å; E618-R622 PolarHBondContact OE1-NH2 3.29Å
619	R	92.7	Very high	91.2	Very high	177 Å²	177	122.7 Å²	122.7	67%	0.668	53%	0.532	S	S	*	.	H	α-helix	trans	-60.7	-51	171.7	176.8	-178.5	170.9	173.4	-1.2	111.2	L615 E616 R617 E621 R622 E623	L615-R619 WeakPolarHBondContact O-CB 3.36Å; L615-R619 PolarHBondContact O-N 2.9Å; E616-R619 WeakPolarHBondContact O-CB 3.34Å; E616-R619 PolarHBondContact O-N 2.94Å; R617-R619 VanDerWaalsContact C-N 3.34Å; R617-R619 PolarHBondContact O-N 2.91Å; R619-E621 VanDerWaalsContact C-N 3.27Å; R619-E621 PolarHBondContact O-N 3.31Å; R619-R622 PolarHBondContact O-N 2.96Å; R619-E623 WeakPolarHBondContact O-CB 3.35Å; R619-E623 PolarHBondContact O-N 2.86Å
620	L	89.6	Confident	90.9	Very high	98 Å²	98	121.7 Å²	121.7	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-64.7	-30.6	179.4	-69.7	170.5	0	0	0	112.3	E616 R617 R624	E616-L620 HydrophobicContact CG-CD1 4.17Å; E616-L620 WeakPolarHBondContact O-CB 3.48Å; E616-L620 WeakPolarHBondContact O-CG 3.49Å; E616-L620 PolarHBondContact O-N 3.48Å; R617-L620 PolarHBondContact O-N 3.35Å; L620-R624 WeakPolarHBondContact O-CB 3.4Å; L620-R624 PolarHBondContact O-N 3.42Å
621	E	90.2	Very high	91	Very high	112 Å²	112	124.5 Å²	124.5	52%	0.523	53%	0.534	S	S	.	.	H	α-helix	trans	-70.9	-45.6	173.7	-179.4	164	-133.3	0	0	111.7	R617 E618 R619 E623 R624 I625	R617-E621 VanDerWaalsContact O-CB 3.29Å; R617-E621 WeakPolarHBondContact O-CB 3.44Å; R617-E621 PolarHBondContact O-N 3.42Å; E618-E621 PolarHBondContact O-N 2.83Å; R619-E621 VanDerWaalsContact C-N 3.27Å; R619-E621 PolarHBondContact O-N 3.31Å; E621-E623 VanDerWaalsContact C-N 3.28Å; E621-E623 PolarHBondContact O-N 2.82Å; E621-R624 PolarHBondContact O-N 2.79Å; E621-I625 HydrophobicContact CG-CD1 3.92Å; E621-I625 WeakPolarHBondContact O-CB 3.3Å; E621-I625 WeakPolarHBondContact O-CD1 3.17Å; E621-I625 WeakPolarHBondContact O-CG1 3.32Å; E621-I625 PolarHBondContact O-N 3.49Å
622	R	89.8	Confident	91.1	Very high	167 Å²	167	129 Å²	129	63%	0.63	55%	0.546	S	S	*	.	H	α-helix	trans	-59.1	-40	172.9	-69.1	164.8	179.3	-146.9	5.4	111.6	E618 R619 R626	E618-R622 WeakPolarHBondContact O-CB 3.34Å; E618-R622 WeakPolarHBondContact O-CD 3.39Å; E618-R622 WeakPolarHBondContact O-CG 3.46Å; E618-R622 PolarHBondContact O-N 3.15Å; E618-R622 IonicContact OE1-CZ 3.25Å; E618-R622 IonicContact OE1-NE 3.07Å; E618-R622 PolarHBondContact OE1-NE 3.39Å; E618-R622 IonicContact OE1-NH2 2.66Å; E618-R622 PolarHBondContact OE1-NH2 3.29Å; R619-R622 PolarHBondContact O-N 2.96Å; R622-R626 PolarHBondContact O-N 3.48Å; R622-R626 VanDerWaalsContact O-N 3.07Å
623	E	90.2	Very high	91.2	Very high	93 Å²	93	128.5 Å²	128.5	44%	0.435	55%	0.548	S	S	.	.	H	α-helix	trans	-68.6	-45.2	176.4	-174	155.3	-148.7	0	0	112.1	R619 E621 I625 R626 I627	R619-E623 WeakPolarHBondContact O-CB 3.35Å; R619-E623 PolarHBondContact O-N 2.86Å; E621-E623 VanDerWaalsContact C-N 3.28Å; E621-E623 PolarHBondContact O-N 2.82Å; E623-I625 VanDerWaalsContact C-N 3.33Å; E623-I625 PolarHBondContact O-N 2.94Å; E623-R626 WeakPolarHBondContact O-CB 3.17Å; E623-R626 PolarHBondContact O-N 2.95Å; E623-R626 VanDerWaalsContact O-N 3.15Å; E623-I627 HydrophobicContact CG-CD1 4.22Å; E623-I627 WeakPolarHBondContact O-CG1 3.41Å; E623-I627 PolarHBondContact O-N 3.39Å
624	R	91.4	Very high	91.1	Very high	174 Å²	174	131 Å²	131	66%	0.657	56%	0.56	S	S	*	*	H	α-helix	trans	-59.3	-41.3	172.1	-179	-178	176.1	-135.5	-3.3	112.2	L620 E621 R626 I627 E628	L620-R624 WeakPolarHBondContact O-CB 3.4Å; L620-R624 PolarHBondContact O-N 3.42Å; E621-R624 PolarHBondContact O-N 2.79Å; R624-R626 VanDerWaalsContact C-N 3.33Å; R624-I627 PolarHBondContact O-N 2.93Å; R624-E628 WeakPolarHBondContact O-CB 3.29Å; R624-E628 PolarHBondContact O-N 3.1Å
625	I	91.1	Very high	90.8	Very high	85 Å²	85	125 Å²	125	44%	0.436	55%	0.55	S	S	.	*	H	α-helix	trans	-63.5	-40	176.2	-72.3	164.3	0	0	0	110.7	E621 E623 Q629	E621-I625 HydrophobicContact CG-CD1 3.92Å; E621-I625 WeakPolarHBondContact O-CB 3.3Å; E621-I625 WeakPolarHBondContact O-CD1 3.17Å; E621-I625 WeakPolarHBondContact O-CG1 3.32Å; E621-I625 PolarHBondContact O-N 3.49Å; E623-I625 VanDerWaalsContact C-N 3.33Å; E623-I625 PolarHBondContact O-N 2.94Å; I625-Q629 WeakPolarHBondContact O-CB 3.5Å; I625-Q629 VanDerWaalsContact O-CG 3.27Å; I625-Q629 WeakPolarHBondContact O-CG 3.22Å; I625-Q629 PolarHBondContact O-N 2.57Å
626	R	93.7	Very high	90.9	Very high	181 Å²	181	124.4 Å²	124.4	68%	0.683	54%	0.544	S	S	*	.	H	α-helix	trans	-61.6	-49.6	173.7	177.9	-178.3	171.9	175.6	-1.2	111.4	R622 E623 R624 E628 Q629 E630	R622-R626 PolarHBondContact O-N 3.48Å; R622-R626 VanDerWaalsContact O-N 3.07Å; E623-R626 WeakPolarHBondContact O-CB 3.17Å; E623-R626 PolarHBondContact O-N 2.95Å; E623-R626 VanDerWaalsContact O-N 3.15Å; R624-R626 VanDerWaalsContact C-N 3.33Å; R626-E628 PolarHBondContact O-N 2.73Å; R626-Q629 PolarHBondContact O-N 3Å; R626-E630 WeakPolarHBondContact O-CB 3.49Å; R626-E630 PolarHBondContact O-N 2.93Å
627	I	89.6	Confident	90.9	Very high	101 Å²	101	126.4 Å²	126.4	52%	0.518	55%	0.547	S	S	.	.	H	α-helix	trans	-62	-43.1	179.7	-66.3	164.7	0	0	0	111	E623 R624 E630 R631	E623-I627 HydrophobicContact CG-CD1 4.22Å; E623-I627 WeakPolarHBondContact O-CG1 3.41Å; E623-I627 PolarHBondContact O-N 3.39Å; R624-I627 PolarHBondContact O-N 2.93Å; I627-E630 PolarHBondContact O-N 3.25Å; I627-R631 VanDerWaalsContact O-CB 3.32Å; I627-R631 WeakPolarHBondContact O-CB 3.5Å; I627-R631 PolarHBondContact O-N 3.49Å
628	E	90.7	Very high	91	Very high	93 Å²	93	124 Å²	124	44%	0.435	54%	0.543	S	S	.	.	H	α-helix	trans	-68.8	-33.8	178.4	-165.2	65.1	-132	0	0	112	R624 R626 R632	R624-E628 WeakPolarHBondContact O-CB 3.29Å; R624-E628 PolarHBondContact O-N 3.1Å; R626-E628 PolarHBondContact O-N 2.73Å; E628-R632 WeakPolarHBondContact O-CB 3.47Å; E628-R632 PolarHBondContact O-N 2.76Å
629	Q	92.9	Very high	91	Very high	108 Å²	108	123.3 Å²	123.3	51%	0.505	55%	0.55	S	S	.	.	H	α-helix	trans	-66.8	-38.1	171	-76.7	-179.9	27.1	0	0	112.7	I625 R626 R632 K633	I625-Q629 WeakPolarHBondContact O-CB 3.5Å; I625-Q629 VanDerWaalsContact O-CG 3.27Å; I625-Q629 WeakPolarHBondContact O-CG 3.22Å; I625-Q629 PolarHBondContact O-N 2.57Å; R626-Q629 PolarHBondContact O-N 3Å; Q629-R632 PolarHBondContact O-N 2.88Å; Q629-K633 VanDerWaalsContact O-CG 3.31Å; Q629-K633 WeakPolarHBondContact O-CG 3.21Å; Q629-K633 PolarHBondContact O-N 3.47Å
630	E	91.6	Very high	91	Very high	119 Å²	119	122.3 Å²	122.3	56%	0.556	55%	0.546	S	S	*	.	H	α-helix	trans	-66.9	-51	177.1	-173.7	151.3	-149	0	0	110.7	R626 I627 R632 K633 E634	R626-E630 WeakPolarHBondContact O-CB 3.49Å; R626-E630 PolarHBondContact O-N 2.93Å; I627-E630 PolarHBondContact O-N 3.25Å; E630-R632 VanDerWaalsContact C-N 3.26Å; E630-R632 PolarHBondContact O-N 3.24Å; E630-K633 WeakPolarHBondContact O-CB 3.05Å; E630-K633 PolarHBondContact O-N 3.03Å; E630-K633 VanDerWaalsContact O-N 3.08Å; E630-E634 PolarHBondContact O-N 3.47Å
631	R	91.2	Very high	91.1	Very high	156 Å²	156	122.2 Å²	122.2	59%	0.589	54%	0.543	S	S	*	.	H	α-helix	trans	-55.9	-37	171.7	-168.5	-174.2	-170.2	-163	5.8	112.9	I627 E634 A635	I627-R631 VanDerWaalsContact O-CB 3.32Å; I627-R631 WeakPolarHBondContact O-CB 3.5Å; I627-R631 PolarHBondContact O-N 3.49Å; R631-E634 PolarHBondContact O-N 2.99Å; R631-A635 VanDerWaalsContact O-CB 3.3Å; R631-A635 WeakPolarHBondContact O-CB 3.46Å; R631-A635 PolarHBondContact O-N 2.92Å
632	R	92.9	Very high	91.2	Very high	193 Å²	193	126.3 Å²	126.3	73%	0.728	55%	0.554	S	S	*	*	H	α-helix	trans	-69.4	-39	176.1	-175.9	173.1	178.6	169.3	0.4	112.5	E628 Q629 E630 E636	E628-R632 WeakPolarHBondContact O-CB 3.47Å; E628-R632 PolarHBondContact O-N 2.76Å; Q629-R632 PolarHBondContact O-N 2.88Å; E630-R632 VanDerWaalsContact C-N 3.26Å; E630-R632 PolarHBondContact O-N 3.24Å; R632-E636 WeakPolarHBondContact O-CB 3.41Å; R632-E636 PolarHBondContact O-N 3.26Å
633	K	94.4	Very high	91.3	Very high	137 Å²	137	122.7 Å²	122.7	60%	0.596	54%	0.544	S	S	*	.	H	α-helix	trans	-67.8	-37.2	173.8	-71.6	166	-177	173.3	0	111.8	Q629 E630 E636 R637	Q629-K633 VanDerWaalsContact O-CG 3.31Å; Q629-K633 WeakPolarHBondContact O-CG 3.21Å; Q629-K633 PolarHBondContact O-N 3.47Å; E630-K633 WeakPolarHBondContact O-CB 3.05Å; E630-K633 PolarHBondContact O-N 3.03Å; E630-K633 VanDerWaalsContact O-N 3.08Å; K633-E636 PolarHBondContact O-N 3.41Å; K633-R637 PolarHBondContact O-N 2.89Å
