A0A5K4F442_SCHMA Loading...

LSDAT_euk domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F442, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,279 aa.

						>A0A5K4F442_SCHMA|A0A5K4F442
MTEQIPFQRTSTLKHRISRTGSVGQDNNNNITGSINISSGINTGIQQQSSIRRASVMQKYMGEIEFTGLNQTARFCKLNSETPDSILRDILKRKWGLKPPTLIITVFGTDFEKKRKLKMIFKKGLWKAAESGCWIVTGGFHLGVMKLTGEAVRDYTDAYGGNRMMAFGVASWDCVTKNEILEAALHEGTAVYQSEEDEEEEAEDSEPILVDPLSQGGIKSVRSDIEERALDPNHNFFVLVDDGTTDQLKGKEAELRARFERCISLWNCASSPQEQTTTVTSQQSGPISSTTHLQQPQNGISTSSNVNNNVNLGGLQRQGSTMGGQASTTSGPQTSATSIGKTSAITGGSSSNSALSKGVSEPVVSNQPVSTASVTRGTKDKLTTESSLKPAKSGKSVGSEEEILVPMCGLVVGGDRFTLRQVYCSMIRNRCPIVVTKGTSGAADVLAFGLDAANKMASEEVVDDKDQVPLEARLESIIEEFLGDLHPDYTNYTDEVNMLCEIINEYTNLVSVFDMEEDSDLDGYVISSLLASAGSTVASDQINLEQLEITLTLNRADIAREKIFLENKKWKKGQLNDYMYQALMSDRHDFVKLFLEQGFSLEDFLTIYMLEKLYTDQLKNLNSKVAIFNKMWEYNRSHRKLGRTVSKEHKTSKVALRDVGKVIKALVGDFYHPLYLSKEFQAKLMPEKRLEGADICQRLLGSNKLRSSQDYSNMSPSSSSSSTSSSSHHNGAICPRTLGLKDNVRFIDYNEDYDLMNLNSLHLTSPPPPLPPPPPTSTTTVIEEIGFRNPAFLECDKYGTRAIIRRGATSVEPAEKNDGDNDDDDNDYDVDDREDHDDDNEIYGSNMNGFTMNSRLPRSSTTMTTVSGEPLISSNVLRYNDKGNTMGTSTVSHLGSSRIRDGTIQQQYHLNDEGNSSRPHNTDDMSSQLKKSKYLSATRNNDNGNRNGYSSRNKHGRRPSSQTNEHDMLIPGQPLIYNATITNINRSGHSSRGPYTSLGPGHFRITGRAPLAYDATSMGTTTPIQSPKPIINDTLQFSFDNEHVQRNSVLISSIPNEKSNKPVLFEDETINKPSRSCLMSCIQRITSFCSRLFRCNTDTKKVNKGLSLSQESTGIKGPKEFATLRAMAALAAATAATAVADPTKTTQGDLIIPSNFFEPDEEQTKSIQLDRPARELLIWSILVGKLRMAELFWTMEKEPIAAALLASILLTSLGNKTDDFTDKEDYRSFAKNFQERAEGVLNECYREDEHRTQLIINHELIYYGRSSVIKLAAEGQSIKFMAHPCCQDFLTNTWSGNLSTKNSVFRYIMGVVCGLTLPFLIPKVILSKPKTNPTTEGEESSPTSEQQGSTQSNHTMKYVLTAEDAGKKGVRKTLQARTVEYISQIRDFYMAPVVRFVYNTISYITFLILFSYLLLVDFRINITVVEYIVIAWVITLFIEEIKQIAWAVLSGISFRTYISDGWNKLDCAGLALYIIGFILRLIVLLRLGQENNFNIKYERYYIVTDPILDPSRICLAISLFTFYIRLMYTFSFHIALGPKLIMIGKMVTNDLIPFMIILTVIMVGYAVAAQSIAYPNGLFTKENMTLNSEIKHMTFADIIFSMYTTAYFQMFGDFSLDALQGEDRTCQNHMCPTKTSRWLVPIMLGFYVLLTNILMFNLLIAMFSKTYEEIESASTYYWNYQRYQMINDYVHRSPLAPPIIIVWHFYEAYKAIGNQCASLRNAETAKYNPFCVRFTDVKKEREMVKWEHMKAMDYLREPSTKATGKRGVAESRAVVFRGGGGVGPGQGPVMDLKSEMSSVTEGIGMELEKRFKEIDNQFQRFNDVDSRLNDVTQLLTNLSEVISNVTETQQRIIRQINELPTCQCNEFTDEVVPVQKSTTHQTDSGTAETRKRTKLEVAIQSALEAAKDVLRPPTPPPPPPPPPPPQGKESPVLLAAVVPGSEDDSSGSEEGGDPSADPVLVPQVPDIKTGRVIERTLGDHRLWRMAPFNFEKYPGMRMNVPPERMAWTVEYPDYFAYDACEEILLFPSEESHDGVNFTHGNIVFTFQHSENLRTINFNQYDAKAKLRRQSLLGRYRLDSTTGAPLNPMGRTGLLGKGLLPRWGPNHSFVLCITRWTRDTRTGAQIIRSNRGVLQYLALERNKRLCMPWYLTDHTSKCDFDECVLKIISSLITRRGHAMLPEKRVDRLLKRIEKAEVTQIFKGYLDDQLNADSAWMETVVINLHESESKGAQLPDDILKLLNEPNTEEQSKWIEVSHSSNLRTSHNYILKNVAELRRAFY
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	31.7	Very low	27.5	Very low	216 Å²	216	138.5 Å²	138.5	100%	1.064	69%	0.689	S	S	*	*				0	120.7	0	-77.4	164	168.7	0	0	108.3
2	T	25.8	Very low	27.6	Very low	100 Å²	100	137.3 Å²	137.3	61%	0.613	70%	0.695	S	S	*	*			cis	170.8	172.7	-20.1	19.7	0	0	0	0	105.3
3	E	30.7	Very low	27.7	Very low	125 Å²	125	132.8 Å²	132.8	58%	0.584	67%	0.674	S	S	*	*			cis	-111.2	160.8	-17.1	-88.5	77	-149.8	0	0	105.6	I5	E3-I5 HydrophobicContact CG-CD1 4.32Å
4	Q	26.3	Very low	27.6	Very low	196 Å²	196	132.2 Å²	132.2	92%	0.916	66%	0.664	S	S	*	*			cis	56.3	56	9.8	-136.5	-174.5	23.7	0	0	117.4
5	I	27.6	Very low	27.9	Very low	148 Å²	148	133.4 Å²	133.4	76%	0.759	67%	0.666	S	S	*	*			trans	-150.3	142.2	146.2	-98.5	140.9	0	0	0	107.4	E3	E3-I5 HydrophobicContact CG-CD1 4.32Å
6	P	27.3	Very low	27.9	Very low	90 Å²	90	139.5 Å²	139.5	58%	0.584	68%	0.679	S	S	*	*			trans	-110	155.1	-155.7	37.2	-28.2	0	0	0	115	Q8	P6-Q8 VanDerWaalsContact C-N 3.27Å; P6-Q8 HydrophobicContact CG-CB 4.27Å; P6-Q8 PolarHBondContact O-N 3.5Å
7	F	25	Very low	28.4	Very low	217 Å²	217	141.3 Å²	141.3	95%	0.952	69%	0.69	S	S	*	*			trans	-69.8	86.1	158.5	-130.3	-78.9	0	0	0	108.8	R9	F7-R9 PolarHBondContact O-N 3.45Å
8	Q	27	Very low	28.5	Very low	145 Å²	145	138.9 Å²	138.9	68%	0.678	69%	0.691	S	S	*	*			trans	-78.2	92	-165.9	-160.8	171.1	4.1	0	0	112.3	P6 T10	P6-Q8 VanDerWaalsContact C-N 3.27Å; P6-Q8 HydrophobicContact CG-CB 4.27Å; P6-Q8 PolarHBondContact O-N 3.5Å; Q8-T10 HydrophobicContact CG-CG2 4.49Å; Q8-T10 PolarHBondContact O-N 2.84Å
9	R	28	Very low	29.2	Very low	155 Å²	155	140.2 Å²	140.2	59%	0.585	69%	0.686	S	S	*	*			trans	-60.6	91.4	164.3	-85.1	-176.7	169.7	155.7	-16	110.9	F7 D246	F7-R9 PolarHBondContact O-N 3.45Å; R9-D246 IonicContact CZ-OD2 3.78Å; R9-D246 VanDerWaalsContact CZ-OD2 3.24Å; R9-D246 IonicContact NE-OD2 3.5Å; R9-D246 VanDerWaalsContact NH1-CG 3.33Å; R9-D246 IonicContact NH1-OD2 3.73Å; R9-D246 PolarHBondContact NH1-OD2 2.59Å; R9-D246 IonicContact NH2-OD2 2.7Å
10	T	27	Very low	29.2	Very low	81 Å²	81	139.4 Å²	139.4	50%	0.497	69%	0.69	S	S	.	*			trans	-145.8	87	165.7	44.2	0	0	0	0	113.4	Q8	Q8-T10 HydrophobicContact CG-CG2 4.49Å; Q8-T10 PolarHBondContact O-N 2.84Å
11	S	26.4	Very low	29.5	Very low	50 Å²	50	136.4 Å²	136.4	35%	0.35	70%	0.695	S	S	.	*				60.6	131.1	124	64.7	0	0	0	0	124.2	G33 S34	S11-G33 VanDerWaalsContact CB-CA 3.5Å; S11-G33 WeakPolarHBondContact CB-O 3.48Å; S11-S34 VanDerWaalsContact CB-CB 3.49Å; S11-S34 WeakPolarHBondContact OG-CA 3.36Å; S11-S34 WeakPolarHBondContact OG-CB 3.2Å
12	T	28.5	Very low	29.6	Very low	124 Å²	124	130.3 Å²	130.3	76%	0.761	67%	0.674	S	S	*	*			trans	-146.6	95.7	150	49.4	0	0	0	0	111.1	K14 T32	T12-K14 PolarHBondContact O-N 3.15Å; T12-T32 CarbonylContact C-O 3.55Å; T12-T32 PolarHBondContact N-O 3.2Å; T12-T32 WeakPolarHBondContact O-CB 3.24Å; T12-T32 PolarHBondContact O-OG1 3.14Å
13	L	28.2	Very low	30	Very low	79 Å²	79	131.3 Å²	131.3	41%	0.414	68%	0.679	S	S	.	*			trans	-68.5	118.3	-169.9	-127.8	156.8	0	0	0	112.8	H15 I31 T32 G33	L13-H15 HydrophobicContact CD2-CB 3.79Å; L13-H15 PolarHBondContact O-N 3Å; L13-I31 HydrophobicContact CD2-CD1 3.8Å; L13-T32 WeakPolarHBondContact CA-O 3.27Å; L13-T32 PolarHBondContact N-O 2.89Å; L13-G33 VanDerWaalsContact CG-CA 3.43Å
14	K	26.9	Very low	30.2	Very low	125 Å²	125	127.1 Å²	127.1	54%	0.543	67%	0.67	S	S	.	*			trans	-63.8	84.7	151.1	-82.6	175.2	173.2	179.7	0	108.6	T12 N29 N30 I31 T32	T12-K14 PolarHBondContact O-N 3.15Å; K14-N29 PolarHBondContact NZ-O 3.3Å; K14-N30 WeakPolarHBondContact CD-O 3.44Å; K14-N30 PolarHBondContact NZ-O 3.06Å; K14-I31 WeakPolarHBondContact O-CD1 3.48Å; K14-T32 PolarHBondContact N-OG1 3.21Å
15	H	31.8	Very low	30.8	Very low	150 Å²	150	125.8 Å²	125.8	69%	0.694	66%	0.664	S	S	*	*			trans	-121.7	145.9	162.7	-134.6	-89.2	0	0	0	110.8	L13	L13-H15 HydrophobicContact CD2-CB 3.79Å; L13-H15 PolarHBondContact O-N 3Å
16	R	27.9	Very low	31.2	Very low	231 Å²	231	124.6 Å²	124.6	87%	0.872	66%	0.659	S	S	*	*			trans	-92.3	121.7	-166.8	-159.3	-177.3	-159.2	172.8	6.5	110.5
17	I	37.5	Very low	31.7	Very low	170 Å²	170	127.6 Å²	127.6	87%	0.872	67%	0.67	S	S	*	*			trans	-114.6	145.8	152.7	-68.1	-176.8	0	0	0	107.5
18	S	29.4	Very low	32.4	Very low	99 Å²	99	123.2 Å²	123.2	69%	0.692	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-87	154.3	-157.9	51.3	0	0	0	0	114.6	T20	S18-T20 PolarHBondContact O-N 2.77Å
19	R	42.1	Very low	33.1	Very low	162 Å²	162	121.5 Å²	121.5	61%	0.611	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-47.3	117	139.5	-102.6	179.7	170.3	144.1	-12.1	109.2	S22 V23 G24	R19-S22 PolarHBondContact NE-O 3.12Å; R19-S22 PolarHBondContact NH2-O 2.85Å; R19-V23 VanDerWaalsContact NH2-C 3.31Å; R19-V23 PolarHBondContact NH2-O 3.39Å; R19-G24 PolarHBondContact NH1-O 3.24Å; R19-G24 PolarHBondContact NH2-O 3.36Å
20	T	28	Very low	33.7	Very low	125 Å²	125	119.1 Å²	119.1	77%	0.767	65%	0.651	S	S	*	*	P	Polyproline II helix		-59.1	158.5	124.1	50.8	0	0	0	0	108	S18 S22	S18-T20 PolarHBondContact O-N 2.77Å; T20-S22 PolarHBondContact O-N 3.23Å
21	G	37	Very low	34.4	Very low	77 Å²	77	119.3 Å²	119.3	79%	0.794	65%	0.648	S	S	*	*	S	Bend	trans	-45.2	139.6	-179.5	0	0	0	0	0	112.9
22	S	33.1	Very low	35.1	Very low	87 Å²	87	120.2 Å²	120.2	61%	0.608	65%	0.652	S	S	*	*			cis	-142.1	126.1	42.8	-156.7	0	0	0	0	116.3	R19 T20	R19-S22 PolarHBondContact NE-O 3.12Å; R19-S22 PolarHBondContact NH2-O 2.85Å; T20-S22 PolarHBondContact O-N 3.23Å
23	V	34.1	Very low	35.8	Very low	121 Å²	121	116.5 Å²	116.5	73%	0.733	64%	0.638	S	S	*	*			trans	58.8	119.7	134.6	179.7	0	0	0	0	121.6	R19	R19-V23 VanDerWaalsContact NH2-C 3.31Å; R19-V23 PolarHBondContact NH2-O 3.39Å
24	G	35.7	Very low	36	Very low	38 Å²	38	116.3 Å²	116.3	39%	0.392	64%	0.643	S	S	.	*			trans	77.4	149.1	155.8	0	0	0	0	0	118.3	R19	R19-G24 PolarHBondContact NH1-O 3.24Å; R19-G24 PolarHBondContact NH2-O 3.36Å
25	Q	37.8	Very low	36.1	Very low	167 Å²	167	116.8 Å²	116.8	78%	0.78	65%	0.65	S	S	*	*			cis	-158.8	144.6	-27.8	-132.6	176.5	-86	0	0	110.7
26	D	37	Very low	36	Very low	124 Å²	124	117.5 Å²	117.5	66%	0.663	66%	0.659	S	S	*	*			trans	65.9	128.6	161.4	-48	-38.3	0	0	0	120.8
27	N	38.3	Very low	36	Very low	153 Å²	153	114.2 Å²	114.2	82%	0.818	66%	0.657	S	S	*	*			trans	80.8	155.8	-176	-76.8	-72.3	0	0	0	118.5
28	N	39.7	Very low	35.4	Very low	125 Å²	125	111 Å²	111	67%	0.668	65%	0.65	S	S	*	*			cis	-153.7	-153	-25.5	-153.7	-73.4	0	0	0	110.7
29	N	40.5	Very low	35.3	Very low	108 Å²	108	112.2 Å²	112.2	58%	0.578	66%	0.658	S	S	*	*			trans	-121.5	154.3	-151.3	-71.3	-19.7	0	0	0	120.3	K14	K14-N29 PolarHBondContact NZ-O 3.3Å
30	N	41	Very low	34.5	Very low	105 Å²	105	107.8 Å²	107.8	56%	0.561	66%	0.663	S	S	*	*			trans	41.6	158	139.1	-59.8	-2.7	0	0	0	124.7	K14	K14-N30 WeakPolarHBondContact CD-O 3.44Å; K14-N30 PolarHBondContact NZ-O 3.06Å
31	I	41.3	Very low	34.4	Very low	85 Å²	85	109.3 Å²	109.3	44%	0.436	67%	0.665	S	S	.	*			cis	-165	128	-22.6	-98.9	-75.1	0	0	0	107.5	L13 K14	L13-I31 HydrophobicContact CD2-CD1 3.8Å; K14-I31 WeakPolarHBondContact O-CD1 3.48Å
32	T	42	Very low	33.9	Very low	69 Å²	69	112.7 Å²	112.7	42%	0.423	67%	0.665	S	S	.	*			trans	-163.4	50.7	-156.7	51.4	0	0	0	0	121.4	T12 L13 K14	T12-T32 CarbonylContact C-O 3.55Å; T12-T32 PolarHBondContact N-O 3.2Å; T12-T32 WeakPolarHBondContact O-CB 3.24Å; T12-T32 PolarHBondContact O-OG1 3.14Å; L13-T32 WeakPolarHBondContact CA-O 3.27Å; L13-T32 PolarHBondContact N-O 2.89Å; K14-T32 PolarHBondContact N-OG1 3.21Å
33	G	43.1	Very low	33.7	Very low	46 Å²	46	115.1 Å²	115.1	47%	0.474	68%	0.676	S	S	.	*			trans	-158.5	-145.6	-163.1	0	0	0	0	0	126.5	S11 L13	S11-G33 VanDerWaalsContact CB-CA 3.5Å; S11-G33 WeakPolarHBondContact CB-O 3.48Å; L13-G33 VanDerWaalsContact CG-CA 3.43Å
34	S	32.7	Very low	33.4	Very low	75 Å²	75	112.5 Å²	112.5	52%	0.524	67%	0.674	S	S	.	*				-107.6	147.6	-129.5	57.1	0	0	0	0	120	S11	S11-S34 VanDerWaalsContact CB-CB 3.49Å; S11-S34 WeakPolarHBondContact OG-CA 3.36Å; S11-S34 WeakPolarHBondContact OG-CB 3.2Å
35	I	28.7	Very low	33.3	Very low	135 Å²	135	118.6 Å²	118.6	69%	0.692	70%	0.696	S	S	*	*			trans	-120.4	133.9	168.3	-68	175.7	0	0	0	110.4	I37	I35-I37 HydrophobicContact CG2-CG1 4.1Å
36	N	28	Very low	32.9	Very low	165 Å²	165	118.4 Å²	118.4	88%	0.882	70%	0.695	S	S	*	*			trans	-96.8	137.2	162.5	-79.9	-52	0	0	0	109.4
37	I	28.2	Very low	32.5	Very low	163 Å²	163	120.2 Å²	120.2	84%	0.836	70%	0.699	S	S	*	*			trans	-124.1	136.1	159.1	-66.8	-178.7	0	0	0	108.4	I35	I35-I37 HydrophobicContact CG2-CG1 4.1Å
38	S	26.3	Very low	32.1	Very low	101 Å²	101	120.7 Å²	120.7	71%	0.706	70%	0.697	S	S	*	*			trans	-122.3	162	-178.9	58.9	0	0	0	0	111.3
39	S	25.6	Very low	31.8	Very low	125 Å²	125	118.9 Å²	118.9	87%	0.874	69%	0.694	S	S	*	*			trans	70.7	167.5	169.4	83.5	0	0	0	0	117.8
40	G	26.7	Very low	31.8	Very low	69 Å²	69	117.7 Å²	117.7	71%	0.711	69%	0.694	S	S	*	*			trans	125.5	33.4	139.4	0	0	0	0	0	119.7	N42	G40-N42 PolarHBondContact O-N 3.22Å
41	I	25.7	Very low	31.9	Very low	157 Å²	157	120.7 Å²	120.7	81%	0.805	71%	0.708	S	S	*	*			trans	-19.2	114.8	159	-57.5	159.1	0	0	0	113.9
42	N	27.3	Very low	31.6	Very low	149 Å²	149	124.9 Å²	124.9	80%	0.797	72%	0.719	S	S	*	*				-175.3	152.9	123.1	-102.2	-54.2	0	0	0	115.6	G40	G40-N42 PolarHBondContact O-N 3.22Å
43	T	26.9	Very low	31.5	Very low	137 Å²	137	130.4 Å²	130.4	84%	0.84	73%	0.732	S	S	*	*			trans	-83	146	175.6	51	0	0	0	0	112.9
44	G	29	Very low	31.3	Very low	67 Å²	67	133.1 Å²	133.1	69%	0.691	75%	0.749	S	S	*	*			trans	-176	123	164.3	0	0	0	0	0	116.6
45	I	33.8	Very low	31.8	Very low	165 Å²	165	133.4 Å²	133.4	85%	0.846	75%	0.752	S	S	*	*			trans	48.1	96.4	139.8	-51.4	173.1	0	0	0	115.1
46	Q	28.3	Very low	32.5	Very low	164 Å²	164	130.3 Å²	130.3	77%	0.766	74%	0.739	S	S	*	*			cis	65.3	122.7	42.9	-141.5	-164.4	17.4	0	0	114.8
47	Q	29.6	Very low	33.4	Very low	162 Å²	162	125.5 Å²	125.5	76%	0.757	71%	0.712	S	S	*	*			trans	78.8	160.7	169.4	-50.8	-178.2	-8.6	0	0	119.1
48	Q	29.7	Very low	34.4	Very low	162 Å²	162	125.1 Å²	125.1	76%	0.757	71%	0.707	S	S	*	*			trans	73.1	72.1	168.5	-52	-169.6	18.9	0	0	120.3
49	S	32.7	Very low	35.9	Very low	88 Å²	88	126.1 Å²	126.1	62%	0.615	70%	0.698	S	S	*	*			trans	-135.2	-20.4	161.4	66.9	0	0	0	0	116.1	I51 R52	S49-I51 PolarHBondContact O-N 2.82Å; S49-I51 VanDerWaalsContact O-N 3.11Å; S49-R52 PolarHBondContact O-N 3.15Å
50	S	41.3	Very low	38	Very low	82 Å²	82	125 Å²	125	57%	0.573	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-18.1	-175.8	48.5	0	0	0	0	115.5
51	I	42.3	Very low	40.3	Very low	168 Å²	168	123.6 Å²	123.6	86%	0.862	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-11.8	-175.3	-63.3	174.7	0	0	0	112.6	S49	S49-I51 PolarHBondContact O-N 2.82Å; S49-I51 VanDerWaalsContact O-N 3.11Å
52	R	36.7	Very low	43	Very low	174 Å²	174	116.6 Å²	116.6	66%	0.657	62%	0.617	S	S	*	*			trans	-95.5	-2.7	-174.8	-78	-175.8	174	166.1	-1.2	116	S49 A54 S55	S49-R52 PolarHBondContact O-N 3.15Å; R52-A54 PolarHBondContact O-N 3.36Å; R52-S55 PolarHBondContact O-N 3.2Å; R52-S55 PolarHBondContact O-OG 3.24Å
53	R	38.8	Very low	45.8	Very low	184 Å²	184	112.5 Å²	112.5	69%	0.694	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-60.5	-23.7	-165.2	-66.4	-174.7	-179.1	133.2	-3.6	115.9
54	A	39	Very low	48.6	Very low	103 Å²	103	106 Å²	106	85%	0.851	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-71.8	-26.7	-178.7	0	0	0	0	0	114.5	R52	R52-A54 PolarHBondContact O-N 3.36Å
55	S	42.6	Very low	51.3	Low	82 Å²	82	107.4 Å²	107.4	57%	0.573	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-100.6	-2.3	-174.3	70.2	0	0	0	0	114.6	R52	R52-S55 PolarHBondContact O-N 3.2Å; R52-S55 PolarHBondContact O-OG 3.24Å
56	V	43	Very low	53.7	Low	70 Å²	70	99.7 Å²	99.7	42%	0.424	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-31.1	-173.7	176.5	0	0	0	0	112	Q58 K59 Y60	V56-Q58 PolarHBondContact O-N 3Å; V56-K59 WeakPolarHBondContact O-CB 3.43Å; V56-K59 PolarHBondContact O-N 2.8Å; V56-K59 VanDerWaalsContact O-N 3.16Å; V56-Y60 HydrophobicContact CG1-CE2 3.98Å; V56-Y60 WeakPolarHBondContact O-CD2 3.4Å; V56-Y60 WeakPolarHBondContact O-CE2 3.44Å
57	M	48.6	Very low	55.8	Low	64 Å²	64	94.3 Å²	94.3	32%	0.315	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-69.1	-13.2	-178.4	-74	-135.6	71.8	0	0	115.3	K59 I86 I90	M57-K59 PolarHBondContact O-N 3.23Å; M57-I86 HydrophobicContact CE-CG2 3.45Å; M57-I86 VanDerWaalsContact CE-CG2 3.45Å; M57-I86 HydrophobicContact SD-CG2 3.78Å; M57-I90 HydrophobicContact CE-CD1 4.17Å; M57-I90 HydrophobicContact CE-CG1 4.25Å
58	Q	49.2	Very low	57.5	Low	154 Å²	154	90.4 Å²	90.4	72%	0.72	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-70.4	-12.2	171.6	-91.7	178.9	-74.1	0	0	113.4	V56 Y60	V56-Q58 PolarHBondContact O-N 3Å; Q58-Y60 PolarHBondContact O-N 3Å
59	K	58.1	Low	59.1	Low	122 Å²	122	85.6 Å²	85.6	53%	0.53	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-93.1	14.7	-172.6	-143.1	-163.7	179.4	-146	0	114.9	V56 M57	V56-K59 WeakPolarHBondContact O-CB 3.43Å; V56-K59 PolarHBondContact O-N 2.8Å; V56-K59 VanDerWaalsContact O-N 3.16Å; M57-K59 PolarHBondContact O-N 3.23Å
60	Y	67.8	Low	60.6	Low	102 Å²	102	89.4 Å²	89.4	40%	0.4	48%	0.477	S	S	.	.	S	Bend	trans	-143.2	17.8	-164.8	-64.8	-79.6	0	0	0	113.8	V56 Q58 C76 K77	V56-Y60 HydrophobicContact CG1-CE2 3.98Å; V56-Y60 WeakPolarHBondContact O-CD2 3.4Å; V56-Y60 WeakPolarHBondContact O-CE2 3.44Å; Q58-Y60 PolarHBondContact O-N 3Å; Y60-C76 VanDerWaalsContact O-CA 3.25Å; Y60-C76 WeakPolarHBondContact O-CA 3.26Å; Y60-C76 WeakPolarHBondContact O-CB 3.19Å; Y60-K77 WeakPolarHBondContact CD1-O 3.43Å; Y60-K77 PolarHBondContact O-N 2.93Å
61	M	76.7	Confident	61.9	Low	39 Å²	39	88.4 Å²	88.4	19%	0.192	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	147.7	-177.9	-69.4	-178.7	162.2	0	0	111	C76 I90 K94	M61-C76 HydrophobicContact CG-CB 4.18Å; M61-I90 HydrophobicContact CE-CB 4.02Å; M61-I90 HydrophobicContact CE-CD1 3.99Å; M61-I90 HydrophobicContact CE-CG1 3.54Å; M61-I90 HydrophobicContact CE-CG2 3.58Å; M61-K94 HydrophobicContact CE-CB 3.96Å; M61-K94 HydrophobicContact CE-CG 3.99Å; M61-K94 HydrophobicContact SD-CB 4.21Å; M61-K94 HydrophobicContact SD-CD 4.25Å; M61-K94 HydrophobicContact SD-CG 4.08Å
62	G	81.7	Confident	63.7	Low	10 Å²	10	85 Å²	85	10%	0.103	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	-178.2	169.1	0	0	0	0	0	111.3	F75	G62-F75 VanDerWaalsContact CA-CE1 3.45Å; G62-F75 PolarHBondContact N-O 3.39Å; G62-F75 VanDerWaalsContact N-O 3.15Å; G62-F75 WeakPolarHBondContact O-CD1 3.19Å; G62-F75 PolarHBondContact O-N 3.47Å
63	E	85.9	Confident	66.1	Low	64 Å²	64	76.8 Å²	76.8	30%	0.299	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.4	172.4	-52.4	-165.8	140.4	0	0	109.5	A73 R74 G188 T189 A190	E63-A73 CarbonylContact C-O 3.59Å; E63-A73 WeakPolarHBondContact CA-O 3.27Å; E63-R74 HydrophobicContact CG-CG 4.17Å; E63-R74 IonicContact OE1-CZ 2.67Å; E63-R74 VanDerWaalsContact OE1-CZ 3.26Å; E63-R74 IonicContact OE1-NE 2.98Å; E63-R74 PolarHBondContact OE1-NE 2.57Å; E63-R74 IonicContact OE1-NH2 3.61Å; E63-R74 PolarHBondContact OE1-NH2 3.44Å; E63-G188 PolarHBondContact N-O 2.83Å; E63-T189 CarbonylContact O-C 3.33Å; E63-T189 WeakPolarHBondContact O-CA 3.47Å; E63-A190 PolarHBondContact O-N 3.37Å
64	I	86.7	Confident	68.4	Low	1 Å²	1	72.7 Å²	72.7	1%	0.005	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	130.4	178.1	-49.6	-178.4	0	0	0	107.6	F66 T72 A73 F75 L181 Y192 L230 F237	I64-F66 HydrophobicContact CB-CE2 4.38Å; I64-F66 HydrophobicContact CG2-CD2 4.24Å; I64-F66 HydrophobicContact CG2-CE1 4.35Å; I64-F66 HydrophobicContact CG2-CE2 3.99Å; I64-F66 HydrophobicContact CG2-CZ 4.05Å; I64-T72 CarbonylContact O-C 3.59Å; I64-T72 VanDerWaalsContact O-CA 3.24Å; I64-T72 WeakPolarHBondContact O-CA 3.41Å; I64-A73 PolarHBondContact N-O 3.47Å; I64-A73 PolarHBondContact O-N 3.41Å; I64-F75 HydrophobicContact CD1-CB 4.08Å; I64-F75 HydrophobicContact CD1-CD1 4.03Å; I64-F75 HydrophobicContact CD1-CG 4.17Å; I64-F75 HydrophobicContact CG1-CB 4.31Å; I64-F75 HydrophobicContact CG1-CD1 3.46Å; I64-F75 VanDerWaalsContact CG1-CD1 3.46Å; I64-F75 HydrophobicContact CG1-CE1 3.99Å; I64-F75 HydrophobicContact CG1-CG 4.11Å; I64-L181 HydrophobicContact CD1-CD2 3.74Å; I64-L181 HydrophobicContact CG1-CD2 3.95Å; I64-Y192 HydrophobicContact CG2-CG 4.26Å; I64-L230 HydrophobicContact CD1-CD1 3.99Å; I64-F237 HydrophobicContact CD1-CD2 4.04Å; I64-F237 HydrophobicContact CD1-CE2 4.41Å
65	E	85.7	Confident	70.9	Confident	95 Å²	95	67.8 Å²	67.8	44%	0.444	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	118.5	169.1	-176.5	171.1	-159.8	0	0	107.8	T72 A190 V191 Y192	E65-T72 HydrophobicContact CB-CG2 4.33Å; E65-T72 HydrophobicContact CG-CG2 4.49Å; E65-A190 PolarHBondContact N-O 2.96Å; E65-V191 WeakPolarHBondContact O-CA 3.49Å; E65-Y192 PolarHBondContact O-N 2.84Å
66	F	83.9	Confident	73.1	Confident	3 Å²	3	63.9 Å²	63.9	1%	0.013	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	127	-177.4	-73.4	-85.5	0	0	0	111	I64 G68 L69 A73 Y192 L230 P232 F237	I64-F66 HydrophobicContact CB-CE2 4.38Å; I64-F66 HydrophobicContact CG2-CD2 4.24Å; I64-F66 HydrophobicContact CG2-CE1 4.35Å; I64-F66 HydrophobicContact CG2-CE2 3.99Å; I64-F66 HydrophobicContact CG2-CZ 4.05Å; F66-G68 PolarHBondContact O-N 2.8Å; F66-L69 HydrophobicContact CB-CB 4.42Å; F66-L69 CarbonylContact O-C 3.51Å; F66-L69 PolarHBondContact O-N 3.47Å; F66-L69 VanDerWaalsContact O-N 3.15Å; F66-A73 HydrophobicContact CE2-CB 3.89Å; F66-Y192 WeakPolarHBondContact CA-O 3.35Å; F66-Y192 AromaticContact CD1-CD1 3.84Å; F66-Y192 HydrophobicContact CD1-CD1 3.84Å; F66-Y192 AromaticContact CE1-CD1 3.53Å; F66-Y192 HydrophobicContact CE1-CD1 3.53Å; F66-Y192 HydrophobicContact CE1-CE1 4.06Å; F66-Y192 HydrophobicContact CE1-CG 4.48Å; F66-L230 HydrophobicContact CE1-CB 4.29Å; F66-L230 HydrophobicContact CZ-CB 4.31Å; F66-P232 HydrophobicContact CB-CB 3.96Å; F66-P232 HydrophobicContact CD1-CB 3.6Å; F66-P232 HydrophobicContact CD2-CB 4.01Å; F66-P232 HydrophobicContact CE1-CB 4.01Å; F66-P232 HydrophobicContact CE2-CB 4.4Å; F66-P232 HydrophobicContact CG-CB 3.59Å; F66-P232 HydrophobicContact CZ-CB 4.4Å; F66-F237 HydrophobicContact CE2-CE2 4.06Å; F66-F237 AromaticContact CZ-CE2 3.86Å; F66-F237 HydrophobicContact CZ-CE2 3.86Å; F66-F237 HydrophobicContact CZ-CZ 4.01Å
67	T	71.7	Confident	75.2	Confident	51 Å²	51	61.4 Å²	61.4	31%	0.313	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	130.1	179.2	54.5	0	0	0	0	111	L69 V191 Y192 Q193	T67-L69 VanDerWaalsContact C-N 3.32Å; T67-L69 PolarHBondContact O-N 3.11Å; T67-V191 HydrophobicContact CG2-CG1 3.49Å; T67-V191 VanDerWaalsContact CG2-CG1 3.49Å; T67-Y192 PolarHBondContact N-O 2.88Å; T67-Q193 HydrophobicContact CG2-CB 4.44Å; T67-Q193 VanDerWaalsContact OG1-CA 3.31Å; T67-Q193 WeakPolarHBondContact OG1-CA 3.49Å; T67-Q193 WeakPolarHBondContact OG1-CB 3.36Å; T67-Q193 WeakPolarHBondContact OG1-CG 3.2Å
68	G	65	Low	76.9	Confident	80 Å²	80	58.8 Å²	58.8	83%	0.825	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.3	-10.4	-178.4	0	0	0	0	0	115.2	F66	F66-G68 PolarHBondContact O-N 2.8Å
69	L	63.9	Low	78.4	Confident	61 Å²	61	54.9 Å²	54.9	32%	0.319	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	115.5	178	-72.7	165.9	0	0	0	110	F66 T67 Q71 P232	F66-L69 HydrophobicContact CB-CB 4.42Å; F66-L69 CarbonylContact O-C 3.51Å; F66-L69 PolarHBondContact O-N 3.47Å; F66-L69 VanDerWaalsContact O-N 3.15Å; T67-L69 VanDerWaalsContact C-N 3.32Å; T67-L69 PolarHBondContact O-N 3.11Å; L69-Q71 PolarHBondContact O-N 3.17Å; L69-P232 HydrophobicContact CD1-CB 3.6Å; L69-P232 HydrophobicContact CD1-CG 3.64Å