634	E	88.9	Confident	91.4	Very high	112 Å²	112	123.9 Å²	123.9	52%	0.523	55%	0.55	S	S	.	.	H	α-helix	trans	-65.3	-49.1	173.3	-178.4	177	-128.5	0	0	111.3	E630 R631 E636 R637 M638	E630-E634 PolarHBondContact O-N 3.47Å; R631-E634 PolarHBondContact O-N 2.99Å; E634-E636 PolarHBondContact O-N 3.32Å; E634-R637 WeakPolarHBondContact O-CA 3.49Å; E634-R637 WeakPolarHBondContact O-CB 3.39Å; E634-R637 PolarHBondContact O-N 3.16Å; E634-M638 WeakPolarHBondContact O-CG 3.26Å; E634-M638 PolarHBondContact O-N 2.93Å
635	A	89.9	Confident	91.5	Very high	60 Å²	60	120.2 Å²	120.2	50%	0.496	54%	0.542	S	S	.	.	H	α-helix	trans	-58.9	-35.2	174.2	0	0	0	0	0	112.4	R631 A639	R631-A635 VanDerWaalsContact O-CB 3.3Å; R631-A635 WeakPolarHBondContact O-CB 3.46Å; R631-A635 PolarHBondContact O-N 2.92Å; A635-A639 VanDerWaalsContact O-CB 3.26Å; A635-A639 WeakPolarHBondContact O-CB 3.4Å; A635-A639 PolarHBondContact O-N 3.28Å
636	E	92.7	Very high	91.6	Very high	95 Å²	95	123.1 Å²	123.1	44%	0.444	55%	0.548	S	S	.	.	H	α-helix	trans	-68.3	-41.1	172.9	-164.9	-173.4	158.1	0	0	112.3	R632 K633 E634 A639 R640	R632-E636 WeakPolarHBondContact O-CB 3.41Å; R632-E636 PolarHBondContact O-N 3.26Å; K633-E636 PolarHBondContact O-N 3.41Å; E634-E636 PolarHBondContact O-N 3.32Å; E636-A639 PolarHBondContact O-N 2.86Å; E636-R640 WeakPolarHBondContact O-CG 3.19Å; E636-R640 PolarHBondContact O-N 2.9Å; E636-R640 IonicContact OE1-CZ 3.33Å; E636-R640 IonicContact OE1-NE 2.7Å; E636-R640 PolarHBondContact OE1-NE 3.43Å; E636-R640 IonicContact OE1-NH2 3.11Å; E636-R640 PolarHBondContact OE1-NH2 3.08Å
637	R	92.6	Very high	91.5	Very high	168 Å²	168	121.2 Å²	121.2	63%	0.634	54%	0.541	S	S	*	.	H	α-helix	trans	-58.5	-51.8	172.9	-175.2	-168.3	-67	151	-3.4	110.7	K633 E634 A639 R640 E641	K633-R637 PolarHBondContact O-N 2.89Å; E634-R637 WeakPolarHBondContact O-CA 3.49Å; E634-R637 WeakPolarHBondContact O-CB 3.39Å; E634-R637 PolarHBondContact O-N 3.16Å; R637-A639 VanDerWaalsContact C-N 3.25Å; R637-A639 PolarHBondContact O-N 3.5Å; R637-R640 PolarHBondContact O-N 3.05Å; R637-R640 VanDerWaalsContact O-N 3.16Å; R637-E641 PolarHBondContact O-N 3.04Å
638	M	84.1	Confident	91.7	Very high	105 Å²	105	120.5 Å²	120.5	52%	0.517	54%	0.535	S	S	.	.	H	α-helix	trans	-60.6	-33.9	177.1	-63.8	-54.5	-59.5	0	0	112.3	E634 R642	E634-M638 WeakPolarHBondContact O-CG 3.26Å; E634-M638 PolarHBondContact O-N 2.93Å; M638-R642 WeakPolarHBondContact O-CB 3.38Å; M638-R642 PolarHBondContact O-N 2.87Å
639	A	91.3	Very high	91.7	Very high	56 Å²	56	122.8 Å²	122.8	46%	0.463	55%	0.546	S	S	.	.	H	α-helix	trans	-68.9	-41.1	175.6	0	0	0	0	0	112.4	A635 E636 R637 R642 E643	A635-A639 VanDerWaalsContact O-CB 3.26Å; A635-A639 WeakPolarHBondContact O-CB 3.4Å; A635-A639 PolarHBondContact O-N 3.28Å; E636-A639 PolarHBondContact O-N 2.86Å; R637-A639 VanDerWaalsContact C-N 3.25Å; R637-A639 PolarHBondContact O-N 3.5Å; A639-R642 PolarHBondContact O-N 3.25Å; A639-E643 WeakPolarHBondContact O-CB 3.5Å; A639-E643 PolarHBondContact O-N 3.27Å
640	R	92.5	Very high	91.5	Very high	156 Å²	156	121.9 Å²	121.9	59%	0.589	54%	0.541	S	S	*	.	H	α-helix	trans	-66.1	-45.9	175.7	-67.2	178.3	-160.1	170.5	2.8	111.8	E636 R637 R642 E643 E644	E636-R640 WeakPolarHBondContact O-CG 3.19Å; E636-R640 PolarHBondContact O-N 2.9Å; E636-R640 IonicContact OE1-CZ 3.33Å; E636-R640 IonicContact OE1-NE 2.7Å; E636-R640 PolarHBondContact OE1-NE 3.43Å; E636-R640 IonicContact OE1-NH2 3.11Å; E636-R640 PolarHBondContact OE1-NH2 3.08Å; R637-R640 PolarHBondContact O-N 3.05Å; R637-R640 VanDerWaalsContact O-N 3.16Å; R640-R642 VanDerWaalsContact C-N 3.3Å; R640-R642 PolarHBondContact O-N 2.96Å; R640-E643 CarbonylContact O-C 3.56Å; R640-E643 WeakPolarHBondContact O-CB 3.49Å; R640-E643 PolarHBondContact O-N 2.96Å; R640-E643 VanDerWaalsContact O-N 3.09Å; R640-E644 PolarHBondContact O-N 2.84Å
641	E	91.7	Very high	91.4	Very high	96 Å²	96	122.2 Å²	122.2	45%	0.449	54%	0.543	S	S	.	.	H	α-helix	trans	-58.2	-43.5	175.6	-175.2	-174.9	157.2	0	0	111.2	R637 E643 E644 L645	R637-E641 PolarHBondContact O-N 3.04Å; E641-E643 VanDerWaalsContact C-N 3.35Å; E641-E643 PolarHBondContact O-N 3.27Å; E641-E644 PolarHBondContact O-N 3.46Å; E641-L645 HydrophobicContact CG-CD1 4.49Å; E641-L645 WeakPolarHBondContact O-CG 3.31Å; E641-L645 PolarHBondContact O-N 3.08Å
642	R	91.1	Very high	91.3	Very high	198 Å²	198	120.2 Å²	120.2	75%	0.747	54%	0.544	S	S	*	.	H	α-helix	trans	-66.6	-32.5	174.8	-173.8	175.8	-179.4	-179.5	0.9	113.4	M638 A639 R640 R646	M638-R642 WeakPolarHBondContact O-CB 3.38Å; M638-R642 PolarHBondContact O-N 2.87Å; A639-R642 PolarHBondContact O-N 3.25Å; R640-R642 VanDerWaalsContact C-N 3.3Å; R640-R642 PolarHBondContact O-N 2.96Å; R642-R646 WeakPolarHBondContact O-CB 3.27Å; R642-R646 PolarHBondContact O-N 2.78Å; R642-R646 VanDerWaalsContact O-N 3.08Å
643	E	92.1	Very high	90.9	Very high	91 Å²	91	119 Å²	119	43%	0.425	54%	0.539	S	S	.	.	H	α-helix	trans	-71.4	-37.8	172.2	-159.7	-165.3	155	0	0	111.4	A639 R640 E641 R646 R647	A639-E643 WeakPolarHBondContact O-CB 3.5Å; A639-E643 PolarHBondContact O-N 3.27Å; R640-E643 CarbonylContact O-C 3.56Å; R640-E643 WeakPolarHBondContact O-CB 3.49Å; R640-E643 PolarHBondContact O-N 2.96Å; R640-E643 VanDerWaalsContact O-N 3.09Å; E641-E643 VanDerWaalsContact C-N 3.35Å; E641-E643 PolarHBondContact O-N 3.27Å; E643-R646 CarbonylContact O-C 3.58Å; E643-R646 WeakPolarHBondContact O-CB 3.41Å; E643-R646 PolarHBondContact O-N 3.5Å; E643-R647 WeakPolarHBondContact O-CG 3.46Å; E643-R647 PolarHBondContact O-N 2.84Å; E643-R647 IonicContact OE1-CZ 2.73Å; E643-R647 VanDerWaalsContact OE1-CZ 3.29Å; E643-R647 IonicContact OE1-NE 2.91Å; E643-R647 PolarHBondContact OE1-NE 3.07Å; E643-R647 VanDerWaalsContact OE1-NE 3.14Å; E643-R647 IonicContact OE1-NH2 2.77Å; E643-R647 PolarHBondContact OE1-NH2 3.25Å; E643-R647 IonicContact OE2-NH2 3.6Å
644	E	93.6	Very high	90.5	Very high	118 Å²	118	119.2 Å²	119.2	55%	0.551	54%	0.54	S	S	*	.	H	α-helix	trans	-66.4	-46.4	176.4	-171.9	169.6	178.2	0	0	111.6	R640 E641 R646 R647 Q648	R640-E644 PolarHBondContact O-N 2.84Å; E641-E644 PolarHBondContact O-N 3.46Å; E644-R646 VanDerWaalsContact C-N 3.26Å; E644-R646 PolarHBondContact O-N 3.19Å; E644-R647 CarbonylContact O-C 3.36Å; E644-R647 PolarHBondContact O-N 3.49Å; E644-Q648 WeakPolarHBondContact O-CG 3.25Å; E644-Q648 PolarHBondContact O-N 2.93Å
645	L	92.2	Very high	90.3	Very high	97 Å²	97	118.1 Å²	118.1	51%	0.508	54%	0.535	S	S	.	.	H	α-helix	trans	-57.8	-37.9	170.5	-73.1	169.9	0	0	0	112.1	E641 Q648 Q649	E641-L645 HydrophobicContact CG-CD1 4.49Å; E641-L645 WeakPolarHBondContact O-CG 3.31Å; E641-L645 PolarHBondContact O-N 3.08Å; L645-Q648 PolarHBondContact O-N 3.27Å; L645-Q649 WeakPolarHBondContact O-CB 3.3Å; L645-Q649 PolarHBondContact O-N 3.34Å
646	R	93	Very high	89.9	Confident	146 Å²	146	121.5 Å²	121.5	55%	0.551	54%	0.541	S	S	*	.	H	α-helix	trans	-64.3	-44.5	172.5	178.2	-176.9	167.1	-149.2	-15.2	111.4	R642 E643 E644 Q649 E650	R642-R646 WeakPolarHBondContact O-CB 3.27Å; R642-R646 PolarHBondContact O-N 2.78Å; R642-R646 VanDerWaalsContact O-N 3.08Å; E643-R646 CarbonylContact O-C 3.58Å; E643-R646 WeakPolarHBondContact O-CB 3.41Å; E643-R646 PolarHBondContact O-N 3.5Å; E644-R646 VanDerWaalsContact C-N 3.26Å; E644-R646 PolarHBondContact O-N 3.19Å; R646-Q649 PolarHBondContact O-N 3.06Å; R646-E650 HydrophobicContact CG-CG 4.42Å; R646-E650 IonicContact CZ-OE1 3.24Å; R646-E650 IonicContact NE-OE1 2.93Å; R646-E650 PolarHBondContact NE-OE1 2.9Å; R646-E650 IonicContact NE-OE2 3.32Å; R646-E650 IonicContact NH2-OE1 2.88Å; R646-E650 PolarHBondContact NH2-OE1 3.12Å; R646-E650 IonicContact NH2-OE2 3.7Å; R646-E650 WeakPolarHBondContact O-CB 3.25Å; R646-E650 WeakPolarHBondContact O-CG 3.29Å; R646-E650 PolarHBondContact O-N 2.83Å
647	R	93.1	Very high	89.2	Confident	140 Å²	140	121.2 Å²	121.2	53%	0.528	54%	0.539	S	S	.	.	H	α-helix	trans	-64.2	-39.3	177.1	-71	173.5	-172.2	-172.4	3.4	111.7	E643 E644 E650 Q651	E643-R647 WeakPolarHBondContact O-CG 3.46Å; E643-R647 PolarHBondContact O-N 2.84Å; E643-R647 IonicContact OE1-CZ 2.73Å; E643-R647 VanDerWaalsContact OE1-CZ 3.29Å; E643-R647 IonicContact OE1-NE 2.91Å; E643-R647 PolarHBondContact OE1-NE 3.07Å; E643-R647 VanDerWaalsContact OE1-NE 3.14Å; E643-R647 IonicContact OE1-NH2 2.77Å; E643-R647 PolarHBondContact OE1-NH2 3.25Å; E643-R647 IonicContact OE2-NH2 3.6Å; E644-R647 CarbonylContact O-C 3.36Å; E644-R647 PolarHBondContact O-N 3.49Å; R647-E650 PolarHBondContact O-N 3.25Å; R647-Q651 WeakPolarHBondContact O-CB 3.38Å; R647-Q651 VanDerWaalsContact O-CG 3.25Å; R647-Q651 WeakPolarHBondContact O-CG 3.43Å; R647-Q651 PolarHBondContact O-N 3.08Å