70	N	63.2	Low	79.2	Confident	168 Å²	168	50.1 Å²	50.1	90%	0.898	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	40.6	-180	-65.1	1.5	0	0	0	113.3
71	Q	70	Confident	79.5	Confident	62 Å²	62	53.3 Å²	53.3	29%	0.29	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	123.9	179.6	-59.3	-168.6	9.5	0	0	109	L69	L69-Q71 PolarHBondContact O-N 3.17Å
72	T	80.4	Confident	79.5	Confident	95 Å²	95	52.4 Å²	52.4	58%	0.583	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.7	130.9	174.2	52.4	0	0	0	0	111	I64 E65	I64-T72 CarbonylContact O-C 3.59Å; I64-T72 VanDerWaalsContact O-CA 3.24Å; I64-T72 WeakPolarHBondContact O-CA 3.41Å; E65-T72 HydrophobicContact CB-CG2 4.33Å; E65-T72 HydrophobicContact CG-CG2 4.49Å
73	A	86.1	Confident	79.4	Confident	2 Å²	2	55.1 Å²	55.1	2%	0.017	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	147	177.4	0	0	0	0	0	110.8	E63 I64 F66 H234 N235 F237	E63-A73 CarbonylContact C-O 3.59Å; E63-A73 WeakPolarHBondContact CA-O 3.27Å; I64-A73 PolarHBondContact N-O 3.47Å; I64-A73 PolarHBondContact O-N 3.41Å; F66-A73 HydrophobicContact CE2-CB 3.89Å; A73-H234 VanDerWaalsContact CB-O 3.29Å; A73-H234 WeakPolarHBondContact CB-O 3.39Å; A73-N235 WeakPolarHBondContact CA-O 3.36Å; A73-F237 HydrophobicContact CB-CD2 3.92Å; A73-F237 HydrophobicContact CB-CE2 3.69Å
74	R	88.4	Confident	79.1	Confident	98 Å²	98	54.3 Å²	54.3	37%	0.37	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	128.7	179.8	-75.2	-179.1	162.5	143.8	12.7	111.3	E63 W95 N235 F236 F237	E63-R74 HydrophobicContact CG-CG 4.17Å; E63-R74 IonicContact OE1-CZ 2.67Å; E63-R74 VanDerWaalsContact OE1-CZ 3.26Å; E63-R74 IonicContact OE1-NE 2.98Å; E63-R74 PolarHBondContact OE1-NE 2.57Å; E63-R74 IonicContact OE1-NH2 3.61Å; E63-R74 PolarHBondContact OE1-NH2 3.44Å; R74-W95 HydrophobicContact CB-CZ2 4.42Å; R74-N235 PolarHBondContact N-O 2.84Å; R74-F236 HydrophobicContact CB-CD1 3.83Å; R74-F236 HydrophobicContact CB-CE1 4.08Å; R74-F236 CarbonylContact O-C 3.47Å; R74-F236 WeakPolarHBondContact O-CA 3.39Å; R74-F237 PolarHBondContact O-N 2.85Å
75	F	90.1	Very high	78.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	151.7	178.6	81.8	-79.1	0	0	0	113.4	G62 I64 L181 A184 L185 F237 L239	G62-F75 VanDerWaalsContact CA-CE1 3.45Å; G62-F75 PolarHBondContact N-O 3.39Å; G62-F75 VanDerWaalsContact N-O 3.15Å; G62-F75 WeakPolarHBondContact O-CD1 3.19Å; G62-F75 PolarHBondContact O-N 3.47Å; I64-F75 HydrophobicContact CD1-CB 4.08Å; I64-F75 HydrophobicContact CD1-CD1 4.03Å; I64-F75 HydrophobicContact CD1-CG 4.17Å; I64-F75 HydrophobicContact CG1-CB 4.31Å; I64-F75 HydrophobicContact CG1-CD1 3.46Å; I64-F75 VanDerWaalsContact CG1-CD1 3.46Å; I64-F75 HydrophobicContact CG1-CE1 3.99Å; I64-F75 HydrophobicContact CG1-CG 4.11Å; F75-L181 HydrophobicContact CE2-CB 4.17Å; F75-L181 HydrophobicContact CZ-CB 4.27Å; F75-L181 WeakPolarHBondContact CZ-O 3.08Å; F75-A184 HydrophobicContact CE1-CB 4.13Å; F75-A184 HydrophobicContact CZ-CB 4.02Å; F75-L185 HydrophobicContact CD2-CD2 4.49Å; F75-L185 HydrophobicContact CE2-CD2 3.63Å; F75-L185 HydrophobicContact CE2-CG 3.95Å; F75-L185 HydrophobicContact CZ-CD2 3.96Å; F75-L185 HydrophobicContact CZ-CG 4.15Å; F75-F237 WeakPolarHBondContact CA-O 3.27Å; F75-F237 HydrophobicContact CB-CB 3.81Å; F75-L239 HydrophobicContact CD2-CD1 3.96Å
76	C	88.3	Confident	78.4	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.007	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.3	166.6	63.4	0	0	0	0	111.3	Y60 M61 L78 W95 F237 L239	Y60-C76 VanDerWaalsContact O-CA 3.25Å; Y60-C76 WeakPolarHBondContact O-CA 3.26Å; Y60-C76 WeakPolarHBondContact O-CB 3.19Å; M61-C76 HydrophobicContact CG-CB 4.18Å; C76-L78 HydrophobicContact CB-CD2 4.49Å; C76-W95 HydrophobicContact CB-CZ2 4.17Å; C76-F237 PolarHBondContact N-O 3.08Å; C76-L239 PolarHBondContact O-N 3.18Å
77	K	87.2	Confident	78.3	Confident	18 Å²	18	55.7 Å²	55.7	8%	0.078	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	115.7	177.3	-174.1	173.3	179.4	176.7	0	109.3	Y60 W172 E182 L185 L239 D241	Y60-K77 WeakPolarHBondContact CD1-O 3.43Å; Y60-K77 PolarHBondContact O-N 2.93Å; K77-W172 HydrophobicContact CD-CD2 3.86Å; K77-W172 HydrophobicContact CD-CE3 3.68Å; K77-W172 HydrophobicContact CD-CH2 4.08Å; K77-W172 HydrophobicContact CD-CZ2 4.23Å; K77-W172 HydrophobicContact CD-CZ3 3.8Å; K77-W172 HydrophobicContact CG-CD2 4.43Å; K77-W172 HydrophobicContact CG-CE3 4.01Å; K77-W172 HydrophobicContact CG-CZ3 4.35Å; K77-W172 VanDerWaalsContact NZ-CE2 3.25Å; K77-E182 IonicContact NZ-OE1 3.31Å; K77-L185 HydrophobicContact CB-CD1 4.08Å; K77-L185 HydrophobicContact CB-CD2 4.47Å; K77-L185 HydrophobicContact CD-CD1 3.77Å; K77-L239 WeakPolarHBondContact CA-O 3.2Å; K77-D241 WeakPolarHBondContact CE-OD2 3.3Å; K77-D241 HydrophobicContact CG-CB 4.34Å; K77-D241 IonicContact NZ-OD2 3.74Å; K77-D241 PolarHBondContact NZ-OD2 2.66Å
78	L	84.8	Confident	78.7	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.047	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.1	-173.4	-57.4	-175.4	0	0	0	111.4	C76 L87 I90 V238 L239 V240 D241 L255	C76-L78 HydrophobicContact CB-CD2 4.49Å; L78-L87 HydrophobicContact CD1-CD2 3.4Å; L78-I90 HydrophobicContact CD2-CD1 3.84Å; L78-V238 HydrophobicContact CD1-CG1 3.76Å; L78-V238 HydrophobicContact CG-CG1 4.41Å; L78-L239 PolarHBondContact N-O 3.17Å; L78-V240 CarbonylContact O-C 3.02Å; L78-V240 WeakPolarHBondContact O-CA 3.5Å; L78-D241 PolarHBondContact O-N 3.37Å; L78-L255 HydrophobicContact CB-CD1 4.41Å
79	N	80.2	Confident	79.5	Confident	72 Å²	72	56.5 Å²	56.5	39%	0.385	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	147.1	169.5	-178.6	-79.5	0	0	0	110.5	E81 T82 D241	N79-E81 PolarHBondContact O-N 3.05Å; N79-E81 WeakPolarHBondContact OD1-CB 3.35Å; N79-E81 PolarHBondContact OD1-N 3.15Å; N79-T82 PolarHBondContact N-OG1 3.02Å; N79-T82 WeakPolarHBondContact O-CB 3.34Å; N79-T82 PolarHBondContact O-N 3.14Å; N79-T82 PolarHBondContact O-OG1 2.96Å; N79-D241 WeakPolarHBondContact CA-O 3.33Å; N79-D241 PolarHBondContact ND2-O 3.02Å
80	S	74.5	Confident	80.4	Confident	21 Å²	21	53.9 Å²	53.9	15%	0.147	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-36.9	176.9	178	0	0	0	0	113.4	T82 D242 R258	S80-T82 PolarHBondContact O-N 3.11Å; S80-T82 VanDerWaalsContact O-N 3.12Å; S80-D242 WeakPolarHBondContact CB-OD1 3.38Å; S80-R258 PolarHBondContact O-NH1 3.33Å
81	E	74.6	Confident	81.4	Confident	170 Å²	170	46 Å²	46	79%	0.794	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-0.6	176	-59.3	-166.7	160.2	0	0	114.7	N79 P83	N79-E81 PolarHBondContact O-N 3.05Å; N79-E81 WeakPolarHBondContact OD1-CB 3.35Å; N79-E81 PolarHBondContact OD1-N 3.15Å; E81-P83 WeakPolarHBondContact O-CD 3.29Å
82	T	76.9	Confident	82	Confident	20 Å²	20	49.2 Å²	49.2	12%	0.123	25%	0.252	C	S	.	.			trans	-57.9	121.7	-176.2	-61.1	0	0	0	0	111.4	N79 S80 I86 R258	N79-T82 PolarHBondContact N-OG1 3.02Å; N79-T82 WeakPolarHBondContact O-CB 3.34Å; N79-T82 PolarHBondContact O-N 3.14Å; N79-T82 PolarHBondContact O-OG1 2.96Å; S80-T82 PolarHBondContact O-N 3.11Å; S80-T82 VanDerWaalsContact O-N 3.12Å; T82-I86 HydrophobicContact CG2-CB 4.02Å; T82-I86 HydrophobicContact CG2-CD1 4.41Å; T82-I86 HydrophobicContact CG2-CG2 3.99Å; T82-R258 PolarHBondContact O-NH2 3.44Å
83	P	80.2	Confident	81.9	Confident	67 Å²	67	53.3 Å²	53.3	44%	0.435	26%	0.257	S	S	.	.			trans	-73.4	142.2	-175.4	27.7	-35.6	0	0	0	113.2	E81 S85 I86	E81-P83 WeakPolarHBondContact O-CD 3.29Å; P83-S85 PolarHBondContact O-N 2.95Å; P83-I86 HydrophobicContact CG-CD1 3.9Å; P83-I86 HydrophobicContact CG-CG1 4.2Å; P83-I86 WeakPolarHBondContact O-CB 3.48Å; P83-I86 PolarHBondContact O-N 3.45Å
84	D	80.3	Confident	81.5	Confident	47 Å²	47	59.2 Å²	59.2	25%	0.251	28%	0.282	S	S	.	.	H	α-helix	trans	-54.9	-23.4	-172.5	-49.4	2.9	0	0	0	115.1	I86 L87 R88 R258	D84-I86 VanDerWaalsContact C-N 3.27Å; D84-I86 PolarHBondContact O-N 3.36Å; D84-L87 PolarHBondContact O-N 2.98Å; D84-R88 VanDerWaalsContact CB-NH2 3.33Å; D84-R88 PolarHBondContact O-N 2.89Å; D84-R258 IonicContact OD1-CZ 3.89Å; D84-R258 IonicContact OD1-NE 3.43Å; D84-R258 IonicContact OD1-NH2 2.66Å; D84-R258 PolarHBondContact OD1-NH2 2.98Å
85	S	76.8	Confident	81.2	Confident	73 Å²	73	55.5 Å²	55.5	51%	0.51	27%	0.268	S	S	.	.	H	α-helix	trans	-63.2	-33.4	173.5	53.9	0	0	0	0	112.7	P83 D89	P83-S85 PolarHBondContact O-N 2.95Å; S85-D89 PolarHBondContact O-N 2.04Å
86	I	80.4	Confident	80.7	Confident	50 Å²	50	58.4 Å²	58.4	26%	0.256	30%	0.298	S	S	.	.	H	α-helix	trans	-72.9	-44.7	178	-66.3	-179.6	0	0	0	109.8	M57 T82 P83 D84 R88 D89 I90	M57-I86 HydrophobicContact CE-CG2 3.45Å; M57-I86 VanDerWaalsContact CE-CG2 3.45Å; M57-I86 HydrophobicContact SD-CG2 3.78Å; T82-I86 HydrophobicContact CG2-CB 4.02Å; T82-I86 HydrophobicContact CG2-CD1 4.41Å; T82-I86 HydrophobicContact CG2-CG2 3.99Å; P83-I86 HydrophobicContact CG-CD1 3.9Å; P83-I86 HydrophobicContact CG-CG1 4.2Å; P83-I86 WeakPolarHBondContact O-CB 3.48Å; P83-I86 PolarHBondContact O-N 3.45Å; D84-I86 VanDerWaalsContact C-N 3.27Å; D84-I86 PolarHBondContact O-N 3.36Å; I86-R88 VanDerWaalsContact C-N 3.33Å; I86-R88 PolarHBondContact O-N 3.33Å; I86-D89 PolarHBondContact O-N 3.35Å; I86-I90 HydrophobicContact CG2-CD1 4.08Å; I86-I90 HydrophobicContact CG2-CG1 4.37Å; I86-I90 WeakPolarHBondContact O-CG1 3.25Å; I86-I90 PolarHBondContact O-N 3.38Å
87	L	81.9	Confident	80.5	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-54.4	-46.4	175.9	-72.3	172.5	0	0	0	112.1	L78 D84 D89 I90 L91 F259 C262	L78-L87 HydrophobicContact CD1-CD2 3.4Å; D84-L87 PolarHBondContact O-N 2.98Å; L87-D89 VanDerWaalsContact C-N 3.34Å; L87-D89 PolarHBondContact O-N 3.43Å; L87-I90 PolarHBondContact O-N 2.74Å; L87-L91 WeakPolarHBondContact O-CG 3.14Å; L87-L91 PolarHBondContact O-N 2.94Å; L87-L91 VanDerWaalsContact O-N 3.14Å; L87-F259 HydrophobicContact CD2-CD2 4.23Å; L87-C262 VanDerWaalsContact CB-SG 3.58Å; L87-C262 HydrophobicContact CD1-CB 4.41Å
88	R	80.5	Confident	80.1	Confident	84 Å²	84	66.9 Å²	66.9	32%	0.317	34%	0.336	S	S	.	.	H	α-helix	trans	-60.1	-40.3	174.8	-74.3	-176.2	-98.8	-91.2	-2.7	113.1	D84 I86 K92 C262	D84-R88 VanDerWaalsContact CB-NH2 3.33Å; D84-R88 PolarHBondContact O-N 2.89Å; I86-R88 VanDerWaalsContact C-N 3.33Å; I86-R88 PolarHBondContact O-N 3.33Å; R88-K92 WeakPolarHBondContact O-CB 2.96Å; R88-K92 PolarHBondContact O-N 2.85Å; R88-C262 WeakPolarHBondContact CG-SG 3.37Å
89	D	81.1	Confident	79.7	Confident	63 Å²	63	68.9 Å²	68.9	34%	0.337	35%	0.349	S	S	.	.	H	α-helix	trans	-71.5	-32.8	179.8	-85.4	-15.6	0	0	0	113	S85 I86 L87 R93	S85-D89 PolarHBondContact O-N 2.04Å; I86-D89 PolarHBondContact O-N 3.35Å; L87-D89 VanDerWaalsContact C-N 3.34Å; L87-D89 PolarHBondContact O-N 3.43Å; D89-R93 VanDerWaalsContact CG-NE 3.32Å; D89-R93 WeakPolarHBondContact O-CA 3.44Å; D89-R93 VanDerWaalsContact O-CB 3.27Å; D89-R93 WeakPolarHBondContact O-CB 3.18Å; D89-R93 PolarHBondContact O-N 2.9Å; D89-R93 IonicContact OD1-CZ 2.52Å; D89-R93 IonicContact OD1-NE 2.74Å; D89-R93 PolarHBondContact OD1-NE 3.08Å; D89-R93 IonicContact OD1-NH2 2.65Å; D89-R93 PolarHBondContact OD1-NH2 2.95Å; D89-R93 IonicContact OD2-CZ 3.91Å; D89-R93 IonicContact OD2-NE 2.59Å; D89-R93 IonicContact OD2-NH2 2.69Å; D89-R93 PolarHBondContact OD2-NH2 3.17Å
90	I	82.2	Confident	79.8	Confident	6 Å²	6	66 Å²	66	3%	0.031	33%	0.334	C	S	.	.	I	π-helix	trans	-61.2	-59.8	171.3	-65.9	175.7	0	0	0	109.8	M57 M61 L78 I86 L87 K92 K94 W95	M57-I90 HydrophobicContact CE-CD1 4.17Å; M57-I90 HydrophobicContact CE-CG1 4.25Å; M61-I90 HydrophobicContact CE-CB 4.02Å; M61-I90 HydrophobicContact CE-CD1 3.99Å; M61-I90 HydrophobicContact CE-CG1 3.54Å; M61-I90 HydrophobicContact CE-CG2 3.58Å; L78-I90 HydrophobicContact CD2-CD1 3.84Å; I86-I90 HydrophobicContact CG2-CD1 4.08Å; I86-I90 HydrophobicContact CG2-CG1 4.37Å; I86-I90 WeakPolarHBondContact O-CG1 3.25Å; I86-I90 PolarHBondContact O-N 3.38Å; L87-I90 PolarHBondContact O-N 2.74Å; I90-K92 PolarHBondContact O-N 3.39Å; I90-K94 WeakPolarHBondContact O-CA 3.29Å; I90-K94 WeakPolarHBondContact O-CB 3.37Å; I90-K94 PolarHBondContact O-N 3.1Å; I90-W95 HydrophobicContact CG2-CD2 4.11Å; I90-W95 HydrophobicContact CG2-CE3 4.41Å; I90-W95 HydrophobicContact CG2-CZ2 4.31Å; I90-W95 PolarHBondContact O-N 3.02Å
91	L	84.5	Confident	80	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.01	34%	0.343	C	S	.	.	I	π-helix	trans	-59.7	-47.6	-174.9	-64.1	169.9	0	0	0	111.7	L87 W95 G96 L97 F167 F259 I263 W266	L87-L91 WeakPolarHBondContact O-CG 3.14Å; L87-L91 PolarHBondContact O-N 2.94Å; L87-L91 VanDerWaalsContact O-N 3.14Å; L91-W95 HydrophobicContact CD2-CE3 3.74Å; L91-W95 HydrophobicContact CD2-CZ3 3.92Å; L91-G96 PolarHBondContact O-N 3.01Å; L91-L97 HydrophobicContact CD2-CD1 3.95Å; L91-L97 PolarHBondContact O-N 3.14Å; L91-F167 HydrophobicContact CD2-CE1 4.17Å; L91-F259 HydrophobicContact CD1-CE2 4.16Å; L91-F259 HydrophobicContact CD2-CE2 4.19Å; L91-F259 HydrophobicContact CD2-CZ 4.46Å; L91-I263 HydrophobicContact CD1-CD1 4.46Å; L91-I263 HydrophobicContact CD1-CG1 3.9Å; L91-W266 HydrophobicContact CB-CH2 3.67Å; L91-W266 HydrophobicContact CB-CZ3 3.54Å; L91-W266 HydrophobicContact CD1-CE3 4.34Å; L91-W266 HydrophobicContact CD1-CZ3 3.91Å; L91-W266 HydrophobicContact CG-CZ3 4.28Å
92	K	81.8	Confident	80.4	Confident	131 Å²	131	59.6 Å²	59.6	57%	0.57	31%	0.306	S	S	*	.	I	π-helix	trans	-79.9	-38.8	-173.7	-171.8	173.1	-179.2	173.8	0	114.2	R88 I90 W266	R88-K92 WeakPolarHBondContact O-CB 2.96Å; R88-K92 PolarHBondContact O-N 2.85Å; I90-K92 PolarHBondContact O-N 3.39Å; K92-W266 HydrophobicContact CB-CH2 4.42Å; K92-W266 HydrophobicContact CB-CZ2 3.88Å; K92-W266 HydrophobicContact CG-CZ2 4.19Å
93	R	78.5	Confident	81	Confident	180 Å²	180	58.7 Å²	58.7	68%	0.679	30%	0.3	S	S	*	.	I	π-helix	trans	-105.8	-26	-172.6	-46.4	-168.7	-152.5	-178.3	10.7	114.8	D89	D89-R93 VanDerWaalsContact CG-NE 3.32Å; D89-R93 WeakPolarHBondContact O-CA 3.44Å; D89-R93 VanDerWaalsContact O-CB 3.27Å; D89-R93 WeakPolarHBondContact O-CB 3.18Å; D89-R93 PolarHBondContact O-N 2.9Å; D89-R93 IonicContact OD1-CZ 2.52Å; D89-R93 IonicContact OD1-NE 2.74Å; D89-R93 PolarHBondContact OD1-NE 3.08Å; D89-R93 IonicContact OD1-NH2 2.65Å; D89-R93 PolarHBondContact OD1-NH2 2.95Å; D89-R93 IonicContact OD2-CZ 3.91Å; D89-R93 IonicContact OD2-NE 2.59Å; D89-R93 IonicContact OD2-NH2 2.69Å; D89-R93 PolarHBondContact OD2-NH2 3.17Å
94	K	77.4	Confident	81.4	Confident	127 Å²	127	55.7 Å²	55.7	55%	0.552	28%	0.28	S	S	*	.	I	π-helix	trans	-101.8	-43.7	-176.1	-73.2	-70.6	-168.2	170.6	0	112.8	M61 I90	M61-K94 HydrophobicContact CE-CB 3.96Å; M61-K94 HydrophobicContact CE-CG 3.99Å; M61-K94 HydrophobicContact SD-CB 4.21Å; M61-K94 HydrophobicContact SD-CD 4.25Å; M61-K94 HydrophobicContact SD-CG 4.08Å; I90-K94 WeakPolarHBondContact O-CA 3.29Å; I90-K94 WeakPolarHBondContact O-CB 3.37Å; I90-K94 PolarHBondContact O-N 3.1Å
95	W	83.8	Confident	81.9	Confident	20 Å²	20	53.4 Å²	53.4	8%	0.076	27%	0.268	C	S	.	.	S	Bend	trans	-90.1	-13.1	176.8	-65.4	-12.2	0	0	0	113.6	R74 C76 I90 L91 L97 F167 F236 V238	R74-W95 HydrophobicContact CB-CZ2 4.42Å; C76-W95 HydrophobicContact CB-CZ2 4.17Å; I90-W95 HydrophobicContact CG2-CD2 4.11Å; I90-W95 HydrophobicContact CG2-CE3 4.41Å; I90-W95 HydrophobicContact CG2-CZ2 4.31Å; I90-W95 PolarHBondContact O-N 3.02Å; L91-W95 HydrophobicContact CD2-CE3 3.74Å; L91-W95 HydrophobicContact CD2-CZ3 3.92Å; W95-L97 VanDerWaalsContact C-N 3.33Å; W95-L97 HydrophobicContact CB-CD1 3.77Å; W95-L97 HydrophobicContact CB-CG 3.96Å; W95-L97 HydrophobicContact CE3-CD1 3.93Å; W95-L97 PolarHBondContact O-N 3.39Å; W95-F167 HydrophobicContact CE3-CE1 4.2Å; W95-F167 HydrophobicContact CZ3-CD1 4.22Å; W95-F167 AromaticContact CZ3-CE1 3.96Å; W95-F167 HydrophobicContact CZ3-CE1 3.96Å; W95-F236 HydrophobicContact CB-CE1 4.05Å; W95-F236 AromaticContact CD2-CD1 3.64Å; W95-F236 HydrophobicContact CD2-CD1 3.64Å; W95-F236 AromaticContact CD2-CE1 3.91Å; W95-F236 HydrophobicContact CD2-CE1 3.91Å; W95-F236 HydrophobicContact CE3-CB 4.43Å; W95-F236 AromaticContact CE3-CD1 3.42Å; W95-F236 HydrophobicContact CE3-CD1 3.42Å; W95-F236 VanDerWaalsContact CE3-CD1 3.42Å; W95-F236 AromaticContact CE3-CE1 3.94Å; W95-F236 HydrophobicContact CE3-CE1 3.94Å; W95-F236 HydrophobicContact CE3-CG 4.09Å; W95-F236 HydrophobicContact CG-CD1 4.21Å; W95-F236 AromaticContact CG-CE1 3.98Å; W95-F236 HydrophobicContact CG-CE1 3.98Å; W95-F236 HydrophobicContact CH2-CB 4.2Å; W95-F236 HydrophobicContact CH2-CD1 4.21Å; W95-F236 HydrophobicContact CZ2-CD1 4.38Å; W95-F236 HydrophobicContact CZ3-CB 3.91Å; W95-F236 AromaticContact CZ3-CD1 3.74Å; W95-F236 HydrophobicContact CZ3-CD1 3.74Å; W95-F236 HydrophobicContact CZ3-CG 4.07Å; W95-V238 HydrophobicContact CH2-CG2 4.14Å
96	G	79.7	Confident	82.6	Confident	60 Å²	60	50.1 Å²	50.1	62%	0.619	25%	0.245	S	C	*	.			trans	73.9	22.3	172.3	0	0	0	0	0	114.4	L91	L91-G96 PolarHBondContact O-N 3.01Å
97	L	82.4	Confident	83	Confident	21 Å²	21	47.8 Å²	47.8	11%	0.11	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-79	140.9	-168	-70.3	165.3	0	0	0	112.9	L91 W95 W134 M165 F167 F236 W266	L91-L97 HydrophobicContact CD2-CD1 3.95Å; L91-L97 PolarHBondContact O-N 3.14Å; W95-L97 VanDerWaalsContact C-N 3.33Å; W95-L97 HydrophobicContact CB-CD1 3.77Å; W95-L97 HydrophobicContact CB-CG 3.96Å; W95-L97 HydrophobicContact CE3-CD1 3.93Å; W95-L97 PolarHBondContact O-N 3.39Å; L97-W134 HydrophobicContact CB-CH2 3.78Å; L97-W134 HydrophobicContact CB-CZ2 3.8Å; L97-W134 HydrophobicContact CD1-CH2 3.77Å; L97-W134 HydrophobicContact CD1-CZ2 4.2Å; L97-W134 HydrophobicContact CD2-CH2 4.47Å; L97-W134 HydrophobicContact CD2-CZ2 4.06Å; L97-W134 HydrophobicContact CG-CH2 4.22Å; L97-W134 HydrophobicContact CG-CZ2 4.25Å; L97-M165 HydrophobicContact CD2-CE 3.77Å; L97-M165 HydrophobicContact CD2-SD 4.12Å; L97-F167 HydrophobicContact CD1-CE1 4.03Å; L97-F167 HydrophobicContact CD1-CZ 3.86Å; L97-F236 HydrophobicContact CD1-CE1 4.4Å; L97-F236 HydrophobicContact CD1-CZ 4.28Å; L97-F236 HydrophobicContact CD2-CE2 4.01Å; L97-F236 HydrophobicContact CD2-CZ 3.79Å; L97-F236 HydrophobicContact CG-CZ 4.39Å; L97-W266 HydrophobicContact CB-CH2 4.06Å; L97-W266 WeakPolarHBondContact O-CZ2 3.34Å
98	K	79.1	Confident	83	Confident	177 Å²	177	47.7 Å²	47.7	77%	0.77	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-80.6	145.8	167	-65	177.2	-177.9	173.4	0	109.4	W134	K98-W134 WeakPolarHBondContact O-CZ2 3.48Å
99	P	77.2	Confident	82.9	Confident	51 Å²	51	44.8 Å²	44.8	33%	0.331	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-60.1	139.6	175.4	26.5	-34.6	0	0	0	111	W266	P99-W266 HydrophobicContact CB-CD2 4.26Å; P99-W266 HydrophobicContact CB-CG 4.22Å
100	P	81.6	Confident	82.5	Confident	10 Å²	10	45 Å²	45	7%	0.065	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-64.6	158.6	175	15.3	-20.1	0	0	0	112.8	L102 I103 W134 I263 V405	P100-L102 WeakPolarHBondContact CB-O 3.36Å; P100-I103 HydrophobicContact CG-CG1 3.99Å; P100-W134 HydrophobicContact CB-CB 4.11Å; P100-W134 HydrophobicContact CB-CD2 3.87Å; P100-W134 HydrophobicContact CB-CG 3.62Å; P100-W134 HydrophobicContact CG-CB 4.33Å; P100-W134 HydrophobicContact CG-CD2 3.56Å; P100-W134 HydrophobicContact CG-CE3 3.81Å; P100-W134 HydrophobicContact CG-CG 3.82Å; P100-W134 HydrophobicContact CG-CZ2 4.5Å; P100-W134 HydrophobicContact CG-CZ3 4.37Å; P100-I263 HydrophobicContact CG-CG2 3.66Å; P100-V405 HydrophobicContact CB-CG1 4.33Å; P100-V405 HydrophobicContact CG-CG1 4.14Å; P100-V405 VanDerWaalsContact O-CG1 3.3Å; P100-V405 WeakPolarHBondContact O-CG1 3.36Å
101	T	78.6	Confident	82.2	Confident	56 Å²	56	45.3 Å²	45.3	34%	0.344	23%	0.227	S	C	.	.	S	Bend	trans	-86.2	-26.9	164.5	53	0	0	0	0	112.2	S131 G132 P406	T101-S131 WeakPolarHBondContact CB-O 3.28Å; T101-S131 WeakPolarHBondContact CG2-O 3.29Å; T101-S131 VanDerWaalsContact OG1-C 3.3Å; T101-S131 PolarHBondContact OG1-O 2.75Å; T101-G132 PolarHBondContact N-O 3.32Å; T101-G132 PolarHBondContact OG1-O 3.23Å; T101-G132 VanDerWaalsContact OG1-O 3.06Å; T101-P406 WeakPolarHBondContact O-CD 3.28Å; T101-P406 VanDerWaalsContact O-CG 3.22Å; T101-P406 WeakPolarHBondContact O-CG 3.41Å
102	L	84.1	Confident	81.3	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	144.6	179.3	176.1	60	0	0	0	110.2	P100 I104 C133 W134 P406 L529 L553	P100-L102 WeakPolarHBondContact CB-O 3.36Å; L102-I104 HydrophobicContact CD2-CD1 4.14Å; L102-I104 HydrophobicContact CD2-CG1 4.16Å; L102-I104 HydrophobicContact CG-CG1 4.22Å; L102-C133 HydrophobicContact CB-CB 4.4Å; L102-C133 WeakPolarHBondContact O-CA 3.26Å; L102-C133 PolarHBondContact O-SG 3.46Å; L102-W134 PolarHBondContact O-N 3.49Å; L102-P406 HydrophobicContact CD1-CB 4.27Å; L102-P406 HydrophobicContact CD1-CG 4.27Å; L102-L529 HydrophobicContact CD1-CD1 3.48Å; L102-L529 VanDerWaalsContact CD1-CD1 3.48Å; L102-L529 HydrophobicContact CD1-CD2 4.11Å; L102-L529 HydrophobicContact CD1-CG 4.41Å; L102-L529 HydrophobicContact CD2-CD1 4.36Å; L102-L553 HydrophobicContact CD2-CD2 4.42Å
103	I	88.2	Confident	80.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	124.1	170.9	-51.5	164.1	0	0	0	108.4	P100 V136 I263 V405 P406 M407 C408	P100-I103 HydrophobicContact CG-CG1 3.99Å; I103-V136 HydrophobicContact CG2-CG2 4.12Å; I103-I263 HydrophobicContact CD1-CB 3.95Å; I103-I263 HydrophobicContact CD1-CG2 3.58Å; I103-I263 HydrophobicContact CG1-CG2 4.13Å; I103-V405 HydrophobicContact CD1-CB 4.41Å; I103-V405 HydrophobicContact CD1-CG1 4.19Å; I103-V405 HydrophobicContact CG1-CG1 4.08Å; I103-P406 PolarHBondContact N-O 3.18Å; I103-M407 HydrophobicContact CB-CB 4.22Å; I103-M407 HydrophobicContact CB-CG 4.04Å; I103-M407 HydrophobicContact CD1-CB 4.47Å; I103-M407 HydrophobicContact CD1-CE 4.05Å; I103-M407 HydrophobicContact CG2-CG 4.09Å; I103-M407 CarbonylContact O-C 3.33Å; I103-M407 VanDerWaalsContact O-CA 3.31Å; I103-M407 WeakPolarHBondContact O-CA 3.27Å; I103-C408 PolarHBondContact O-N 2.94Å