648	Q	92.8	Very high	88.4	Confident	87 Å²	87	120.1 Å²	120.1	41%	0.407	54%	0.539	S	S	.	.	H	α-helix	trans	-62.8	-43.5	172.7	-68.8	174.1	14.9	0	0	111.2	E644 L645 Q651 L652	E644-Q648 WeakPolarHBondContact O-CG 3.25Å; E644-Q648 PolarHBondContact O-N 2.93Å; L645-Q648 PolarHBondContact O-N 3.27Å; Q648-Q651 PolarHBondContact O-N 3.39Å; Q648-L652 WeakPolarHBondContact O-CB 3.41Å; Q648-L652 WeakPolarHBondContact O-CG 3.39Å; Q648-L652 PolarHBondContact O-N 2.82Å
649	Q	91.4	Very high	87.5	Confident	140 Å²	140	122.6 Å²	122.6	65%	0.654	54%	0.543	S	S	*	.	H	α-helix	trans	-65	-38	174.8	-176.7	172.2	74.3	0	0	112.5	L645 R646 R653	L645-Q649 WeakPolarHBondContact O-CB 3.3Å; L645-Q649 PolarHBondContact O-N 3.34Å; R646-Q649 PolarHBondContact O-N 3.06Å; Q649-R653 WeakPolarHBondContact O-CB 3.35Å; Q649-R653 PolarHBondContact O-N 3.33Å
650	E	89.4	Confident	86	Confident	89 Å²	89	123.2 Å²	123.2	42%	0.416	54%	0.538	S	S	.	.	H	α-helix	trans	-70	-35	175	-74.5	174.2	170.4	0	0	111.9	R646 R647 F654	R646-E650 HydrophobicContact CG-CG 4.42Å; R646-E650 IonicContact CZ-OE1 3.24Å; R646-E650 IonicContact NE-OE1 2.93Å; R646-E650 PolarHBondContact NE-OE1 2.9Å; R646-E650 IonicContact NE-OE2 3.32Å; R646-E650 IonicContact NH2-OE1 2.88Å; R646-E650 PolarHBondContact NH2-OE1 3.12Å; R646-E650 IonicContact NH2-OE2 3.7Å; R646-E650 WeakPolarHBondContact O-CB 3.25Å; R646-E650 WeakPolarHBondContact O-CG 3.29Å; R646-E650 PolarHBondContact O-N 2.83Å; R647-E650 PolarHBondContact O-N 3.25Å; E650-F654 VanDerWaalsContact O-CB 3.29Å; E650-F654 WeakPolarHBondContact O-CB 3.33Å; E650-F654 PolarHBondContact O-N 2.98Å
651	Q	89.2	Confident	84.2	Confident	126 Å²	126	120.7 Å²	120.7	59%	0.589	54%	0.536	S	S	*	.	H	α-helix	trans	-66.7	-47.1	170.9	-75.9	170.9	3.6	0	0	112.1	R647 Q648 R653 F654 E655	R647-Q651 WeakPolarHBondContact O-CB 3.38Å; R647-Q651 VanDerWaalsContact O-CG 3.25Å; R647-Q651 WeakPolarHBondContact O-CG 3.43Å; R647-Q651 PolarHBondContact O-N 3.08Å; Q648-Q651 PolarHBondContact O-N 3.39Å; Q651-R653 VanDerWaalsContact C-N 3.28Å; Q651-R653 PolarHBondContact O-N 2.91Å; Q651-F654 CarbonylContact O-C 3.59Å; Q651-F654 PolarHBondContact O-N 2.95Å; Q651-F654 VanDerWaalsContact O-N 3.12Å; Q651-E655 PolarHBondContact O-N 2.65Å
652	L	87.9	Confident	82.4	Confident	115 Å²	115	123.2 Å²	123.2	60%	0.602	55%	0.552	S	S	*	*	H	α-helix	trans	-59.8	-40.1	175.1	-74.2	171	0	0	0	111.3	Q648 Q656	Q648-L652 WeakPolarHBondContact O-CB 3.41Å; Q648-L652 WeakPolarHBondContact O-CG 3.39Å; Q648-L652 PolarHBondContact O-N 2.82Å; L652-Q656 VanDerWaalsContact O-CB 3.3Å; L652-Q656 WeakPolarHBondContact O-CB 3.49Å; L652-Q656 PolarHBondContact O-N 3.35Å
653	R	85.3	Confident	80.6	Confident	166 Å²	166	122.6 Å²	122.6	63%	0.626	56%	0.555	S	S	*	*	H	α-helix	trans	-63.9	-45.3	172.1	-179.2	179.3	169.5	-178.4	-2.2	111.7	Q649 Q651 E655 Q656 E657	Q649-R653 WeakPolarHBondContact O-CB 3.35Å; Q649-R653 PolarHBondContact O-N 3.33Å; Q651-R653 VanDerWaalsContact C-N 3.28Å; Q651-R653 PolarHBondContact O-N 2.91Å; R653-E655 PolarHBondContact O-N 3.09Å; R653-Q656 CarbonylContact O-C 3.59Å; R653-Q656 PolarHBondContact O-N 2.81Å; R653-E657 VanDerWaalsContact O-CB 3.25Å; R653-E657 WeakPolarHBondContact O-CB 3.5Å; R653-E657 PolarHBondContact O-N 3.28Å
654	F	85.8	Confident	78.4	Confident	142 Å²	142	127.6 Å²	127.6	62%	0.623	57%	0.57	S	S	*	*	H	α-helix	trans	-64	-38.4	178.4	-179.9	-103.3	0	0	0	112.2	E650 Q651 K658	E650-F654 VanDerWaalsContact O-CB 3.29Å; E650-F654 WeakPolarHBondContact O-CB 3.33Å; E650-F654 PolarHBondContact O-N 2.98Å; Q651-F654 CarbonylContact O-C 3.59Å; Q651-F654 PolarHBondContact O-N 2.95Å; Q651-F654 VanDerWaalsContact O-N 3.12Å; F654-K658 VanDerWaalsContact O-CB 3.31Å; F654-K658 WeakPolarHBondContact O-CB 3.39Å; F654-K658 PolarHBondContact O-N 2.67Å
655	E	84.8	Confident	75.9	Confident	89 Å²	89	125.3 Å²	125.3	42%	0.416	58%	0.578	S	S	.	*	H	α-helix	trans	-67.2	-41.2	170.7	-68.3	-156.6	152.5	0	0	112.3	Q651 R653 E657 K658 R659	Q651-E655 PolarHBondContact O-N 2.65Å; R653-E655 PolarHBondContact O-N 3.09Å; E655-E657 VanDerWaalsContact C-N 3.3Å; E655-E657 PolarHBondContact O-N 3.4Å; E655-K658 PolarHBondContact O-N 3.27Å; E655-R659 VanDerWaalsContact CB-NH1 3.31Å; E655-R659 WeakPolarHBondContact O-CB 3.41Å; E655-R659 VanDerWaalsContact O-CG 3.28Å; E655-R659 WeakPolarHBondContact O-CG 3.38Å; E655-R659 PolarHBondContact O-N 3.14Å; E655-R659 IonicContact OE2-CZ 3.73Å; E655-R659 IonicContact OE2-NH1 3.67Å; E655-R659 PolarHBondContact OE2-NH1 2.74Å; E655-R659 IonicContact OE2-NH2 3.07Å; E655-R659 PolarHBondContact OE2-NH2 2.86Å
656	Q	80.6	Confident	73.7	Confident	131 Å²	131	132 Å²	132	61%	0.612	60%	0.596	S	S	*	*	H	α-helix	trans	-63.1	-40.4	176.6	-170.2	-179.8	40	0	0	110.7	L652 R653 R659 N660	L652-Q656 VanDerWaalsContact O-CB 3.3Å; L652-Q656 WeakPolarHBondContact O-CB 3.49Å; L652-Q656 PolarHBondContact O-N 3.35Å; R653-Q656 CarbonylContact O-C 3.59Å; R653-Q656 PolarHBondContact O-N 2.81Å; Q656-R659 CarbonylContact O-C 3.6Å; Q656-R659 PolarHBondContact O-N 2.8Å; Q656-N660 VanDerWaalsContact O-CB 3.25Å; Q656-N660 WeakPolarHBondContact O-CB 3.4Å; Q656-N660 PolarHBondContact O-N 3.33Å
657	E	78.1	Confident	71.1	Confident	89 Å²	89	134 Å²	134	42%	0.416	61%	0.612	S	S	.	*	H	α-helix	trans	-66.5	-41.7	174.8	-171.8	157.1	-161.9	0	0	111.3	R653 E655 R659 N660 N661	R653-E657 VanDerWaalsContact O-CB 3.25Å; R653-E657 WeakPolarHBondContact O-CB 3.5Å; R653-E657 PolarHBondContact O-N 3.28Å; E655-E657 VanDerWaalsContact C-N 3.3Å; E655-E657 PolarHBondContact O-N 3.4Å; E657-R659 VanDerWaalsContact C-N 3.34Å; E657-R659 PolarHBondContact O-N 2.74Å; E657-N660 CarbonylContact O-C 3.6Å; E657-N660 PolarHBondContact O-N 2.85Å; E657-N660 VanDerWaalsContact O-N 3.08Å; E657-N661 WeakPolarHBondContact O-CB 3.34Å; E657-N661 PolarHBondContact O-N 2.81Å; E657-N661 PolarHBondContact O-OD1 2.81Å
658	K	75.9	Confident	69	Low	145 Å²	145	134.5 Å²	134.5	63%	0.63	63%	0.63	S	S	*	*	H	α-helix	trans	-59.2	-41.5	169.7	-172.1	176.8	-179.4	-179.4	0	112	F654 E655 N660 L662	F654-K658 VanDerWaalsContact O-CB 3.31Å; F654-K658 WeakPolarHBondContact O-CB 3.39Å; F654-K658 PolarHBondContact O-N 2.67Å; E655-K658 PolarHBondContact O-N 3.27Å; K658-N660 VanDerWaalsContact C-N 3.33Å; K658-L662 VanDerWaalsContact O-CD1 3.32Å; K658-L662 WeakPolarHBondContact O-CD1 3.37Å
659	R	65.4	Low	66.4	Low	158 Å²	158	138.3 Å²	138.3	60%	0.596	65%	0.648	S	S	*	*	H	α-helix	trans	-69.7	-26.3	174	-69.7	172.2	-175.5	114.7	8.4	112.9	E655 Q656 E657	E655-R659 VanDerWaalsContact CB-NH1 3.31Å; E655-R659 WeakPolarHBondContact O-CB 3.41Å; E655-R659 VanDerWaalsContact O-CG 3.28Å; E655-R659 WeakPolarHBondContact O-CG 3.38Å; E655-R659 PolarHBondContact O-N 3.14Å; E655-R659 IonicContact OE2-CZ 3.73Å; E655-R659 IonicContact OE2-NH1 3.67Å; E655-R659 PolarHBondContact OE2-NH1 2.74Å; E655-R659 IonicContact OE2-NH2 3.07Å; E655-R659 PolarHBondContact OE2-NH2 2.86Å; Q656-R659 CarbonylContact O-C 3.6Å; Q656-R659 PolarHBondContact O-N 2.8Å; E657-R659 VanDerWaalsContact C-N 3.34Å; E657-R659 PolarHBondContact O-N 2.74Å
660	N	59.8	Low	64	Low	69 Å²	69	140.4 Å²	140.4	37%	0.369	66%	0.657	S	S	.	*	H	α-helix	trans	-85.4	-36	-179.6	-157.2	-27.6	0	0	0	112.2	Q656 E657 K658 L662 K663 R664	Q656-N660 VanDerWaalsContact O-CB 3.25Å; Q656-N660 WeakPolarHBondContact O-CB 3.4Å; Q656-N660 PolarHBondContact O-N 3.33Å; E657-N660 CarbonylContact O-C 3.6Å; E657-N660 PolarHBondContact O-N 2.85Å; E657-N660 VanDerWaalsContact O-N 3.08Å; K658-N660 VanDerWaalsContact C-N 3.33Å; N660-L662 PolarHBondContact O-N 3.42Å; N660-K663 CarbonylContact O-C 3.6Å; N660-K663 WeakPolarHBondContact O-CA 3.28Å; N660-K663 PolarHBondContact O-N 2.82Å; N660-R664 PolarHBondContact O-N 2.67Å; N660-R664 PolarHBondContact OD1-NH1 3.33Å; N660-R664 VanDerWaalsContact OD1-NH1 3.1Å
661	N	56.3	Low	61.4	Low	102 Å²	102	139.6 Å²	139.6	55%	0.545	67%	0.672	S	S	.	*	H	α-helix	trans	-67.8	-21.2	178	-69.5	-5.5	0	0	0	112.4	E657 K663	E657-N661 WeakPolarHBondContact O-CB 3.34Å; E657-N661 PolarHBondContact O-N 2.81Å; E657-N661 PolarHBondContact O-OD1 2.81Å; N661-K663 PolarHBondContact O-N 2.82Å
662	L	53.5	Low	59.2	Low	150 Å²	150	145.3 Å²	145.3	79%	0.785	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-4.6	165.8	-91.3	75.8	0	0	0	113.9	K658 N660	K658-L662 VanDerWaalsContact O-CD1 3.32Å; K658-L662 WeakPolarHBondContact O-CD1 3.37Å; N660-L662 PolarHBondContact O-N 3.42Å
663	K	52	Low	56.7	Low	184 Å²	184	151.7 Å²	151.7	80%	0.8	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.9	0.4	179.8	-81.6	-172.6	172.5	-177.6	0	115.2	N660 N661	N660-K663 CarbonylContact O-C 3.6Å; N660-K663 WeakPolarHBondContact O-CA 3.28Å; N660-K663 PolarHBondContact O-N 2.82Å; N661-K663 PolarHBondContact O-N 2.82Å
664	R	46.9	Very low	54.3	Low	197 Å²	197	152.2 Å²	152.2	74%	0.743	71%	0.714	S	S	*	*			trans	-127.1	79.6	166	-70.5	-161.3	-175.7	94	-8.3	110.6	N660	N660-R664 PolarHBondContact O-N 2.67Å; N660-R664 PolarHBondContact OD1-NH1 3.33Å; N660-R664 VanDerWaalsContact OD1-NH1 3.1Å
665	G	41.4	Very low	51.9	Low	69 Å²	69	151.9 Å²	151.9	71%	0.711	72%	0.719	S	S	*	*			trans	-129.8	33.7	-173.5	0	0	0	0	0	114.8
666	R	46.3	Very low	50.3	Low	239 Å²	239	153 Å²	153	90%	0.902	73%	0.734	S	S	*	*	S	Bend	trans	-157.9	162.4	172.8	-95.3	-79.6	-163.7	-99.4	-1.9	108.7
667	E	38.4	Very low	48.2	Very low	187 Å²	187	155.8 Å²	155.8	87%	0.874	74%	0.74	S	S	*	*			trans	68.5	63.8	168.4	-155.2	161.6	-102.4	0	0	116.6
668	V	47.3	Very low	46.5	Very low	151 Å²	151	162.9 Å²	162.9	92%	0.915	76%	0.764	S	S	*	*			trans	-129.6	67.5	151.4	-173.7	0	0	0	0	108.6
669	E	38.9	Very low	44.9	Very low	167 Å²	167	164.4 Å²	164.4	78%	0.78	78%	0.778	S	S	*	*			trans	-154.8	86.1	166.7	-171.4	160.8	-137.3	0	0	110.8
670	H	41.1	Very low	43.4	Very low	184 Å²	184	159 Å²	159	85%	0.852	77%	0.772	S	S	*	*				172.2	147.2	128.6	-95.3	-60.8	0	0	0	113.4
671	G	35	Very low	42.2	Very low	71 Å²	71	162.5 Å²	162.5	73%	0.732	79%	0.79	S	S	*	*				87.1	90.1	126.2	0	0	0	0	0	118.3
672	R	42	Very low	41.3	Very low	247 Å²	247	165.5 Å²	165.5	93%	0.932	80%	0.799	S	S	*	*			trans	-38.4	137.3	162	-52.6	177.4	-177	-162	3	114
673	R	35.3	Very low	40.8	Very low	248 Å²	248	167.5 Å²	167.5	94%	0.936	80%	0.801	S	S	*	*				-157.8	141.2	128.1	-109.4	169.2	-153.7	-116.7	0.9	110.3
674	E	35	Very low	40	Very low	178 Å²	178	167.7 Å²	167.7	83%	0.832	81%	0.807	S	S	*	*			trans	-87.7	149.4	162.2	-66.2	-177.6	-163.8	0	0	109
675	D	35.9	Very low	39.3	Very low	134 Å²	134	165.2 Å²	165.2	72%	0.717	80%	0.804	S	S	*	*			trans	-151.7	94.9	153.7	-161.2	-6.9	0	0	0	110.5	Y677	D675-Y677 PolarHBondContact O-N 3.48Å; D675-Y677 WeakPolarHBondContact OD1-CB 3.45Å
676	P	51.7	Low	39.6	Very low	114 Å²	114	167.6 Å²	167.6	74%	0.74	81%	0.806	S	S	*	*			trans	-81.7	51.6	-178.5	34.6	-35.5	0	0	0	112.1
677	Y	36.8	Very low	39	Very low	189 Å²	189	164 Å²	164	74%	0.741	80%	0.8	S	S	*	*			trans	-142	76.4	-170.7	-122.7	-85.8	0	0	0	113.5	D675	D675-Y677 PolarHBondContact O-N 3.48Å; D675-Y677 WeakPolarHBondContact OD1-CB 3.45Å
678	W	41.4	Very low	38.8	Very low	238 Å²	238	160.1 Å²	160.1	90%	0.902	79%	0.794	S	S	*	*			trans	-160.8	89.2	155	-96.4	109.8	0	0	0	111.8
679	N	43.3	Very low	38.2	Very low	176 Å²	176	160.8 Å²	160.8	94%	0.941	79%	0.787	S	S	*	*			trans	-124.3	82.7	162.4	-144.6	-14.1	0	0	0	107.8
680	G	33	Very low	38.1	Very low	44 Å²	44	157 Å²	157	45%	0.454	78%	0.775	S	S	.	*			trans	-118.4	0.8	-144.8	0	0	0	0	0	118.5
681	N	34.8	Very low	37.7	Very low	143 Å²	143	158 Å²	158	77%	0.765	77%	0.771	S	S	*	*			trans	73.9	151.7	158.8	-143.3	-14.9	0	0	0	118.6
682	K	36.4	Very low	37.6	Very low	166 Å²	166	162 Å²	162	72%	0.722	78%	0.775	S	S	*	*			trans	78.9	114	161	-60.2	162.2	-173.4	169.2	0	121.3
683	K	43.5	Very low	37	Very low	192 Å²	192	156.6 Å²	156.6	84%	0.835	77%	0.765	S	S	*	*			trans	61	120.4	131.1	-57.4	179.5	179.8	-170.8	0	120.1
684	M	34.7	Very low	37.1	Very low	188 Å²	188	152.9 Å²	152.9	93%	0.926	76%	0.758	S	S	*	*				-151	140	115.1	-92.8	-46.7	-142.2	0	0	111.3
685	H	32	Very low	36.7	Very low	144 Å²	144	147.8 Å²	147.8	67%	0.667	75%	0.753	S	S	*	*			trans	-133	109.7	165.6	175.8	-91.4	0	0	0	107.1	E687	H685-E687 IonicContact CE1-OE1 3Å
686	P	49	Very low	36.4	Very low	119 Å²	119	147.1 Å²	147.1	77%	0.773	76%	0.759	S	S	*	*			trans	-94.5	119.8	171.9	32.6	-26.2	0	0	0	110.2
687	E	33.2	Very low	35.4	Very low	164 Å²	164	148.6 Å²	148.6	77%	0.766	76%	0.761	S	S	*	*			trans	-111.7	125.9	172.9	-158.9	168.1	-118.9	0	0	108.6	H685	H685-E687 IonicContact CE1-OE1 3Å
688	S	34.2	Very low	35.2	Very low	106 Å²	106	149.5 Å²	149.5	74%	0.741	76%	0.764	S	S	*	*			trans	-166.2	94.3	170.8	54.6	0	0	0	0	108.1
689	E	35.9	Very low	34.6	Very low	165 Å²	165	145.9 Å²	145.9	77%	0.771	76%	0.763	S	S	*	*				70.8	136.1	77.3	-83.6	-129.2	126.2	0	0	115.4
690	V	36.1	Very low	34.1	Very low	88 Å²	88	146.1 Å²	146.1	53%	0.533	75%	0.751	S	S	.	*			trans	76.8	135.3	139.3	156	0	0	0	0	117.9
691	R	33.3	Very low	34	Very low	203 Å²	203	152 Å²	152	77%	0.766	77%	0.766	S	S	*	*			cis	-161.2	143.2	0	-117.7	167.9	-134.4	124	10.3	111.2
692	L	32.1	Very low	34.1	Very low	157 Å²	157	153.5 Å²	153.5	82%	0.822	77%	0.769	S	S	*	*			trans	166.3	124.1	137.8	-111.1	59.5	0	0	0	108.1
693	N	29.8	Very low	33.8	Very low	132 Å²	132	151.1 Å²	151.1	71%	0.706	76%	0.764	S	S	*	*				61.7	130.6	68.5	-95.8	-9.8	0	0	0	114.8
694	Q	36	Very low	33.2	Very low	170 Å²	170	151.2 Å²	151.2	79%	0.794	76%	0.759	S	S	*	*			cis	-164.1	154.3	-1.2	-165.1	169.3	90.4	0	0	113.6
695	G	27	Very low	32.8	Very low	71 Å²	71	150.6 Å²	150.6	73%	0.732	75%	0.751	S	S	*	*			trans	109.7	147.3	158.7	0	0	0	0	0	115.8
696	S	29.7	Very low	33.5	Very low	121 Å²	121	148.7 Å²	148.7	85%	0.846	75%	0.752	S	S	*	*			cis	-162.3	152.1	-16.9	-168.3	0	0	0	0	109.4
697	N	30.7	Very low	32.7	Very low	145 Å²	145	150 Å²	150	78%	0.775	75%	0.752	S	S	*	*			trans	-98.6	137.9	-173.8	-62.1	-58.5	0	0	0	113.8
698	Y	32.7	Very low	32.6	Very low	207 Å²	207	149 Å²	149	81%	0.812	76%	0.757	S	S	*	*			trans	-147.4	142.8	132.2	-77.2	-72.4	0	0	0	106.6
699	N	29.2	Very low	32.6	Very low	163 Å²	163	151.1 Å²	151.1	87%	0.872	76%	0.76	S	S	*	*			cis	-121.3	173.8	32.6	-160.2	1.4	0	0	0	114.1
700	R	33.3	Very low	33.1	Very low	181 Å²	181	148.5 Å²	148.5	68%	0.683	76%	0.758	S	S	*	*			trans	-126.1	126.2	-159.3	176.5	-176.9	-68.5	-153.4	1.1	114.9
701	Q	31.2	Very low	32.9	Very low	167 Å²	167	155.2 Å²	155.2	78%	0.78	77%	0.774	S	S	*	*			trans	26.3	122.5	145.5	-56.5	172	-35.3	0	0	121.2
702	Q	35.1	Very low	32.9	Very low	175 Å²	175	152.8 Å²	152.8	82%	0.818	77%	0.771	S	S	*	*			trans	167.6	155.9	130.1	-92.9	-178.2	108.4	0	0	108.2
703	N	30.9	Very low	33	Very low	115 Å²	115	156.2 Å²	156.2	62%	0.615	77%	0.773	S	S	*	*			cis	-138.7	154.1	-15.3	-99.9	-38.8	0	0	0	106.2
704	R	30.5	Very low	33.1	Very low	194 Å²	194	153.1 Å²	153.1	73%	0.732	77%	0.773	S	S	*	*			cis	96.2	112	38.7	-158.3	-175.9	-171	159.1	5.8	113
705	F	26.9	Very low	32.9	Very low	175 Å²	175	155.6 Å²	155.6	77%	0.768	77%	0.774	S	S	*	*			trans	99.5	148.8	172.6	-60.8	-59.3	0	0	0	118.4
706	P	46.2	Very low	33	Very low	105 Å²	105	161.2 Å²	161.2	68%	0.682	78%	0.779	S	S	*	*			trans	-142.3	179.1	-142.6	42.9	-22.4	0	0	0	118.3
707	N	32.3	Very low	33.6	Very low	147 Å²	147	161 Å²	161	79%	0.786	78%	0.775	S	S	*	*			trans	46.3	112.4	150	-70.7	-6.7	0	0	0	121.7
708	T	30.7	Very low	33.5	Very low	141 Å²	141	161.6 Å²	161.6	87%	0.865	78%	0.778	S	S	*	*			trans	-142.5	136.3	138	46	0	0	0	0	111.5
709	N	34.8	Very low	33.3	Very low	151 Å²	151	156.4 Å²	156.4	81%	0.807	78%	0.778	S	S	*	*			trans	-99.9	-164.5	177.3	-72.3	-25.4	0	0	0	110.7
710	P	47	Very low	33.5	Very low	111 Å²	111	151.3 Å²	151.3	72%	0.721	76%	0.764	S	S	*	*				-133	136	-74.4	38.1	-22.6	0	0	0	114
711	R	30.8	Very low	33.4	Very low	229 Å²	229	152.1 Å²	152.1	86%	0.864	78%	0.776	S	S	*	*			trans	-165.8	149.9	162.6	-126.6	169.3	177.4	82.5	-5	113.9
712	E	33.4	Very low	33.6	Very low	151 Å²	151	152.2 Å²	152.2	71%	0.706	78%	0.776	S	S	*	*			trans	63.6	144.3	171	-64.7	-167	-130.4	0	0	115.4
713	R	35.1	Very low	33.9	Very low	229 Å²	229	149.6 Å²	149.6	86%	0.864	77%	0.774	S	S	*	*			cis	-142.7	165.7	-13	-99.6	165.6	-169.8	-148.1	2	105.3
714	G	31.7	Very low	33.8	Very low	68 Å²	68	150.9 Å²	150.9	70%	0.701	78%	0.781	S	S	*	*			cis	146.3	62.8	8.1	0	0	0	0	0	112.4
715	R	31	Very low	34	Very low	221 Å²	221	148.3 Å²	148.3	83%	0.834	79%	0.787	S	S	*	*			trans	42.3	122.1	167.8	-49.1	-179.9	-163.2	-92.1	3.5	119
716	F	29.5	Very low	34.2	Very low	189 Å²	189	148.8 Å²	148.8	83%	0.829	79%	0.789	S	S	*	*				-173.9	175.9	99.6	-106	-61.9	0	0	0	111.3
717	P	42.8	Very low	33.6	Very low	117 Å²	117	150.3 Å²	150.3	76%	0.76	79%	0.791	S	S	*	*				-98.2	163.6	-118.2	41.1	-36.4	0	0	0	116.5
718	D	27.7	Very low	33.6	Very low	158 Å²	158	152.4 Å²	152.4	85%	0.845	79%	0.789	S	S	*	*			trans	-79.4	161.8	174	177.4	39.4	0	0	0	113.5
719	A	30.2	Very low	33.7	Very low	98 Å²	98	156 Å²	156	81%	0.81	79%	0.786	S	S	*	*			trans	-122.8	41	-167.7	0	0	0	0	0	115.3
720	G	32	Very low	33.6	Very low	56 Å²	56	155.5 Å²	155.5	58%	0.577	78%	0.784	S	S	*	*			trans	79.2	152.1	147	0	0	0	0	0	119.2
721	Q	32	Very low	32.7	Very low	198 Å²	198	160.4 Å²	160.4	93%	0.925	79%	0.788	S	S	*	*			trans	-159.3	156.2	157.5	-111.9	163.2	25.7	0	0	111.7