104	I	89.7	Confident	80	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	114.4	169.2	-67.3	172.7	0	0	0	108.7	L102 V106 L125 A128 W134 I135 V136 C408	L102-I104 HydrophobicContact CD2-CD1 4.14Å; L102-I104 HydrophobicContact CD2-CG1 4.16Å; L102-I104 HydrophobicContact CG-CG1 4.22Å; I104-V106 HydrophobicContact CG2-CG2 3.95Å; I104-L125 HydrophobicContact CD1-CD2 4.32Å; I104-L125 HydrophobicContact CG2-CD2 4.35Å; I104-A128 HydrophobicContact CD1-CB 3.81Å; I104-W134 PolarHBondContact N-O 3.42Å; I104-I135 CarbonylContact O-C 3.55Å; I104-I135 VanDerWaalsContact O-CA 3.29Å; I104-I135 WeakPolarHBondContact O-CA 3.21Å; I104-V136 PolarHBondContact O-N 3.39Å; I104-C408 CarbonylContact C-O 3.49Å; I104-C408 WeakPolarHBondContact CA-O 2.94Å
105	T	91.3	Very high	80	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	114.1	173.6	-69.2	0	0	0	0	109	F107 V136 E260 C408 G409 L410	T105-F107 HydrophobicContact CG2-CD1 4.18Å; T105-F107 HydrophobicContact CG2-CD2 4.11Å; T105-F107 HydrophobicContact CG2-CE1 3.58Å; T105-F107 HydrophobicContact CG2-CE2 3.52Å; T105-F107 HydrophobicContact CG2-CG 4.43Å; T105-F107 HydrophobicContact CG2-CZ 3.23Å; T105-V136 WeakPolarHBondContact CA-O 3.35Å; T105-E260 WeakPolarHBondContact CG2-OE1 3.47Å; T105-E260 PolarHBondContact OG1-OE1 2.83Å; T105-C408 PolarHBondContact N-O 3.38Å; T105-G409 CarbonylContact O-C 3.25Å; T105-G409 VanDerWaalsContact O-CA 3.3Å; T105-G409 WeakPolarHBondContact O-CA 3.49Å; T105-L410 PolarHBondContact O-N 2.94Å
106	V	91	Very high	79.7	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122.3	179.7	-174.9	0	0	0	0	110.4	I104 F121 I135 V136 T137 V144 T148 R256	I104-V106 HydrophobicContact CG2-CG2 3.95Å; V106-F121 HydrophobicContact CG1-CZ 4.26Å; V106-I135 HydrophobicContact CG2-CG2 3.77Å; V106-V136 PolarHBondContact N-O 3.28Å; V106-T137 HydrophobicContact CB-CG2 4.38Å; V106-V144 HydrophobicContact CG1-CG1 3.48Å; V106-V144 VanDerWaalsContact CG1-CG1 3.48Å; V106-T148 HydrophobicContact CG2-CG2 4.35Å; V106-R256 PolarHBondContact O-NH2 3.13Å
107	F	89	Confident	79.5	Confident	1 Å²	1	54.8 Å²	54.8	0%	0.004	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.4	177	-57.7	-73.1	0	0	0	109.2	T105 L410 V411 V412 T418 Q421 V422 I433	T105-F107 HydrophobicContact CG2-CD1 4.18Å; T105-F107 HydrophobicContact CG2-CD2 4.11Å; T105-F107 HydrophobicContact CG2-CE1 3.58Å; T105-F107 HydrophobicContact CG2-CE2 3.52Å; T105-F107 HydrophobicContact CG2-CG 4.43Å; T105-F107 HydrophobicContact CG2-CZ 3.23Å; F107-L410 PolarHBondContact N-O 2.91Å; F107-V411 HydrophobicContact CB-CG2 4.04Å; F107-V411 HydrophobicContact CD2-CG2 3.97Å; F107-V411 HydrophobicContact CG-CG2 4.42Å; F107-V411 WeakPolarHBondContact O-CA 3.19Å; F107-V412 PolarHBondContact O-N 3.21Å; F107-T418 HydrophobicContact CB-CG2 3.83Å; F107-Q421 HydrophobicContact CD1-CB 3.89Å; F107-Q421 HydrophobicContact CE1-CB 3.85Å; F107-V422 HydrophobicContact CB-CG2 4.33Å; F107-V422 HydrophobicContact CD2-CG2 3.99Å; F107-V422 HydrophobicContact CE2-CG2 4.34Å; F107-V422 HydrophobicContact CG-CG2 4.07Å; F107-I433 HydrophobicContact CE2-CD1 4.33Å
108	G	82.4	Confident	79.5	Confident	3 Å²	3	56.8 Å²	56.8	3%	0.031	26%	0.261	C	S	.	.			trans	150.1	157.9	-178.9	0	0	0	0	0	113.1	M145 V412	G108-M145 WeakPolarHBondContact O-CE 3.48Å; G108-V412 WeakPolarHBondContact CA-O 3.32Å
109	T	76.8	Confident	79.7	Confident	23 Å²	23	55 Å²	55	14%	0.141	26%	0.257	C	S	.	.			trans	-113.6	-126.1	175.5	52.8	0	0	0	0	109.8	G143 V144 G414 D415	T109-G143 CarbonylContact O-C 3.33Å; T109-G143 VanDerWaalsContact O-CA 3.31Å; T109-G143 WeakPolarHBondContact O-CA 3.3Å; T109-V144 WeakPolarHBondContact O-CG2 3.47Å; T109-V144 PolarHBondContact O-N 2.87Å; T109-G414 WeakPolarHBondContact OG1-CA 3.24Å; T109-D415 HydrophobicContact CG2-CB 4.44Å; T109-D415 WeakPolarHBondContact CG2-OD2 3.46Å
110	D	74.6	Confident	80	Confident	68 Å²	68	53.5 Å²	53.5	36%	0.364	25%	0.246	S	C	.	.			trans	-93.6	157.8	171.6	-155.5	18.5	0	0	0	111.3	K113 L142 G143	D110-K113 WeakPolarHBondContact OD1-CE 3.48Å; D110-K113 IonicContact OD1-NZ 3.53Å; D110-K113 PolarHBondContact OD1-NZ 3.32Å; D110-K113 IonicContact OD2-NZ 3.55Å; D110-K113 PolarHBondContact OD2-NZ 2.85Å; D110-L142 HydrophobicContact CB-CD1 4.45Å; D110-G143 VanDerWaalsContact OD1-CA 3.26Å; D110-G143 WeakPolarHBondContact OD1-CA 3.49Å
111	F	75.2	Confident	80.2	Confident	13 Å²	13	53.2 Å²	53.2	6%	0.057	24%	0.244	C	C	.	.			trans	-154.9	161.1	-173.8	69.1	-82.1	0	0	0	110.2	K113 L117 V144 L147	F111-K113 HydrophobicContact CE2-CG 4.29Å; F111-K113 HydrophobicContact CZ-CG 4.33Å; F111-K113 PolarHBondContact O-N 3.49Å; F111-L117 HydrophobicContact CD2-CD2 3.49Å; F111-L117 VanDerWaalsContact CD2-CD2 3.49Å; F111-L117 HydrophobicContact CE2-CD2 3.42Å; F111-L117 VanDerWaalsContact CE2-CD2 3.42Å; F111-L117 HydrophobicContact CZ-CD2 4.5Å; F111-V144 HydrophobicContact CD1-CG2 3.44Å; F111-V144 VanDerWaalsContact CD1-CG2 3.44Å; F111-V144 HydrophobicContact CE1-CB 4.48Å; F111-V144 HydrophobicContact CE1-CG2 3.75Å; F111-V144 HydrophobicContact CG-CG2 4.44Å; F111-L147 HydrophobicContact CE1-CD2 4.37Å; F111-L147 HydrophobicContact CZ-CD2 3.87Å
112	E	65.6	Low	80.6	Confident	154 Å²	154	51.8 Å²	51.8	72%	0.72	23%	0.233	S	C	*	.			trans	-68.4	122.2	179.9	-72.1	-148.2	136.6	0	0	113.1	K114	E112-K114 PolarHBondContact O-N 3.37Å
113	K	60.9	Low	80.6	Confident	117 Å²	117	56.7 Å²	56.7	51%	0.509	25%	0.254	S	S	.	.			trans	-81	48.7	-167.2	-70	133	-169.8	159.8	0	114.2	D110 F111 R115	D110-K113 WeakPolarHBondContact OD1-CE 3.48Å; D110-K113 IonicContact OD1-NZ 3.53Å; D110-K113 PolarHBondContact OD1-NZ 3.32Å; D110-K113 IonicContact OD2-NZ 3.55Å; D110-K113 PolarHBondContact OD2-NZ 2.85Å; F111-K113 HydrophobicContact CE2-CG 4.29Å; F111-K113 HydrophobicContact CZ-CG 4.33Å; F111-K113 PolarHBondContact O-N 3.49Å; K113-R115 PolarHBondContact O-N 3.42Å
114	K	71.1	Confident	80.3	Confident	96 Å²	96	57 Å²	57	42%	0.417	26%	0.257	S	S	.	.			trans	-47.4	122.1	167.9	-82.1	178.6	179.7	173.2	0	109.6	E112 K116 L117 K118 E516	E112-K114 PolarHBondContact O-N 3.37Å; K114-K116 VanDerWaalsContact C-N 3.29Å; K114-K116 PolarHBondContact O-N 3.12Å; K114-L117 HydrophobicContact CB-CB 3.92Å; K114-L117 WeakPolarHBondContact O-CA 3.39Å; K114-L117 WeakPolarHBondContact O-CB 3.32Å; K114-L117 PolarHBondContact O-N 3.2Å; K114-K118 PolarHBondContact O-N 3.38Å; K114-E516 IonicContact NZ-OE1 3.01Å; K114-E516 PolarHBondContact NZ-OE1 2.7Å
115	R	77.9	Confident	80.1	Confident	231 Å²	231	57 Å²	57	87%	0.872	26%	0.257	S	S	*	.	H	α-helix	trans	-60.5	-34.3	-175.5	-172	176.3	178.1	176	0.7	113.4	K113 L117 M119	K113-R115 PolarHBondContact O-N 3.42Å; R115-L117 VanDerWaalsContact C-N 3.3Å; R115-L117 PolarHBondContact O-N 3.2Å; R115-M119 PolarHBondContact O-N 3.38Å
116	K	78	Confident	79.8	Confident	109 Å²	109	61.1 Å²	61.1	47%	0.474	27%	0.272	S	S	.	.	H	α-helix	trans	-55.9	-45.4	171.1	-169.2	-159.1	-176.1	-158.1	0	110.7	K114 M119 I120 M515 E516	K114-K116 VanDerWaalsContact C-N 3.29Å; K114-K116 PolarHBondContact O-N 3.12Å; K116-M119 PolarHBondContact O-N 3.06Å; K116-I120 HydrophobicContact CD-CD1 4.12Å; K116-I120 HydrophobicContact CG-CD1 3.86Å; K116-I120 WeakPolarHBondContact O-CG1 3.25Å; K116-I120 PolarHBondContact O-N 3.47Å; K116-M515 PolarHBondContact NZ-O 3.08Å; K116-E516 PolarHBondContact NZ-O 3.18Å
117	L	75.5	Confident	79.2	Confident	11 Å²	11	64 Å²	64	6%	0.058	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-52.7	-176	-148.2	100.6	0	0	0	111.8	F111 K114 R115 M119 I120 F121 T439 M515	F111-L117 HydrophobicContact CD2-CD2 3.49Å; F111-L117 VanDerWaalsContact CD2-CD2 3.49Å; F111-L117 HydrophobicContact CE2-CD2 3.42Å; F111-L117 VanDerWaalsContact CE2-CD2 3.42Å; F111-L117 HydrophobicContact CZ-CD2 4.5Å; K114-L117 HydrophobicContact CB-CB 3.92Å; K114-L117 WeakPolarHBondContact O-CA 3.39Å; K114-L117 WeakPolarHBondContact O-CB 3.32Å; K114-L117 PolarHBondContact O-N 3.2Å; R115-L117 VanDerWaalsContact C-N 3.3Å; R115-L117 PolarHBondContact O-N 3.2Å; L117-M119 PolarHBondContact O-N 3.16Å; L117-I120 PolarHBondContact O-N 2.99Å; L117-F121 WeakPolarHBondContact O-CB 3.47Å; L117-F121 PolarHBondContact O-N 3.3Å; L117-T439 HydrophobicContact CD1-CG2 3.97Å; L117-T439 HydrophobicContact CD2-CG2 3.97Å; L117-T439 HydrophobicContact CG-CG2 4.45Å; L117-M515 HydrophobicContact CB-CE 4.44Å; L117-M515 HydrophobicContact CD1-CB 3.97Å; L117-M515 HydrophobicContact CD1-CE 3.72Å; L117-M515 HydrophobicContact CD1-CG 4.27Å; L117-M515 HydrophobicContact CD1-SD 3.46Å; L117-M515 WeakPolarHBondContact CD1-SD 3.28Å; L117-M515 HydrophobicContact CD2-SD 4.45Å; L117-M515 HydrophobicContact CG-CE 3.66Å; L117-M515 HydrophobicContact CG-SD 3.72Å
118	K	81.3	Confident	78.6	Confident	63 Å²	63	64.5 Å²	64.5	27%	0.274	29%	0.289	S	S	.	.	H	α-helix	trans	-54.6	-40.5	175.2	-78.1	-158.3	169.5	-156.1	0	111.7	K114 K122 L147 E150	K114-K118 PolarHBondContact O-N 3.38Å; K118-K122 WeakPolarHBondContact O-CB 3.18Å; K118-K122 WeakPolarHBondContact O-CG 3.23Å; K118-K122 PolarHBondContact O-N 2.94Å; K118-L147 HydrophobicContact CB-CD1 4.24Å; K118-L147 HydrophobicContact CD-CD1 3.74Å; K118-L147 HydrophobicContact CG-CD1 3.78Å; K118-L147 HydrophobicContact CG-CD2 4.15Å; K118-E150 IonicContact NZ-OE1 3.16Å; K118-E150 PolarHBondContact NZ-OE1 2.99Å; K118-E150 IonicContact NZ-OE2 2.63Å
119	M	83	Confident	78.2	Confident	141 Å²	141	64.4 Å²	64.4	70%	0.695	29%	0.288	S	S	*	.	H	α-helix	trans	-71	-42.3	-179.4	-171.4	175.7	179.9	0	0	112.8	R115 K116 L117 K123	R115-M119 PolarHBondContact O-N 3.38Å; K116-M119 PolarHBondContact O-N 3.06Å; L117-M119 PolarHBondContact O-N 3.16Å; M119-K123 WeakPolarHBondContact O-CB 3.49Å; M119-K123 PolarHBondContact O-N 2.8Å
120	I	84.2	Confident	77.9	Confident	18 Å²	18	69.6 Å²	69.6	9%	0.092	31%	0.311	C	S	.	.	H	α-helix	trans	-64.1	-46.9	175.9	-67.4	169.5	0	0	0	110.3	K116 L117 K123 G124 F513 M515 L521	K116-I120 HydrophobicContact CD-CD1 4.12Å; K116-I120 HydrophobicContact CG-CD1 3.86Å; K116-I120 WeakPolarHBondContact O-CG1 3.25Å; K116-I120 PolarHBondContact O-N 3.47Å; L117-I120 PolarHBondContact O-N 2.99Å; I120-K123 PolarHBondContact O-N 3.41Å; I120-G124 PolarHBondContact O-N 2.69Å; I120-F513 HydrophobicContact CG2-CE1 4.07Å; I120-F513 HydrophobicContact CG2-CZ 4.05Å; I120-M515 HydrophobicContact CB-CE 3.8Å; I120-M515 HydrophobicContact CD1-CE 4.25Å; I120-M515 HydrophobicContact CG2-CE 3.7Å; I120-L521 HydrophobicContact CG2-CB 4.42Å
121	F	85.4	Confident	77.4	Confident	5 Å²	5	67.5 Å²	67.5	2%	0.022	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-51	179.3	-177	-94	0	0	0	112.1	V106 L117 K123 G124 L125 V144 L147 L410 V412	V106-F121 HydrophobicContact CG1-CZ 4.26Å; L117-F121 WeakPolarHBondContact O-CB 3.47Å; L117-F121 PolarHBondContact O-N 3.3Å; F121-K123 PolarHBondContact O-N 3.05Å; F121-G124 PolarHBondContact O-N 2.96Å; F121-L125 HydrophobicContact CD1-CD1 3.94Å; F121-L125 HydrophobicContact CE1-CD1 3.4Å; F121-L125 VanDerWaalsContact CE1-CD1 3.4Å; F121-L125 HydrophobicContact CE1-CG 4.33Å; F121-L125 HydrophobicContact CZ-CD1 3.74Å; F121-L125 HydrophobicContact CZ-CG 4.47Å; F121-L125 PolarHBondContact O-N 3.01Å; F121-V144 HydrophobicContact CE2-CG1 4.21Å; F121-V144 HydrophobicContact CZ-CG1 3.84Å; F121-L147 HydrophobicContact CB-CD2 4.22Å; F121-L147 HydrophobicContact CD1-CD2 3.37Å; F121-L147 HydrophobicContact CD1-CG 3.77Å; F121-L147 HydrophobicContact CE1-CD2 3.85Å; F121-L147 HydrophobicContact CE1-CG 3.97Å; F121-L147 HydrophobicContact CG-CD2 3.93Å; F121-L410 HydrophobicContact CD2-CD2 4.23Å; F121-L410 HydrophobicContact CE2-CD2 3.66Å; F121-L410 HydrophobicContact CE2-CG 4.47Å; F121-V412 HydrophobicContact CD2-CG2 4.1Å; F121-V412 HydrophobicContact CE2-CG2 3.81Å
122	K	86.7	Confident	77.3	Confident	25 Å²	25	68.1 Å²	68.1	11%	0.109	31%	0.311	C	S	.	.	H	α-helix	trans	-59.7	-46.3	175.9	-72.6	-166.5	178.9	-179.3	0	111.8	K118 G124 L125 W126 L147 E150 A151 D154	K118-K122 WeakPolarHBondContact O-CB 3.18Å; K118-K122 WeakPolarHBondContact O-CG 3.23Å; K118-K122 PolarHBondContact O-N 2.94Å; K122-G124 PolarHBondContact O-N 3.44Å; K122-L125 PolarHBondContact O-N 2.7Å; K122-W126 HydrophobicContact CB-CZ2 4.28Å; K122-W126 HydrophobicContact CD-CZ2 4.4Å; K122-W126 WeakPolarHBondContact O-CB 3.46Å; K122-W126 VanDerWaalsContact O-CD1 3.31Å; K122-W126 PolarHBondContact O-N 2.9Å; K122-L147 HydrophobicContact CG-CD1 4.39Å; K122-E150 WeakPolarHBondContact CE-OE2 3.32Å; K122-E150 IonicContact NZ-OE2 2.76Å; K122-E150 PolarHBondContact NZ-OE2 3.36Å; K122-A151 HydrophobicContact CD-CB 4.39Å; K122-A151 HydrophobicContact CG-CB 3.86Å; K122-D154 IonicContact NZ-OD2 3.65Å; K122-D154 PolarHBondContact NZ-OD2 2.82Å
123	K	84.5	Confident	78.2	Confident	106 Å²	106	60.9 Å²	60.9	46%	0.461	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-41.4	179.1	-173.7	-174.2	178.8	-166.2	0	112.6	M119 I120 F121 W126 K127	M119-K123 WeakPolarHBondContact O-CB 3.49Å; M119-K123 PolarHBondContact O-N 2.8Å; I120-K123 PolarHBondContact O-N 3.41Å; F121-K123 PolarHBondContact O-N 3.05Å; K123-W126 PolarHBondContact O-N 3.16Å; K123-K127 WeakPolarHBondContact O-CG 3.45Å; K123-K127 PolarHBondContact O-N 2.71Å
124	G	82.6	Confident	79.5	Confident	5 Å²	5	55.7 Å²	55.7	5%	0.052	26%	0.255	C	S	.	.	H	α-helix	trans	-64	-47	176.6	0	0	0	0	0	112.2	I120 F121 K122 K127 A128	I120-G124 PolarHBondContact O-N 2.69Å; F121-G124 PolarHBondContact O-N 2.96Å; K122-G124 PolarHBondContact O-N 3.44Å; G124-K127 PolarHBondContact O-N 2.72Å; G124-A128 PolarHBondContact O-N 3.47Å
125	L	85.5	Confident	80.5	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-42.9	174.3	-73.1	-177.5	0	0	0	112.4	I104 F121 K122 A128 A129 I135 T148 A151 M164	I104-L125 HydrophobicContact CD1-CD2 4.32Å; I104-L125 HydrophobicContact CG2-CD2 4.35Å; F121-L125 HydrophobicContact CD1-CD1 3.94Å; F121-L125 HydrophobicContact CE1-CD1 3.4Å; F121-L125 VanDerWaalsContact CE1-CD1 3.4Å; F121-L125 HydrophobicContact CE1-CG 4.33Å; F121-L125 HydrophobicContact CZ-CD1 3.74Å; F121-L125 HydrophobicContact CZ-CG 4.47Å; F121-L125 PolarHBondContact O-N 3.01Å; K122-L125 PolarHBondContact O-N 2.7Å; L125-A128 PolarHBondContact O-N 2.93Å; L125-A129 VanDerWaalsContact O-CB 3.3Å; L125-A129 WeakPolarHBondContact O-CB 3.36Å; L125-A129 PolarHBondContact O-N 2.96Å; L125-I135 HydrophobicContact CD2-CD1 4.34Å; L125-T148 HydrophobicContact CD1-CG2 4.35Å; L125-A151 HydrophobicContact CD1-CB 4.05Å; L125-M164 HydrophobicContact CB-CE 3.84Å; L125-M164 HydrophobicContact CD1-CE 4.49Å
126	W	84.9	Confident	81.1	Confident	86 Å²	86	40.2 Å²	40.2	33%	0.326	19%	0.194	S	C	.	.	H	α-helix	trans	-63.3	-42.3	178.7	-66.6	-11.5	0	0	0	113	K122 K123 A129 E130 A151 D154 Y155	K122-W126 HydrophobicContact CB-CZ2 4.28Å; K122-W126 HydrophobicContact CD-CZ2 4.4Å; K122-W126 WeakPolarHBondContact O-CB 3.46Å; K122-W126 VanDerWaalsContact O-CD1 3.31Å; K122-W126 PolarHBondContact O-N 2.9Å; K123-W126 PolarHBondContact O-N 3.16Å; W126-A129 WeakPolarHBondContact O-CB 3.47Å; W126-A129 PolarHBondContact O-N 3.17Å; W126-E130 PolarHBondContact O-N 3.12Å; W126-A151 PolarHBondContact NE1-O 3.17Å; W126-D154 HydrophobicContact CZ2-CB 3.8Å; W126-Y155 HydrophobicContact CB-CD2 4Å; W126-Y155 HydrophobicContact CB-CE2 4.37Å; W126-Y155 AromaticContact CD1-CD2 3.65Å; W126-Y155 AromaticContact CG-CD2 3.89Å; W126-Y155 HydrophobicContact CG-CD2 3.89Å
127	K	78	Confident	81.8	Confident	63 Å²	63	35 Å²	35	27%	0.274	17%	0.172	S	C	.	.	H	α-helix	trans	-63	-43.4	173.8	-76.4	178.6	170.4	-172.9	0	111.9	K123 G124 A129 E130 D520 D522	K123-K127 WeakPolarHBondContact O-CG 3.45Å; K123-K127 PolarHBondContact O-N 2.71Å; G124-K127 PolarHBondContact O-N 2.72Å; K127-A129 VanDerWaalsContact C-N 3.27Å; K127-A129 PolarHBondContact O-N 2.86Å; K127-E130 WeakPolarHBondContact O-CB 3.49Å; K127-E130 PolarHBondContact O-N 2.89Å; K127-D520 IonicContact NZ-OD1 3.09Å; K127-D520 PolarHBondContact NZ-OD1 2.8Å; K127-D520 IonicContact NZ-OD2 2.67Å; K127-D522 HydrophobicContact CB-CB 4.18Å; K127-D522 HydrophobicContact CD-CB 4.11Å; K127-D522 WeakPolarHBondContact CD-OD1 3.24Å; K127-D522 WeakPolarHBondContact CD-OD2 3.44Å; K127-D522 WeakPolarHBondContact CE-OD1 3.32Å; K127-D522 IonicContact NZ-OD1 3.08Å; K127-D522 PolarHBondContact NZ-OD1 3.35Å; K127-D522 IonicContact NZ-OD2 2.75Å; K127-D522 PolarHBondContact NZ-OD2 3.5Å
128	A	75.9	Confident	82.2	Confident	13 Å²	13	34.7 Å²	34.7	11%	0.107	17%	0.171	C	C	.	.	H	α-helix	trans	-63.4	-36	175.9	0	0	0	0	0	111.8	I104 G124 L125 E130 S131	I104-A128 HydrophobicContact CD1-CB 3.81Å; G124-A128 PolarHBondContact O-N 3.47Å; L125-A128 PolarHBondContact O-N 2.93Å; A128-E130 VanDerWaalsContact C-N 3.27Å; A128-E130 PolarHBondContact O-N 2.92Å; A128-S131 PolarHBondContact O-N 3.16Å; A128-S131 PolarHBondContact O-OG 3.19Å
129	A	75	Confident	82.4	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.008	16%	0.158	C	C	.	.	H	α-helix	trans	-66.7	-18.3	178.7	0	0	0	0	0	114.7	L125 W126 K127 S131 G132 Y155 M164	L125-A129 VanDerWaalsContact O-CB 3.3Å; L125-A129 WeakPolarHBondContact O-CB 3.36Å; L125-A129 PolarHBondContact O-N 2.96Å; W126-A129 WeakPolarHBondContact O-CB 3.47Å; W126-A129 PolarHBondContact O-N 3.17Å; K127-A129 VanDerWaalsContact C-N 3.27Å; K127-A129 PolarHBondContact O-N 2.86Å; A129-S131 PolarHBondContact O-N 3.03Å; A129-G132 PolarHBondContact O-N 3.32Å; A129-Y155 HydrophobicContact CB-CD2 4.21Å; A129-Y155 HydrophobicContact CB-CE1 4.44Å; A129-Y155 HydrophobicContact CB-CE2 3.76Å; A129-M164 HydrophobicContact CB-CB 3.97Å; A129-M164 HydrophobicContact CB-CE 4.39Å; A129-M164 HydrophobicContact CB-CG 3.78Å; A129-M164 HydrophobicContact CB-SD 3.73Å
130	E	69.9	Low	82.6	Confident	131 Å²	131	26 Å²	26	61%	0.612	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-24	170.6	-70.3	-167.8	-170.3	0	0	113.1	W126 K127 A128	W126-E130 PolarHBondContact O-N 3.12Å; K127-E130 WeakPolarHBondContact O-CB 3.49Å; K127-E130 PolarHBondContact O-N 2.89Å; A128-E130 VanDerWaalsContact C-N 3.27Å; A128-E130 PolarHBondContact O-N 2.92Å
131	S	64.6	Low	82.7	Confident	25 Å²	25	27.5 Å²	27.5	18%	0.175	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-16.9	-177.8	68.5	0	0	0	0	115.9	T101 A128 A129 L553	T101-S131 WeakPolarHBondContact CB-O 3.28Å; T101-S131 WeakPolarHBondContact CG2-O 3.29Å; T101-S131 VanDerWaalsContact OG1-C 3.3Å; T101-S131 PolarHBondContact OG1-O 2.75Å; A128-S131 PolarHBondContact O-N 3.16Å; A128-S131 PolarHBondContact O-OG 3.19Å; A129-S131 PolarHBondContact O-N 3.03Å; S131-L553 VanDerWaalsContact CB-CD2 3.4Å
132	G	72.8	Confident	82.6	Confident	25 Å²	25	30 Å²	30	26%	0.258	15%	0.149	S	C	.	.			trans	96.2	48.6	-171.2	0	0	0	0	0	114.4	T101 A129 R163	T101-G132 PolarHBondContact N-O 3.32Å; T101-G132 PolarHBondContact OG1-O 3.23Å; T101-G132 VanDerWaalsContact OG1-O 3.06Å; A129-G132 PolarHBondContact O-N 3.32Å; G132-R163 CarbonylContact C-O 3.53Å; G132-R163 VanDerWaalsContact CA-O 3.28Å; G132-R163 WeakPolarHBondContact CA-O 3.22Å
133	C	84.3	Confident	82.3	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.014	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	145.1	-170.6	-167.5	0	0	0	0	113.5	L102 R163 M165	L102-C133 HydrophobicContact CB-CB 4.4Å; L102-C133 WeakPolarHBondContact O-CA 3.26Å; L102-C133 PolarHBondContact O-SG 3.46Å; C133-R163 PolarHBondContact N-O 3.5Å; C133-M165 PolarHBondContact O-N 3.09Å
134	W	89.4	Confident	82.4	Confident	8 Å²	8	24.2 Å²	24.2	3%	0.03	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	144.5	163.6	-71.7	15.1	0	0	0	110.2	L97 K98 P100 L102 I104 M165 F167 I263 W266	L97-W134 HydrophobicContact CB-CH2 3.78Å; L97-W134 HydrophobicContact CB-CZ2 3.8Å; L97-W134 HydrophobicContact CD1-CH2 3.77Å; L97-W134 HydrophobicContact CD1-CZ2 4.2Å; L97-W134 HydrophobicContact CD2-CH2 4.47Å; L97-W134 HydrophobicContact CD2-CZ2 4.06Å; L97-W134 HydrophobicContact CG-CH2 4.22Å; L97-W134 HydrophobicContact CG-CZ2 4.25Å; K98-W134 WeakPolarHBondContact O-CZ2 3.48Å; P100-W134 HydrophobicContact CB-CB 4.11Å; P100-W134 HydrophobicContact CB-CD2 3.87Å; P100-W134 HydrophobicContact CB-CG 3.62Å; P100-W134 HydrophobicContact CG-CB 4.33Å; P100-W134 HydrophobicContact CG-CD2 3.56Å; P100-W134 HydrophobicContact CG-CE3 3.81Å; P100-W134 HydrophobicContact CG-CG 3.82Å; P100-W134 HydrophobicContact CG-CZ2 4.5Å; P100-W134 HydrophobicContact CG-CZ3 4.37Å; L102-W134 PolarHBondContact O-N 3.49Å; I104-W134 PolarHBondContact N-O 3.42Å; W134-M165 HydrophobicContact CZ2-CE 4.08Å; W134-F167 HydrophobicContact CB-CE2 4.22Å; W134-F167 AromaticContact CD2-CE2 3.54Å; W134-F167 HydrophobicContact CD2-CE2 3.54Å; W134-F167 AromaticContact CD2-CZ 3.93Å; W134-F167 HydrophobicContact CD2-CZ 3.93Å; W134-F167 HydrophobicContact CE3-CD2 4.26Å; W134-F167 HydrophobicContact CE3-CE1 4.49Å; W134-F167 AromaticContact CE3-CE2 3.44Å; W134-F167 HydrophobicContact CE3-CE2 3.44Å; W134-F167 VanDerWaalsContact CE3-CE2 3.44Å; W134-F167 AromaticContact CE3-CZ 3.58Å; W134-F167 HydrophobicContact CE3-CZ 3.58Å; W134-F167 AromaticContact CG-CE2 3.9Å; W134-F167 HydrophobicContact CG-CE2 3.9Å; W134-F167 AromaticContact CH2-CZ 3.96Å; W134-F167 HydrophobicContact CH2-CZ 3.96Å; W134-F167 HydrophobicContact CZ2-CZ 4.27Å; W134-F167 HydrophobicContact CZ3-CE1 4.3Å; W134-F167 AromaticContact CZ3-CE2 3.99Å; W134-F167 HydrophobicContact CZ3-CE2 3.99Å; W134-F167 AromaticContact CZ3-CZ 3.61Å; W134-F167 HydrophobicContact CZ3-CZ 3.61Å; W134-I263 HydrophobicContact CE3-CD1 4.14Å; W134-I263 HydrophobicContact CE3-CG2 4.18Å; W134-I263 HydrophobicContact CZ3-CD1 4.1Å; W134-I263 HydrophobicContact CZ3-CG1 4.4Å; W134-I263 HydrophobicContact CZ3-CG2 4.16Å; W134-W266 HydrophobicContact CH2-CH2 4.14Å; W134-W266 AromaticContact CH2-CZ3 3.61Å; W134-W266 HydrophobicContact CH2-CZ3 3.61Å; W134-W266 HydrophobicContact CZ3-CZ3 4.08Å
135	I	91.3	Very high	82.6	Confident	2 Å²	2	25 Å²	25	1%	0.01	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.9	-179.6	-53.6	-178.2	0	0	0	109.3	I104 V106 L125 T137 T148 V152 M164 M165 A166 F167	I104-I135 CarbonylContact O-C 3.55Å; I104-I135 VanDerWaalsContact O-CA 3.29Å; I104-I135 WeakPolarHBondContact O-CA 3.21Å; V106-I135 HydrophobicContact CG2-CG2 3.77Å; L125-I135 HydrophobicContact CD2-CD1 4.34Å; I135-T137 HydrophobicContact CG2-CG2 3.94Å; I135-T148 HydrophobicContact CG2-CG2 3.67Å; I135-V152 HydrophobicContact CD1-CG2 4.01Å; I135-M164 HydrophobicContact CD1-CE 3.45Å; I135-M164 VanDerWaalsContact CD1-CE 3.45Å; I135-M164 HydrophobicContact CD1-CG 4.03Å; I135-M165 PolarHBondContact N-O 3.42Å; I135-A166 CarbonylContact O-C 3Å; I135-A166 WeakPolarHBondContact O-CA 3.44Å; I135-F167 PolarHBondContact O-N 2.97Å
136	V	91.3	Very high	82.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.3	179.8	-176	0	0	0	0	108.8	I103 I104 T105 V106 F167 V169 R256 F259	I103-V136 HydrophobicContact CG2-CG2 4.12Å; I104-V136 PolarHBondContact O-N 3.39Å; T105-V136 WeakPolarHBondContact CA-O 3.35Å; V106-V136 PolarHBondContact N-O 3.28Å; V136-F167 WeakPolarHBondContact CA-O 3.36Å; V136-V169 HydrophobicContact CG1-CG2 3.9Å; V136-R256 HydrophobicContact CG1-CG 4.5Å; V136-R256 PolarHBondContact O-NH2 2.7Å; V136-F259 HydrophobicContact CG1-CD1 4.41Å; V136-F259 HydrophobicContact CG1-CE1 4.38Å; V136-F259 HydrophobicContact CG2-CE1 4.29Å
137	T	90.9	Very high	82.9	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	-178.8	-177.6	82.2	0	0	0	0	110.5	V106 I135 G139 T148 F167 V169 H234	V106-T137 HydrophobicContact CB-CG2 4.38Å; I135-T137 HydrophobicContact CG2-CG2 3.94Å; T137-G139 VanDerWaalsContact C-N 3.33Å; T137-G139 PolarHBondContact OG1-N 3.42Å; T137-T148 HydrophobicContact CG2-CG2 3.8Å; T137-F167 PolarHBondContact N-O 2.7Å; T137-V169 PolarHBondContact O-N 3.14Å; T137-H234 PolarHBondContact OG1-CD2 3.27Å; T137-H234 PolarHBondContact OG1-NE2 3.04Å
138	G	85.4	Confident	83.4	Confident	4 Å²	4	21.6 Å²	21.6	4%	0.041	12%	0.117	C	C	.	.			trans	-80.4	-5.2	168.8	0	0	0	0	0	115.1	F140 M145 V169	G138-F140 VanDerWaalsContact C-N 3.29Å; G138-F140 VanDerWaalsContact O-CD2 3.27Å; G138-F140 WeakPolarHBondContact O-CD2 3.38Å; G138-F140 PolarHBondContact O-N 3.02Å; G138-M145 WeakPolarHBondContact CA-SD 3.16Å; G138-V169 WeakPolarHBondContact CA-O 3.37Å
139	G	85.3	Confident	84	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.111	C	C	.	.			trans	73.7	-2	173.2	0	0	0	0	0	117.9	T137 D231	T137-G139 VanDerWaalsContact C-N 3.33Å; T137-G139 PolarHBondContact OG1-N 3.42Å; G139-D231 PolarHBondContact O-N 2.8Å
140	F	87.2	Confident	84.6	Confident	22 Å²	22	22.4 Å²	22.4	10%	0.096	12%	0.118	C	C	.	.	B	Isolated β-bridge	trans	-86.2	154.3	180	-62.3	-72.3	0	0	0	112.9	G138 L142 M145 A170 C174 V175 R228 A229	G138-F140 VanDerWaalsContact C-N 3.29Å; G138-F140 VanDerWaalsContact O-CD2 3.27Å; G138-F140 WeakPolarHBondContact O-CD2 3.38Å; G138-F140 PolarHBondContact O-N 3.02Å; F140-L142 PolarHBondContact O-N 2.68Å; F140-M145 HydrophobicContact CB-SD 4.2Å; F140-M145 HydrophobicContact CD2-SD 4.28Å; F140-M145 WeakPolarHBondContact O-CB 3.46Å; F140-A170 HydrophobicContact CE1-CB 4.27Å; F140-A170 HydrophobicContact CE2-CB 3.96Å; F140-A170 HydrophobicContact CZ-CB 3.69Å; F140-C174 HydrophobicContact CE1-CB 4.3Å; F140-C174 WeakPolarHBondContact CE1-O 3.46Å; F140-C174 HydrophobicContact CZ-CB 3.85Å; F140-V175 HydrophobicContact CE1-CG2 4.16Å; F140-R228 HydrophobicContact CB-CB 4.41Å; F140-R228 HydrophobicContact CD1-CB 3.55Å; F140-R228 HydrophobicContact CE1-CB 4.03Å; F140-R228 HydrophobicContact CG-CB 4.13Å; F140-A229 CarbonylContact C-O 3.58Å; F140-A229 WeakPolarHBondContact CA-O 3.32Å
141	H	86.4	Confident	85.5	Confident	50 Å²	50	16.2 Å²	16.2	23%	0.231	9%	0.089	C	C	.	.	S	Bend	trans	-76.2	35	-179.6	-161.9	55.6	0	0	0	114.5	K146 A229 D231	H141-K146 VanDerWaalsContact CE1-CE 3.42Å; H141-K146 WeakPolarHBondContact CE1-CE 3.41Å; H141-K146 VanDerWaalsContact NE2-CE 3.3Å; H141-K146 WeakPolarHBondContact NE2-CE 3.36Å; H141-K146 PolarHBondContact NE2-NZ 3.49Å; H141-K146 WeakPolarHBondContact O-CD 3.35Å; H141-A229 HydrophobicContact CB-CB 4.42Å; H141-A229 PolarHBondContact N-O 2.75Å; H141-D231 HydrophobicContact CB-CB 4.31Å; H141-D231 IonicContact CE1-OD1 2.79Å; H141-D231 IonicContact CG-OD1 2.84Å; H141-D231 IonicContact ND1-OD1 2.79Å; H141-D231 PolarHBondContact ND1-OD1 3.48Å
142	L	82.4	Confident	86.6	Confident	57 Å²	57	15 Å²	15	30%	0.298	8%	0.081	S	C	.	.	S	Bend	trans	-117.7	140.1	-173.6	-172.8	64	0	0	0	112.2	D110 F140 V144 M145 K146	D110-L142 HydrophobicContact CB-CD1 4.45Å; F140-L142 PolarHBondContact O-N 2.68Å; L142-V144 PolarHBondContact O-N 2.9Å; L142-M145 WeakPolarHBondContact O-CB 3.49Å; L142-M145 PolarHBondContact O-N 2.89Å; L142-K146 PolarHBondContact O-N 2.92Å; L142-K146 VanDerWaalsContact O-N 3.08Å
143	G	80.9	Confident	87.2	Confident	10 Å²	10	17.2 Å²	17.2	10%	0.103	8%	0.081	C	C	.	.	H	α-helix	trans	47.6	-122.8	163.2	0	0	0	0	0	116.7	T109 D110 M145 K146 L147	T109-G143 CarbonylContact O-C 3.33Å; T109-G143 VanDerWaalsContact O-CA 3.31Å; T109-G143 WeakPolarHBondContact O-CA 3.3Å; D110-G143 VanDerWaalsContact OD1-CA 3.26Å; D110-G143 WeakPolarHBondContact OD1-CA 3.49Å; G143-M145 VanDerWaalsContact C-N 3.27Å; G143-M145 PolarHBondContact O-N 3.13Å; G143-K146 PolarHBondContact O-N 3.08Å; G143-L147 PolarHBondContact O-N 2.99Å
144	V	86.3	Confident	87.3	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.1	-33.8	179.5	-174.3	0	0	0	0	111.7	V106 T109 F111 F121 L142 L147 T148 V412	V106-V144 HydrophobicContact CG1-CG1 3.48Å; V106-V144 VanDerWaalsContact CG1-CG1 3.48Å; T109-V144 WeakPolarHBondContact O-CG2 3.47Å; T109-V144 PolarHBondContact O-N 2.87Å; F111-V144 HydrophobicContact CD1-CG2 3.44Å; F111-V144 VanDerWaalsContact CD1-CG2 3.44Å; F111-V144 HydrophobicContact CE1-CB 4.48Å; F111-V144 HydrophobicContact CE1-CG2 3.75Å; F111-V144 HydrophobicContact CG-CG2 4.44Å; F121-V144 HydrophobicContact CE2-CG1 4.21Å; F121-V144 HydrophobicContact CZ-CG1 3.84Å; L142-V144 PolarHBondContact O-N 2.9Å; V144-L147 PolarHBondContact O-N 2.84Å; V144-T148 WeakPolarHBondContact O-CB 3.38Å; V144-T148 PolarHBondContact O-N 3.3Å; V144-T148 PolarHBondContact O-OG1 2.77Å; V144-V412 HydrophobicContact CG1-CB 4.21Å; V144-V412 HydrophobicContact CG2-CB 3.84Å; V144-V412 HydrophobicContact CG2-CG1 3.85Å; V144-V412 WeakPolarHBondContact CG2-O 3.42Å
145	M	87.7	Confident	87.1	Confident	21 Å²	21	19 Å²	19	10%	0.103	9%	0.091	C	C	.	.	H	α-helix	trans	-67.2	-45.7	179.7	-54.1	-176.4	-163.8	0	0	110.5	G108 G138 F140 L142 G143 T148 G149	G108-M145 WeakPolarHBondContact O-CE 3.48Å; G138-M145 WeakPolarHBondContact CA-SD 3.16Å; F140-M145 HydrophobicContact CB-SD 4.2Å; F140-M145 HydrophobicContact CD2-SD 4.28Å; F140-M145 WeakPolarHBondContact O-CB 3.46Å; L142-M145 WeakPolarHBondContact O-CB 3.49Å; L142-M145 PolarHBondContact O-N 2.89Å; G143-M145 VanDerWaalsContact C-N 3.27Å; G143-M145 PolarHBondContact O-N 3.13Å; M145-T148 WeakPolarHBondContact O-CB 3.31Å; M145-T148 PolarHBondContact O-N 3.4Å; M145-G149 PolarHBondContact O-N 2.87Å
146	K	88.1	Confident	86.8	Confident	78 Å²	78	20.9 Å²	20.9	34%	0.339	10%	0.103	S	C	.	.	H	α-helix	trans	-59.9	-44.5	170.5	179.4	166.2	177.9	159.7	0	112.1	H141 L142 G143 T148 G149 E150	H141-K146 VanDerWaalsContact CE1-CE 3.42Å; H141-K146 WeakPolarHBondContact CE1-CE 3.41Å; H141-K146 VanDerWaalsContact NE2-CE 3.3Å; H141-K146 WeakPolarHBondContact NE2-CE 3.36Å; H141-K146 PolarHBondContact NE2-NZ 3.49Å; H141-K146 WeakPolarHBondContact O-CD 3.35Å; L142-K146 PolarHBondContact O-N 2.92Å; L142-K146 VanDerWaalsContact O-N 3.08Å; G143-K146 PolarHBondContact O-N 3.08Å; K146-T148 VanDerWaalsContact C-N 3.28Å; K146-T148 PolarHBondContact O-N 3.28Å; K146-G149 PolarHBondContact O-N 2.95Å; K146-E150 WeakPolarHBondContact O-CG 3.21Å; K146-E150 PolarHBondContact O-N 2.7Å
147	L	88.2	Confident	86.4	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-36	176.2	-177.3	66.3	0	0	0	112.5	F111 K118 F121 K122 G143 V144 A151	F111-L147 HydrophobicContact CE1-CD2 4.37Å; F111-L147 HydrophobicContact CZ-CD2 3.87Å; K118-L147 HydrophobicContact CB-CD1 4.24Å; K118-L147 HydrophobicContact CD-CD1 3.74Å; K118-L147 HydrophobicContact CG-CD1 3.78Å; K118-L147 HydrophobicContact CG-CD2 4.15Å; F121-L147 HydrophobicContact CB-CD2 4.22Å; F121-L147 HydrophobicContact CD1-CD2 3.37Å; F121-L147 HydrophobicContact CD1-CG 3.77Å; F121-L147 HydrophobicContact CE1-CD2 3.85Å; F121-L147 HydrophobicContact CE1-CG 3.97Å; F121-L147 HydrophobicContact CG-CD2 3.93Å; K122-L147 HydrophobicContact CG-CD1 4.39Å; G143-L147 PolarHBondContact O-N 2.99Å; V144-L147 PolarHBondContact O-N 2.84Å; L147-A151 WeakPolarHBondContact O-CB 3.49Å; L147-A151 PolarHBondContact O-N 3.26Å
148	T	88.9	Confident	86	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69.8	-42	177.1	-56.2	0	0	0	0	110.7	V106 L125 I135 T137 V144 M145 K146 A151 V152	V106-T148 HydrophobicContact CG2-CG2 4.35Å; L125-T148 HydrophobicContact CD1-CG2 4.35Å; I135-T148 HydrophobicContact CG2-CG2 3.67Å; T137-T148 HydrophobicContact CG2-CG2 3.8Å; V144-T148 WeakPolarHBondContact O-CB 3.38Å; V144-T148 PolarHBondContact O-N 3.3Å; V144-T148 PolarHBondContact O-OG1 2.77Å; M145-T148 WeakPolarHBondContact O-CB 3.31Å; M145-T148 PolarHBondContact O-N 3.4Å; K146-T148 VanDerWaalsContact C-N 3.28Å; K146-T148 PolarHBondContact O-N 3.28Å; T148-A151 WeakPolarHBondContact O-CB 3.46Å; T148-A151 PolarHBondContact O-N 3.32Å; T148-V152 VanDerWaalsContact O-CG2 3.28Å; T148-V152 WeakPolarHBondContact O-CG2 3.48Å; T148-V152 PolarHBondContact O-N 3.31Å
149	G	87.6	Confident	85.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.6	-51.2	170.3	0	0	0	0	0	112.4	M145 K146 A151 V152 R153 N233	M145-G149 PolarHBondContact O-N 2.87Å; K146-G149 PolarHBondContact O-N 2.95Å; G149-A151 VanDerWaalsContact C-N 3.28Å; G149-A151 PolarHBondContact O-N 2.98Å; G149-V152 PolarHBondContact O-N 2.86Å; G149-R153 PolarHBondContact O-N 2.87Å; G149-N233 VanDerWaalsContact C-CB 3.45Å; G149-N233 VanDerWaalsContact O-CB 3.27Å; G149-N233 WeakPolarHBondContact O-CB 3.41Å
150	E	87.8	Confident	84.8	Confident	32 Å²	32	37.3 Å²	37.3	15%	0.15	20%	0.197	C	C	.	.	H	α-helix	trans	-53.6	-44.8	172	-68.9	176.1	-153.1	0	0	111.3	K118 K122 K146 V152 R153 D154	K118-E150 IonicContact NZ-OE1 3.16Å; K118-E150 PolarHBondContact NZ-OE1 2.99Å; K118-E150 IonicContact NZ-OE2 2.63Å; K122-E150 WeakPolarHBondContact CE-OE2 3.32Å; K122-E150 IonicContact NZ-OE2 2.76Å; K122-E150 PolarHBondContact NZ-OE2 3.36Å; K146-E150 WeakPolarHBondContact O-CG 3.21Å; K146-E150 PolarHBondContact O-N 2.7Å; E150-V152 VanDerWaalsContact C-N 3.32Å; E150-V152 PolarHBondContact O-N 2.88Å; E150-R153 PolarHBondContact O-N 3.07Å; E150-D154 VanDerWaalsContact O-CB 3.31Å; E150-D154 WeakPolarHBondContact O-CB 3.4Å; E150-D154 PolarHBondContact O-N 2.74Å
151	A	88.4	Confident	83.6	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-37	-178	0	0	0	0	0	113	K122 L125 W126 L147 T148 G149 Y155	K122-A151 HydrophobicContact CD-CB 4.39Å; K122-A151 HydrophobicContact CG-CB 3.86Å; L125-A151 HydrophobicContact CD1-CB 4.05Å; W126-A151 PolarHBondContact NE1-O 3.17Å; L147-A151 WeakPolarHBondContact O-CB 3.49Å; L147-A151 PolarHBondContact O-N 3.26Å; T148-A151 WeakPolarHBondContact O-CB 3.46Å; T148-A151 PolarHBondContact O-N 3.32Å; G149-A151 VanDerWaalsContact C-N 3.28Å; G149-A151 PolarHBondContact O-N 2.98Å; A151-Y155 VanDerWaalsContact O-CB 3.31Å; A151-Y155 WeakPolarHBondContact O-CB 3.31Å; A151-Y155 PolarHBondContact O-N 3.07Å; A151-Y155 VanDerWaalsContact O-N 3.1Å
152	V	87.4	Confident	82.7	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-73.9	-40.3	178.4	172.8	0	0	0	0	111.1	I135 T148 G149 E150 T156 M164 A166	I135-V152 HydrophobicContact CD1-CG2 4.01Å; T148-V152 VanDerWaalsContact O-CG2 3.28Å; T148-V152 WeakPolarHBondContact O-CG2 3.48Å; T148-V152 PolarHBondContact O-N 3.31Å; G149-V152 PolarHBondContact O-N 2.86Å; E150-V152 VanDerWaalsContact C-N 3.32Å; E150-V152 PolarHBondContact O-N 2.88Å; V152-T156 VanDerWaalsContact O-CB 3.25Å; V152-T156 WeakPolarHBondContact O-CB 3.37Å; V152-T156 PolarHBondContact O-N 2.91Å; V152-T156 PolarHBondContact O-OG1 2.93Å; V152-M164 HydrophobicContact CG2-CE 3.77Å; V152-M164 HydrophobicContact CG2-CG 4.11Å; V152-M164 HydrophobicContact CG2-SD 4.09Å; V152-A166 HydrophobicContact CG1-CB 4.38Å; V152-A166 HydrophobicContact CG2-CB 4.21Å
153	R	86.1	Confident	82.3	Confident	70 Å²	70	45 Å²	45	26%	0.264	24%	0.24	S	C	.	.	H	α-helix	trans	-64.3	-53.8	172.6	-173.6	-161.6	61.9	-127.8	-5.4	111	G149 E150 Y155 T156 D157 N233	G149-R153 PolarHBondContact O-N 2.87Å; E150-R153 PolarHBondContact O-N 3.07Å; R153-Y155 PolarHBondContact O-N 3.34Å; R153-Y155 VanDerWaalsContact O-N 3.14Å; R153-T156 CarbonylContact O-C 3.16Å; R153-T156 WeakPolarHBondContact O-CA 3.33Å; R153-T156 WeakPolarHBondContact O-CB 3.3Å; R153-T156 PolarHBondContact O-N 2.82Å; R153-D157 VanDerWaalsContact O-CG 3.26Å; R153-D157 PolarHBondContact O-N 3.42Å; R153-N233 HydrophobicContact CB-CB 4.33Å; R153-N233 PolarHBondContact NH1-OD1 2.88Å
154	D	86.7	Confident	82.5	Confident	44 Å²	44	44.6 Å²	44.6	24%	0.235	24%	0.236	C	C	.	.	H	α-helix	trans	-58.2	-32.2	-179.8	-60.6	-8.5	0	0	0	112	K122 W126 E150 A158	K122-D154 IonicContact NZ-OD2 3.65Å; K122-D154 PolarHBondContact NZ-OD2 2.82Å; W126-D154 HydrophobicContact CZ2-CB 3.8Å; E150-D154 VanDerWaalsContact O-CB 3.31Å; E150-D154 WeakPolarHBondContact O-CB 3.4Å; E150-D154 PolarHBondContact O-N 2.74Å; D154-A158 WeakPolarHBondContact O-CB 3.49Å; D154-A158 PolarHBondContact O-N 3.46Å
155	Y	85.8	Confident	82.4	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-73.8	-40.6	171.6	-174.1	-82.3	0	0	0	112.7	W126 A129 A151 R153 D157 A158 Y159 R163 M164	W126-Y155 HydrophobicContact CB-CD2 4Å; W126-Y155 HydrophobicContact CB-CE2 4.37Å; W126-Y155 AromaticContact CD1-CD2 3.65Å; W126-Y155 AromaticContact CG-CD2 3.89Å; W126-Y155 HydrophobicContact CG-CD2 3.89Å; A129-Y155 HydrophobicContact CB-CD2 4.21Å; A129-Y155 HydrophobicContact CB-CE1 4.44Å; A129-Y155 HydrophobicContact CB-CE2 3.76Å; A151-Y155 VanDerWaalsContact O-CB 3.31Å; A151-Y155 WeakPolarHBondContact O-CB 3.31Å; A151-Y155 PolarHBondContact O-N 3.07Å; A151-Y155 VanDerWaalsContact O-N 3.1Å; R153-Y155 PolarHBondContact O-N 3.34Å; R153-Y155 VanDerWaalsContact O-N 3.14Å; Y155-D157 VanDerWaalsContact C-N 3.33Å; Y155-A158 PolarHBondContact O-N 2.8Å; Y155-Y159 HydrophobicContact CD1-CD2 4.4Å; Y155-Y159 AromaticContact CD2-CD2 3.67Å; Y155-Y159 HydrophobicContact CD2-CD2 3.67Å; Y155-Y159 HydrophobicContact CD2-CE2 4.19Å; Y155-Y159 HydrophobicContact CE1-CD2 4.31Å; Y155-Y159 HydrophobicContact CE1-CG 4.45Å; Y155-Y159 AromaticContact CE2-CD2 3.61Å; Y155-Y159 HydrophobicContact CE2-CD2 3.61Å; Y155-Y159 HydrophobicContact CE2-CE2 4.16Å; Y155-Y159 HydrophobicContact CE2-CG 4.29Å; Y155-Y159 HydrophobicContact CG-CD2 4.08Å; Y155-Y159 AromaticContact CZ-CD2 3.94Å; Y155-Y159 PolarHBondContact O-N 3.12Å; Y155-R163 HydrophobicContact CE1-CB 4.01Å; Y155-R163 WeakPolarHBondContact OH-CD 3.45Å; Y155-M164 VanDerWaalsContact CB-SD 3.55Å; Y155-M164 HydrophobicContact CD1-CB 3.84Å; Y155-M164 HydrophobicContact CD1-SD 3.93Å; Y155-M164 HydrophobicContact CD2-SD 4.04Å; Y155-M164 HydrophobicContact CE1-CB 4.1Å; Y155-M164 HydrophobicContact CG-CB 4.44Å; Y155-M164 HydrophobicContact CG-SD 3.56Å; Y155-M164 VanDerWaalsContact CG-SD 3.56Å
156	T	83.6	Confident	82.5	Confident	41 Å²	41	45.3 Å²	45.3	25%	0.252	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-41.2	177.7	-68	0	0	0	0	111.3	V152 R153 A158 G160	V152-T156 VanDerWaalsContact O-CB 3.25Å; V152-T156 WeakPolarHBondContact O-CB 3.37Å; V152-T156 PolarHBondContact O-N 2.91Å; V152-T156 PolarHBondContact O-OG1 2.93Å; R153-T156 CarbonylContact O-C 3.16Å; R153-T156 WeakPolarHBondContact O-CA 3.33Å; R153-T156 WeakPolarHBondContact O-CB 3.3Å; R153-T156 PolarHBondContact O-N 2.82Å; T156-A158 VanDerWaalsContact C-N 3.32Å; T156-A158 PolarHBondContact O-N 2.97Å; T156-G160 WeakPolarHBondContact O-CA 3.18Å; T156-G160 PolarHBondContact O-N 3.15Å
157	D	83.1	Confident	82.7	Confident	112 Å²	112	41.6 Å²	41.6	60%	0.599	22%	0.223	S	C	*	.	H	α-helix	trans	-68.2	-31.1	177.3	-61	-22.2	0	0	0	112	R153 Y155	R153-D157 VanDerWaalsContact O-CG 3.26Å; R153-D157 PolarHBondContact O-N 3.42Å; Y155-D157 VanDerWaalsContact C-N 3.33Å
158	A	82	Confident	82.8	Confident	67 Å²	67	41.4 Å²	41.4	55%	0.554	22%	0.222	S	C	*	.	H	α-helix	trans	-89.3	-33.9	-179.3	0	0	0	0	0	115	D154 Y155 T156	D154-A158 WeakPolarHBondContact O-CB 3.49Å; D154-A158 PolarHBondContact O-N 3.46Å; Y155-A158 PolarHBondContact O-N 2.8Å; T156-A158 VanDerWaalsContact C-N 3.32Å; T156-A158 PolarHBondContact O-N 2.97Å
159	Y	74.8	Confident	82.8	Confident	137 Å²	137	41.4 Å²	41.4	54%	0.537	22%	0.222	S	C	.	.	H	α-helix	trans	-134.5	-6.7	-169.3	-58.6	-73.1	0	0	0	115.1	Y155	Y155-Y159 HydrophobicContact CD1-CD2 4.4Å; Y155-Y159 AromaticContact CD2-CD2 3.67Å; Y155-Y159 HydrophobicContact CD2-CD2 3.67Å; Y155-Y159 HydrophobicContact CD2-CE2 4.19Å; Y155-Y159 HydrophobicContact CE1-CD2 4.31Å; Y155-Y159 HydrophobicContact CE1-CG 4.45Å; Y155-Y159 AromaticContact CE2-CD2 3.61Å; Y155-Y159 HydrophobicContact CE2-CD2 3.61Å; Y155-Y159 HydrophobicContact CE2-CE2 4.16Å; Y155-Y159 HydrophobicContact CE2-CG 4.29Å; Y155-Y159 HydrophobicContact CG-CD2 4.08Å; Y155-Y159 AromaticContact CZ-CD2 3.94Å; Y155-Y159 PolarHBondContact O-N 3.12Å
160	G	71.4	Confident	82.8	Confident	33 Å²	33	41.4 Å²	41.4	34%	0.34	22%	0.222	S	C	.	.			trans	87.4	135.1	-179.3	0	0	0	0	0	114.8	T156 N162	T156-G160 WeakPolarHBondContact O-CA 3.18Å; T156-G160 PolarHBondContact O-N 3.15Å; G160-N162 PolarHBondContact O-N 2.76Å
161	G	61.6	Low	82.7	Confident	30 Å²	30	40.3 Å²	40.3	31%	0.309	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	18.2	-168.1	0	0	0	0	0	118
162	N	67.7	Low	82.5	Confident	147 Å²	147	40.8 Å²	40.8	79%	0.786	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	-5.7	-179.2	-80.4	-36.7	0	0	0	114.3	G160	G160-N162 PolarHBondContact O-N 2.76Å
163	R	73.8	Confident	82	Confident	115 Å²	115	43.8 Å²	43.8	43%	0.434	24%	0.235	S	C	.	.	S	Bend	trans	-110.6	-14.1	-177.7	-55.7	-179.2	-177.9	178.6	3.1	114.5	G132 C133 Y155	G132-R163 CarbonylContact C-O 3.53Å; G132-R163 VanDerWaalsContact CA-O 3.28Å; G132-R163 WeakPolarHBondContact CA-O 3.22Å; C133-R163 PolarHBondContact N-O 3.5Å; Y155-R163 HydrophobicContact CE1-CB 4.01Å; Y155-R163 WeakPolarHBondContact OH-CD 3.45Å
164	M	84.6	Confident	81.8	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	119.5	-174.6	-162.7	-179.3	-175.4	0	0	107.1	L125 A129 I135 V152 Y155	L125-M164 HydrophobicContact CB-CE 3.84Å; L125-M164 HydrophobicContact CD1-CE 4.49Å; A129-M164 HydrophobicContact CB-CB 3.97Å; A129-M164 HydrophobicContact CB-CE 4.39Å; A129-M164 HydrophobicContact CB-CG 3.78Å; A129-M164 HydrophobicContact CB-SD 3.73Å; I135-M164 HydrophobicContact CD1-CE 3.45Å; I135-M164 VanDerWaalsContact CD1-CE 3.45Å; I135-M164 HydrophobicContact CD1-CG 4.03Å; V152-M164 HydrophobicContact CG2-CE 3.77Å; V152-M164 HydrophobicContact CG2-CG 4.11Å; V152-M164 HydrophobicContact CG2-SD 4.09Å; Y155-M164 VanDerWaalsContact CB-SD 3.55Å; Y155-M164 HydrophobicContact CD1-CB 3.84Å; Y155-M164 HydrophobicContact CD1-SD 3.93Å; Y155-M164 HydrophobicContact CD2-SD 4.04Å; Y155-M164 HydrophobicContact CE1-CB 4.1Å; Y155-M164 HydrophobicContact CG-CB 4.44Å; Y155-M164 HydrophobicContact CG-SD 3.56Å; Y155-M164 VanDerWaalsContact CG-SD 3.56Å
165	M	86	Confident	81.6	Confident	35 Å²	35	39.1 Å²	39.1	17%	0.172	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.6	-179.5	-67.1	-174	-61.1	0	0	110.9	L97 C133 W134 I135 F167 N235 F236	L97-M165 HydrophobicContact CD2-CE 3.77Å; L97-M165 HydrophobicContact CD2-SD 4.12Å; C133-M165 PolarHBondContact O-N 3.09Å; W134-M165 HydrophobicContact CZ2-CE 4.08Å; I135-M165 PolarHBondContact N-O 3.42Å; M165-F167 HydrophobicContact CB-CE2 4.4Å; M165-N235 WeakPolarHBondContact CA-OD1 3.42Å; M165-F236 HydrophobicContact SD-CE2 4.11Å
166	A	89.4	Confident	81.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.8	-176.1	0	0	0	0	0	113	I135 V152 H234 N235 F236	I135-A166 CarbonylContact O-C 3Å; I135-A166 WeakPolarHBondContact O-CA 3.44Å; V152-A166 HydrophobicContact CG1-CB 4.38Å; V152-A166 HydrophobicContact CG2-CB 4.21Å; A166-H234 HydrophobicContact CB-CB 4.4Å; A166-N235 PolarHBondContact N-OD1 2.89Å; A166-N235 PolarHBondContact O-N 3.37Å; A166-N235 VanDerWaalsContact O-N 3.13Å; A166-F236 PolarHBondContact O-N 3.36Å; A166-F236 VanDerWaalsContact O-N 3.14Å
167	F	91.4	Very high	81.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	116.5	176.3	-65.7	-100.7	0	0	0	109.5	L91 W95 L97 W134 I135 V136 T137 M165 F236 F259	L91-F167 HydrophobicContact CD2-CE1 4.17Å; W95-F167 HydrophobicContact CE3-CE1 4.2Å; W95-F167 HydrophobicContact CZ3-CD1 4.22Å; W95-F167 AromaticContact CZ3-CE1 3.96Å; W95-F167 HydrophobicContact CZ3-CE1 3.96Å; L97-F167 HydrophobicContact CD1-CE1 4.03Å; L97-F167 HydrophobicContact CD1-CZ 3.86Å; W134-F167 HydrophobicContact CB-CE2 4.22Å; W134-F167 AromaticContact CD2-CE2 3.54Å; W134-F167 HydrophobicContact CD2-CE2 3.54Å; W134-F167 AromaticContact CD2-CZ 3.93Å; W134-F167 HydrophobicContact CD2-CZ 3.93Å; W134-F167 HydrophobicContact CE3-CD2 4.26Å; W134-F167 HydrophobicContact CE3-CE1 4.49Å; W134-F167 AromaticContact CE3-CE2 3.44Å; W134-F167 HydrophobicContact CE3-CE2 3.44Å; W134-F167 VanDerWaalsContact CE3-CE2 3.44Å; W134-F167 AromaticContact CE3-CZ 3.58Å; W134-F167 HydrophobicContact CE3-CZ 3.58Å; W134-F167 AromaticContact CG-CE2 3.9Å; W134-F167 HydrophobicContact CG-CE2 3.9Å; W134-F167 AromaticContact CH2-CZ 3.96Å; W134-F167 HydrophobicContact CH2-CZ 3.96Å; W134-F167 HydrophobicContact CZ2-CZ 4.27Å; W134-F167 HydrophobicContact CZ3-CE1 4.3Å; W134-F167 AromaticContact CZ3-CE2 3.99Å; W134-F167 HydrophobicContact CZ3-CE2 3.99Å; W134-F167 AromaticContact CZ3-CZ 3.61Å; W134-F167 HydrophobicContact CZ3-CZ 3.61Å; I135-F167 PolarHBondContact O-N 2.97Å; V136-F167 WeakPolarHBondContact CA-O 3.36Å; T137-F167 PolarHBondContact N-O 2.7Å; M165-F167 HydrophobicContact CB-CE2 4.4Å; F167-F236 CarbonylContact C-O 3.5Å; F167-F236 WeakPolarHBondContact CA-O 3.46Å; F167-F236 HydrophobicContact CD1-CB 3.43Å; F167-F236 VanDerWaalsContact CD1-CB 3.43Å; F167-F236 HydrophobicContact CD1-CD2 4.07Å; F167-F236 AromaticContact CD1-CG 3.93Å; F167-F236 HydrophobicContact CD1-CG 3.93Å; F167-F236 HydrophobicContact CE1-CB 3.68Å; F167-F236 HydrophobicContact CE1-CD1 4.39Å; F167-F236 AromaticContact CE1-CD2 3.6Å; F167-F236 HydrophobicContact CE1-CD2 3.6Å; F167-F236 HydrophobicContact CE1-CE2 4.4Å; F167-F236 AromaticContact CE1-CG 3.62Å; F167-F236 HydrophobicContact CE1-CG 3.62Å; F167-F236 HydrophobicContact CE2-CD2 4.13Å; F167-F236 HydrophobicContact CG-CB 4.1Å; F167-F236 AromaticContact CZ-CD2 3.62Å; F167-F236 HydrophobicContact CZ-CD2 3.62Å; F167-F236 HydrophobicContact CZ-CE2 4.12Å; F167-F236 HydrophobicContact CZ-CG 4.15Å; F167-F259 HydrophobicContact CB-CE1 4.45Å; F167-F259 AromaticContact CD1-CZ 3.94Å; F167-F259 HydrophobicContact CD1-CZ 3.94Å; F167-F259 HydrophobicContact CG-CZ 4.45Å