722	Q	35.2	Very low	32.5	Very low	169 Å²	169	157.7 Å²	157.7	79%	0.79	78%	0.782	S	S	*	*			trans	-100.7	155.1	170	-74.9	-86.6	-25.5	0	0	109.2
723	P	40.7	Very low	32.3	Very low	120 Å²	120	159 Å²	159	78%	0.779	79%	0.788	S	S	*	*			trans	-127.6	130.7	141.9	34.5	-25.2	0	0	0	112.9
724	N	30.3	Very low	32	Very low	141 Å²	141	151.5 Å²	151.5	75%	0.754	78%	0.783	S	S	*	*			trans	-77.6	150.8	158	-77.6	-63.1	0	0	0	109.3
725	T	33.3	Very low	32	Very low	140 Å²	140	155.7 Å²	155.7	86%	0.859	78%	0.784	S	S	*	*				179.8	159.3	105.6	29.1	0	0	0	0	114.2
726	F	32.2	Very low	32.6	Very low	185 Å²	185	151 Å²	151	81%	0.811	78%	0.783	S	S	*	*			trans	-64.8	157.2	176.4	-78.9	-111.7	0	0	0	114.4
727	D	32.9	Very low	32.8	Very low	137 Å²	137	147.7 Å²	147.7	73%	0.733	77%	0.77	S	S	*	*				-153.6	-179.1	105.4	-143.7	-19.1	0	0	0	112.9
728	R	33.3	Very low	32.4	Very low	192 Å²	192	147.3 Å²	147.3	73%	0.725	78%	0.776	S	S	*	*			trans	-117.7	153.1	-161.3	-48.7	146	174.9	147.6	-3.3	112
729	R	32	Very low	32.7	Very low	216 Å²	216	146.5 Å²	146.5	82%	0.815	77%	0.765	S	S	*	*				169.8	136	114.5	-94.2	162.5	173	142.6	-2.9	113.2
730	N	31.8	Very low	32.9	Very low	141 Å²	141	151.3 Å²	151.3	75%	0.754	77%	0.768	S	S	*	*				40.5	155.6	127.2	-45.3	-1.9	0	0	0	119.8
731	R	29.5	Very low	32.9	Very low	214 Å²	214	154 Å²	154	81%	0.808	78%	0.778	S	S	*	*			cis	-171.5	155.4	28.9	-159.1	178.6	-175.1	172.5	-0.7	112
732	F	25.8	Very low	33	Very low	171 Å²	171	156.2 Å²	156.2	75%	0.75	78%	0.778	S	S	*	*			trans	66.5	156	157.4	-109.6	-136.4	0	0	0	117.1
733	E	30.2	Very low	33	Very low	178 Å²	178	154.2 Å²	154.2	83%	0.832	78%	0.78	S	S	*	*			cis	-108.9	-172.6	-7.7	-41.6	-161.3	121.5	0	0	109.4
734	G	28.8	Very low	32.6	Very low	73 Å²	73	152.9 Å²	152.9	75%	0.753	78%	0.779	S	S	*	*			cis	173.5	143.7	-1.2	0	0	0	0	0	108
735	E	30	Very low	33.6	Very low	156 Å²	156	152.5 Å²	152.5	73%	0.729	78%	0.784	S	S	*	*			trans	-98	160.9	-177.9	-146.1	-148.8	-142.8	0	0	112.1	E737	E735-E737 WeakPolarHBondContact OE2-CG 3.25Å; E735-E737 PolarHBondContact OE2-N 2.84Å
736	P	44.4	Very low	33.3	Very low	123 Å²	123	154.7 Å²	154.7	80%	0.799	78%	0.784	S	S	*	*				-141.9	159.4	94.8	38.4	-24.5	0	0	0	116.7
737	E	33.2	Very low	33.3	Very low	119 Å²	119	155.2 Å²	155.2	56%	0.556	78%	0.78	S	S	*	*			trans	-49.1	146.8	-175.6	-54.6	178.5	96	0	0	118.3	E735 K739	E735-E737 WeakPolarHBondContact OE2-CG 3.25Å; E735-E737 PolarHBondContact OE2-N 2.84Å; E737-K739 WeakPolarHBondContact OE1-CE 3.39Å; E737-K739 IonicContact OE1-NZ 3.08Å; E737-K739 PolarHBondContact OE1-NZ 3.2Å; E737-K739 IonicContact OE2-NZ 2.73Å; E737-K739 PolarHBondContact OE2-NZ 2.92Å
738	A	33.9	Very low	33.5	Very low	108 Å²	108	155.6 Å²	155.6	89%	0.893	78%	0.778	S	S	*	*			trans	-139.6	117.3	146.8	0	0	0	0	0	111
739	K	35.4	Very low	33.4	Very low	141 Å²	141	149.5 Å²	149.5	61%	0.613	78%	0.775	S	S	*	*			trans	-86.9	165.7	-161.3	-61.4	167.9	165.6	90.4	0	114.7	E737	E737-K739 WeakPolarHBondContact OE1-CE 3.39Å; E737-K739 IonicContact OE1-NZ 3.08Å; E737-K739 PolarHBondContact OE1-NZ 3.2Å; E737-K739 IonicContact OE2-NZ 2.73Å; E737-K739 PolarHBondContact OE2-NZ 2.92Å
740	K	34.1	Very low	33.3	Very low	199 Å²	199	145.3 Å²	145.3	87%	0.865	78%	0.779	S	S	*	*			trans	85.4	139.7	166.8	-53.4	161.4	-175	175.5	0	115.3
741	S	32.3	Very low	33.2	Very low	114 Å²	114	141.7 Å²	141.7	80%	0.797	78%	0.775	S	S	*	*			cis	-155.7	154.3	-11.4	-93.9	0	0	0	0	110.9
742	R	33.7	Very low	33	Very low	243 Å²	243	139.3 Å²	139.3	92%	0.917	77%	0.771	S	S	*	*			trans	-89.9	152.7	167	-77.6	178.6	168.9	166.8	-4.1	111.2
743	P	35.8	Very low	33.3	Very low	128 Å²	128	136.6 Å²	136.6	83%	0.831	76%	0.764	S	S	*	*			trans	-108.8	150.6	143.2	34.6	-28.1	0	0	0	112
744	A	32.2	Very low	33.5	Very low	92 Å²	92	137.2 Å²	137.2	76%	0.76	76%	0.758	S	S	*	*			trans	-140.3	163	170.2	0	0	0	0	0	107.7
745	P	50.1	Low	33.6	Very low	133 Å²	133	143.2 Å²	143.2	86%	0.864	76%	0.76	S	S	*	*			trans	-82.7	158.1	-153.1	32.5	-37.1	0	0	0	115.3
746	H	27.4	Very low	34	Very low	185 Å²	185	141.7 Å²	141.7	86%	0.856	76%	0.763	S	S	*	*			trans	-121.6	155.3	164.1	-151.2	-66.2	0	0	0	110.6
747	R	33	Very low	33.4	Very low	196 Å²	196	144 Å²	144	74%	0.74	76%	0.761	S	S	*	*			trans	-144.9	167.4	-175.2	-175	-179.9	136.4	139.1	8.9	109.6
748	E	36.4	Very low	33.6	Very low	146 Å²	146	144.9 Å²	144.9	68%	0.682	77%	0.77	S	S	*	*			trans	69.4	152.7	-177.8	-41.8	-56.9	165.3	0	0	114.2
749	G	30.4	Very low	33.5	Very low	64 Å²	64	150.9 Å²	150.9	66%	0.66	77%	0.771	S	S	*	*			cis	174	-175.9	-4	0	0	0	0	0	112.2
750	S	30.1	Very low	33.3	Very low	128 Å²	128	150.9 Å²	150.9	90%	0.895	78%	0.778	S	S	*	*			trans	70.8	154.2	176.4	-152.2	0	0	0	0	117.8
751	G	30.4	Very low	33.1	Very low	65 Å²	65	145.1 Å²	145.1	67%	0.67	77%	0.767	S	S	*	*			cis	141.2	121.3	-20.1	0	0	0	0	0	117.3
752	F	26	Very low	33.1	Very low	164 Å²	164	145.2 Å²	145.2	72%	0.719	76%	0.762	S	S	*	*			trans	89.1	158.2	149.7	-148.9	-116.8	0	0	0	122.1	R754	F752-R754 VanDerWaalsContact CZ-NH1 3.28Å
753	D	32.4	Very low	33.2	Very low	113 Å²	113	142.5 Å²	142.5	60%	0.604	76%	0.76	S	S	*	*			trans	57.5	165.4	176.9	-75.3	-38.7	0	0	0	120.9
754	R	34.2	Very low	32.9	Very low	192 Å²	192	145.6 Å²	145.6	73%	0.725	76%	0.755	S	S	*	*				-177	129.4	-62.9	-105.6	-171.4	-162.1	134.8	-14.7	111.2	F752	F752-R754 VanDerWaalsContact CZ-NH1 3.28Å
755	Y	30.6	Very low	33.3	Very low	198 Å²	198	147.1 Å²	147.1	78%	0.776	76%	0.757	S	S	*	*			trans	26.2	135.5	149.2	-99.9	-92.5	0	0	0	122.8	K757	Y755-K757 HydrophobicContact CD1-CB 4.01Å
756	P	37.5	Very low	32.2	Very low	124 Å²	124	146.5 Å²	146.5	81%	0.805	74%	0.743	S	S	*	*				-128.2	158.8	96.4	38	-33.6	0	0	0	112.7
757	K	33.1	Very low	33	Very low	171 Å²	171	143.8 Å²	143.8	74%	0.743	74%	0.741	S	S	*	*			cis	113.3	85.1	4.9	-156.4	176.8	-172.8	-173.9	0	115.5	Y755	Y755-K757 HydrophobicContact CD1-CB 4.01Å
758	N	36.3	Very low	32.9	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	74%	0.737	S	S	*	*			trans	37	136.2	147.9	-55.8	27	0	0	0	122.6
759	Y	31.1	Very low	33.6	Very low	233 Å²	233	136.4 Å²	136.4	91%	0.914	74%	0.738	S	S	*	*			trans	-157.2	170.5	144.4	-107.7	-77.8	0	0	0	110.2
760	D	31.7	Very low	33.7	Very low	142 Å²	142	144.2 Å²	144.2	76%	0.759	75%	0.747	S	S	*	*				-149.6	164.2	-94.2	-145.2	-28.8	0	0	0	112.8
761	A	30.5	Very low	33.6	Very low	77 Å²	77	141.8 Å²	141.8	64%	0.636	74%	0.743	S	S	*	*			trans	69.9	134.3	145.1	0	0	0	0	0	125.7
762	V	33	Very low	33.5	Very low	117 Å²	117	146.1 Å²	146.1	71%	0.709	75%	0.75	S	S	*	*			trans	63.1	113.7	149	-130.1	0	0	0	0	124.1
763	H	34.6	Very low	33.7	Very low	185 Å²	185	143.7 Å²	143.7	86%	0.856	75%	0.749	S	S	*	*				175.1	176.8	103.8	-99.1	-71.9	0	0	0	114.5
764	R	30.3	Very low	33.8	Very low	193 Å²	193	143.4 Å²	143.4	73%	0.728	75%	0.748	S	S	*	*			trans	-142.8	142.1	-165.4	163.5	170.3	-176	-151.6	6.5	111	E766	R764-E766 IonicContact CZ-OE1 2.78Å; R764-E766 IonicContact NE-OE1 3.45Å; R764-E766 IonicContact NH2-OE1 3.69Å; R764-E766 PolarHBondContact NH2-OE1 2.73Å
765	P	39.9	Very low	33.7	Very low	125 Å²	125	144.7 Å²	144.7	81%	0.812	75%	0.753	S	S	*	*				-140.6	167.1	107.5	26	-4.8	0	0	0	117.6
766	E	27.8	Very low	33.8	Very low	120 Å²	120	145.5 Å²	145.5	56%	0.561	75%	0.754	S	S	*	*			trans	-39.1	154.7	169	-76	-62.8	126.6	0	0	116.8	R764	R764-E766 IonicContact CZ-OE1 2.78Å; R764-E766 IonicContact NE-OE1 3.45Å; R764-E766 IonicContact NH2-OE1 3.69Å; R764-E766 PolarHBondContact NH2-OE1 2.73Å
767	P	42.6	Very low	33.6	Very low	128 Å²	128	144 Å²	144	83%	0.831	74%	0.739	S	S	*	*				-143.8	177.7	57	41.4	-22.6	0	0	0	118.8
768	A	31.7	Very low	33.8	Very low	77 Å²	77	143.8 Å²	143.8	64%	0.636	73%	0.734	S	S	*	*			trans	-150.5	-177.5	178.6	0	0	0	0	0	110.5
769	P	51	Low	33.7	Very low	109 Å²	109	144.1 Å²	144.1	71%	0.708	74%	0.735	S	S	*	*			cis	-113.6	-149.9	-16.2	19.4	6.6	0	0	0	109.8
770	R	32.1	Very low	34.2	Very low	229 Å²	229	140.6 Å²	140.6	86%	0.864	73%	0.728	S	S	*	*			cis	-157.6	150.5	15.9	-57.3	165.8	-178.4	-93.3	-0.6	111.4
771	G	28.9	Very low	34.3	Very low	77 Å²	77	145.7 Å²	145.7	79%	0.794	74%	0.736	S	S	*	*			trans	74.2	147.8	150.8	0	0	0	0	0	117.7
772	D	28.1	Very low	34.6	Very low	156 Å²	156	153.4 Å²	153.4	83%	0.834	75%	0.749	S	S	*	*			cis	-146.7	172.2	-5.6	-149.1	-24.1	0	0	0	110.5
773	T	31.2	Very low	34.7	Very low	112 Å²	112	153.2 Å²	153.2	69%	0.687	75%	0.75	S	S	*	*			trans	-111.1	142.5	-148.6	51	0	0	0	0	118.1
774	D	33.8	Very low	35.3	Very low	108 Å²	108	149.8 Å²	149.8	58%	0.578	74%	0.744	S	S	*	*			trans	49.2	128.5	145.3	-73.8	-57.2	0	0	0	121.7
775	R	31.6	Very low	36.6	Very low	219 Å²	219	145.8 Å²	145.8	83%	0.826	74%	0.743	S	S	*	*				60.9	146.2	71	-64.5	-168	-166.8	116.5	-12.1	114.8