168	G	90.8	Very high	81.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.3	170.2	0	0	0	0	0	111.3	F236 F237 V238	G168-F236 PolarHBondContact N-O 2.77Å; G168-F237 WeakPolarHBondContact O-CA 3.23Å; G168-V238 PolarHBondContact O-N 3.44Å
169	V	89.9	Confident	81.2	Confident	1 Å²	1	43 Å²	43	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	105.3	172.7	-173.8	0	0	0	0	108.7	V136 T137 G138 V238 V240 L255 R256 F259	V136-V169 HydrophobicContact CG1-CG2 3.9Å; T137-V169 PolarHBondContact O-N 3.14Å; G138-V169 WeakPolarHBondContact CA-O 3.37Å; V169-V238 WeakPolarHBondContact CA-O 3.22Å; V169-V238 HydrophobicContact CG2-CB 4.35Å; V169-V240 HydrophobicContact CG1-CG2 4.44Å; V169-L255 HydrophobicContact CG1-CD2 4.21Å; V169-R256 HydrophobicContact CG1-CB 4.1Å; V169-F259 HydrophobicContact CG2-CD1 4.07Å; V169-F259 HydrophobicContact CG2-CE1 4.2Å
170	A	87.1	Confident	81.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	152.9	-170.8	0	0	0	0	0	112.1	F140 V238 L239 V240	F140-A170 HydrophobicContact CE1-CB 4.27Å; F140-A170 HydrophobicContact CE2-CB 3.96Å; F140-A170 HydrophobicContact CZ-CB 3.69Å; A170-V238 PolarHBondContact N-O 2.98Å; A170-L239 HydrophobicContact CB-CD2 3.93Å; A170-L239 CarbonylContact O-C 3.58Å; A170-L239 WeakPolarHBondContact O-CA 3.43Å; A170-V240 PolarHBondContact O-N 3.03Å
171	S	85.3	Confident	82.2	Confident	8 Å²	8	38.1 Å²	38.1	6%	0.056	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	130.6	167.2	-179.1	0	0	0	0	110.1	D173 C174	S171-D173 PolarHBondContact O-N 2.73Å; S171-C174 PolarHBondContact O-N 3.03Å; S171-C174 VanDerWaalsContact O-N 3.11Å
172	W	84	Confident	83.2	Confident	11 Å²	11	41.4 Å²	41.4	4%	0.042	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-59.3	-35.1	179.5	175.2	-89.8	0	0	0	112.6	K77 C174 N178 L181 E182 L239 V240 D241	K77-W172 HydrophobicContact CD-CD2 3.86Å; K77-W172 HydrophobicContact CD-CE3 3.68Å; K77-W172 HydrophobicContact CD-CH2 4.08Å; K77-W172 HydrophobicContact CD-CZ2 4.23Å; K77-W172 HydrophobicContact CD-CZ3 3.8Å; K77-W172 HydrophobicContact CG-CD2 4.43Å; K77-W172 HydrophobicContact CG-CE3 4.01Å; K77-W172 HydrophobicContact CG-CZ3 4.35Å; K77-W172 VanDerWaalsContact NZ-CE2 3.25Å; W172-C174 PolarHBondContact O-N 3.28Å; W172-N178 HydrophobicContact CZ2-CB 4.12Å; W172-N178 PolarHBondContact O-ND2 3.26Å; W172-L181 HydrophobicContact CH2-CB 3.74Å; W172-L181 HydrophobicContact CZ3-CB 3.96Å; W172-E182 HydrophobicContact CH2-CB 4.19Å; W172-E182 HydrophobicContact CZ2-CB 4.07Å; W172-L239 HydrophobicContact CE3-CB 3.93Å; W172-L239 HydrophobicContact CE3-CD1 3.73Å; W172-L239 HydrophobicContact CE3-CG 4.49Å; W172-L239 HydrophobicContact CZ3-CD1 3.78Å; W172-V240 VanDerWaalsContact CB-O 3.23Å; W172-V240 WeakPolarHBondContact CB-O 3.39Å; W172-V240 PolarHBondContact N-O 3.33Å; W172-D241 HydrophobicContact CB-CB 4.28Å
173	D	77.8	Confident	83.7	Confident	63 Å²	63	36.5 Å²	36.5	34%	0.337	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-75.5	-2.9	-179.8	-60.9	-23.9	0	0	0	113.4	S171	S171-D173 PolarHBondContact O-N 2.73Å
174	C	80.2	Confident	83.8	Confident	17 Å²	17	31.1 Å²	31.1	12%	0.115	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-112.3	4.7	-179.3	-61	0	0	0	0	113.5	F140 S171 W172 R228	F140-C174 HydrophobicContact CE1-CB 4.3Å; F140-C174 WeakPolarHBondContact CE1-O 3.46Å; F140-C174 HydrophobicContact CZ-CB 3.85Å; S171-C174 PolarHBondContact O-N 3.03Å; S171-C174 VanDerWaalsContact O-N 3.11Å; W172-C174 PolarHBondContact O-N 3.28Å; C174-R228 PolarHBondContact O-N 3.26Å
175	V	82.8	Confident	83.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-95.4	123.2	-177.9	175.4	0	0	0	0	110.3	F140 N178 L181 Y192 L230 L239	F140-V175 HydrophobicContact CE1-CG2 4.16Å; V175-N178 HydrophobicContact CB-CB 4.34Å; V175-N178 HydrophobicContact CG1-CB 4.42Å; V175-N178 WeakPolarHBondContact O-CB 2.95Å; V175-L181 HydrophobicContact CG1-CD1 3.85Å; V175-Y192 HydrophobicContact CG1-CE2 4.37Å; V175-L230 HydrophobicContact CG1-CD1 4.1Å; V175-L230 HydrophobicContact CG1-CD2 4.26Å; V175-L230 HydrophobicContact CG1-CG 3.89Å; V175-L230 HydrophobicContact CG2-CD2 3.85Å; V175-L230 HydrophobicContact CG2-CG 4.41Å; V175-L239 HydrophobicContact CG2-CD2 4.38Å
176	T	82.2	Confident	82.4	Confident	33 Å²	33	36.6 Å²	36.6	20%	0.202	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	148.2	172.7	50	0	0	0	0	111.1	N178 Y192 E227 R228 A229	T176-N178 PolarHBondContact O-N 3.06Å; T176-N178 VanDerWaalsContact O-N 3.16Å; T176-Y192 VanDerWaalsContact O-CE2 3.26Å; T176-Y192 WeakPolarHBondContact O-CE2 3.39Å; T176-Y192 PolarHBondContact O-OH 3Å; T176-Y192 PolarHBondContact OG1-OH 2.88Å; T176-Y192 VanDerWaalsContact OG1-OH 3.06Å; T176-E227 HydrophobicContact CG2-CB 3.52Å; T176-R228 PolarHBondContact N-O 2.77Å; T176-R228 VanDerWaalsContact N-O 3.12Å; T176-A229 WeakPolarHBondContact OG1-CA 3.39Å
177	K	81.9	Confident	81.4	Confident	75 Å²	75	44.3 Å²	44.3	33%	0.326	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	29.6	173.6	-58	170.9	179.4	168.8	0	112.7	E179 I180 Y192 D197	K177-E179 PolarHBondContact O-N 3.33Å; K177-E179 VanDerWaalsContact O-N 3.15Å; K177-I180 HydrophobicContact CB-CD1 3.95Å; K177-I180 HydrophobicContact CB-CG1 4.44Å; K177-I180 WeakPolarHBondContact O-CB 3.28Å; K177-I180 WeakPolarHBondContact O-CG1 3.25Å; K177-I180 PolarHBondContact O-N 2.92Å; K177-I180 VanDerWaalsContact O-N 3.08Å; K177-Y192 HydrophobicContact CB-CE2 4.3Å; K177-D197 IonicContact NZ-OD2 2.86Å; K177-D197 PolarHBondContact NZ-OD2 3.12Å
178	N	81.7	Confident	80.5	Confident	41 Å²	41	45.9 Å²	45.9	22%	0.219	24%	0.24	C	C	.	.	H	α-helix	trans	-62.8	-20.4	-173.9	68.4	4.7	0	0	0	115.2	W172 V175 T176 I180 L181 E182	W172-N178 HydrophobicContact CZ2-CB 4.12Å; W172-N178 PolarHBondContact O-ND2 3.26Å; V175-N178 HydrophobicContact CB-CB 4.34Å; V175-N178 HydrophobicContact CG1-CB 4.42Å; V175-N178 WeakPolarHBondContact O-CB 2.95Å; T176-N178 PolarHBondContact O-N 3.06Å; T176-N178 VanDerWaalsContact O-N 3.16Å; N178-I180 PolarHBondContact O-N 3.24Å; N178-L181 WeakPolarHBondContact O-CB 3.27Å; N178-L181 PolarHBondContact O-N 3.45Å; N178-E182 PolarHBondContact O-N 3.4Å
179	E	81.9	Confident	80	Confident	157 Å²	157	50.1 Å²	50.1	73%	0.734	27%	0.265	S	S	*	.	H	α-helix	trans	-53.3	-36.8	170	-58.8	-173.2	164.9	0	0	112.4	K177 L181 E182 A183	K177-E179 PolarHBondContact O-N 3.33Å; K177-E179 VanDerWaalsContact O-N 3.15Å; E179-L181 VanDerWaalsContact C-N 3.34Å; E179-E182 PolarHBondContact O-N 3.01Å; E179-A183 PolarHBondContact O-N 2.93Å
180	I	83	Confident	79.5	Confident	66 Å²	66	50.1 Å²	50.1	34%	0.338	27%	0.266	S	S	.	.	H	α-helix	trans	-66.5	-38.7	178	-54.5	179.4	0	0	0	110.7	K177 N178 E182 A183 A184 A190 V191	K177-I180 HydrophobicContact CB-CD1 3.95Å; K177-I180 HydrophobicContact CB-CG1 4.44Å; K177-I180 WeakPolarHBondContact O-CB 3.28Å; K177-I180 WeakPolarHBondContact O-CG1 3.25Å; K177-I180 PolarHBondContact O-N 2.92Å; K177-I180 VanDerWaalsContact O-N 3.08Å; N178-I180 PolarHBondContact O-N 3.24Å; I180-E182 VanDerWaalsContact C-N 3.33Å; I180-A183 PolarHBondContact O-N 3.03Å; I180-A184 PolarHBondContact O-N 2.91Å; I180-A184 VanDerWaalsContact O-N 3.15Å; I180-A190 HydrophobicContact CG2-CB 4.12Å; I180-V191 WeakPolarHBondContact CG2-O 3.43Å
181	L	82.9	Confident	79.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-70.6	-31.8	176.5	-57.1	179.9	0	0	0	111.1	I64 F75 W172 V175 N178 E179 A184 L185 A190 Y192 L230 L239	I64-L181 HydrophobicContact CD1-CD2 3.74Å; I64-L181 HydrophobicContact CG1-CD2 3.95Å; F75-L181 HydrophobicContact CE2-CB 4.17Å; F75-L181 HydrophobicContact CZ-CB 4.27Å; F75-L181 WeakPolarHBondContact CZ-O 3.08Å; W172-L181 HydrophobicContact CH2-CB 3.74Å; W172-L181 HydrophobicContact CZ3-CB 3.96Å; V175-L181 HydrophobicContact CG1-CD1 3.85Å; N178-L181 WeakPolarHBondContact O-CB 3.27Å; N178-L181 PolarHBondContact O-N 3.45Å; E179-L181 VanDerWaalsContact C-N 3.34Å; L181-A184 PolarHBondContact O-N 3.39Å; L181-L185 WeakPolarHBondContact O-CG 3.42Å; L181-L185 PolarHBondContact O-N 3.15Å; L181-A190 HydrophobicContact CD2-CB 3.82Å; L181-Y192 HydrophobicContact CD1-CE2 4.35Å; L181-Y192 HydrophobicContact CD2-CD2 3.98Å; L181-Y192 HydrophobicContact CG-CD2 4.25Å; L181-Y192 HydrophobicContact CG-CE2 4.4Å; L181-L230 HydrophobicContact CD1-CD1 4.04Å; L181-L239 HydrophobicContact CD1-CD1 3.98Å
182	E	82	Confident	79.2	Confident	100 Å²	100	53.9 Å²	53.9	47%	0.467	29%	0.288	S	S	.	.	H	α-helix	trans	-70.3	-35.5	174.3	-170.7	150.3	-129.8	0	0	112.3	K77 W172 N178 E179 I180 L185	K77-E182 IonicContact NZ-OE1 3.31Å; W172-E182 HydrophobicContact CH2-CB 4.19Å; W172-E182 HydrophobicContact CZ2-CB 4.07Å; N178-E182 PolarHBondContact O-N 3.4Å; E179-E182 PolarHBondContact O-N 3.01Å; I180-E182 VanDerWaalsContact C-N 3.33Å; E182-L185 PolarHBondContact O-N 2.83Å
183	A	78.2	Confident	78.9	Confident	43 Å²	43	56.3 Å²	56.3	36%	0.355	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-43.6	169.4	0	0	0	0	0	111.8	E179 I180 L185 H186 E187	E179-A183 PolarHBondContact O-N 2.93Å; I180-A183 PolarHBondContact O-N 3.03Å; A183-L185 VanDerWaalsContact C-N 3.29Å; A183-L185 PolarHBondContact O-N 2.89Å; A183-H186 WeakPolarHBondContact O-CA 3.41Å; A183-H186 WeakPolarHBondContact O-CB 3.48Å; A183-H186 PolarHBondContact O-N 2.95Å; A183-E187 PolarHBondContact O-N 3.49Å
184	A	76	Confident	78.6	Confident	2 Å²	2	53.8 Å²	53.8	2%	0.017	29%	0.287	C	S	.	.	H	α-helix	trans	-69.1	-19.8	179.2	0	0	0	0	0	115.1	F75 I180 L181 H186 G188 A190	F75-A184 HydrophobicContact CE1-CB 4.13Å; F75-A184 HydrophobicContact CZ-CB 4.02Å; I180-A184 PolarHBondContact O-N 2.91Å; I180-A184 VanDerWaalsContact O-N 3.15Å; L181-A184 PolarHBondContact O-N 3.39Å; A184-H186 PolarHBondContact O-N 2.72Å; A184-G188 VanDerWaalsContact O-CA 3.31Å; A184-G188 WeakPolarHBondContact O-CA 3.21Å; A184-G188 PolarHBondContact O-N 3.15Å; A184-A190 HydrophobicContact CB-CB 3.47Å; A184-A190 VanDerWaalsContact CB-CB 3.47Å; A184-A190 VanDerWaalsContact CB-N 3.31Å
185	L	73.8	Confident	77.8	Confident	18 Å²	18	58.3 Å²	58.3	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-66	-12.2	166.8	-67.2	175.4	0	0	0	113	F75 K77 L181 E182 A183	F75-L185 HydrophobicContact CD2-CD2 4.49Å; F75-L185 HydrophobicContact CE2-CD2 3.63Å; F75-L185 HydrophobicContact CE2-CG 3.95Å; F75-L185 HydrophobicContact CZ-CD2 3.96Å; F75-L185 HydrophobicContact CZ-CG 4.15Å; K77-L185 HydrophobicContact CB-CD1 4.08Å; K77-L185 HydrophobicContact CB-CD2 4.47Å; K77-L185 HydrophobicContact CD-CD1 3.77Å; L181-L185 WeakPolarHBondContact O-CG 3.42Å; L181-L185 PolarHBondContact O-N 3.15Å; E182-L185 PolarHBondContact O-N 2.83Å; A183-L185 VanDerWaalsContact C-N 3.29Å; A183-L185 PolarHBondContact O-N 2.89Å
186	H	68.5	Low	76.5	Confident	134 Å²	134	65.6 Å²	65.6	62%	0.62	34%	0.341	S	S	*	.	H	α-helix	trans	-109.5	-38.6	173.9	-73	-62.9	0	0	0	113.3	A183 A184	A183-H186 WeakPolarHBondContact O-CA 3.41Å; A183-H186 WeakPolarHBondContact O-CB 3.48Å; A183-H186 PolarHBondContact O-N 2.95Å; A184-H186 PolarHBondContact O-N 2.72Å
187	E	68.8	Low	74.5	Confident	161 Å²	161	69.2 Å²	69.2	75%	0.752	36%	0.359	S	S	*	.	H	α-helix	trans	-96.6	-17.2	-172.8	-60.7	-173.8	163.7	0	0	113.7	A183	A183-E187 PolarHBondContact O-N 3.49Å
188	G	71.7	Confident	72.6	Confident	34 Å²	34	74.5 Å²	74.5	35%	0.351	39%	0.385	S	S	.	.	S	Bend	trans	102.7	-34.7	173.2	0	0	0	0	0	114.7	E63 A184	E63-G188 PolarHBondContact N-O 2.83Å; A184-G188 VanDerWaalsContact O-CA 3.31Å; A184-G188 WeakPolarHBondContact O-CA 3.21Å; A184-G188 PolarHBondContact O-N 3.15Å
189	T	79.5	Confident	70.6	Confident	88 Å²	88	82.1 Å²	82.1	54%	0.54	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.1	-175.1	48.5	0	0	0	0	111.7	E63	E63-T189 CarbonylContact O-C 3.33Å; E63-T189 WeakPolarHBondContact O-CA 3.47Å
190	A	79.8	Confident	68.3	Low	2 Å²	2	83.6 Å²	83.6	2%	0.017	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.8	170.9	0	0	0	0	0	110.5	E63 E65 I180 L181 A184	E63-A190 PolarHBondContact O-N 3.37Å; E65-A190 PolarHBondContact N-O 2.96Å; I180-A190 HydrophobicContact CG2-CB 4.12Å; L181-A190 HydrophobicContact CD2-CB 3.82Å; A184-A190 HydrophobicContact CB-CB 3.47Å; A184-A190 VanDerWaalsContact CB-CB 3.47Å; A184-A190 VanDerWaalsContact CB-N 3.31Å
191	V	82.3	Confident	66.2	Low	87 Å²	87	89.6 Å²	89.6	53%	0.527	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	111.4	162.7	178.5	0	0	0	0	107.7	E65 T67 I180	E65-V191 WeakPolarHBondContact O-CA 3.49Å; T67-V191 HydrophobicContact CG2-CG1 3.49Å; T67-V191 VanDerWaalsContact CG2-CG1 3.49Å; I180-V191 WeakPolarHBondContact CG2-O 3.43Å
192	Y	83.5	Confident	63.9	Low	0 Å²	0	94.6 Å²	94.6	0%	0	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	129.9	-171.3	-173.1	-90.3	0	0	0	111.3	I64 E65 F66 T67 V175 T176 K177 L181 L230	I64-Y192 HydrophobicContact CG2-CG 4.26Å; E65-Y192 PolarHBondContact O-N 2.84Å; F66-Y192 WeakPolarHBondContact CA-O 3.35Å; F66-Y192 AromaticContact CD1-CD1 3.84Å; F66-Y192 HydrophobicContact CD1-CD1 3.84Å; F66-Y192 AromaticContact CE1-CD1 3.53Å; F66-Y192 HydrophobicContact CE1-CD1 3.53Å; F66-Y192 HydrophobicContact CE1-CE1 4.06Å; F66-Y192 HydrophobicContact CE1-CG 4.48Å; T67-Y192 PolarHBondContact N-O 2.88Å; V175-Y192 HydrophobicContact CG1-CE2 4.37Å; T176-Y192 VanDerWaalsContact O-CE2 3.26Å; T176-Y192 WeakPolarHBondContact O-CE2 3.39Å; T176-Y192 PolarHBondContact O-OH 3Å; T176-Y192 PolarHBondContact OG1-OH 2.88Å; T176-Y192 VanDerWaalsContact OG1-OH 3.06Å; K177-Y192 HydrophobicContact CB-CE2 4.3Å; L181-Y192 HydrophobicContact CD1-CE2 4.35Å; L181-Y192 HydrophobicContact CD2-CD2 3.98Å; L181-Y192 HydrophobicContact CG-CD2 4.25Å; L181-Y192 HydrophobicContact CG-CE2 4.4Å; Y192-L230 HydrophobicContact CE1-CB 3.99Å; Y192-L230 HydrophobicContact CE1-CG 4.41Å; Y192-L230 PolarHBondContact OH-N 2.97Å
193	Q	78.5	Confident	61.6	Low	62 Å²	62	98.2 Å²	98.2	29%	0.29	51%	0.511	S	S	.	.			trans	-99.4	115.4	176.1	-173.7	-178.9	16	0	0	109.6	T67 E195	T67-Q193 HydrophobicContact CG2-CB 4.44Å; T67-Q193 VanDerWaalsContact OG1-CA 3.31Å; T67-Q193 WeakPolarHBondContact OG1-CA 3.49Å; T67-Q193 WeakPolarHBondContact OG1-CB 3.36Å; T67-Q193 WeakPolarHBondContact OG1-CG 3.2Å; Q193-E195 VanDerWaalsContact C-N 3.34Å; Q193-E195 HydrophobicContact CG-CB 4.06Å; Q193-E195 PolarHBondContact NE2-OE2 2.73Å
194	S	71.8	Confident	59.5	Low	10 Å²	10	103.4 Å²	103.4	7%	0.07	53%	0.533	C	S	.	.			trans	-86.5	-2.6	179.5	54.4	0	0	0	0	114.2	A229 L230	S194-A229 WeakPolarHBondContact O-CB 3.43Å; S194-L230 WeakPolarHBondContact CB-O 3.41Å
195	E	63.8	Low	57.6	Low	111 Å²	111	109.4 Å²	109.4	52%	0.519	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-76.7	138	177.2	-66	160.4	155.9	0	0	110.3	Q193	Q193-E195 VanDerWaalsContact C-N 3.34Å; Q193-E195 HydrophobicContact CG-CB 4.06Å; Q193-E195 PolarHBondContact NE2-OE2 2.73Å
196	E	55.6	Low	55.6	Low	153 Å²	153	117.6 Å²	117.6	72%	0.715	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-81.2	120.9	159.2	-69.7	164.4	-176.3	0	0	105.6	E198	E196-E198 PolarHBondContact O-N 2.93Å
197	D	39	Very low	53.8	Low	110 Å²	110	116.8 Å²	116.8	59%	0.588	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-63.8	117.8	-174.9	-63.3	-79.6	0	0	0	109.9	K177 E199	K177-D197 IonicContact NZ-OD2 2.86Å; K177-D197 PolarHBondContact NZ-OD2 3.12Å; D197-E199 PolarHBondContact O-N 2.94Å; D197-E199 VanDerWaalsContact O-N 3.08Å
198	E	42.1	Very low	51.9	Low	185 Å²	185	116.9 Å²	116.9	86%	0.864	62%	0.623	S	S	*	*			trans	-70	100.2	-173.3	-67.6	-178.7	147.7	0	0	111.6	E196 E200	E196-E198 PolarHBondContact O-N 2.93Å; E198-E200 PolarHBondContact O-N 2.9Å
199	E	40.1	Very low	50.3	Low	202 Å²	202	123 Å²	123	94%	0.944	65%	0.646	S	S	*	*			trans	-74.4	48	171.7	-66.9	-165.1	150.9	0	0	112.9	D197	D197-E199 PolarHBondContact O-N 2.94Å; D197-E199 VanDerWaalsContact O-N 3.08Å
200	E	34.1	Very low	48.2	Very low	188 Å²	188	125.4 Å²	125.4	88%	0.879	66%	0.661	S	S	*	*			trans	-116.8	47.8	173.4	-74	-155.3	150.9	0	0	113.2	E198	E198-E200 PolarHBondContact O-N 2.9Å
201	E	37.1	Very low	45.9	Very low	191 Å²	191	132.5 Å²	132.5	89%	0.893	70%	0.698	S	S	*	*			trans	-143.9	71.6	167.5	-137.1	179.1	-122	0	0	113.5
202	A	35.7	Very low	43.5	Very low	105 Å²	105	134.2 Å²	134.2	87%	0.868	71%	0.712	S	S	*	*			trans	-147.3	67.6	172.7	0	0	0	0	0	111.7
203	E	33.8	Very low	41	Very low	176 Å²	176	142.3 Å²	142.3	82%	0.822	75%	0.754	S	S	*	*			trans	-66.9	157.5	-178.9	-59.9	-177.6	125.3	0	0	114.1
204	D	34.2	Very low	38.9	Very low	153 Å²	153	143.8 Å²	143.8	82%	0.818	77%	0.771	S	S	*	*			trans	50.5	89.8	155.4	-69.7	-3.6	0	0	0	120
205	S	35.8	Very low	37	Very low	127 Å²	127	152.4 Å²	152.4	89%	0.888	81%	0.81	S	S	*	*			trans	-154.6	125.1	151.8	-80.6	0	0	0	0	113.2
206	E	31.3	Very low	35.4	Very low	190 Å²	190	150.6 Å²	150.6	89%	0.888	82%	0.822	S	S	*	*			trans	-80.4	161.8	-178.1	-92.8	-162	142.7	0	0	114.6
207	P	31.2	Very low	34.2	Very low	118 Å²	118	147 Å²	147	77%	0.766	83%	0.826	S	S	*	*			trans	-96.2	125.7	-147.4	34.7	-35.9	0	0	0	116.6
208	I	28.3	Very low	33.8	Very low	162 Å²	162	149.7 Å²	149.7	83%	0.831	84%	0.838	S	S	*	*			trans	-143.7	102.8	173.4	-51.1	-179.7	0	0	0	108.7
209	L	39	Very low	33.3	Very low	162 Å²	162	149.7 Å²	149.7	85%	0.848	84%	0.835	S	S	*	*				74	93.1	68	-150	-178.1	0	0	0	114.1
210	V	34.4	Very low	33.1	Very low	140 Å²	140	145.7 Å²	145.7	85%	0.848	83%	0.83	S	S	*	*			trans	-167.3	160.4	154.7	133.7	0	0	0	0	109.9
211	D	31.7	Very low	33.1	Very low	150 Å²	150	141.9 Å²	141.9	80%	0.802	82%	0.819	S	S	*	*			trans	-66.5	144.4	-156.9	-72.2	-69.3	0	0	0	119.1	L213	D211-L213 PolarHBondContact O-N 2.99Å
212	P	32.6	Very low	33	Very low	124 Å²	124	139.7 Å²	139.7	81%	0.805	80%	0.803	S	S	*	*			trans	-95.3	76.6	-173.8	38	-36.3	0	0	0	114
213	L	32.1	Very low	33.4	Very low	169 Å²	169	139.5 Å²	139.5	89%	0.885	80%	0.795	S	S	*	*			trans	-157.1	70.3	-179.4	-123.5	176.8	0	0	0	117.1	D211	D211-L213 PolarHBondContact O-N 2.99Å
214	S	33.8	Very low	34.2	Very low	93 Å²	93	133.5 Å²	133.5	65%	0.65	77%	0.769	S	S	*	*			trans	-171.1	150.5	146.9	74.4	0	0	0	0	114.9
215	Q	32.3	Very low	35.1	Very low	191 Å²	191	129.2 Å²	129.2	89%	0.893	75%	0.745	S	S	*	*			trans	63.1	151.1	153.3	-64.5	162.7	82.3	0	0	118.7
216	G	29.7	Very low	36.4	Very low	74 Å²	74	127.5 Å²	127.5	76%	0.763	72%	0.723	S	S	*	*			trans	156.5	-64.6	168.3	0	0	0	0	0	116.6
217	G	29.6	Very low	38.2	Very low	77 Å²	77	124.2 Å²	124.2	79%	0.794	71%	0.707	S	S	*	*			trans	76.4	44.1	179	0	0	0	0	0	115.4
218	I	31	Very low	40.4	Very low	167 Å²	167	121.3 Å²	121.3	86%	0.856	68%	0.681	S	S	*	*			trans	-70.4	133.3	178.3	-58.7	175.6	0	0	0	110.5
219	K	32.6	Very low	43.1	Very low	184 Å²	184	113.8 Å²	113.8	80%	0.8	64%	0.643	S	S	*	*			trans	-76.8	137.8	179.1	-62.1	172.4	-174.7	168.8	0	110.4	V221	K219-V221 PolarHBondContact O-N 2.93Å
220	S	35.4	Very low	45.4	Very low	118 Å²	118	106.1 Å²	106.1	83%	0.825	60%	0.603	S	S	*	*			trans	-70	94.3	167	-174.8	0	0	0	0	109.5
221	V	34.4	Very low	48	Very low	109 Å²	109	99.4 Å²	99.4	66%	0.661	56%	0.563	S	S	*	*			trans	-64.3	140.7	171.4	-177.5	0	0	0	0	108.9	K219 I225	K219-V221 PolarHBondContact O-N 2.93Å; V221-I225 HydrophobicContact CG1-CD1 4.13Å
222	R	34	Very low	50.6	Low	145 Å²	145	92.7 Å²	92.7	55%	0.547	53%	0.527	S	S	.	.			trans	-85.6	138.1	171.5	-80.8	-177.8	167.2	139.8	-7.7	109.7	D224 I225	R222-D224 PolarHBondContact O-N 2.81Å; R222-D224 VanDerWaalsContact O-N 3.08Å; R222-I225 HydrophobicContact CB-CD1 4.06Å; R222-I225 HydrophobicContact CB-CG1 4.29Å; R222-I225 WeakPolarHBondContact O-CG1 3.31Å; R222-I225 PolarHBondContact O-N 2.81Å; R222-I225 VanDerWaalsContact O-N 3.09Å
223	S	45.2	Very low	53.2	Low	101 Å²	101	87.1 Å²	87.1	71%	0.706	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-11.5	176	41	0	0	0	0	114.6	I225	S223-I225 PolarHBondContact O-N 2.95Å
224	D	50.5	Low	55.9	Low	50 Å²	50	79.2 Å²	79.2	27%	0.267	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.5	173	-47.9	-62.2	0	0	0	112.4	R222 E226 K249	R222-D224 PolarHBondContact O-N 2.81Å; R222-D224 VanDerWaalsContact O-N 3.08Å; D224-E226 PolarHBondContact O-N 2.85Å; D224-K249 WeakPolarHBondContact O-CE 3.31Å; D224-K249 PolarHBondContact O-NZ 2.81Å
225	I	52.7	Low	58.4	Low	62 Å²	62	76.9 Å²	76.9	32%	0.318	43%	0.429	S	S	.	.			trans	-95.6	89.4	-170.6	-43.3	162	0	0	0	110.2	V221 R222 S223 Q247	V221-I225 HydrophobicContact CG1-CD1 4.13Å; R222-I225 HydrophobicContact CB-CD1 4.06Å; R222-I225 HydrophobicContact CB-CG1 4.29Å; R222-I225 WeakPolarHBondContact O-CG1 3.31Å; R222-I225 PolarHBondContact O-N 2.81Å; R222-I225 VanDerWaalsContact O-N 3.09Å; S223-I225 PolarHBondContact O-N 2.95Å; I225-Q247 VanDerWaalsContact CD1-CD 3.44Å; I225-Q247 HydrophobicContact CD1-CG 4.3Å; I225-Q247 VanDerWaalsContact CD1-NE2 3.34Å; I225-Q247 HydrophobicContact CG1-CB 4.28Å; I225-Q247 HydrophobicContact CG1-CG 3.93Å
226	E	61.7	Low	61.2	Low	92 Å²	92	68.6 Å²	68.6	43%	0.43	39%	0.39	S	S	.	.			trans	-118.8	113.1	161.7	-63.6	167.3	154.3	0	0	107.4	D224 R228 K249	D224-E226 PolarHBondContact O-N 2.85Å; E226-R228 HydrophobicContact CB-CG 4.35Å; E226-R228 IonicContact OE2-CZ 2.99Å; E226-R228 VanDerWaalsContact OE2-CZ 3.3Å; E226-R228 IonicContact OE2-NE 3.17Å; E226-R228 PolarHBondContact OE2-NE 2.54Å; E226-R228 IonicContact OE2-NH2 3.39Å; E226-R228 PolarHBondContact OE2-NH2 2.89Å; E226-K249 IonicContact OE2-NZ 3.64Å; E226-K249 PolarHBondContact OE2-NZ 3.26Å