776	R	33.3	Very low	36.3	Very low	215 Å²	215	148.8 Å²	148.8	81%	0.811	75%	0.749	S	S	*	*			cis	-161.7	-136.1	-28.6	-149.4	-178	-158	-168.2	7.5	107.6	G879 S880	R776-G879 CarbonylContact O-C 3.29Å; R776-G879 WeakPolarHBondContact O-CA 3.37Å; R776-S880 PolarHBondContact O-N 3.04Å
777	D	33.9	Very low	36.6	Very low	92 Å²	92	146.8 Å²	146.8	49%	0.492	76%	0.76	S	S	.	*			trans	-103	165.6	-171.1	-136.2	-40.6	0	0	0	116.1	G878 G879 S880 G881	D777-G878 CarbonylContact O-C 3.5Å; D777-G879 WeakPolarHBondContact O-CA 3.32Å; D777-G879 PolarHBondContact O-N 2.77Å; D777-S880 VanDerWaalsContact CG-C 3.43Å; D777-S880 WeakPolarHBondContact OD1-CA 3.31Å; D777-G881 VanDerWaalsContact CG-N 3.3Å; D777-G881 PolarHBondContact OD1-N 3.43Å; D777-G881 WeakPolarHBondContact OD2-CA 3.19Å; D777-G881 PolarHBondContact OD2-N 2.67Å
778	R	35.9	Very low	35.9	Very low	166 Å²	166	145.8 Å²	145.8	63%	0.626	76%	0.762	S	S	*	*			trans	-91.1	161.9	-162.4	102.2	-162.8	-53.4	146.4	6	114.8	G879 S880	R778-G879 VanDerWaalsContact CB-C 3.43Å; R778-G879 WeakPolarHBondContact CB-O 3.19Å; R778-S880 PolarHBondContact NH1-OG 3.33Å
779	D	35.3	Very low	36.3	Very low	146 Å²	146	152.3 Å²	152.3	78%	0.781	77%	0.771	S	S	*	*			trans	-145	168.8	153.9	-142.8	-31.6	0	0	0	111.7
780	E	40	Very low	35.6	Very low	160 Å²	160	152.3 Å²	152.3	75%	0.748	77%	0.77	S	S	*	*			trans	-92.2	154.5	-163.6	-55.1	-172.2	142.8	0	0	115.6
781	R	34.1	Very low	36.1	Very low	248 Å²	248	145.6 Å²	145.6	94%	0.936	76%	0.757	S	S	*	*				177.8	169.8	116.6	-91.7	155.5	-163.5	-147.2	4	112.7
782	R	36.9	Very low	36.9	Very low	239 Å²	239	146.5 Å²	146.5	90%	0.902	74%	0.742	S	S	*	*			trans	-122.5	136.7	-162.2	176.1	-170.6	-175.9	-173.6	4.1	113.3
783	P	36.4	Very low	37.6	Very low	113 Å²	113	144.4 Å²	144.4	73%	0.734	74%	0.737	S	S	*	*			trans	-122	167.3	157.3	37.6	-26.7	0	0	0	114
784	P	45.4	Very low	38	Very low	113 Å²	113	143.4 Å²	143.4	73%	0.734	74%	0.74	S	S	*	*			trans	-118.4	-165.4	173.5	41.6	-27.7	0	0	0	112.5
785	P	59.3	Low	38.1	Very low	110 Å²	110	147 Å²	147	71%	0.714	76%	0.756	S	S	*	*				-128.8	-169	-69.9	39.2	-22	0	0	0	113.8
786	M	33.2	Very low	38.2	Very low	188 Å²	188	140.4 Å²	140.4	93%	0.926	74%	0.743	S	S	*	*			trans	76.5	142.7	173.1	-48.3	-72.6	-84	0	0	116.8
787	G	34.2	Very low	38.1	Very low	77 Å²	77	137.9 Å²	137.9	79%	0.794	74%	0.74	S	S	*	*			cis	156.8	102	-16.3	0	0	0	0	0	116
788	A	28.1	Very low	37.9	Very low	107 Å²	107	140.8 Å²	140.8	88%	0.884	76%	0.756	S	S	*	*			trans	-159	166.1	169.2	0	0	0	0	0	113.6
789	R	39.4	Very low	38.2	Very low	215 Å²	215	144.7 Å²	144.7	81%	0.811	77%	0.771	S	S	*	*			trans	-146.8	167.5	-176.1	-98.6	-176	171.2	-156.2	-1.5	109.3
790	P	37	Very low	38.1	Very low	108 Å²	108	143.3 Å²	143.3	70%	0.701	77%	0.769	S	S	*	*			cis	-138.8	-108.9	42.1	27.2	2.1	0	0	0	120.3
791	P	42.5	Very low	38.1	Very low	89 Å²	89	141.2 Å²	141.2	58%	0.578	77%	0.769	S	S	*	*				-119.5	-165.4	-116.7	39.1	-20.6	0	0	0	120.2	G804 G805	P791-G804 WeakPolarHBondContact O-CA 3.39Å; P791-G805 CarbonylContact C-O 3.56Å; P791-G805 VanDerWaalsContact C-O 3.29Å; P791-G805 WeakPolarHBondContact CA-O 3.14Å; P791-G805 WeakPolarHBondContact CB-O 3.05Å; P791-G805 PolarHBondContact O-N 3.41Å
792	I	46	Very low	38	Very low	95 Å²	95	140.2 Å²	140.2	49%	0.487	77%	0.766	S	S	.	*			trans	-128	150.8	-157.4	-163.6	159.7	0	0	0	119.4	G805	I792-G805 VanDerWaalsContact CG2-C 3.48Å; I792-G805 WeakPolarHBondContact CG2-O 3.12Å; I792-G805 PolarHBondContact N-O 2.95Å
793	P	43.1	Very low	37.9	Very low	113 Å²	113	134 Å²	134	73%	0.734	75%	0.75	S	S	*	*			trans	-125.4	173.1	148.2	38.4	-25.3	0	0	0	113.7
794	A	38.8	Very low	37.7	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	73%	0.733	S	S	*	*			trans	-150.5	160.1	-175	0	0	0	0	0	117.8
795	M	35.3	Very low	37.1	Very low	184 Å²	184	126 Å²	126	91%	0.906	71%	0.709	S	S	*	*			trans	71.1	148.3	173	-50.3	-175.1	74	0	0	115.6
796	S	33.3	Very low	36.1	Very low	80 Å²	80	124.1 Å²	124.1	56%	0.559	70%	0.703	S	S	*	*			cis	-148.6	169.1	6.7	-175.3	0	0	0	0	112
797	H	31.7	Very low	36	Very low	162 Å²	162	118.6 Å²	118.6	75%	0.75	69%	0.694	S	S	*	*	S	Bend	trans	75.3	148.4	172.7	-50.9	-76.4	0	0	0	118.8
798	N	29.2	Very low	35.9	Very low	153 Å²	153	125.6 Å²	125.6	82%	0.818	70%	0.697	S	S	*	*	S	Bend	trans	40	93.9	166.8	-59.7	-9.9	0	0	0	117	P800	N798-P800 WeakPolarHBondContact O-CD 2.99Å
799	R	44.1	Very low	36	Very low	249 Å²	249	128.3 Å²	128.3	94%	0.94	69%	0.689	S	S	*	*			trans	-68.2	109.6	-173.3	-62.2	179.6	177.2	-168.4	-1.6	113.3
800	P	31.9	Very low	35.5	Very low	116 Å²	116	123.9 Å²	123.9	75%	0.753	68%	0.681	S	S	*	*				-122.2	-140.4	116.1	41.9	-34.4	0	0	0	110.4	N798	N798-P800 WeakPolarHBondContact O-CD 2.99Å
801	P	40.3	Very low	35.2	Very low	116 Å²	116	126 Å²	126	75%	0.753	69%	0.686	S	S	*	*			trans	-123.2	160.7	-132.5	23.8	1.4	0	0	0	118.8
802	R	31	Very low	34.6	Very low	227 Å²	227	125.3 Å²	125.3	86%	0.857	70%	0.696	S	S	*	*			trans	74.2	152.3	159.6	-173.2	170.1	173.3	-138.4	-17.6	115.7
803	D	35.8	Very low	34	Very low	108 Å²	108	124.4 Å²	124.4	58%	0.578	71%	0.71	S	S	*	*			cis	-145.4	-177.5	10.2	-144.4	-17.7	0	0	0	114.5
804	G	31.7	Very low	34	Very low	35 Å²	35	125.4 Å²	125.4	36%	0.361	71%	0.714	S	S	.	*			trans	112.6	169	151.6	0	0	0	0	0	118.6	P791	P791-G804 WeakPolarHBondContact O-CA 3.39Å
805	G	33.2	Very low	33.7	Very low	24 Å²	24	128.1 Å²	128.1	25%	0.247	72%	0.715	C	S	.	*			trans	-147.2	166.9	169.8	0	0	0	0	0	120.9	P791 I792	P791-G805 CarbonylContact C-O 3.56Å; P791-G805 VanDerWaalsContact C-O 3.29Å; P791-G805 WeakPolarHBondContact CA-O 3.14Å; P791-G805 WeakPolarHBondContact CB-O 3.05Å; P791-G805 PolarHBondContact O-N 3.41Å; I792-G805 VanDerWaalsContact CG2-C 3.48Å; I792-G805 WeakPolarHBondContact CG2-O 3.12Å; I792-G805 PolarHBondContact N-O 2.95Å
806	A	38.3	Very low	33.6	Very low	70 Å²	70	124 Å²	124	58%	0.579	71%	0.705	S	S	*	*			trans	56.2	128.5	159.6	0	0	0	0	0	123.2
807	G	32.3	Very low	33.6	Very low	72 Å²	72	125.4 Å²	125.4	74%	0.742	72%	0.715	S	S	*	*			trans	145.9	89	142.6	0	0	0	0	0	122.5
808	W	32.1	Very low	33.8	Very low	225 Å²	225	127.2 Å²	127.2	85%	0.852	72%	0.721	S	S	*	*			trans	58.3	136.8	133.1	-83.5	16	0	0	0	125.5
809	K	29.8	Very low	33.9	Very low	164 Å²	164	123 Å²	123	71%	0.713	71%	0.714	S	S	*	*			trans	76	156.4	151	-62.2	171	175.1	-178.3	0	118.7
810	N	28.9	Very low	33.4	Very low	122 Å²	122	117.6 Å²	117.6	65%	0.652	70%	0.703	S	S	*	*			cis	-160.7	160.2	-13.6	-112.6	26.4	0	0	0	112.8
811	D	30.6	Very low	33.4	Very low	151 Å²	151	118.1 Å²	118.1	81%	0.807	70%	0.697	S	S	*	*			trans	47.4	152.9	145.8	-60.8	-50.4	0	0	0	125.7
812	G	29.3	Very low	33	Very low	75 Å²	75	123.4 Å²	123.4	77%	0.773	70%	0.702	S	S	*	*			trans	113.4	126.7	169.3	0	0	0	0	0	113.4
813	G	34.5	Very low	32.9	Very low	76 Å²	76	116.1 Å²	116.1	78%	0.784	70%	0.698	S	S	*	*			cis	87.3	126.8	16.8	0	0	0	0	0	110.5
814	V	42.6	Very low	33.3	Very low	135 Å²	135	117 Å²	117	82%	0.818	71%	0.709	S	S	*	*			cis	-149.7	152.6	20.2	-151.3	0	0	0	0	108.3
815	N	32.6	Very low	33.3	Very low	146 Å²	146	122.5 Å²	122.5	78%	0.781	73%	0.727	S	S	*	*				154.4	167.6	98.1	69.1	47.1	0	0	0	108.9
816	S	32.3	Very low	33.3	Very low	99 Å²	99	132.1 Å²	132.1	69%	0.692	76%	0.756	S	S	*	*			cis	-160.6	145.1	-4.9	-138.4	0	0	0	0	112.7
817	S	33.6	Very low	33.1	Very low	109 Å²	109	135 Å²	135	76%	0.762	76%	0.759	S	S	*	*			trans	54.7	156.3	148	56.9	0	0	0	0	123.8
818	K	35	Very low	33.1	Very low	200 Å²	200	140.6 Å²	140.6	87%	0.87	76%	0.758	S	S	*	*			cis	-177.7	136.2	-25.7	-178.4	175.4	-177.2	-177.9	0	111.4
819	G	31.6	Very low	33.1	Very low	65 Å²	65	135.2 Å²	135.2	67%	0.67	75%	0.746	S	S	*	*			trans	81.2	167.6	157.3	0	0	0	0	0	118.2
820	D	34.2	Very low	33.2	Very low	135 Å²	135	133.2 Å²	133.2	72%	0.722	74%	0.743	S	S	*	*			cis	-166.9	172.4	-18	-138.4	-57.4	0	0	0	112.7
821	M	30.9	Very low	33.3	Very low	126 Å²	126	137.5 Å²	137.5	62%	0.621	75%	0.75	S	S	*	*			trans	69.4	118.2	159.5	-64.2	-70.3	166.3	0	0	123.1
822	R	32.5	Very low	34.2	Very low	228 Å²	228	136.1 Å²	136.1	86%	0.86	75%	0.749	S	S	*	*			trans	60.5	131.1	135.1	-56.9	175.5	-161.9	-125.6	-2.3	121
823	G	28.4	Very low	34.6	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	75%	0.75	S	S	*	*			trans	-138.3	169.8	157.7	0	0	0	0	0	111.8
824	P	44.1	Very low	34.6	Very low	126 Å²	126	143.2 Å²	143.2	82%	0.818	75%	0.753	S	S	*	*			trans	-123.1	151.4	165.1	37.4	-26	0	0	0	114.2
825	M	32.7	Very low	34	Very low	150 Å²	150	142.2 Å²	142.2	74%	0.739	74%	0.743	S	S	*	*			trans	-4.4	132	148.3	-71.3	-80	179.3	0	0	115.9	M827	M825-M827 HydrophobicContact CE-CE 4.31Å; M825-M827 HydrophobicContact SD-CE 3.49Å; M825-M827 WeakPolarHBondContact SD-CE 2.93Å; M825-M827 HydrophobicContact SD-CG 4.07Å