227	E	69.1	Low	64.2	Low	120 Å²	120	65.1 Å²	65.1	56%	0.561	35%	0.354	S	S	*	.			trans	-68.9	137.2	159	-63.6	177.1	-149.6	0	0	107.8	T176	T176-E227 HydrophobicContact CG2-CB 3.52Å
228	R	77.3	Confident	67	Low	58 Å²	58	61.5 Å²	61.5	22%	0.219	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-130	143.5	-179.1	-65.6	176	179.4	179.9	-6.2	110.4	F140 C174 T176 E226	F140-R228 HydrophobicContact CB-CB 4.41Å; F140-R228 HydrophobicContact CD1-CB 3.55Å; F140-R228 HydrophobicContact CE1-CB 4.03Å; F140-R228 HydrophobicContact CG-CB 4.13Å; C174-R228 PolarHBondContact O-N 3.26Å; T176-R228 PolarHBondContact N-O 2.77Å; T176-R228 VanDerWaalsContact N-O 3.12Å; E226-R228 HydrophobicContact CB-CG 4.35Å; E226-R228 IonicContact OE2-CZ 2.99Å; E226-R228 VanDerWaalsContact OE2-CZ 3.3Å; E226-R228 IonicContact OE2-NE 3.17Å; E226-R228 PolarHBondContact OE2-NE 2.54Å; E226-R228 IonicContact OE2-NH2 3.39Å; E226-R228 PolarHBondContact OE2-NH2 2.89Å
229	A	85.3	Confident	69.8	Low	4 Å²	4	53.6 Å²	53.6	3%	0.033	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-68.6	145	176.9	0	0	0	0	0	112.1	F140 H141 T176 S194	F140-A229 CarbonylContact C-O 3.58Å; F140-A229 WeakPolarHBondContact CA-O 3.32Å; H141-A229 HydrophobicContact CB-CB 4.42Å; H141-A229 PolarHBondContact N-O 2.75Å; T176-A229 WeakPolarHBondContact OG1-CA 3.39Å; S194-A229 WeakPolarHBondContact O-CB 3.43Å
230	L	88.5	Confident	72.3	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-70.9	140.4	168.8	-63.5	179.5	0	0	0	110.8	I64 F66 V175 L181 Y192 S194 F237 L239	I64-L230 HydrophobicContact CD1-CD1 3.99Å; F66-L230 HydrophobicContact CE1-CB 4.29Å; F66-L230 HydrophobicContact CZ-CB 4.31Å; V175-L230 HydrophobicContact CG1-CD1 4.1Å; V175-L230 HydrophobicContact CG1-CD2 4.26Å; V175-L230 HydrophobicContact CG1-CG 3.89Å; V175-L230 HydrophobicContact CG2-CD2 3.85Å; V175-L230 HydrophobicContact CG2-CG 4.41Å; L181-L230 HydrophobicContact CD1-CD1 4.04Å; Y192-L230 HydrophobicContact CE1-CB 3.99Å; Y192-L230 HydrophobicContact CE1-CG 4.41Å; Y192-L230 PolarHBondContact OH-N 2.97Å; S194-L230 WeakPolarHBondContact CB-O 3.41Å; L230-F237 HydrophobicContact CB-CE1 3.95Å; L230-F237 HydrophobicContact CB-CZ 3.98Å; L230-F237 HydrophobicContact CD1-CD1 4.23Å; L230-F237 HydrophobicContact CD1-CE1 4.19Å; L230-F237 HydrophobicContact CD1-CG 4.49Å; L230-F237 HydrophobicContact CD1-CZ 4.42Å; L230-F237 HydrophobicContact CD2-CD1 4.02Å; L230-F237 HydrophobicContact CD2-CE1 3.84Å; L230-F237 HydrophobicContact CG-CE1 4.21Å; L230-L239 HydrophobicContact CD2-CD2 4.48Å
231	D	88.5	Confident	74.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-76.4	121.9	178.5	-179.3	80.8	0	0	0	111.8	G139 H141 N233 H234 F237	G139-D231 PolarHBondContact O-N 2.8Å; H141-D231 HydrophobicContact CB-CB 4.31Å; H141-D231 IonicContact CE1-OD1 2.79Å; H141-D231 IonicContact CG-OD1 2.84Å; H141-D231 IonicContact ND1-OD1 2.79Å; H141-D231 PolarHBondContact ND1-OD1 3.48Å; D231-N233 VanDerWaalsContact CG-ND2 3.33Å; D231-N233 PolarHBondContact O-N 3.4Å; D231-N233 VanDerWaalsContact O-N 3.1Å; D231-N233 PolarHBondContact OD1-ND2 3.38Å; D231-N233 VanDerWaalsContact OD1-ND2 3.1Å; D231-N233 VanDerWaalsContact OD2-CB 3.31Å; D231-N233 WeakPolarHBondContact OD2-CB 3.38Å; D231-N233 PolarHBondContact OD2-N 3.18Å; D231-N233 PolarHBondContact OD2-ND2 3Å; D231-H234 PolarHBondContact O-N 2.79Å; D231-H234 IonicContact OD2-CE1 3.01Å; D231-H234 PolarHBondContact OD2-CE1 2.95Å; D231-H234 IonicContact OD2-ND1 3.6Å; D231-H234 PolarHBondContact OD2-ND1 3.08Å; D231-F237 WeakPolarHBondContact O-CZ 3.47Å
232	P	86.4	Confident	76	Confident	8 Å²	8	38.2 Å²	38.2	5%	0.052	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-7.1	-171.1	31.1	-38.1	0	0	0	114.6	F66 L69	F66-P232 HydrophobicContact CB-CB 3.96Å; F66-P232 HydrophobicContact CD1-CB 3.6Å; F66-P232 HydrophobicContact CD2-CB 4.01Å; F66-P232 HydrophobicContact CE1-CB 4.01Å; F66-P232 HydrophobicContact CE2-CB 4.4Å; F66-P232 HydrophobicContact CG-CB 3.59Å; F66-P232 HydrophobicContact CZ-CB 4.4Å; L69-P232 HydrophobicContact CD1-CB 3.6Å; L69-P232 HydrophobicContact CD1-CG 3.64Å
233	N	87	Confident	77.3	Confident	7 Å²	7	34.4 Å²	34.4	4%	0.037	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	2.4	179.9	-39.4	-95.9	0	0	0	112.4	G149 R153 D231	G149-N233 VanDerWaalsContact C-CB 3.45Å; G149-N233 VanDerWaalsContact O-CB 3.27Å; G149-N233 WeakPolarHBondContact O-CB 3.41Å; R153-N233 HydrophobicContact CB-CB 4.33Å; R153-N233 PolarHBondContact NH1-OD1 2.88Å; D231-N233 VanDerWaalsContact CG-ND2 3.33Å; D231-N233 PolarHBondContact O-N 3.4Å; D231-N233 VanDerWaalsContact O-N 3.1Å; D231-N233 PolarHBondContact OD1-ND2 3.38Å; D231-N233 VanDerWaalsContact OD1-ND2 3.1Å; D231-N233 VanDerWaalsContact OD2-CB 3.31Å; D231-N233 WeakPolarHBondContact OD2-CB 3.38Å; D231-N233 PolarHBondContact OD2-N 3.18Å; D231-N233 PolarHBondContact OD2-ND2 3Å
234	H	89	Confident	78	Confident	3 Å²	3	32.4 Å²	32.4	1%	0.014	18%	0.179	C	C	.	.			trans	-92.8	131.4	-179.9	-74.8	64	0	0	0	111.9	A73 T137 A166 D231 F237	A73-H234 VanDerWaalsContact CB-O 3.29Å; A73-H234 WeakPolarHBondContact CB-O 3.39Å; T137-H234 PolarHBondContact OG1-CD2 3.27Å; T137-H234 PolarHBondContact OG1-NE2 3.04Å; A166-H234 HydrophobicContact CB-CB 4.4Å; D231-H234 PolarHBondContact O-N 2.79Å; D231-H234 IonicContact OD2-CE1 3.01Å; D231-H234 PolarHBondContact OD2-CE1 2.95Å; D231-H234 IonicContact OD2-ND1 3.6Å; D231-H234 PolarHBondContact OD2-ND1 3.08Å; H234-F237 HydrophobicContact CB-CE1 4.1Å; H234-F237 HydrophobicContact CB-CE2 4.2Å; H234-F237 HydrophobicContact CB-CZ 3.68Å
235	N	87	Confident	78.2	Confident	45 Å²	45	36.1 Å²	36.1	24%	0.241	20%	0.204	C	C	.	.	S	Bend	trans	-79.9	-29.5	-173.1	-45.3	107.8	0	0	0	113.2	A73 R74 M165 A166	A73-N235 WeakPolarHBondContact CA-O 3.36Å; R74-N235 PolarHBondContact N-O 2.84Å; M165-N235 WeakPolarHBondContact CA-OD1 3.42Å; A166-N235 PolarHBondContact N-OD1 2.89Å; A166-N235 PolarHBondContact O-N 3.37Å; A166-N235 VanDerWaalsContact O-N 3.13Å
236	F	90.5	Very high	78.1	Confident	17 Å²	17	36.3 Å²	36.3	8%	0.075	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	141.2	-174	-61.7	-79.8	0	0	0	111.7	R74 W95 L97 M165 A166 F167 G168	R74-F236 HydrophobicContact CB-CD1 3.83Å; R74-F236 HydrophobicContact CB-CE1 4.08Å; R74-F236 CarbonylContact O-C 3.47Å; R74-F236 WeakPolarHBondContact O-CA 3.39Å; W95-F236 HydrophobicContact CB-CE1 4.05Å; W95-F236 AromaticContact CD2-CD1 3.64Å; W95-F236 HydrophobicContact CD2-CD1 3.64Å; W95-F236 AromaticContact CD2-CE1 3.91Å; W95-F236 HydrophobicContact CD2-CE1 3.91Å; W95-F236 HydrophobicContact CE3-CB 4.43Å; W95-F236 AromaticContact CE3-CD1 3.42Å; W95-F236 HydrophobicContact CE3-CD1 3.42Å; W95-F236 VanDerWaalsContact CE3-CD1 3.42Å; W95-F236 AromaticContact CE3-CE1 3.94Å; W95-F236 HydrophobicContact CE3-CE1 3.94Å; W95-F236 HydrophobicContact CE3-CG 4.09Å; W95-F236 HydrophobicContact CG-CD1 4.21Å; W95-F236 AromaticContact CG-CE1 3.98Å; W95-F236 HydrophobicContact CG-CE1 3.98Å; W95-F236 HydrophobicContact CH2-CB 4.2Å; W95-F236 HydrophobicContact CH2-CD1 4.21Å; W95-F236 HydrophobicContact CZ2-CD1 4.38Å; W95-F236 HydrophobicContact CZ3-CB 3.91Å; W95-F236 AromaticContact CZ3-CD1 3.74Å; W95-F236 HydrophobicContact CZ3-CD1 3.74Å; W95-F236 HydrophobicContact CZ3-CG 4.07Å; L97-F236 HydrophobicContact CD1-CE1 4.4Å; L97-F236 HydrophobicContact CD1-CZ 4.28Å; L97-F236 HydrophobicContact CD2-CE2 4.01Å; L97-F236 HydrophobicContact CD2-CZ 3.79Å; L97-F236 HydrophobicContact CG-CZ 4.39Å; M165-F236 HydrophobicContact SD-CE2 4.11Å; A166-F236 PolarHBondContact O-N 3.36Å; A166-F236 VanDerWaalsContact O-N 3.14Å; F167-F236 CarbonylContact C-O 3.5Å; F167-F236 WeakPolarHBondContact CA-O 3.46Å; F167-F236 HydrophobicContact CD1-CB 3.43Å; F167-F236 VanDerWaalsContact CD1-CB 3.43Å; F167-F236 HydrophobicContact CD1-CD2 4.07Å; F167-F236 AromaticContact CD1-CG 3.93Å; F167-F236 HydrophobicContact CD1-CG 3.93Å; F167-F236 HydrophobicContact CE1-CB 3.68Å; F167-F236 HydrophobicContact CE1-CD1 4.39Å; F167-F236 AromaticContact CE1-CD2 3.6Å; F167-F236 HydrophobicContact CE1-CD2 3.6Å; F167-F236 HydrophobicContact CE1-CE2 4.4Å; F167-F236 AromaticContact CE1-CG 3.62Å; F167-F236 HydrophobicContact CE1-CG 3.62Å; F167-F236 HydrophobicContact CE2-CD2 4.13Å; F167-F236 HydrophobicContact CG-CB 4.1Å; F167-F236 AromaticContact CZ-CD2 3.62Å; F167-F236 HydrophobicContact CZ-CD2 3.62Å; F167-F236 HydrophobicContact CZ-CE2 4.12Å; F167-F236 HydrophobicContact CZ-CG 4.15Å; G168-F236 PolarHBondContact N-O 2.77Å
237	F	91.4	Very high	77.8	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	133.4	176.6	-68.7	-81.2	0	0	0	112.1	I64 F66 A73 R74 F75 C76 G168 L230 D231 H234 L239	I64-F237 HydrophobicContact CD1-CD2 4.04Å; I64-F237 HydrophobicContact CD1-CE2 4.41Å; F66-F237 HydrophobicContact CE2-CE2 4.06Å; F66-F237 AromaticContact CZ-CE2 3.86Å; F66-F237 HydrophobicContact CZ-CE2 3.86Å; F66-F237 HydrophobicContact CZ-CZ 4.01Å; A73-F237 HydrophobicContact CB-CD2 3.92Å; A73-F237 HydrophobicContact CB-CE2 3.69Å; R74-F237 PolarHBondContact O-N 2.85Å; F75-F237 WeakPolarHBondContact CA-O 3.27Å; F75-F237 HydrophobicContact CB-CB 3.81Å; C76-F237 PolarHBondContact N-O 3.08Å; G168-F237 WeakPolarHBondContact O-CA 3.23Å; L230-F237 HydrophobicContact CB-CE1 3.95Å; L230-F237 HydrophobicContact CB-CZ 3.98Å; L230-F237 HydrophobicContact CD1-CD1 4.23Å; L230-F237 HydrophobicContact CD1-CE1 4.19Å; L230-F237 HydrophobicContact CD1-CG 4.49Å; L230-F237 HydrophobicContact CD1-CZ 4.42Å; L230-F237 HydrophobicContact CD2-CD1 4.02Å; L230-F237 HydrophobicContact CD2-CE1 3.84Å; L230-F237 HydrophobicContact CG-CE1 4.21Å; D231-F237 WeakPolarHBondContact O-CZ 3.47Å; H234-F237 HydrophobicContact CB-CE1 4.1Å; H234-F237 HydrophobicContact CB-CE2 4.2Å; H234-F237 HydrophobicContact CB-CZ 3.68Å; F237-L239 HydrophobicContact CB-CD2 4.23Å; F237-L239 HydrophobicContact CB-CG 4.45Å
238	V	90	Very high	77.1	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	104	172.6	-177.8	0	0	0	0	107.2	L78 W95 G168 V169 A170 L255 F259	L78-V238 HydrophobicContact CD1-CG1 3.76Å; L78-V238 HydrophobicContact CG-CG1 4.41Å; W95-V238 HydrophobicContact CH2-CG2 4.14Å; G168-V238 PolarHBondContact O-N 3.44Å; V169-V238 WeakPolarHBondContact CA-O 3.22Å; V169-V238 HydrophobicContact CG2-CB 4.35Å; A170-V238 PolarHBondContact N-O 2.98Å; V238-L255 HydrophobicContact CG1-CD2 3.95Å; V238-F259 HydrophobicContact CG2-CE2 4.05Å; V238-F259 HydrophobicContact CG2-CZ 4.14Å
239	L	88.8	Confident	76.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	122.7	-174.3	-52.9	-179.1	0	0	0	109.9	F75 C76 K77 L78 A170 W172 V175 L181 L230 F237	F75-L239 HydrophobicContact CD2-CD1 3.96Å; C76-L239 PolarHBondContact O-N 3.18Å; K77-L239 WeakPolarHBondContact CA-O 3.2Å; L78-L239 PolarHBondContact N-O 3.17Å; A170-L239 HydrophobicContact CB-CD2 3.93Å; A170-L239 CarbonylContact O-C 3.58Å; A170-L239 WeakPolarHBondContact O-CA 3.43Å; W172-L239 HydrophobicContact CE3-CB 3.93Å; W172-L239 HydrophobicContact CE3-CD1 3.73Å; W172-L239 HydrophobicContact CE3-CG 4.49Å; W172-L239 HydrophobicContact CZ3-CD1 3.78Å; V175-L239 HydrophobicContact CG2-CD2 4.38Å; L181-L239 HydrophobicContact CD1-CD1 3.98Å; L230-L239 HydrophobicContact CD2-CD2 4.48Å; F237-L239 HydrophobicContact CB-CD2 4.23Å; F237-L239 HydrophobicContact CB-CG 4.45Å
240	V	86	Confident	75.5	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.018	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.4	-172	-172.6	0	0	0	0	111.1	L78 V169 A170 W172 E252 L255	L78-V240 CarbonylContact O-C 3.02Å; L78-V240 WeakPolarHBondContact O-CA 3.5Å; V169-V240 HydrophobicContact CG1-CG2 4.44Å; A170-V240 PolarHBondContact O-N 3.03Å; W172-V240 VanDerWaalsContact CB-O 3.23Å; W172-V240 WeakPolarHBondContact CB-O 3.39Å; W172-V240 PolarHBondContact N-O 3.33Å; V240-E252 HydrophobicContact CG2-CB 4.34Å; V240-L255 HydrophobicContact CG1-CB 4.46Å; V240-L255 HydrophobicContact CG1-CD1 4.22Å; V240-L255 HydrophobicContact CG2-CB 4.18Å; V240-L255 HydrophobicContact CG2-CD1 4.06Å; V240-L255 HydrophobicContact CG2-CD2 3.87Å; V240-L255 HydrophobicContact CG2-CG 4.25Å
241	D	80.6	Confident	74.7	Confident	42 Å²	42	36 Å²	36	23%	0.225	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	111.3	178.1	-179.7	-4.9	0	0	0	110.8	K77 L78 N79 W172 G243	K77-D241 WeakPolarHBondContact CE-OD2 3.3Å; K77-D241 HydrophobicContact CG-CB 4.34Å; K77-D241 IonicContact NZ-OD2 3.74Å; K77-D241 PolarHBondContact NZ-OD2 2.66Å; L78-D241 PolarHBondContact O-N 3.37Å; N79-D241 WeakPolarHBondContact CA-O 3.33Å; N79-D241 PolarHBondContact ND2-O 3.02Å; W172-D241 HydrophobicContact CB-CB 4.28Å; D241-G243 WeakPolarHBondContact OD1-CA 3.47Å; D241-G243 PolarHBondContact OD1-N 3.04Å
242	D	67	Low	74.3	Confident	43 Å²	43	36.9 Å²	36.9	23%	0.23	21%	0.213	C	C	.	.			trans	-92.3	-3.8	178.3	-74.4	-16.8	0	0	0	113.5	S80 T244 K251	S80-D242 WeakPolarHBondContact CB-OD1 3.38Å; D242-T244 PolarHBondContact O-N 3.21Å; D242-T244 VanDerWaalsContact O-N 3.08Å; D242-K251 WeakPolarHBondContact OD2-CB 3.24Å; D242-K251 WeakPolarHBondContact OD2-CD 3.44Å
243	G	61.8	Low	74.1	Confident	65 Å²	65	36.8 Å²	36.8	67%	0.67	21%	0.213	S	C	*	.	S	Bend	trans	65.4	5.6	-179.2	0	0	0	0	0	115.6	D241	D241-G243 WeakPolarHBondContact OD1-CA 3.47Å; D241-G243 PolarHBondContact OD1-N 3.04Å
244	T	59.7	Low	73.9	Confident	60 Å²	60	40 Å²	40	37%	0.368	23%	0.228	S	C	.	.			trans	-111	114	179.6	65.2	0	0	0	0	110.9	D242 D246 K251	D242-T244 PolarHBondContact O-N 3.21Å; D242-T244 VanDerWaalsContact O-N 3.08Å; T244-D246 PolarHBondContact O-N 2.77Å; T244-K251 PolarHBondContact OG1-NZ 3.24Å; T244-K251 VanDerWaalsContact OG1-NZ 3.16Å
245	T	53.1	Low	73.7	Confident	128 Å²	128	40 Å²	40	79%	0.785	23%	0.228	S	C	*	.			trans	-65.4	1.1	-175.8	-19.7	0	0	0	0	115.2	Q247	T245-Q247 PolarHBondContact O-N 2.6Å; T245-Q247 VanDerWaalsContact O-N 3.12Å
246	D	52	Low	73.8	Confident	66 Å²	66	38 Å²	38	35%	0.353	22%	0.217	S	C	.	.			trans	-83.4	75.6	174.4	-68.2	-73.4	0	0	0	111.5	R9 T244 L248 K251	R9-D246 IonicContact CZ-OD2 3.78Å; R9-D246 VanDerWaalsContact CZ-OD2 3.24Å; R9-D246 IonicContact NE-OD2 3.5Å; R9-D246 VanDerWaalsContact NH1-CG 3.33Å; R9-D246 IonicContact NH1-OD2 3.73Å; R9-D246 PolarHBondContact NH1-OD2 2.59Å; R9-D246 IonicContact NH2-OD2 2.7Å; T244-D246 PolarHBondContact O-N 2.77Å; D246-L248 PolarHBondContact O-N 2.79Å; D246-K251 PolarHBondContact O-NZ 3.39Å
247	Q	54.1	Low	73.6	Confident	87 Å²	87	37.1 Å²	37.1	41%	0.407	21%	0.213	S	C	.	.				41.3	6.6	119.8	-72.4	172.1	-7.7	0	0	122	I225 T245	I225-Q247 VanDerWaalsContact CD1-CD 3.44Å; I225-Q247 HydrophobicContact CD1-CG 4.3Å; I225-Q247 VanDerWaalsContact CD1-NE2 3.34Å; I225-Q247 HydrophobicContact CG1-CB 4.28Å; I225-Q247 HydrophobicContact CG1-CG 3.93Å; T245-Q247 PolarHBondContact O-N 2.6Å; T245-Q247 VanDerWaalsContact O-N 3.12Å
248	L	55.8	Low	73.4	Confident	88 Å²	88	39.5 Å²	39.5	46%	0.461	22%	0.222	S	C	.	.			trans	-94.6	111.7	-179.4	-69.9	164.5	0	0	0	111.4	D246 K251	D246-L248 PolarHBondContact O-N 2.79Å; L248-K251 WeakPolarHBondContact O-CE 3.38Å
249	K	62.2	Low	73.3	Confident	40 Å²	40	39.5 Å²	39.5	17%	0.174	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	149.3	164.4	-68.5	165.8	174.5	162.9	0	110.3	D224 E226 F417	D224-K249 WeakPolarHBondContact O-CE 3.31Å; D224-K249 PolarHBondContact O-NZ 2.81Å; E226-K249 IonicContact OE2-NZ 3.64Å; E226-K249 PolarHBondContact OE2-NZ 3.26Å; K249-F417 HydrophobicContact CB-CD1 4.44Å; K249-F417 HydrophobicContact CB-CE1 4.14Å; K249-F417 HydrophobicContact CB-CE2 4.48Å; K249-F417 HydrophobicContact CB-CZ 4.16Å; K249-F417 VanDerWaalsContact O-CE1 3.26Å; K249-F417 WeakPolarHBondContact O-CE1 3.34Å
250	G	66.8	Low	73.2	Confident	8 Å²	8	39.5 Å²	39.5	8%	0.082	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	98.2	-0.3	174.4	0	0	0	0	0	116.1	E252 A253	G250-E252 VanDerWaalsContact C-N 3.33Å; G250-E252 VanDerWaalsContact C-OE2 3.32Å; G250-E252 VanDerWaalsContact CA-OE1 3.24Å; G250-E252 WeakPolarHBondContact CA-OE1 3.31Å; G250-E252 VanDerWaalsContact CA-OE2 3.26Å; G250-E252 WeakPolarHBondContact CA-OE2 3.4Å; G250-E252 PolarHBondContact N-OE2 2.92Å; G250-A253 WeakPolarHBondContact O-CB 3.46Å
251	K	71.7	Confident	73.1	Confident	45 Å²	45	45.3 Å²	45.3	20%	0.196	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-30.5	176.2	-61.1	-178.8	-156.3	167.8	0	112	D242 T244 D246 L248 A253 E254	D242-K251 WeakPolarHBondContact OD2-CB 3.24Å; D242-K251 WeakPolarHBondContact OD2-CD 3.44Å; T244-K251 PolarHBondContact OG1-NZ 3.24Å; T244-K251 VanDerWaalsContact OG1-NZ 3.16Å; D246-K251 PolarHBondContact O-NZ 3.39Å; L248-K251 WeakPolarHBondContact O-CE 3.38Å; K251-A253 PolarHBondContact O-N 3.09Å; K251-A253 VanDerWaalsContact O-N 3.11Å; K251-E254 PolarHBondContact O-N 2.68Å
252	E	80.3	Confident	73.3	Confident	18 Å²	18	43.3 Å²	43.3	8%	0.084	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-19.7	179.5	72.6	-55.7	132.4	0	0	113.5	V240 G250 E254 L255 R256 Q421	V240-E252 HydrophobicContact CG2-CB 4.34Å; G250-E252 VanDerWaalsContact C-N 3.33Å; G250-E252 VanDerWaalsContact C-OE2 3.32Å; G250-E252 VanDerWaalsContact CA-OE1 3.24Å; G250-E252 WeakPolarHBondContact CA-OE1 3.31Å; G250-E252 VanDerWaalsContact CA-OE2 3.26Å; G250-E252 WeakPolarHBondContact CA-OE2 3.4Å; G250-E252 PolarHBondContact N-OE2 2.92Å; E252-E254 VanDerWaalsContact C-N 3.28Å; E252-E254 PolarHBondContact O-N 3.23Å; E252-L255 PolarHBondContact O-N 3.38Å; E252-R256 VanDerWaalsContact O-CB 3.24Å; E252-R256 WeakPolarHBondContact O-CB 3.36Å; E252-R256 PolarHBondContact O-N 3.08Å; E252-Q421 PolarHBondContact OE1-NE2 3.46Å
253	A	82.3	Confident	74.1	Confident	5 Å²	5	41.2 Å²	41.2	4%	0.041	22%	0.222	C	C	.	.	H	α-helix	trans	-53.8	-39.3	174	0	0	0	0	0	113.8	G250 K251 A257 Q421	G250-A253 WeakPolarHBondContact O-CB 3.46Å; K251-A253 PolarHBondContact O-N 3.09Å; K251-A253 VanDerWaalsContact O-N 3.11Å; A253-A257 WeakPolarHBondContact O-CB 3.35Å; A253-A257 PolarHBondContact O-N 3.14Å; A253-A257 VanDerWaalsContact O-N 3.09Å; A253-Q421 HydrophobicContact CB-CG 3.81Å
254	E	82.1	Confident	75.1	Confident	76 Å²	76	39 Å²	39	36%	0.355	20%	0.196	S	C	.	.	H	α-helix	trans	-59.9	-51.4	178	169.6	73.2	-124.8	0	0	111.1	K251 E252 R258 R428	K251-E254 PolarHBondContact O-N 2.68Å; E252-E254 VanDerWaalsContact C-N 3.28Å; E252-E254 PolarHBondContact O-N 3.23Å; E254-R258 WeakPolarHBondContact O-CG 3.09Å; E254-R258 PolarHBondContact O-N 3.34Å; E254-R428 VanDerWaalsContact CD-NH2 3.35Å; E254-R428 PolarHBondContact O-NH1 2.81Å; E254-R428 IonicContact OE1-CZ 3.27Å; E254-R428 IonicContact OE1-NH1 3.68Å; E254-R428 PolarHBondContact OE1-NH1 3.41Å; E254-R428 IonicContact OE1-NH2 3.68Å; E254-R428 PolarHBondContact OE1-NH2 2.75Å; E254-R428 IonicContact OE2-CZ 2.98Å; E254-R428 IonicContact OE2-NH1 2.79Å; E254-R428 PolarHBondContact OE2-NH1 2.64Å; E254-R428 IonicContact OE2-NH2 2.69Å; E254-R428 PolarHBondContact OE2-NH2 3.1Å
255	L	85.2	Confident	76	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-76.1	-37.3	-179.3	-174.6	146.7	0	0	0	111.6	L78 V169 V238 V240 E252 A257 R258 F259	L78-L255 HydrophobicContact CB-CD1 4.41Å; V169-L255 HydrophobicContact CG1-CD2 4.21Å; V238-L255 HydrophobicContact CG1-CD2 3.95Å; V240-L255 HydrophobicContact CG1-CB 4.46Å; V240-L255 HydrophobicContact CG1-CD1 4.22Å; V240-L255 HydrophobicContact CG2-CB 4.18Å; V240-L255 HydrophobicContact CG2-CD1 4.06Å; V240-L255 HydrophobicContact CG2-CD2 3.87Å; V240-L255 HydrophobicContact CG2-CG 4.25Å; E252-L255 PolarHBondContact O-N 3.38Å; L255-A257 PolarHBondContact O-N 3.46Å; L255-R258 CarbonylContact O-C 3.6Å; L255-R258 PolarHBondContact O-N 3.03Å; L255-R258 VanDerWaalsContact O-N 3.11Å; L255-F259 HydrophobicContact CD2-CB 4.41Å; L255-F259 WeakPolarHBondContact O-CB 3.46Å; L255-F259 PolarHBondContact O-N 2.69Å
256	R	88.5	Confident	77	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-56.5	-51.2	176.2	-176.7	179.7	-177.2	165.9	13	111	V106 V136 V169 E252 R258 F259 E260	V106-R256 PolarHBondContact O-NH2 3.13Å; V136-R256 HydrophobicContact CG1-CG 4.5Å; V136-R256 PolarHBondContact O-NH2 2.7Å; V169-R256 HydrophobicContact CG1-CB 4.1Å; E252-R256 VanDerWaalsContact O-CB 3.24Å; E252-R256 WeakPolarHBondContact O-CB 3.36Å; E252-R256 PolarHBondContact O-N 3.08Å; R256-R258 VanDerWaalsContact C-N 3.27Å; R256-R258 PolarHBondContact O-N 3.23Å; R256-F259 WeakPolarHBondContact O-CB 3.14Å; R256-F259 PolarHBondContact O-N 2.94Å; R256-E260 WeakPolarHBondContact CG-OE1 3.38Å; R256-E260 IonicContact NE-OE1 3.32Å; R256-E260 PolarHBondContact NE-OE1 3.34Å; R256-E260 WeakPolarHBondContact O-CB 3.48Å; R256-E260 VanDerWaalsContact O-CG 3.31Å; R256-E260 WeakPolarHBondContact O-CG 3.21Å; R256-E260 PolarHBondContact O-N 3.4Å
257	A	86.2	Confident	77.4	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.1	-37	176.3	0	0	0	0	0	112.1	A253 L255 R261 R428 N429	A253-A257 WeakPolarHBondContact O-CB 3.35Å; A253-A257 PolarHBondContact O-N 3.14Å; A253-A257 VanDerWaalsContact O-N 3.09Å; L255-A257 PolarHBondContact O-N 3.46Å; A257-R261 WeakPolarHBondContact O-CB 3.24Å; A257-R261 PolarHBondContact O-N 2.79Å; A257-R428 HydrophobicContact CB-CB 4.41Å; A257-N429 PolarHBondContact O-ND2 3.49Å; A257-N429 PolarHBondContact O-OD1 3.47Å
258	R	86.7	Confident	76.8	Confident	50 Å²	50	35.1 Å²	35.1	19%	0.189	18%	0.176	C	C	.	.	H	α-helix	trans	-73.5	-33.1	176.6	-71.8	177.9	56.1	-132.3	-15.9	113.5	S80 T82 D84 E254 L255 R256 C262	S80-R258 PolarHBondContact O-NH1 3.33Å; T82-R258 PolarHBondContact O-NH2 3.44Å; D84-R258 IonicContact OD1-CZ 3.89Å; D84-R258 IonicContact OD1-NE 3.43Å; D84-R258 IonicContact OD1-NH2 2.66Å; D84-R258 PolarHBondContact OD1-NH2 2.98Å; E254-R258 WeakPolarHBondContact O-CG 3.09Å; E254-R258 PolarHBondContact O-N 3.34Å; L255-R258 CarbonylContact O-C 3.6Å; L255-R258 PolarHBondContact O-N 3.03Å; L255-R258 VanDerWaalsContact O-N 3.11Å; R256-R258 VanDerWaalsContact C-N 3.27Å; R256-R258 PolarHBondContact O-N 3.23Å; R258-C262 WeakPolarHBondContact O-CB 3.26Å; R258-C262 PolarHBondContact O-N 3Å