826	R	32.9	Very low	33.7	Very low	227 Å²	227	140.6 Å²	140.6	86%	0.857	75%	0.75	S	S	*	*			cis	-152	165.9	39.5	-67.6	-177.4	-178.6	-180	-0.1	110.3
827	M	34.9	Very low	33.5	Very low	130 Å²	130	139.4 Å²	139.4	64%	0.64	75%	0.753	S	S	*	*			cis	-177.2	152.1	-21.5	-90.5	-171.5	177.4	0	0	104.1	M825	M825-M827 HydrophobicContact CE-CE 4.31Å; M825-M827 HydrophobicContact SD-CE 3.49Å; M825-M827 WeakPolarHBondContact SD-CE 2.93Å; M825-M827 HydrophobicContact SD-CG 4.07Å
828	R	31.8	Very low	33.3	Very low	189 Å²	189	145.3 Å²	145.3	71%	0.713	76%	0.758	S	S	*	*			cis	-163.5	159.1	-10.5	-103.1	179.8	66.7	-155.1	-10.2	106.1
829	D	31.6	Very low	32.9	Very low	113 Å²	113	140.6 Å²	140.6	60%	0.604	75%	0.751	S	S	*	*			cis	-109.7	-106.4	-11.3	-78.3	-63.2	0	0	0	109.7
830	D	32.4	Very low	32.7	Very low	122 Å²	122	141 Å²	141	65%	0.652	75%	0.754	S	S	*	*			trans	-169.9	166.3	-167.6	-106.7	-33.8	0	0	0	108.9
831	R	31.2	Very low	32.4	Very low	211 Å²	211	144 Å²	144	80%	0.796	76%	0.762	S	S	*	*			cis	-157.9	156.2	13.9	-133.8	143.8	-150.5	-112.3	-0.6	111.5
832	P	48.9	Very low	32.2	Very low	123 Å²	123	145.5 Å²	145.5	80%	0.799	77%	0.772	S	S	*	*			trans	-83.8	171.3	167.6	35.6	-35.2	0	0	0	112.4
833	G	38.7	Very low	32	Very low	77 Å²	77	140.5 Å²	140.5	79%	0.794	76%	0.762	S	S	*	*			trans	-152	179	-177.6	0	0	0	0	0	116
834	R	32.7	Very low	31.9	Very low	223 Å²	223	148.2 Å²	148.2	84%	0.842	77%	0.769	S	S	*	*			trans	-163.3	147.2	166.6	-128.1	-168.7	178.8	-129.7	8.9	113
835	D	30	Very low	31.1	Very low	114 Å²	114	146.1 Å²	146.1	61%	0.61	77%	0.77	S	S	*	*			trans	49.6	141.5	149.8	-56.6	-23.5	0	0	0	125
836	A	27	Very low	31.2	Very low	112 Å²	112	146.9 Å²	146.9	93%	0.926	77%	0.772	S	S	*	*			trans	70	150.8	151.9	0	0	0	0	0	119.3
837	G	28.6	Very low	31.6	Very low	73 Å²	73	141.7 Å²	141.7	75%	0.753	77%	0.767	S	S	*	*			trans	-161	168.7	-179	0	0	0	0	0	114.3
838	R	30.1	Very low	31.3	Very low	233 Å²	233	142.6 Å²	142.6	88%	0.879	77%	0.772	S	S	*	*			trans	-164.4	120.3	176.3	-108.4	173.8	173.8	-92.9	3.9	107.6
839	S	25.5	Very low	31.1	Very low	102 Å²	102	137.1 Å²	137.1	71%	0.713	77%	0.774	S	S	*	*				82.3	117.4	86.1	77.3	0	0	0	0	114.7
840	G	26.9	Very low	30.9	Very low	72 Å²	72	139 Å²	139	74%	0.742	78%	0.781	S	S	*	*			trans	155.3	73	177.5	0	0	0	0	0	112.4
841	F	28.6	Very low	30.7	Very low	200 Å²	200	138.9 Å²	138.9	88%	0.877	78%	0.781	S	S	*	*				54.9	114.2	96.2	-107.5	-85.4	0	0	0	115.7
842	N	26.3	Very low	30.4	Very low	157 Å²	157	137 Å²	137	84%	0.84	78%	0.781	S	S	*	*			trans	-153.1	171.8	140.9	-132.8	-25.9	0	0	0	113.5
843	N	27.9	Very low	29.6	Very low	122 Å²	122	138.8 Å²	138.8	65%	0.652	78%	0.778	S	S	*	*			trans	-96.1	157.7	-150.9	-103.2	-70.4	0	0	0	117.9
844	R	27.7	Very low	30	Very low	237 Å²	237	139.8 Å²	139.8	89%	0.894	77%	0.771	S	S	*	*			trans	64.3	138.3	147.1	-68.5	169.3	-176.9	-171.4	-0.8	120.5
845	G	27.4	Very low	29.6	Very low	82 Å²	82	138.2 Å²	138.2	85%	0.845	77%	0.77	S	S	*	*			trans	159.5	94.8	162.6	0	0	0	0	0	114
846	Q	33.7	Very low	29.4	Very low	166 Å²	166	138.1 Å²	138.1	78%	0.776	78%	0.779	S	S	*	*			trans	-131.7	141	167.9	-107.6	-78.7	-23.9	0	0	107.2
847	P	41.8	Very low	29.5	Very low	118 Å²	118	138.9 Å²	138.9	77%	0.766	78%	0.777	S	S	*	*				-146.3	132.8	114.2	35.3	-19.3	0	0	0	116.2
848	M	29.2	Very low	29.5	Very low	149 Å²	149	138.8 Å²	138.8	73%	0.734	78%	0.776	S	S	*	*			trans	50.1	116.2	134.4	-72.5	-63.7	-159.7	0	0	121.3
849	G	27.8	Very low	29.7	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	78%	0.775	S	S	*	*			trans	-135.5	128.4	143.8	0	0	0	0	0	108.9
850	M	27.2	Very low	29.9	Very low	153 Å²	153	142.6 Å²	142.6	75%	0.754	78%	0.783	S	S	*	*			trans	-60.6	143.4	-172.5	-67.7	-64.7	171.1	0	0	113
851	N	27.1	Very low	30.1	Very low	119 Å²	119	144.4 Å²	144.4	64%	0.636	78%	0.779	S	S	*	*				63.7	136.9	74.7	-134.9	47.5	0	0	0	112.1
852	E	26.6	Very low	30.2	Very low	171 Å²	171	140.9 Å²	140.9	80%	0.799	77%	0.774	S	S	*	*			cis	-140.8	167.6	30.4	-36.8	-149.6	104.6	0	0	117.4
853	Q	31.8	Very low	30.5	Very low	161 Å²	161	138.8 Å²	138.8	75%	0.752	77%	0.766	S	S	*	*			trans	-115	161.7	157	-94.2	-88.2	-39.2	0	0	105.7
854	P	46.1	Very low	31	Very low	97 Å²	97	139.5 Å²	139.5	63%	0.63	77%	0.766	S	S	*	*				-168	-174.7	59.1	47.1	-24.1	0	0	0	121.1
855	F	25.2	Very low	31.5	Very low	191 Å²	191	136.7 Å²	136.7	84%	0.838	76%	0.755	S	S	*	*			trans	54.3	113.3	144.7	-70	-53.2	0	0	0	124
856	S	25.6	Very low	31.7	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	76%	0.756	S	S	*	*				-171.2	131.6	105.8	28.8	0	0	0	0	108.8
857	S	29	Very low	31.6	Very low	127 Å²	127	139.2 Å²	139.2	89%	0.888	76%	0.758	S	S	*	*				66.6	130.5	72.7	-156	0	0	0	0	113.5
858	G	28.8	Very low	31	Very low	71 Å²	71	144.9 Å²	144.9	73%	0.732	76%	0.764	S	S	*	*			cis	-150.6	-156.3	17.7	0	0	0	0	0	116.9
859	R	32.8	Very low	31.1	Very low	226 Å²	226	143.9 Å²	143.9	85%	0.853	76%	0.761	S	S	*	*			trans	-115.5	157.8	-165.1	-63.7	169.4	163.2	-173.5	-4.3	113.7	V861	R859-V861 HydrophobicContact CB-CG2 4.14Å
860	Q	31.5	Very low	31.2	Very low	190 Å²	190	150 Å²	150	89%	0.888	77%	0.77	S	S	*	*				-174.6	131.1	127.6	-99.4	161.5	12.1	0	0	108.4
861	V	30.3	Very low	31.4	Very low	109 Å²	109	145.8 Å²	145.8	66%	0.661	77%	0.766	S	S	*	*			cis	93.1	140.8	9.9	-167.6	0	0	0	0	115.9	R859	R859-V861 HydrophobicContact CB-CG2 4.14Å
862	V	30.1	Very low	31.6	Very low	127 Å²	127	147.7 Å²	147.7	77%	0.77	78%	0.776	S	S	*	*			trans	91.1	113.1	-179.4	-172.2	0	0	0	0	113.5
863	V	32.9	Very low	31.9	Very low	112 Å²	112	148.8 Å²	148.8	68%	0.679	77%	0.772	S	S	*	*			cis	97.8	106.6	35.9	169.6	0	0	0	0	111
864	E	37.8	Very low	32	Very low	138 Å²	138	148 Å²	148	65%	0.645	77%	0.766	S	S	*	*				74.8	139.8	97.8	-138.8	-158.4	-175.4	0	0	112.1
865	R	38.3	Very low	31.4	Very low	177 Å²	177	147.6 Å²	147.6	67%	0.668	76%	0.756	S	S	*	*			cis	-153.3	-173.9	41.7	-79	176	173.9	-107.7	-27.1	110.1
866	H	31.2	Very low	31.7	Very low	185 Å²	185	148.3 Å²	148.3	86%	0.856	75%	0.753	S	S	*	*				-166.2	170.2	53	-84.1	-95.8	0	0	0	113.3
867	S	31.6	Very low	32	Very low	117 Å²	117	150.7 Å²	150.7	82%	0.818	75%	0.752	S	S	*	*			trans	-110.2	160.7	-168.5	-17.7	0	0	0	0	115.5
868	R	29.5	Very low	31.9	Very low	237 Å²	237	147 Å²	147	89%	0.894	73%	0.734	S	S	*	*			trans	-164.2	169.7	136.7	-144.3	154.5	-179.1	165.7	-2.8	115
869	D	32.4	Very low	31.8	Very low	128 Å²	128	145.3 Å²	145.3	68%	0.684	72%	0.716	S	S	*	*			trans	-84.3	-179.7	-158.4	-48.3	-93.7	0	0	0	119.8
870	Q	30	Very low	31.7	Very low	201 Å²	201	138.1 Å²	138.1	94%	0.939	70%	0.701	S	S	*	*			trans	93.9	151.1	155	-67.5	178.4	51.6	0	0	121.1
871	G	30.1	Very low	31.4	Very low	66 Å²	66	131.3 Å²	131.3	68%	0.68	68%	0.682	S	S	*	*			trans	164.1	170.1	-179.1	0	0	0	0	0	110.2
872	L	32.4	Very low	31.4	Very low	159 Å²	159	131.4 Å²	131.4	83%	0.832	69%	0.687	S	S	*	*			trans	-167.9	140.8	170.9	-135.5	76.9	0	0	0	115.4
873	R	33.1	Very low	31.6	Very low	193 Å²	193	133.8 Å²	133.8	73%	0.728	69%	0.69	S	S	*	*			trans	55.6	155.1	154.4	-77.8	-177.5	175.4	-109.2	6.7	120.6	E875	R873-E875 IonicContact NH1-OE1 3.72Å; R873-E875 PolarHBondContact NH1-OE1 2.91Å
874	K	34	Very low	31.3	Very low	144 Å²	144	135 Å²	135	63%	0.626	70%	0.697	S	S	*	*			cis	178.6	-162.2	-29.2	-136.4	175.1	142	-85.4	0	103.9
875	E	33.1	Very low	31	Very low	90 Å²	90	137.6 Å²	137.6	42%	0.421	71%	0.707	S	S	.	*			cis	-156.3	141.7	-12.6	26	-146.5	114.8	0	0	106.4	R873	R873-E875 IonicContact NH1-OE1 3.72Å; R873-E875 PolarHBondContact NH1-OE1 2.91Å
876	W	30.6	Very low	30.6	Very low	205 Å²	205	133.6 Å²	133.6	78%	0.777	71%	0.706	S	S	*	*				-164.1	-118	79.5	-100.9	88.3	0	0	0	114.9
877	H	32.1	Very low	30.4	Very low	163 Å²	163	132.1 Å²	132.1	76%	0.755	70%	0.704	S	S	*	*			trans	-163.8	173.8	-152.8	-69.5	-90.8	0	0	0	109.6
878	G	27.3	Very low	30.2	Very low	50 Å²	50	133.8 Å²	133.8	52%	0.515	70%	0.704	S	S	.	*			cis	154.9	168.5	-2	0	0	0	0	0	112.5	D777	D777-G878 CarbonylContact O-C 3.5Å
879	G	27.8	Very low	30.4	Very low	34 Å²	34	133.7 Å²	133.7	35%	0.351	70%	0.704	S	S	.	*			trans	165.1	-157.6	178.1	0	0	0	0	0	117.7	R776 D777 R778	R776-G879 CarbonylContact O-C 3.29Å; R776-G879 WeakPolarHBondContact O-CA 3.37Å; D777-G879 WeakPolarHBondContact O-CA 3.32Å; D777-G879 PolarHBondContact O-N 2.77Å; R778-G879 VanDerWaalsContact CB-C 3.43Å; R778-G879 WeakPolarHBondContact CB-O 3.19Å
880	S	28.8	Very low	30.4	Very low	76 Å²	76	137.8 Å²	137.8	53%	0.531	71%	0.71	S	S	.	*			trans	-171.1	150.2	167.4	-169.6	0	0	0	0	114.8	R776 D777 R778	R776-S880 PolarHBondContact O-N 3.04Å; D777-S880 VanDerWaalsContact CG-C 3.43Å; D777-S880 WeakPolarHBondContact OD1-CA 3.31Å; R778-S880 PolarHBondContact NH1-OG 3.33Å
881	G	26.6	Very low	30.6	Very low	47 Å²	47	134.8 Å²	134.8	49%	0.485	70%	0.697	S	S	.	*			trans	-167.6	169.3	174.5	0	0	0	0	0	116.7	D777	D777-G881 VanDerWaalsContact CG-N 3.3Å; D777-G881 PolarHBondContact OD1-N 3.43Å; D777-G881 WeakPolarHBondContact OD2-CA 3.19Å; D777-G881 PolarHBondContact OD2-N 2.67Å
882	S	29.5	Very low	30.8	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	70%	0.704	S	S	*	*			trans	-157.6	134.8	-169.7	170.8	0	0	0	0	114.9
883	Q	33.8	Very low	30.9	Very low	177 Å²	177	134.5 Å²	134.5	83%	0.827	70%	0.7	S	S	*	*			trans	27.8	120.6	145.7	-169.9	-176.4	7.9	0	0	120.8
884	V	28.1	Very low	31	Very low	136 Å²	136	128.8 Å²	128.8	82%	0.824	70%	0.701	S	S	*	*			trans	174.9	160.4	135.2	144.7	0	0	0	0	111.7
885	F	31	Very low	31	Very low	194 Å²	194	134 Å²	134	85%	0.851	72%	0.717	S	S	*	*			trans	-77.4	171.8	175	-70.2	-119.4	0	0	0	111.5
886	S	29.5	Very low	30.9	Very low	93 Å²	93	133.7 Å²	133.7	65%	0.65	74%	0.738	S	S	*	*			cis	-152.8	166.1	18.5	-50	0	0	0	0	112.7
887	D	27.7	Very low	30.9	Very low	153 Å²	153	127.4 Å²	127.4	82%	0.818	74%	0.737	S	S	*	*			trans	73.5	161.8	139.4	-87.5	-58	0	0	0	123.7
888	N	27.9	Very low	31	Very low	153 Å²	153	127.8 Å²	127.8	82%	0.818	74%	0.741	S	S	*	*			trans	83.5	126.8	165.9	-86.5	-15.2	0	0	0	122.2
889	R	32.5	Very low	31.3	Very low	235 Å²	235	133.2 Å²	133.2	89%	0.887	76%	0.755	S	S	*	*			trans	-66.2	155.5	171.5	-46.3	160.5	-173.3	173.3	0.2	110.6
890	R	31.7	Very low	31.4	Very low	214 Å²	214	135.5 Å²	135.5	81%	0.808	77%	0.771	S	S	*	*				136.7	136.5	115.4	-168.5	170.5	-169.7	-147.2	1.6	115.4
891	M	36.1	Very low	31.5	Very low	137 Å²	137	138.8 Å²	138.8	68%	0.675	79%	0.788	S	S	*	*			trans	73.4	137.7	163.5	-101.1	55.6	-167.2	0	0	119.6	D893	M891-D893 WeakPolarHBondContact CE-OD2 3.17Å
892	G	33.2	Very low	31.5	Very low	80 Å²	80	141.4 Å²	141.4	83%	0.825	80%	0.799	S	S	*	*			trans	154	54.1	-172.2	0	0	0	0	0	110.4
893	D	34.4	Very low	31.5	Very low	139 Å²	139	141.6 Å²	141.6	74%	0.743	80%	0.8	S	S	*	*			trans	-83.2	153.6	-164.4	-102.3	-67.4	0	0	0	115.5	M891	M891-D893 WeakPolarHBondContact CE-OD2 3.17Å
894	G	34.8	Very low	31.4	Very low	74 Å²	74	141.2 Å²	141.2	76%	0.763	80%	0.798	S	S	*	*			trans	-154.3	35.1	-168.1	0	0	0	0	0	117.6
895	R	35	Very low	31.3	Very low	252 Å²	252	138.9 Å²	138.9	95%	0.951	79%	0.788	S	S	*	*			trans	24.6	127.8	161	-62	-174.5	176.2	-150.3	-0.9	121.2
896	G	31.5	Very low	31.3	Very low	84 Å²	84	135.2 Å²	135.2	87%	0.866	79%	0.786	S	S	*	*			trans	138.9	141.9	148.2	0	0	0	0	0	115.9
897	G	30.4	Very low	31.4	Very low	74 Å²	74	136.4 Å²	136.4	76%	0.763	80%	0.795	S	S	*	*			cis	178.4	10.6	2.3	0	0	0	0	0	120.6
898	M	33	Very low	31.6	Very low	170 Å²	170	132.6 Å²	132.6	84%	0.837	79%	0.791	S	S	*	*			trans	64.3	129.7	157.5	-63.7	179.6	75.2	0	0	122.7
899	M	33.6	Very low	31.9	Very low	164 Å²	164	133.9 Å²	133.9	81%	0.808	80%	0.797	S	S	*	*			trans	76.5	112.6	135.9	-63.2	-71.9	-107.3	0	0	124.9
900	A	30.4	Very low	31.9	Very low	82 Å²	82	126.3 Å²	126.3	68%	0.678	79%	0.792	S	S	*	*				88.2	163	118.1	0	0	0	0	0	124.6
901	T	30.9	Very low	32	Very low	145 Å²	145	128 Å²	128	89%	0.89	80%	0.799	S	S	*	*			trans	89.8	-178.6	168.4	76.4	0	0	0	0	119.3
902	S	27.2	Very low	31.8	Very low	103 Å²	103	125.9 Å²	125.9	72%	0.72	79%	0.789	S	S	*	*			trans	-162.9	156.9	-133.8	54.5	0	0	0	0	116.2
903	S	29.8	Very low	31.8	Very low	115 Å²	115	128.5 Å²	128.5	80%	0.804	79%	0.789	S	S	*	*			trans	73.8	156.5	171.9	-65.2	0	0	0	0	115.7
904	H	29.9	Very low	31.8	Very low	168 Å²	168	128 Å²	128	78%	0.778	78%	0.782	S	S	*	*			cis	-151.9	-173	-9.6	42.6	-152.2	0	0	0	108.3
905	S	27	Very low	31.7	Very low	88 Å²	88	131.7 Å²	131.7	62%	0.615	78%	0.782	S	S	*	*				171.9	175.1	55.7	-119.3	0	0	0	0	111
906	S	31.1	Very low	31.6	Very low	116 Å²	116	125.9 Å²	125.9	81%	0.811	78%	0.775	S	S	*	*			trans	73.4	156.9	162.1	79.5	0	0	0	0	120.9
907	S	31.3	Very low	31.9	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	77%	0.774	S	S	*	*			cis	-167.9	149.7	-43.1	54	0	0	0	0	113.3
908	G	31	Very low	32	Very low	72 Å²	72	133.6 Å²	133.6	74%	0.742	78%	0.779	S	S	*	*			trans	87.1	155.3	162.7	0	0	0	0	0	118
909	L	34.1	Very low	32	Very low	180 Å²	180	129.4 Å²	129.4	94%	0.942	77%	0.767	S	S	*	*			cis	171.7	109.9	-21.3	-113.6	165.2	0	0	0	105.9
910	G	33.7	Very low	31.9	Very low	76 Å²	76	129.4 Å²	129.4	78%	0.784	77%	0.768	S	S	*	*			trans	-149.3	96.4	-168.6	0	0	0	0	0	115.5
911	R	34.2	Very low	32	Very low	251 Å²	251	130.5 Å²	130.5	95%	0.947	77%	0.771	S	S	*	*			trans	-61.7	151.4	-164.1	-54.8	170.2	-163.9	-163.8	2.3	116.1
912	I	32	Very low	32.1	Very low	92 Å²	92	129.4 Å²	129.4	47%	0.472	77%	0.769	S	S	.	*			trans	-95.6	144.2	-179.7	-65.1	166.5	0	0	0	112.4	Q914	I912-Q914 HydrophobicContact CG2-CG 3.95Å
913	V	31.6	Very low	32.3	Very low	135 Å²	135	127.4 Å²	127.4	82%	0.818	77%	0.765	S	S	*	*			trans	-131.5	142.4	152.2	-178.1	0	0	0	0	109.3
914	Q	34.4	Very low	32.4	Very low	128 Å²	128	128.9 Å²	128.9	60%	0.598	77%	0.769	S	S	*	*			trans	-131	126.8	176.3	-65.3	-179.9	-84.9	0	0	110.6	I912	I912-Q914 HydrophobicContact CG2-CG 3.95Å
915	I	32.9	Very low	32.7	Very low	151 Å²	151	127.9 Å²	127.9	77%	0.774	77%	0.774	S	S	*	*			trans	-138.8	95.2	167.7	-62.8	-174.2	0	0	0	110
916	T	33.1	Very low	32.9	Very low	130 Å²	130	127.3 Å²	127.3	80%	0.798	78%	0.783	S	S	*	*			trans	52.6	148.5	135.8	62.5	0	0	0	0	124.6
917	N	37.6	Very low	33	Very low	159 Å²	159	125.1 Å²	125.1	85%	0.85	78%	0.778	S	S	*	*			trans	-97.1	158.6	171	-65.4	-30.1	0	0	0	112.7
918	N	33.6	Very low	33	Very low	162 Å²	162	129.9 Å²	129.9	87%	0.866	78%	0.784	S	S	*	*			trans	176.4	160.8	147.4	-96.2	-14.9	0	0	0	109.6
919	S	31.7	Very low	33.2	Very low	82 Å²	82	136.1 Å²	136.1	57%	0.573	79%	0.791	S	S	*	*			cis	-173	164.5	-25	52	0	0	0	0	110
920	I	32.7	Very low	33.3	Very low	163 Å²	163	132.3 Å²	132.3	84%	0.836	79%	0.785	S	S	*	*			trans	54.6	151	162.4	62.2	174.9	0	0	0	119.1
921	S	32.7	Very low	33.1	Very low	105 Å²	105	139 Å²	139	73%	0.734	79%	0.793	S	S	*	*			cis	-171.6	163.6	39.4	52.1	0	0	0	0	112.9
922	S	32.1	Very low	33.3	Very low	123 Å²	123	136.7 Å²	136.7	86%	0.86	79%	0.79	S	S	*	*			trans	55.2	151.6	162	-132.8	0	0	0	0	120.1
923	G	30.7	Very low	33.6	Very low	61 Å²	61	136.1 Å²	136.1	63%	0.629	81%	0.807	S	S	*	*			cis	129.6	128.7	-4.3	0	0	0	0	0	113.3
924	T	32.3	Very low	33.9	Very low	146 Å²	146	134 Å²	134	90%	0.896	80%	0.803	S	S	*	*			trans	173.9	156.3	146.3	-69.2	0	0	0	0	109.2
925	V	37.8	Very low	34.1	Very low	146 Å²	146	132.8 Å²	132.8	89%	0.885	81%	0.809	S	S	*	*			trans	-125.1	145.9	-164.6	-170.2	0	0	0	0	112.3
926	G	31.2	Very low	34.3	Very low	77 Å²	77	136.5 Å²	136.5	79%	0.794	81%	0.813	S	S	*	*			trans	165	130.4	163.5	0	0	0	0	0	113.1
927	G	33.1	Very low	35.4	Very low	69 Å²	69	135.3 Å²	135.3	71%	0.711	81%	0.808	S	S	*	*			cis	141.8	81.6	-8.6	0	0	0	0	0	113.4
928	F	31.2	Very low	35.5	Very low	219 Å²	219	141.3 Å²	141.3	96%	0.961	83%	0.827	S	S	*	*			trans	-138.3	147	169.5	-107.8	-89.3	0	0	0	111.6
929	K	35	Very low	35.6	Very low	203 Å²	203	140.3 Å²	140.3	88%	0.883	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-91.3	151.3	-171.8	-65.9	178.9	178.8	177.6	0	112
930	A	34.7	Very low	35.8	Very low	100 Å²	100	143.4 Å²	143.4	83%	0.826	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-76.9	143.5	169.4	0	0	0	0	0	111.3
931	F	31.5	Very low	36	Very low	216 Å²	216	142.3 Å²	142.3	95%	0.947	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-92.9	143.8	164.7	-125.7	-94.1	0	0	0	109.9
932	K	38.5	Very low	36.2	Very low	204 Å²	204	144.5 Å²	144.5	89%	0.887	85%	0.845	S	S	*	*			trans	-131.4	116.4	-175.5	-173.9	-176.1	-178.1	-173.3	0	107.7
933	G	37.4	Very low	36.5	Very low	79 Å²	79	145.8 Å²	145.8	81%	0.814	84%	0.844	S	S	*	*			trans	-155.1	127.2	178.9	0	0	0	0	0	109
934	A	37.1	Very low	36.8	Very low	90 Å²	90	151.5 Å²	151.5	74%	0.744	86%	0.858	S	S	*	*			trans	-133.4	127	-173	0	0	0	0	0	111.5
935	S	39.8	Very low	37.2	Very low	103 Å²	103	151.9 Å²	151.9	72%	0.72	86%	0.855	S	S	*	*			trans	68	149.4	144	69.5	0	0	0	0	121.3
936	R	36.8	Very low	37.1	Very low	229 Å²	229	152.3 Å²	152.3	86%	0.864	85%	0.853	S	S	*	*			trans	81.2	151.3	164.6	-55.4	-172.2	172.7	-94.3	1.4	115.8
937	P	57	Low	37.6	Very low	105 Å²	105	158.6 Å²	158.6	68%	0.682	86%	0.858	S	S	*	*				-139.2	155.2	-68.6	33.4	-15.7	0	0	0	114.1
938	F	39.5	Very low	38	Very low	286 Å²	286	166.7 Å²	166.7	100%	1.254	87%	0.871	S	S	*	*			trans	-159.5	0	132.3	-101	-70.6	0	0	0	107.5

Retrieved 938 of 938 residues in 126.4 ms (Link to these results)

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