259	F	87.8	Confident	75.7	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.009	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-47.1	173.3	175.8	-106.7	0	0	0	111	L87 L91 V136 F167 V169 V238 L255 R256 R261 C262 I263	L87-F259 HydrophobicContact CD2-CD2 4.23Å; L91-F259 HydrophobicContact CD1-CE2 4.16Å; L91-F259 HydrophobicContact CD2-CE2 4.19Å; L91-F259 HydrophobicContact CD2-CZ 4.46Å; V136-F259 HydrophobicContact CG1-CD1 4.41Å; V136-F259 HydrophobicContact CG1-CE1 4.38Å; V136-F259 HydrophobicContact CG2-CE1 4.29Å; F167-F259 HydrophobicContact CB-CE1 4.45Å; F167-F259 AromaticContact CD1-CZ 3.94Å; F167-F259 HydrophobicContact CD1-CZ 3.94Å; F167-F259 HydrophobicContact CG-CZ 4.45Å; V169-F259 HydrophobicContact CG2-CD1 4.07Å; V169-F259 HydrophobicContact CG2-CE1 4.2Å; V238-F259 HydrophobicContact CG2-CE2 4.05Å; V238-F259 HydrophobicContact CG2-CZ 4.14Å; L255-F259 HydrophobicContact CD2-CB 4.41Å; L255-F259 WeakPolarHBondContact O-CB 3.46Å; L255-F259 PolarHBondContact O-N 2.69Å; R256-F259 WeakPolarHBondContact O-CB 3.14Å; R256-F259 PolarHBondContact O-N 2.94Å; F259-R261 PolarHBondContact O-N 3.16Å; F259-C262 WeakPolarHBondContact O-CA 3.29Å; F259-C262 VanDerWaalsContact O-CB 3.28Å; F259-C262 WeakPolarHBondContact O-CB 3.5Å; F259-C262 PolarHBondContact O-N 2.97Å; F259-C262 VanDerWaalsContact O-N 3.08Å; F259-I263 HydrophobicContact CD1-CD1 3.98Å; F259-I263 HydrophobicContact CD2-CD1 4.49Å; F259-I263 HydrophobicContact CE1-CD1 3.6Å; F259-I263 HydrophobicContact CE2-CD1 4.15Å; F259-I263 HydrophobicContact CG-CD1 4.42Å; F259-I263 HydrophobicContact CZ-CD1 3.69Å; F259-I263 WeakPolarHBondContact O-CG1 3.34Å; F259-I263 PolarHBondContact O-N 3.31Å
260	E	87.2	Confident	74.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-55.5	-48.4	171.8	-75.5	168.1	-177.4	0	0	111.8	T105 R256 C262 I263 S264 M407 S425	T105-E260 WeakPolarHBondContact CG2-OE1 3.47Å; T105-E260 PolarHBondContact OG1-OE1 2.83Å; R256-E260 WeakPolarHBondContact CG-OE1 3.38Å; R256-E260 IonicContact NE-OE1 3.32Å; R256-E260 PolarHBondContact NE-OE1 3.34Å; R256-E260 WeakPolarHBondContact O-CB 3.48Å; R256-E260 VanDerWaalsContact O-CG 3.31Å; R256-E260 WeakPolarHBondContact O-CG 3.21Å; R256-E260 PolarHBondContact O-N 3.4Å; E260-C262 VanDerWaalsContact C-N 3.29Å; E260-C262 PolarHBondContact O-N 2.7Å; E260-I263 PolarHBondContact O-N 2.96Å; E260-S264 PolarHBondContact O-N 2.98Å; E260-S264 PolarHBondContact O-OG 2.86Å; E260-M407 HydrophobicContact CB-CE 3.67Å; E260-M407 HydrophobicContact CB-SD 3.93Å; E260-M407 HydrophobicContact CG-SD 4.34Å; E260-M407 WeakPolarHBondContact O-CE 3.1Å; E260-S425 PolarHBondContact OE2-OG 2.82Å
261	R	84.6	Confident	72.3	Confident	124 Å²	124	44.6 Å²	44.6	47%	0.468	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-35.7	174.3	-168.2	169.2	174.2	152	-4.3	113.2	A257 F259 I263 S264 L265 R428 N429	A257-R261 WeakPolarHBondContact O-CB 3.24Å; A257-R261 PolarHBondContact O-N 2.79Å; F259-R261 PolarHBondContact O-N 3.16Å; R261-I263 VanDerWaalsContact C-N 3.32Å; R261-S264 WeakPolarHBondContact CA-OG 3.27Å; R261-S264 PolarHBondContact O-OG 2.88Å; R261-L265 HydrophobicContact CG-CD1 4.03Å; R261-L265 WeakPolarHBondContact O-CB 3.47Å; R261-L265 WeakPolarHBondContact O-CD1 3.34Å; R261-L265 WeakPolarHBondContact O-CG 3.18Å; R261-L265 PolarHBondContact O-N 3.33Å; R261-R428 PolarHBondContact NH1-O 2.76Å; R261-N429 WeakPolarHBondContact CB-OD1 3.1Å
262	C	84.2	Confident	70.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-66.4	-33.9	177.8	177.9	0	0	0	0	112.3	L87 R88 R258 F259 E260	L87-C262 VanDerWaalsContact CB-SG 3.58Å; L87-C262 HydrophobicContact CD1-CB 4.41Å; R88-C262 WeakPolarHBondContact CG-SG 3.37Å; R258-C262 WeakPolarHBondContact O-CB 3.26Å; R258-C262 PolarHBondContact O-N 3Å; F259-C262 WeakPolarHBondContact O-CA 3.29Å; F259-C262 VanDerWaalsContact O-CB 3.28Å; F259-C262 WeakPolarHBondContact O-CB 3.5Å; F259-C262 PolarHBondContact O-N 2.97Å; F259-C262 VanDerWaalsContact O-N 3.08Å; E260-C262 VanDerWaalsContact C-N 3.29Å; E260-C262 PolarHBondContact O-N 2.7Å
263	I	84.3	Confident	68	Low	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-82.2	-41.8	177.7	-57.6	164.4	0	0	0	111.5	L91 P100 I103 W134 F259 E260 R261 L265 W266	L91-I263 HydrophobicContact CD1-CD1 4.46Å; L91-I263 HydrophobicContact CD1-CG1 3.9Å; P100-I263 HydrophobicContact CG-CG2 3.66Å; I103-I263 HydrophobicContact CD1-CB 3.95Å; I103-I263 HydrophobicContact CD1-CG2 3.58Å; I103-I263 HydrophobicContact CG1-CG2 4.13Å; W134-I263 HydrophobicContact CE3-CD1 4.14Å; W134-I263 HydrophobicContact CE3-CG2 4.18Å; W134-I263 HydrophobicContact CZ3-CD1 4.1Å; W134-I263 HydrophobicContact CZ3-CG1 4.4Å; W134-I263 HydrophobicContact CZ3-CG2 4.16Å; F259-I263 HydrophobicContact CD1-CD1 3.98Å; F259-I263 HydrophobicContact CD2-CD1 4.49Å; F259-I263 HydrophobicContact CE1-CD1 3.6Å; F259-I263 HydrophobicContact CE2-CD1 4.15Å; F259-I263 HydrophobicContact CG-CD1 4.42Å; F259-I263 HydrophobicContact CZ-CD1 3.69Å; F259-I263 WeakPolarHBondContact O-CG1 3.34Å; F259-I263 PolarHBondContact O-N 3.31Å; E260-I263 PolarHBondContact O-N 2.96Å; R261-I263 VanDerWaalsContact C-N 3.32Å; I263-L265 PolarHBondContact O-N 2.87Å; I263-W266 HydrophobicContact CG2-CE3 4.44Å; I263-W266 WeakPolarHBondContact O-CB 3.3Å; I263-W266 PolarHBondContact O-N 2.79Å
264	S	81.4	Confident	65.6	Low	18 Å²	18	59.2 Å²	59.2	13%	0.126	34%	0.338	C	S	.	.	H	α-helix	trans	-60.5	-32.4	177.4	49.9	0	0	0	0	113.4	E260 R261 W266 V405	E260-S264 PolarHBondContact O-N 2.98Å; E260-S264 PolarHBondContact O-OG 2.86Å; R261-S264 WeakPolarHBondContact CA-OG 3.27Å; R261-S264 PolarHBondContact O-OG 2.88Å; S264-W266 VanDerWaalsContact C-N 3.28Å; S264-W266 PolarHBondContact O-N 2.86Å; S264-V405 PolarHBondContact O-N 2.8Å
265	L	79.8	Confident	63.1	Low	73 Å²	73	61.9 Å²	61.9	38%	0.382	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	9.1	173.3	-67.3	168.6	0	0	0	114.2	R261 I263 N267 L404	R261-L265 HydrophobicContact CG-CD1 4.03Å; R261-L265 WeakPolarHBondContact O-CB 3.47Å; R261-L265 WeakPolarHBondContact O-CD1 3.34Å; R261-L265 WeakPolarHBondContact O-CG 3.18Å; R261-L265 PolarHBondContact O-N 3.33Å; I263-L265 PolarHBondContact O-N 2.87Å; L265-N267 VanDerWaalsContact C-N 3.32Å; L265-N267 PolarHBondContact O-N 3.45Å; L265-L404 HydrophobicContact CD2-CD2 3.72Å
266	W	73.4	Confident	60.5	Low	20 Å²	20	65.1 Å²	65.1	8%	0.076	37%	0.37	C	S	.	.			trans	-81	74.8	-176.8	-169.1	-21.7	0	0	0	112.1	L91 K92 L97 P99 W134 I263 S264	L91-W266 HydrophobicContact CB-CH2 3.67Å; L91-W266 HydrophobicContact CB-CZ3 3.54Å; L91-W266 HydrophobicContact CD1-CE3 4.34Å; L91-W266 HydrophobicContact CD1-CZ3 3.91Å; L91-W266 HydrophobicContact CG-CZ3 4.28Å; K92-W266 HydrophobicContact CB-CH2 4.42Å; K92-W266 HydrophobicContact CB-CZ2 3.88Å; K92-W266 HydrophobicContact CG-CZ2 4.19Å; L97-W266 HydrophobicContact CB-CH2 4.06Å; L97-W266 WeakPolarHBondContact O-CZ2 3.34Å; P99-W266 HydrophobicContact CB-CD2 4.26Å; P99-W266 HydrophobicContact CB-CG 4.22Å; W134-W266 HydrophobicContact CH2-CH2 4.14Å; W134-W266 AromaticContact CH2-CZ3 3.61Å; W134-W266 HydrophobicContact CH2-CZ3 3.61Å; W134-W266 HydrophobicContact CZ3-CZ3 4.08Å; I263-W266 HydrophobicContact CG2-CE3 4.44Å; I263-W266 WeakPolarHBondContact O-CB 3.3Å; I263-W266 PolarHBondContact O-N 2.79Å; S264-W266 VanDerWaalsContact C-N 3.28Å; S264-W266 PolarHBondContact O-N 2.86Å
267	N	60.3	Low	57.5	Low	67 Å²	67	69.9 Å²	69.9	36%	0.358	40%	0.399	S	S	.	.			trans	-83.7	156.4	-179.9	-143.4	-39.2	0	0	0	113.9	L265 E402 I403	L265-N267 VanDerWaalsContact C-N 3.32Å; L265-N267 PolarHBondContact O-N 3.45Å; N267-E402 WeakPolarHBondContact ND2-CA 3.49Å; N267-I403 PolarHBondContact ND2-N 2.88Å; N267-I403 VanDerWaalsContact ND2-N 3.16Å; N267-I403 PolarHBondContact ND2-O 3.34Å
268	C	43	Very low	54.6	Low	99 Å²	99	74.1 Å²	74.1	67%	0.669	43%	0.425	S	S	*	.			trans	-110.9	46	-170.4	-110.3	0	0	0	0	113.6
269	A	32.2	Very low	51.7	Low	97 Å²	97	76.3 Å²	76.3	80%	0.802	44%	0.444	S	S	*	.			trans	-69	137.9	177.9	0	0	0	0	0	113.3
270	S	28.8	Very low	48.8	Very low	121 Å²	121	81.8 Å²	81.8	85%	0.846	48%	0.478	S	S	*	.			trans	-71.2	145.4	-161.3	57.6	0	0	0	0	117.8
271	S	28.4	Very low	45.8	Very low	118 Å²	118	86.1 Å²	86.1	83%	0.825	51%	0.508	S	S	*	.			trans	-145.8	138.4	154.5	58.3	0	0	0	0	111.2
272	P	30.5	Very low	43.1	Very low	118 Å²	118	87.7 Å²	87.7	77%	0.766	52%	0.521	S	S	*	.			trans	-112.2	163.2	-174.2	40.3	-34.1	0	0	0	115.5
273	Q	30.9	Very low	40.3	Very low	114 Å²	114	95.8 Å²	95.8	53%	0.533	56%	0.559	S	S	.	*			trans	75.6	96.1	166.8	-65.9	-168	-92.4	0	0	119.6	N305 V306	Q273-N305 WeakPolarHBondContact CA-OD1 3.42Å; Q273-V306 HydrophobicContact CG-CG2 3.69Å
274	E	32.5	Very low	37.5	Very low	143 Å²	143	101.9 Å²	101.9	67%	0.668	60%	0.601	S	S	*	*			trans	174.3	142.5	143.1	-98.7	170	179.3	0	0	118.6	S304 N305	E274-S304 VanDerWaalsContact O-CB 3.28Å; E274-S304 WeakPolarHBondContact O-CB 3.45Å; E274-N305 PolarHBondContact N-ND2 3.08Å; E274-N305 PolarHBondContact N-OD1 3.36Å; E274-N305 VanDerWaalsContact N-OD1 3.15Å
275	Q	28.9	Very low	35.1	Very low	132 Å²	132	104.4 Å²	104.4	62%	0.617	63%	0.63	S	S	*	*			trans	55.8	134.5	143.4	-63.4	178.2	48.7	0	0	127.4	S303	Q275-S303 VanDerWaalsContact C-OG 3.26Å; Q275-S303 WeakPolarHBondContact O-CB 3.45Å; Q275-S303 PolarHBondContact O-OG 3.35Å; Q275-S303 VanDerWaalsContact O-OG 3.07Å
276	T	31.6	Very low	32.9	Very low	69 Å²	69	106.3 Å²	106.3	42%	0.423	65%	0.646	S	S	.	*			trans	99.5	130.7	163.1	66.5	0	0	0	0	118.4	T302 S303	T276-T302 PolarHBondContact OG1-OG1 2.98Å; T276-S303 PolarHBondContact O-OG 3.19Å
277	T	25.7	Very low	30.7	Very low	102 Å²	102	112.8 Å²	112.8	63%	0.626	68%	0.681	S	S	*	*			cis	91.5	117.9	10.9	76.9	0	0	0	0	119.3
278	T	25	Very low	29.1	Very low	89 Å²	89	114.3 Å²	114.3	55%	0.546	70%	0.697	S	S	.	*			trans	67.5	150.7	142.2	51.5	0	0	0	0	121.1	P772	T278-P772 HydrophobicContact CG2-CB 4.04Å
279	V	25.8	Very low	28.3	Very low	97 Å²	97	114.2 Å²	114.2	59%	0.588	70%	0.697	S	S	*	*			cis	-168	142.8	-33.1	102.1	0	0	0	0	110.3	P772	V279-P772 HydrophobicContact CG1-CB 4.42Å
280	T	25.4	Very low	28.1	Very low	116 Å²	116	115.3 Å²	115.3	71%	0.712	69%	0.694	S	S	*	*			trans	56.1	129.9	162.7	59.4	0	0	0	0	123.6
281	S	25.8	Very low	28	Very low	91 Å²	91	115.6 Å²	115.6	64%	0.636	69%	0.691	S	S	*	*				108.1	146.6	127.4	78	0	0	0	0	121.4
282	Q	27.5	Very low	28	Very low	157 Å²	157	118.6 Å²	118.6	73%	0.734	69%	0.692	S	S	*	*			trans	70.6	153.1	170.1	-55.6	176.7	26.2	0	0	116.8
283	Q	24.3	Very low	27.8	Very low	171 Å²	171	119.8 Å²	119.8	80%	0.799	69%	0.691	S	S	*	*			cis	-174	152.5	-49.1	-115.9	176.5	-18.1	0	0	107.6
284	S	27.2	Very low	27.7	Very low	128 Å²	128	122 Å²	122	90%	0.895	70%	0.701	S	S	*	*			trans	62.1	150.5	-176.2	65.1	0	0	0	0	116.2
285	G	29.9	Very low	27.4	Very low	70 Å²	70	119.4 Å²	119.4	72%	0.722	69%	0.689	S	S	*	*			cis	117.7	155.1	-4.2	0	0	0	0	0	113.3
286	P	34.5	Very low	27.2	Very low	113 Å²	113	116.6 Å²	116.6	73%	0.734	68%	0.682	S	S	*	*			cis	-131.2	-173.5	-3.8	43	-27.1	0	0	0	114.4
287	I	27.1	Very low	27	Very low	157 Å²	157	121.7 Å²	121.7	81%	0.805	70%	0.701	S	S	*	*			trans	69.5	161.1	160.3	-76.1	169.2	0	0	0	114.2
288	S	26.3	Very low	26.9	Very low	99 Å²	99	124.2 Å²	124.2	69%	0.692	71%	0.711	S	S	*	*			cis	-170.9	168.4	-32.8	-86.2	0	0	0	0	108.4
289	S	26.5	Very low	26.9	Very low	96 Å²	96	123.2 Å²	123.2	67%	0.671	72%	0.718	S	S	*	*			cis	-172.9	-174.2	-27.9	63.5	0	0	0	0	109.8
290	T	27.1	Very low	26.8	Very low	120 Å²	120	125 Å²	125	74%	0.736	72%	0.723	S	S	*	*			trans	65.6	111.2	168.2	35	0	0	0	0	121.5
291	T	27.9	Very low	26.7	Very low	127 Å²	127	123.9 Å²	123.9	78%	0.779	72%	0.72	S	S	*	*			trans	77.8	117.4	141.2	49	0	0	0	0	123.2
292	H	27	Very low	26.5	Very low	182 Å²	182	124.1 Å²	124.1	84%	0.843	72%	0.717	S	S	*	*			trans	78.1	140.6	156.6	-94	-104.3	0	0	0	120.7
293	L	27.6	Very low	26.4	Very low	142 Å²	142	119.3 Å²	119.3	74%	0.743	70%	0.701	S	S	*	*			trans	71	95	171.1	-63.8	168.2	0	0	0	119.7
294	Q	28	Very low	26.3	Very low	160 Å²	160	114.3 Å²	114.3	75%	0.748	69%	0.685	S	S	*	*				71	85.1	121.7	-160.3	171.2	9.5	0	0	121.4
295	Q	26.2	Very low	26.2	Very low	90 Å²	90	111.2 Å²	111.2	42%	0.421	66%	0.659	S	S	.	*			trans	63.6	149.2	135.8	-94.2	179.8	-11.5	0	0	120.7	S623	Q295-S623 PolarHBondContact NE2-OG 3.36Å
296	P	25.2	Very low	26	Very low	72 Å²	72	109.3 Å²	109.3	47%	0.468	63%	0.633	S	S	.	*				-127.5	159.4	-96.4	40.7	-29.1	0	0	0	118
297	Q	26.3	Very low	25.5	Very low	177 Å²	177	107.7 Å²	107.7	83%	0.827	62%	0.618	S	S	*	*			trans	29.4	115.8	146.7	-60.9	-176.7	-2.3	0	0	122.7
298	N	24.4	Very low	25.9	Very low	155 Å²	155	105.1 Å²	105.1	83%	0.829	61%	0.606	S	S	*	*				33.5	137.5	118.6	-54.7	-8.4	0	0	0	122
299	G	25.4	Very low	26.3	Very low	68 Å²	68	103.3 Å²	103.3	70%	0.701	59%	0.588	S	S	*	*			trans	156.5	74.3	153.5	0	0	0	0	0	120.3
300	I	24.3	Very low	26.6	Very low	135 Å²	135	100.8 Å²	100.8	69%	0.692	57%	0.569	S	S	*	*			trans	42.3	148.5	135.8	-64.5	169	0	0	0	122.4	Y753	I300-Y753 HydrophobicContact CB-CE1 4.37Å; I300-Y753 WeakPolarHBondContact CB-OH 3.45Å; I300-Y753 HydrophobicContact CG2-CE1 4.08Å; I300-Y753 WeakPolarHBondContact CG2-OH 3.23Å
301	S	21.8	Very low	26.9	Very low	92 Å²	92	95.5 Å²	95.5	64%	0.643	54%	0.536	S	S	*	.			trans	89.8	175.2	159.6	78.1	0	0	0	0	119.5
302	T	23.2	Very low	26.8	Very low	95 Å²	95	93.4 Å²	93.4	58%	0.583	52%	0.52	S	S	*	.			trans	-113.1	152.4	-148.8	43.3	0	0	0	0	114.4	T276	T276-T302 PolarHBondContact OG1-OG1 2.98Å
303	S	24	Very low	26.6	Very low	56 Å²	56	87.2 Å²	87.2	39%	0.392	51%	0.505	S	S	.	.			trans	83.7	133.6	146.8	104.5	0	0	0	0	119.6	Q275 T276	Q275-S303 VanDerWaalsContact C-OG 3.26Å; Q275-S303 WeakPolarHBondContact O-CB 3.45Å; Q275-S303 PolarHBondContact O-OG 3.35Å; Q275-S303 VanDerWaalsContact O-OG 3.07Å; T276-S303 PolarHBondContact O-OG 3.19Å
304	S	23.6	Very low	26.6	Very low	67 Å²	67	83.7 Å²	83.7	47%	0.469	50%	0.503	S	S	.	.				78.2	119.3	127.1	100.8	0	0	0	0	118.7	E274	E274-S304 VanDerWaalsContact O-CB 3.28Å; E274-S304 WeakPolarHBondContact O-CB 3.45Å
305	N	23.8	Very low	26.4	Very low	62 Å²	62	84.3 Å²	84.3	33%	0.332	51%	0.511	S	S	.	.				91.7	126.3	119.5	-65.3	10.7	0	0	0	120.6	Q273 E274	Q273-N305 WeakPolarHBondContact CA-OD1 3.42Å; E274-N305 PolarHBondContact N-ND2 3.08Å; E274-N305 PolarHBondContact N-OD1 3.36Å; E274-N305 VanDerWaalsContact N-OD1 3.15Å
306	V	25.8	Very low	26.3	Very low	30 Å²	30	87 Å²	87	18%	0.182	52%	0.523	C	S	.	.				69.1	120.1	124	174.9	0	0	0	0	116.8	Q273 T651	Q273-V306 HydrophobicContact CG-CG2 3.69Å; V306-T651 VanDerWaalsContact O-CG2 3.3Å; V306-T651 WeakPolarHBondContact O-CG2 3.27Å; V306-T651 PolarHBondContact O-OG1 3.44Å
307	N	25	Very low	26.2	Very low	79 Å²	79	94.6 Å²	94.6	42%	0.422	54%	0.543	S	S	.	.			cis	-161.9	149.7	-8.3	-115.4	-5.3	0	0	0	108.1	T651	N307-T651 PolarHBondContact N-OG1 2.8Å; N307-T651 PolarHBondContact O-OG1 2.83Å
308	N	34.7	Very low	26.2	Very low	104 Å²	104	93.9 Å²	93.9	56%	0.556	54%	0.539	S	S	*	.			trans	54.2	163.9	136.8	-54.7	-7.5	0	0	0	120.5	K653	N308-K653 WeakPolarHBondContact O-CE 3.44Å; N308-K653 PolarHBondContact O-NZ 3Å
309	N	35.1	Very low	26.3	Very low	60 Å²	60	88.8 Å²	88.8	32%	0.321	52%	0.524	S	S	.	.				153.1	138.5	104.8	-111.8	47.5	0	0	0	107	K653 E1158	N309-K653 VanDerWaalsContact N-NZ 3.19Å; N309-K653 PolarHBondContact O-NZ 2.89Å; N309-E1158 PolarHBondContact ND2-OE1 3.02Å
310	V	31.8	Very low	26.3	Very low	44 Å²	44	90 Å²	90	27%	0.267	52%	0.521	S	S	.	.			trans	78	65.8	143.7	178.7	0	0	0	0	113	Y608 E1161	V310-Y608 WeakPolarHBondContact O-CD2 3.08Å; V310-Y608 WeakPolarHBondContact O-CE2 3.1Å; V310-E1161 VanDerWaalsContact CA-CD 3.47Å; V310-E1161 WeakPolarHBondContact CA-OE1 3.42Å; V310-E1161 HydrophobicContact CB-CG 4.39Å; V310-E1161 HydrophobicContact CG2-CG 3.99Å; V310-E1161 PolarHBondContact N-OE1 3.23Å
311	N	33	Very low	26.4	Very low	8 Å²	8	89.4 Å²	89.4	4%	0.043	52%	0.524	C	S	.	.				173.8	122.5	96.1	-83.1	-4.6	0	0	0	116.5	D1160 E1161 E1162 Q1163 T1164 K1165	N311-D1160 PolarHBondContact ND2-O 3.01Å; N311-D1160 VanDerWaalsContact OD1-C 3.28Å; N311-D1160 PolarHBondContact OD1-O 3.3Å; N311-E1161 CarbonylContact C-O 3.53Å; N311-E1161 WeakPolarHBondContact CA-O 3.43Å; N311-E1161 WeakPolarHBondContact CA-OE2 3.47Å; N311-E1161 WeakPolarHBondContact CB-O 3.2Å; N311-E1161 PolarHBondContact N-OE2 3.46Å; N311-E1161 WeakPolarHBondContact OD1-CA 3.39Å; N311-E1161 PolarHBondContact OD1-N 2.96Å; N311-E1161 PolarHBondContact OD1-O 2.84Å; N311-E1161 VanDerWaalsContact OD1-O 3.07Å; N311-E1162 PolarHBondContact OD1-N 2.99Å; N311-Q1163 PolarHBondContact ND2-N 2.84Å; N311-T1164 PolarHBondContact ND2-N 3.49Å; N311-T1164 PolarHBondContact ND2-OG1 3.23Å; N311-K1165 HydrophobicContact CB-CD 4.49Å; N311-K1165 HydrophobicContact CB-CG 4.44Å; N311-K1165 WeakPolarHBondContact O-CD 3.42Å; N311-K1165 WeakPolarHBondContact O-CE 3.5Å; N311-K1165 PolarHBondContact O-NZ 2.91Å
312	L	27.8	Very low	26.7	Very low	84 Å²	84	93.4 Å²	93.4	44%	0.44	53%	0.534	S	S	.	.				129.9	121.9	120.2	-173.4	144.2	0	0	0	118.6	E1161 E1162 K1165	L312-E1161 WeakPolarHBondContact CA-O 3.4Å; L312-E1161 PolarHBondContact N-O 2.94Å; L312-E1161 PolarHBondContact N-OE2 2.89Å; L312-E1162 HydrophobicContact CB-CG 4.31Å; L312-E1162 HydrophobicContact CD1-CB 3.89Å; L312-E1162 HydrophobicContact CD1-CG 4.26Å; L312-E1162 WeakPolarHBondContact CD1-O 3.36Å; L312-E1162 HydrophobicContact CG-CB 4.23Å; L312-E1162 HydrophobicContact CG-CG 4.04Å; L312-K1165 HydrophobicContact CB-CD 3.7Å; L312-K1165 HydrophobicContact CD1-CB 4.35Å; L312-K1165 HydrophobicContact CD1-CD 4.37Å; L312-K1165 HydrophobicContact CG-CD 4.45Å
313	G	22.6	Very low	26.9	Very low	51 Å²	51	92.8 Å²	92.8	53%	0.526	55%	0.547	S	S	.	.			trans	72.5	86.9	140.5	0	0	0	0	0	120.2	E1162	G313-E1162 VanDerWaalsContact CA-OE1 3.3Å; G313-E1162 WeakPolarHBondContact CA-OE1 3.2Å; G313-E1162 PolarHBondContact N-OE1 3.41Å
314	G	26.3	Very low	27.1	Very low	69 Å²	69	93.4 Å²	93.4	71%	0.711	56%	0.562	S	S	*	*			trans	117.9	103.2	173.7	0	0	0	0	0	111.6
315	L	23.6	Very low	27.3	Very low	172 Å²	172	98.8 Å²	98.8	90%	0.901	58%	0.58	S	S	*	*			cis	62.6	55.2	26.6	-84.3	173.2	0	0	0	114.6
316	Q	24.8	Very low	27.5	Very low	147 Å²	147	97.5 Å²	97.5	69%	0.687	58%	0.578	S	S	*	*				-163.1	100.5	119.1	-105.7	171.8	-0.9	0	0	109.6	G319	Q316-G319 PolarHBondContact NE2-O 3.26Å
317	R	23.9	Very low	27.5	Very low	232 Å²	232	98.3 Å²	98.3	88%	0.875	59%	0.585	S	S	*	*	S	Bend		-83	103.9	101	-163	-177.6	-158.4	-152	7	113.7
318	Q	26.4	Very low	27.6	Very low	162 Å²	162	97.6 Å²	97.6	76%	0.757	58%	0.583	S	S	*	*	S	Bend	trans	61.1	164.9	160.3	-62.5	176.8	-12.7	0	0	117.4
319	G	26.3	Very low	27.2	Very low	48 Å²	48	97.7 Å²	97.7	50%	0.495	59%	0.588	S	S	.	*			trans	76.5	91.7	-164	0	0	0	0	0	110.9	Q316	Q316-G319 PolarHBondContact NE2-O 3.26Å
320	S	24.6	Very low	27	Very low	92 Å²	92	98.9 Å²	98.9	64%	0.643	60%	0.601	S	S	*	*			cis	71.5	136.7	33	110.2	0	0	0	0	113.6
321	T	26.4	Very low	26.8	Very low	123 Å²	123	98.4 Å²	98.4	76%	0.755	61%	0.605	S	S	*	*			trans	65.6	149.1	-179.9	65.8	0	0	0	0	117.6
322	M	27.3	Very low	26.7	Very low	176 Å²	176	101.6 Å²	101.6	87%	0.867	63%	0.626	S	S	*	*			cis	-162.3	136.1	-44.5	-128.8	-160.6	-62.5	0	0	109.8
323	G	28.1	Very low	26.7	Very low	82 Å²	82	105.1 Å²	105.1	85%	0.845	64%	0.64	S	S	*	*			trans	74.1	156.5	171.2	0	0	0	0	0	116.1
324	G	29.2	Very low	27	Very low	69 Å²	69	108.4 Å²	108.4	71%	0.711	65%	0.65	S	S	*	*			cis	169.5	152	-12.2	0	0	0	0	0	115.1
325	Q	27.8	Very low	27	Very low	181 Å²	181	110.3 Å²	110.3	85%	0.846	65%	0.653	S	S	*	*			trans	68.2	144.6	157.2	-64.1	-172.7	8.4	0	0	118.3	L388	Q325-L388 CarbonylContact C-O 3.47Å
326	A	26.4	Very low	27.2	Very low	34 Å²	34	105.8 Å²	105.8	28%	0.281	64%	0.64	S	S	.	*			cis	-154.6	-91.6	-6.9	0	0	0	0	0	116.4	L388 K389 P390	A326-L388 CarbonylContact C-O 3.47Å; A326-L388 WeakPolarHBondContact CA-O 3.48Å; A326-L388 PolarHBondContact N-O 3.29Å; A326-K389 CarbonylContact O-C 3.46Å; A326-K389 WeakPolarHBondContact O-CA 3.37Å; A326-P390 WeakPolarHBondContact O-CD 3.05Å
327	S	26.1	Very low	27.3	Very low	48 Å²	48	105 Å²	105	34%	0.336	65%	0.646	S	S	.	*			trans	-150.1	166.4	-163.1	62.8	0	0	0	0	116.7	S387 L388 K389	S327-S387 CarbonylContact O-C 3.6Å; S327-S387 VanDerWaalsContact O-C 3.22Å; S327-S387 VanDerWaalsContact O-CA 3.22Å; S327-S387 WeakPolarHBondContact O-CA 3.25Å; S327-S387 WeakPolarHBondContact O-CB 3.45Å; S327-S387 PolarHBondContact O-OG 3.49Å; S327-S387 PolarHBondContact OG-OG 2.84Å; S327-L388 VanDerWaalsContact N-CA 3.27Å; S327-L388 PolarHBondContact N-O 3.05Å; S327-L388 WeakPolarHBondContact O-CA 3.44Å; S327-L388 PolarHBondContact O-N 3.43Å; S327-K389 VanDerWaalsContact CA-N 3.3Å; S327-K389 VanDerWaalsContact N-N 3.19Å
328	T	26.7	Very low	27.6	Very low	63 Å²	63	98.1 Å²	98.1	39%	0.387	63%	0.633	S	S	.	*			trans	81.1	157	172.8	82.6	0	0	0	0	118.2	K389	T328-K389 WeakPolarHBondContact O-CD 3.3Å; T328-K389 WeakPolarHBondContact O-CE 3.38Å; T328-K389 WeakPolarHBondContact O-CG 3.5Å
329	T	27.2	Very low	27.7	Very low	107 Å²	107	98 Å²	98	66%	0.656	64%	0.636	S	S	*	*			cis	-139.4	178.3	-11.6	0	0	0	0	0	107.6	K389	T329-K389 VanDerWaalsContact O-CE 3.27Å; T329-K389 WeakPolarHBondContact O-CE 3.3Å; T329-K389 PolarHBondContact O-NZ 3.29Å
330	S	29.7	Very low	27.9	Very low	85 Å²	85	98.8 Å²	98.8	59%	0.594	64%	0.644	S	S	*	*			cis	-140.1	-163.5	-1.7	65	0	0	0	0	107.2	S997	S330-S997 WeakPolarHBondContact OG-CB 3.3Å
331	G	28.4	Very low	28	Very low	34 Å²	34	101.6 Å²	101.6	35%	0.351	64%	0.644	S	S	.	*			cis	105.2	137.1	-1.1	0	0	0	0	0	114.2	S997	G331-S997 WeakPolarHBondContact O-CB 3.18Å; G331-S997 PolarHBondContact O-OG 3.37Å
332	P	31.9	Very low	28.1	Very low	74 Å²	74	101.7 Å²	101.7	48%	0.481	65%	0.645	S	S	.	*			cis	-129.1	135.5	6.9	38.8	-21.6	0	0	0	118.5	S997	P332-S997 WeakPolarHBondContact CD-O 3.49Å
333	Q	26.8	Very low	28.1	Very low	158 Å²	158	98.5 Å²	98.5	74%	0.738	64%	0.64	S	S	*	*			trans	80	155.3	132.5	-66.2	172.3	-7.2	0	0	123.9
334	T	28.3	Very low	28	Very low	121 Å²	121	98.6 Å²	98.6	74%	0.742	63%	0.633	S	S	*	*			trans	60.9	105.6	151.9	41.8	0	0	0	0	119
335	S	26.7	Very low	27.8	Very low	108 Å²	108	103 Å²	103	76%	0.755	64%	0.638	S	S	*	*				85	142.2	70.2	69.8	0	0	0	0	113.5
336	A	28	Very low	27.8	Very low	78 Å²	78	100 Å²	100	65%	0.645	63%	0.633	S	S	*	*			cis	-170.1	179.5	-12.3	0	0	0	0	0	108.3
337	T	27.9	Very low	27.8	Very low	131 Å²	131	101.3 Å²	101.3	80%	0.804	65%	0.649	S	S	*	*			trans	63.6	153.5	160.5	41.6	0	0	0	0	117.4
338	S	29.2	Very low	28.1	Very low	86 Å²	86	100.4 Å²	100.4	60%	0.601	65%	0.648	S	S	*	*			cis	-173.6	159.4	-11.9	47.4	0	0	0	0	109.6
339	I	28.4	Very low	28.4	Very low	161 Å²	161	101.3 Å²	101.3	83%	0.826	66%	0.656	S	S	*	*			trans	61.8	118.6	156.7	-61	151.9	0	0	0	115.2
340	G	29.9	Very low	28.4	Very low	64 Å²	64	99.5 Å²	99.5	66%	0.66	65%	0.649	S	S	*	*			cis	103.5	138.6	7.6	0	0	0	0	0	113
341	K	28.5	Very low	28.7	Very low	150 Å²	150	97.5 Å²	97.5	65%	0.652	64%	0.635	S	S	*	*			trans	-175.5	154.1	162.3	-108.2	164.8	-174.2	173.1	0	109.5	T1021	K341-T1021 PolarHBondContact NZ-O 2.94Å
342	T	27.1	Very low	29.1	Very low	126 Å²	126	98 Å²	98	77%	0.773	63%	0.629	S	S	*	*			trans	35.6	127.6	152.9	56.5	0	0	0	0	119.2
343	S	28.3	Very low	29.3	Very low	109 Å²	109	95.2 Å²	95.2	76%	0.762	61%	0.611	S	S	*	*			cis	-167.6	127.8	6.6	33.5	0	0	0	0	106.6
344	A	24.7	Very low	29.7	Very low	84 Å²	84	88.2 Å²	88.2	69%	0.694	58%	0.581	S	S	*	*				99.4	149.8	63.6	0	0	0	0	0	110.7
345	I	26	Very low	29.9	Very low	160 Å²	160	85.9 Å²	85.9	82%	0.821	56%	0.563	S	S	*	*			trans	69.4	135.7	165.6	-62.5	162	0	0	0	115.7
346	T	27.3	Very low	30.1	Very low	119 Å²	119	83.7 Å²	83.7	73%	0.73	55%	0.548	S	S	*	.			cis	-176.6	144.2	-49.8	25.8	0	0	0	0	108.7
347	G	27.5	Very low	30.2	Very low	61 Å²	61	85.3 Å²	85.3	63%	0.629	54%	0.541	S	S	*	.			trans	82.9	147.1	179.8	0	0	0	0	0	113
348	G	31.3	Very low	30.3	Very low	29 Å²	29	80.7 Å²	80.7	30%	0.299	52%	0.519	S	S	.	.			cis	112	144.9	12.8	0	0	0	0	0	110.9	E1888	G348-E1888 VanDerWaalsContact O-O 3.08Å
349	S	34.3	Very low	30.3	Very low	82 Å²	82	76.9 Å²	76.9	57%	0.573	49%	0.492	S	S	*	.			cis	178	144.8	6	41.7	0	0	0	0	113.2	A1887	S349-A1887 CarbonylContact C-O 3.56Å; S349-A1887 PolarHBondContact N-O 3.5Å; S349-A1887 WeakPolarHBondContact O-CB 3.48Å
350	S	26.2	Very low	30.6	Very low	70 Å²	70	72 Å²	72	49%	0.49	47%	0.472	S	S	.	.			trans	60.9	143.1	174.4	51.3	0	0	0	0	114.4	T1886 A1887	S350-T1886 CarbonylContact C-O 3.39Å; S350-T1886 CarbonylContact O-C 3.6Å; S350-T1886 VanDerWaalsContact O-C 3.27Å; S350-A1887 CarbonylContact O-C 3.58Å; S350-A1887 WeakPolarHBondContact O-CA 3.33Å; S350-A1887 VanDerWaalsContact O-CB 3.26Å; S350-A1887 WeakPolarHBondContact O-CB 3.46Å
351	S	36.4	Very low	30.7	Very low	43 Å²	43	70 Å²	70	30%	0.301	45%	0.445	S	S	.	.			cis	-153	-150.4	24.9	-25.3	0	0	0	0	108.2	G1885 T1886	S351-G1885 WeakPolarHBondContact O-CA 3.08Å; S351-T1886 PolarHBondContact N-O 2.82Å; S351-T1886 PolarHBondContact OG-OG1 2.86Å
352	N	37	Very low	30.9	Very low	44 Å²	44	65 Å²	65	24%	0.235	43%	0.429	C	S	.	.				-140.8	153.7	-67.2	-105.9	15.1	0	0	0	107.5	S539 S1884	N352-S539 PolarHBondContact O-OG 2.83Å; N352-S1884 VanDerWaalsContact C-OG 3.25Å; N352-S1884 WeakPolarHBondContact CA-OG 3.22Å; N352-S1884 WeakPolarHBondContact CB-OG 3.29Å; N352-S1884 PolarHBondContact N-O 2.83Å; N352-S1884 VanDerWaalsContact N-O 3.08Å; N352-S1884 VanDerWaalsContact O-O 3.08Å; N352-S1884 PolarHBondContact O-OG 3.17Å; N352-S1884 VanDerWaalsContact O-OG 3.13Å
353	S	34.9	Very low	31.4	Very low	15 Å²	15	61.7 Å²	61.7	11%	0.105	41%	0.408	C	S	.	.				67.5	130.1	68.5	119.4	0	0	0	0	112.8	D1883 S1884	S353-D1883 VanDerWaalsContact O-OD2 3.11Å; S353-S1884 PolarHBondContact O-OG 3.17Å
354	A	36.6	Very low	31.6	Very low	12 Å²	12	57.2 Å²	57.2	10%	0.099	38%	0.376	C	S	.	.			cis	-165.7	138.1	12.2	0	0	0	0	0	114.7	D1883 S2257	A354-D1883 PolarHBondContact N-OD2 2.67Å; A354-D1883 VanDerWaalsContact N-OD2 3.15Å; A354-S2257 WeakPolarHBondContact CB-OG 3.34Å; A354-S2257 WeakPolarHBondContact O-CB 3.47Å; A354-S2257 PolarHBondContact O-OG 3.27Å
355	L	31.6	Very low	31.8	Very low	71 Å²	71	56.1 Å²	56.1	37%	0.372	36%	0.363	S	S	.	.				65.9	89	102.6	-163.8	73.1	0	0	0	117.6	S2257	L355-S2257 PolarHBondContact O-OG 3.14Å
356	S	31.8	Very low	31.9	Very low	63 Å²	63	51.8 Å²	51.8	44%	0.441	34%	0.342	S	S	.	.				42.7	156.2	120.1	91.5	0	0	0	0	123.1
357	K	29.4	Very low	31.9	Very low	112 Å²	112	54.2 Å²	54.2	49%	0.487	35%	0.345	S	S	.	.			trans	68.9	79	153.4	-69.9	165.2	176.7	167.3	0	115.8	V397	K357-V397 PolarHBondContact NZ-O 2.98Å
358	G	30.6	Very low	31.8	Very low	34 Å²	34	56.3 Å²	56.3	35%	0.351	35%	0.348	S	S	.	.			trans	-57.5	156.2	143.3	0	0	0	0	0	111.1	K2142	G358-K2142 VanDerWaalsContact CA-O 3.29Å; G358-K2142 WeakPolarHBondContact CA-O 3.38Å
359	V	27.9	Very low	31.5	Very low	6 Å²	6	60.9 Å²	60.9	4%	0.036	37%	0.369	C	S	.	.			trans	-143	123.4	-172.7	121.3	0	0	0	0	109.2	E2139 K2142 R2143 L2144 K2250	V359-E2139 VanDerWaalsContact C-CG 3.48Å; V359-E2139 HydrophobicContact CB-CG 4.19Å; V359-E2139 HydrophobicContact CG1-CB 3.51Å; V359-E2139 VanDerWaalsContact CG1-CD 3.42Å; V359-E2139 HydrophobicContact CG1-CG 3.41Å; V359-E2139 VanDerWaalsContact CG1-CG 3.41Å; V359-E2139 WeakPolarHBondContact CG1-OE2 3.45Å; V359-K2142 VanDerWaalsContact C-CA 3.41Å; V359-K2142 PolarHBondContact N-O 2.95Å; V359-K2142 CarbonylContact O-C 3.59Å; V359-K2142 WeakPolarHBondContact O-CA 3.47Å; V359-K2142 PolarHBondContact O-N 2.96Å; V359-R2143 PolarHBondContact O-N 2.95Å; V359-R2143 VanDerWaalsContact O-N 3.09Å; V359-L2144 HydrophobicContact CB-CD2 3.74Å; V359-L2144 HydrophobicContact CG1-CD2 3.17Å; V359-K2250 HydrophobicContact CG1-CD 4.5Å; V359-K2250 HydrophobicContact CG2-CD 3.86Å
360	S	35.3	Very low	31	Very low	58 Å²	58	61.6 Å²	61.6	41%	0.406	37%	0.374	S	S	.	.			trans	-54.7	-171.9	-155.8	-27.9	0	0	0	0	119	E2139 R2140 N2141	S360-E2139 WeakPolarHBondContact CB-OE1 3.42Å; S360-E2139 VanDerWaalsContact N-CG 3.26Å; S360-E2139 PolarHBondContact N-OE1 3.03Å; S360-E2139 CarbonylContact O-C 3.53Å; S360-E2139 WeakPolarHBondContact O-CG 3.36Å; S360-E2139 PolarHBondContact OG-OE1 2.72Å; S360-R2140 CarbonylContact O-C 3.57Å; S360-R2140 WeakPolarHBondContact O-CA 3.38Å; S360-R2140 PolarHBondContact O-N 2.77Å; S360-N2141 PolarHBondContact O-N 2.74Å
361	E	32.8	Very low	30.8	Very low	21 Å²	21	64.3 Å²	64.3	10%	0.098	39%	0.388	C	S	.	.			trans	91.5	82.1	162.7	-62.4	-173.2	129.1	0	0	121.4	E2139 R2140 N2141 E2246 E2247 Q2248	E361-E2139 HydrophobicContact CG-CG 4.31Å; E361-R2140 HydrophobicContact CB-CG 4.48Å; E361-R2140 CarbonylContact O-C 3.54Å; E361-R2140 WeakPolarHBondContact O-CA 3.25Å; E361-R2140 VanDerWaalsContact O-CB 3.24Å; E361-R2140 WeakPolarHBondContact O-CB 3.41Å; E361-R2140 WeakPolarHBondContact O-CD 3.28Å; E361-R2140 WeakPolarHBondContact O-CG 3.32Å; E361-R2140 PolarHBondContact O-NE 3.09Å; E361-R2140 VanDerWaalsContact O-NE 3.09Å; E361-N2141 PolarHBondContact O-N 2.84Å; E361-E2246 HydrophobicContact CB-CB 3.76Å; E361-E2246 VanDerWaalsContact CD-C 3.44Å; E361-E2246 HydrophobicContact CG-CB 3.77Å; E361-E2246 HydrophobicContact CG-CG 4.5Å; E361-E2246 VanDerWaalsContact OE1-CA 3.3Å; E361-E2246 WeakPolarHBondContact OE1-CA 3.33Å; E361-E2247 PolarHBondContact OE1-N 3.34Å; E361-E2247 VanDerWaalsContact OE2-C 3.3Å; E361-E2247 VanDerWaalsContact OE2-CA 3.27Å; E361-E2247 WeakPolarHBondContact OE2-CA 3.28Å; E361-E2247 PolarHBondContact OE2-N 3.44Å; E361-Q2248 PolarHBondContact OE1-NE2 3.39Å; E361-Q2248 VanDerWaalsContact OE2-CB 3.27Å; E361-Q2248 WeakPolarHBondContact OE2-CB 3.29Å; E361-Q2248 VanDerWaalsContact OE2-CG 3.28Å; E361-Q2248 WeakPolarHBondContact OE2-CG 3.45Å; E361-Q2248 PolarHBondContact OE2-N 2.96Å; E361-Q2248 PolarHBondContact OE2-NE2 3.28Å
362	P	32.7	Very low	30.2	Very low	47 Å²	47	67.3 Å²	67.3	31%	0.305	42%	0.416	S	S	.	.			trans	-76.3	-138.4	155	33.8	-29.1	0	0	0	109.3	R2140 N2141 E2246	P362-R2140 PolarHBondContact O-NE 3.1Å; P362-R2140 PolarHBondContact O-NH2 3.07Å; P362-N2141 HydrophobicContact CB-CB 3.95Å; P362-N2141 WeakPolarHBondContact CD-OD1 3.31Å; P362-N2141 HydrophobicContact CG-CB 4.44Å; P362-N2141 WeakPolarHBondContact CG-OD1 3.21Å; P362-E2246 WeakPolarHBondContact O-CB 3.29Å
363	V	37.7	Very low	29.5	Very low	55 Å²	55	70.7 Å²	70.7	33%	0.333	44%	0.443	S	S	.	.			trans	49.3	83.3	150.4	179.6	0	0	0	0	116.4	S365 I1967 E2246	V363-S365 PolarHBondContact O-N 2.91Å; V363-I1967 HydrophobicContact CB-CG2 4.46Å; V363-I1967 HydrophobicContact CG1-CG2 4.08Å; V363-I1967 HydrophobicContact CG2-CG2 4.04Å; V363-E2246 WeakPolarHBondContact CG1-OE1 3.23Å; V363-E2246 WeakPolarHBondContact O-CB 3.48Å; V363-E2246 VanDerWaalsContact O-CD 3.23Å; V363-E2246 WeakPolarHBondContact O-CG 3.38Å
364	V	30.7	Very low	29.1	Very low	16 Å²	16	75.9 Å²	75.9	10%	0.097	47%	0.473	C	S	.	.			trans	-49.1	128.6	137.5	169.6	0	0	0	0	110	I1967 R1971 T2245	V364-I1967 WeakPolarHBondContact O-CG2 3.25Å; V364-R1971 VanDerWaalsContact CG1-NH1 3.34Å; V364-T2245 HydrophobicContact CG2-CG2 4.46Å
365	S	29.8	Very low	28.7	Very low	61 Å²	61	80.4 Å²	80.4	43%	0.427	50%	0.5	S	S	.	.			trans	-149.6	102.3	153.8	58.5	0	0	0	0	114.4	V363	V363-S365 PolarHBondContact O-N 2.91Å
366	N	27.8	Very low	28.7	Very low	69 Å²	69	88.2 Å²	88.2	37%	0.369	53%	0.525	S	S	.	.				16.9	104.3	129.5	-55.1	-3.7	0	0	0	117.4	V1964 R1971	N366-V1964 PolarHBondContact ND2-O 3.13Å; N366-R1971 PolarHBondContact OD1-NH1 2.85Å; N366-R1971 VanDerWaalsContact OD1-NH1 3.12Å; N366-R1971 PolarHBondContact OD1-NH2 2.7Å
367	Q	27	Very low	28.6	Very low	169 Å²	169	88.2 Å²	88.2	79%	0.79	54%	0.535	S	S	*	.				-178.9	137.7	105.2	-97.4	175.1	12.8	0	0	113.2
368	P	26.1	Very low	28.7	Very low	106 Å²	106	88.9 Å²	88.9	69%	0.688	55%	0.548	S	S	*	.			trans	-82.5	-165.1	161.3	35.5	-31.8	0	0	0	110.8
369	V	24.4	Very low	28.6	Very low	124 Å²	124	95.8 Å²	95.8	75%	0.752	57%	0.569	S	S	*	*			trans	87.9	82.8	172.9	-168.6	0	0	0	0	116.2
370	S	23.3	Very low	28.5	Very low	97 Å²	97	102.8 Å²	102.8	68%	0.678	61%	0.606	S	S	*	*				76.1	159.9	121.9	-56.5	0	0	0	0	122.3
371	T	23.3	Very low	27.9	Very low	127 Å²	127	109.1 Å²	109.1	78%	0.779	63%	0.626	S	S	*	*			trans	53.8	84	154.9	43.2	0	0	0	0	116.1
372	A	23	Very low	27.8	Very low	107 Å²	107	115.2 Å²	115.2	88%	0.884	66%	0.658	S	S	*	*				56.1	72.2	65.9	0	0	0	0	0	113.9
373	S	23.4	Very low	27.6	Very low	114 Å²	114	118.1 Å²	118.1	80%	0.797	68%	0.676	S	S	*	*			trans	-162.5	132.1	166	-171.1	0	0	0	0	108.5
374	V	26.7	Very low	27.2	Very low	124 Å²	124	120.6 Å²	120.6	75%	0.752	69%	0.691	S	S	*	*			cis	-142.5	149.5	-6.9	101.7	0	0	0	0	112
375	T	28.1	Very low	27	Very low	107 Å²	107	128 Å²	128	66%	0.656	72%	0.724	S	S	*	*			trans	-29.4	156.3	165.7	64.4	0	0	0	0	116.6
376	R	30.4	Very low	26.9	Very low	236 Å²	236	129.9 Å²	129.9	89%	0.891	74%	0.737	S	S	*	*			cis	-143.2	156.1	34.3	-64.6	168.8	169.1	140.5	-4.7	109
377	G	30.2	Very low	26.9	Very low	63 Å²	63	128.7 Å²	128.7	65%	0.649	73%	0.734	S	S	*	*			cis	95.1	113.3	33.6	0	0	0	0	0	108.9
378	T	31.1	Very low	27.1	Very low	126 Å²	126	126.4 Å²	126.4	77%	0.773	73%	0.727	S	S	*	*				-169.6	145.2	74.1	26.7	0	0	0	0	115.1
379	K	29.5	Very low	27.1	Very low	179 Å²	179	127.9 Å²	127.9	78%	0.778	72%	0.723	S	S	*	*			trans	58	99.8	135.4	-62	174.7	179.3	-179.9	0	121.3
380	D	24.4	Very low	27.3	Very low	153 Å²	153	127.4 Å²	127.4	82%	0.818	72%	0.722	S	S	*	*				43.8	146.5	109.4	-63.6	-51.4	0	0	0	123.6
381	K	23.8	Very low	27.4	Very low	190 Å²	190	127.5 Å²	127.5	83%	0.826	73%	0.729	S	S	*	*			trans	75.4	148.7	162.6	-94.2	-179.1	-179.8	179.5	0	117.6
382	L	29.6	Very low	27.6	Very low	150 Å²	150	131.8 Å²	131.8	79%	0.785	74%	0.737	S	S	*	*			trans	66.7	147.9	161.6	-91.3	49.7	0	0	0	116.2
383	T	29.3	Very low	27.8	Very low	108 Å²	108	132.7 Å²	132.7	66%	0.663	74%	0.737	S	S	*	*			cis	-158.9	154.9	-25.6	2.6	0	0	0	0	109.8
384	T	28.7	Very low	28	Very low	106 Å²	106	131 Å²	131	65%	0.65	74%	0.738	S	S	*	*			trans	28.4	117.4	151.8	54.6	0	0	0	0	121.4
385	E	26.6	Very low	27.9	Very low	171 Å²	171	134.7 Å²	134.7	80%	0.799	74%	0.743	S	S	*	*				79.3	121.3	124.8	-63.7	166.4	-165.5	0	0	122.6
386	S	29.2	Very low	27.7	Very low	101 Å²	101	135 Å²	135	71%	0.706	75%	0.749	S	S	*	*			trans	94.4	107.8	137.4	76.4	0	0	0	0	123.2
387	S	27.8	Very low	27.3	Very low	44 Å²	44	128.8 Å²	128.8	31%	0.308	74%	0.738	S	S	.	*				68.4	99.7	119.3	-64.9	0	0	0	0	125.5	S327	S327-S387 CarbonylContact O-C 3.6Å; S327-S387 VanDerWaalsContact O-C 3.22Å; S327-S387 VanDerWaalsContact O-CA 3.22Å; S327-S387 WeakPolarHBondContact O-CA 3.25Å; S327-S387 WeakPolarHBondContact O-CB 3.45Å; S327-S387 PolarHBondContact O-OG 3.49Å; S327-S387 PolarHBondContact OG-OG 2.84Å
388	L	30	Very low	27.1	Very low	121 Å²	121	129 Å²	129	63%	0.634	74%	0.74	S	S	*	*				-156.9	123.3	122.3	-128.1	68.9	0	0	0	117.2	Q325 A326 S327	Q325-L388 CarbonylContact C-O 3.47Å; A326-L388 CarbonylContact C-O 3.47Å; A326-L388 WeakPolarHBondContact CA-O 3.48Å; A326-L388 PolarHBondContact N-O 3.29Å; S327-L388 VanDerWaalsContact N-CA 3.27Å; S327-L388 PolarHBondContact N-O 3.05Å; S327-L388 WeakPolarHBondContact O-CA 3.44Å; S327-L388 PolarHBondContact O-N 3.43Å
389	K	26.9	Very low	26.9	Very low	137 Å²	137	126.4 Å²	126.4	60%	0.596	73%	0.727	S	S	*	*			trans	-1.8	147.2	-169.6	-76.7	152.3	-176.5	156.6	0	125.4	A326 S327 T328 T329	A326-K389 CarbonylContact O-C 3.46Å; A326-K389 WeakPolarHBondContact O-CA 3.37Å; S327-K389 VanDerWaalsContact CA-N 3.3Å; S327-K389 VanDerWaalsContact N-N 3.19Å; T328-K389 WeakPolarHBondContact O-CD 3.3Å; T328-K389 WeakPolarHBondContact O-CE 3.38Å; T328-K389 WeakPolarHBondContact O-CG 3.5Å; T329-K389 VanDerWaalsContact O-CE 3.27Å; T329-K389 WeakPolarHBondContact O-CE 3.3Å; T329-K389 PolarHBondContact O-NZ 3.29Å
390	P	27.8	Very low	26.8	Very low	114 Å²	114	127.2 Å²	127.2	74%	0.74	73%	0.733	S	S	*	*			trans	-97.4	153.7	173.8	38.8	-35.1	0	0	0	115.6	A326	A326-P390 WeakPolarHBondContact O-CD 3.05Å
391	A	26.3	Very low	27.5	Very low	99 Å²	99	126.4 Å²	126.4	82%	0.818	73%	0.725	S	S	*	*			trans	-149.8	100.4	176.2	0	0	0	0	0	116
392	K	27.2	Very low	28.7	Very low	217 Å²	217	124.2 Å²	124.2	94%	0.943	72%	0.717	S	S	*	*			trans	46.2	70.5	150.6	-58.7	-176.2	179.9	179.7	0	119.7	G394	K392-G394 PolarHBondContact O-N 2.78Å
393	S	27.3	Very low	29.8	Very low	127 Å²	127	121.8 Å²	121.8	89%	0.888	70%	0.704	S	S	*	*			trans	-86.8	82.7	163.3	57	0	0	0	0	112.4
394	G	26.7	Very low	31.6	Very low	79 Å²	79	121.4 Å²	121.4	81%	0.814	70%	0.698	S	S	*	*			trans	-98.2	75	172.1	0	0	0	0	0	112.3	K392	K392-G394 PolarHBondContact O-N 2.78Å
395	K	24.8	Very low	33.8	Very low	201 Å²	201	117.2 Å²	117.2	87%	0.874	67%	0.672	S	S	*	*			trans	-148.2	102.3	178.7	-82	-166.2	172.3	-169.5	0	112.2
396	S	23.2	Very low	36.3	Very low	112 Å²	112	110.6 Å²	110.6	78%	0.783	64%	0.644	S	S	*	*			trans	176	143.6	148.9	58.2	0	0	0	0	112.4
397	V	23.7	Very low	39	Very low	107 Å²	107	106.5 Å²	106.5	65%	0.648	61%	0.614	S	S	*	*			trans	68	52.4	163.2	-149.3	0	0	0	0	118.1	K357	K357-V397 PolarHBondContact NZ-O 2.98Å
398	G	26.2	Very low	41.9	Very low	68 Å²	68	104.5 Å²	104.5	70%	0.701	60%	0.599	S	S	*	*				-92.5	146	128.8	0	0	0	0	0	108.3
399	S	25.4	Very low	44.7	Very low	70 Å²	70	98.7 Å²	98.7	49%	0.49	57%	0.569	S	S	.	*			trans	-72	157.8	173.5	-1.7	0	0	0	0	110.4	E401	S399-E401 PolarHBondContact O-N 3.09Å; S399-E401 PolarHBondContact OG-OE1 3.33Å
400	E	27.2	Very low	47.8	Very low	196 Å²	196	92.3 Å²	92.3	92%	0.916	54%	0.542	S	S	*	.			trans	-71.6	100.4	153.6	-68.6	173	154.1	0	0	105.6
401	E	39.8	Very low	50.8	Low	137 Å²	137	86.9 Å²	86.9	64%	0.64	51%	0.506	S	S	*	.			trans	-83.4	120.3	-178.5	-89.1	146.9	-161.5	0	0	109.6	S399 I403	S399-E401 PolarHBondContact O-N 3.09Å; S399-E401 PolarHBondContact OG-OE1 3.33Å; E401-I403 PolarHBondContact O-N 2.84Å
402	E	49	Very low	53.8	Low	143 Å²	143	82.3 Å²	82.3	67%	0.668	47%	0.468	S	S	*	.			trans	-76.2	105.3	-170.1	-66.8	178.1	155.5	0	0	110.2	N267 L404	N267-E402 WeakPolarHBondContact ND2-CA 3.49Å; E402-L404 PolarHBondContact O-N 2.88Å; E402-L404 VanDerWaalsContact O-N 3.09Å
403	I	52.5	Low	56.4	Low	99 Å²	99	72 Å²	72	51%	0.508	42%	0.423	S	S	.	.	P	Polyproline II helix	trans	-53.6	116.5	175.3	-55.1	175.6	0	0	0	109.9	N267 E401	N267-I403 PolarHBondContact ND2-N 2.88Å; N267-I403 VanDerWaalsContact ND2-N 3.16Å; N267-I403 PolarHBondContact ND2-O 3.34Å; E401-I403 PolarHBondContact O-N 2.84Å
404	L	68.2	Low	59	Low	101 Å²	101	66.1 Å²	66.1	53%	0.529	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-87.2	149.4	179.4	-60.8	175.2	0	0	0	110.8	L265 E402	L265-L404 HydrophobicContact CD2-CD2 3.72Å; E402-L404 PolarHBondContact O-N 2.88Å; E402-L404 VanDerWaalsContact O-N 3.09Å
405	V	74.9	Confident	61.4	Low	18 Å²	18	64 Å²	64	11%	0.109	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-74.8	125.1	168.6	-173.9	0	0	0	0	108.8	P100 I103 S264	P100-V405 HydrophobicContact CB-CG1 4.33Å; P100-V405 HydrophobicContact CG-CG1 4.14Å; P100-V405 VanDerWaalsContact O-CG1 3.3Å; P100-V405 WeakPolarHBondContact O-CG1 3.36Å; I103-V405 HydrophobicContact CD1-CB 4.41Å; I103-V405 HydrophobicContact CD1-CG1 4.19Å; I103-V405 HydrophobicContact CG1-CG1 4.08Å; S264-V405 PolarHBondContact O-N 2.8Å
406	P	79	Confident	64	Low	31 Å²	31	57.7 Å²	57.7	20%	0.201	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-64.7	147.4	-180	25.4	-33.6	0	0	0	112.1	T101 L102 I103 L529	T101-P406 WeakPolarHBondContact O-CD 3.28Å; T101-P406 VanDerWaalsContact O-CG 3.22Å; T101-P406 WeakPolarHBondContact O-CG 3.41Å; L102-P406 HydrophobicContact CD1-CB 4.27Å; L102-P406 HydrophobicContact CD1-CG 4.27Å; I103-P406 PolarHBondContact N-O 3.18Å; P406-L529 HydrophobicContact CB-CD2 3.92Å
407	M	85	Confident	66.7	Low	16 Å²	16	54.5 Å²	54.5	8%	0.079	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	137.8	-176	-173.7	-168.7	-56.1	0	0	109.9	I103 E260 C431 P432 L529	I103-M407 HydrophobicContact CB-CB 4.22Å; I103-M407 HydrophobicContact CB-CG 4.04Å; I103-M407 HydrophobicContact CD1-CB 4.47Å; I103-M407 HydrophobicContact CD1-CE 4.05Å; I103-M407 HydrophobicContact CG2-CG 4.09Å; I103-M407 CarbonylContact O-C 3.33Å; I103-M407 VanDerWaalsContact O-CA 3.31Å; I103-M407 WeakPolarHBondContact O-CA 3.27Å; E260-M407 HydrophobicContact CB-CE 3.67Å; E260-M407 HydrophobicContact CB-SD 3.93Å; E260-M407 HydrophobicContact CG-SD 4.34Å; E260-M407 WeakPolarHBondContact O-CE 3.1Å; M407-C431 HydrophobicContact SD-CB 4.12Å; M407-P432 VanDerWaalsContact O-CD 3.29Å; M407-P432 WeakPolarHBondContact O-CD 3.16Å; M407-P432 WeakPolarHBondContact O-CG 3.46Å; M407-L529 WeakPolarHBondContact O-CD2 3.24Å
408	C	88.5	Confident	69.6	Low	1 Å²	1	49.6 Å²	49.6	1%	0.007	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	134.3	173.2	-174.2	0	0	0	0	110.1	I103 I104 T105 P432 V525 S528 L529	I103-C408 PolarHBondContact O-N 2.94Å; I104-C408 CarbonylContact C-O 3.49Å; I104-C408 WeakPolarHBondContact CA-O 2.94Å; T105-C408 PolarHBondContact N-O 3.38Å; C408-P432 CarbonylContact C-O 3.54Å; C408-P432 WeakPolarHBondContact CA-O 3.17Å; C408-V525 HydrophobicContact CB-CG1 4.13Å; C408-S528 PolarHBondContact SG-OG 3.32Å; C408-L529 HydrophobicContact CB-CD2 3.91Å; C408-L529 HydrophobicContact CB-CG 4.31Å
409	G	89.9	Confident	72.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	148.3	164.9	0	0	0	0	0	111.3	T105 C431 P432 I433 V434	T105-G409 CarbonylContact O-C 3.25Å; T105-G409 VanDerWaalsContact O-CA 3.3Å; T105-G409 WeakPolarHBondContact O-CA 3.49Å; G409-C431 PolarHBondContact N-SG 2.67Å; G409-P432 PolarHBondContact N-O 2.75Å; G409-I433 WeakPolarHBondContact O-CA 3.13Å; G409-V434 PolarHBondContact O-N 2.77Å
410	L	91.3	Very high	75.3	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	117.2	172	177.7	59.9	0	0	0	108.4	T105 F107 F121 V412 V434 T436 L521	T105-L410 PolarHBondContact O-N 2.94Å; F107-L410 PolarHBondContact N-O 2.91Å; F121-L410 HydrophobicContact CD2-CD2 4.23Å; F121-L410 HydrophobicContact CE2-CD2 3.66Å; F121-L410 HydrophobicContact CE2-CG 4.47Å; L410-V412 HydrophobicContact CD1-CG2 4.39Å; L410-V412 HydrophobicContact CG-CG2 4.13Å; L410-V434 CarbonylContact C-O 3.23Å; L410-V434 WeakPolarHBondContact CA-O 3.44Å; L410-V434 HydrophobicContact CD1-CB 3.97Å; L410-V434 HydrophobicContact CD1-CG1 4.01Å; L410-T436 HydrophobicContact CD1-CG2 3.95Å; L410-L521 HydrophobicContact CD1-CD1 4.07Å; L410-L521 HydrophobicContact CD2-CD2 4.46Å
411	V	91.3	Very high	78.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	120.2	-177.9	-175.7	0	0	0	0	109	F107 T418 V422 I433 V434 V435 T436 A443	F107-V411 HydrophobicContact CB-CG2 4.04Å; F107-V411 HydrophobicContact CD2-CG2 3.97Å; F107-V411 HydrophobicContact CG-CG2 4.42Å; F107-V411 WeakPolarHBondContact O-CA 3.19Å; V411-T418 HydrophobicContact CG1-CG2 4.4Å; V411-V422 HydrophobicContact CG2-CG2 3.42Å; V411-V422 VanDerWaalsContact CG2-CG2 3.42Å; V411-I433 HydrophobicContact CG2-CG2 3.5Å; V411-V434 PolarHBondContact N-O 3Å; V411-V435 HydrophobicContact CB-CG2 4.39Å; V411-T436 PolarHBondContact O-N 3.09Å; V411-T436 PolarHBondContact O-OG1 2.88Å; V411-A443 HydrophobicContact CG1-CB 4.08Å
412	V	88	Confident	80.4	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.018	17%	0.165	C	C	.	.			trans	-131.5	122.1	179.4	-177.2	0	0	0	0	108.5	F107 G108 F121 V144 L410 G414 T436 T439	F107-V412 PolarHBondContact O-N 3.21Å; G108-V412 WeakPolarHBondContact CA-O 3.32Å; F121-V412 HydrophobicContact CD2-CG2 4.1Å; F121-V412 HydrophobicContact CE2-CG2 3.81Å; V144-V412 HydrophobicContact CG1-CB 4.21Å; V144-V412 HydrophobicContact CG2-CB 3.84Å; V144-V412 HydrophobicContact CG2-CG1 3.85Å; V144-V412 WeakPolarHBondContact CG2-O 3.42Å; L410-V412 HydrophobicContact CD1-CG2 4.39Å; L410-V412 HydrophobicContact CG-CG2 4.13Å; V412-G414 PolarHBondContact O-N 3.3Å; V412-T436 WeakPolarHBondContact CA-OG1 3.33Å; V412-T436 HydrophobicContact CG2-CG2 3.94Å; V412-T439 HydrophobicContact CG1-CG2 4.22Å
413	G	83.6	Confident	82.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	14%	0.144	C	C	.	.	S	Bend	trans	56.7	-135.2	-171.1	0	0	0	0	0	112	T439 S440 A443	G413-T439 WeakPolarHBondContact CA-O 3.41Å; G413-T439 PolarHBondContact N-OG1 3.49Å; G413-S440 CarbonylContact C-O 3.56Å; G413-S440 WeakPolarHBondContact CA-O 3.34Å; G413-A443 WeakPolarHBondContact O-CB 3.45Å; G413-A443 PolarHBondContact O-N 2.9Å
414	G	80.5	Confident	83.8	Confident	4 Å²	4	27 Å²	27	4%	0.041	13%	0.126	C	C	.	.			trans	104.7	166.1	167.8	0	0	0	0	0	115.1	T109 V412 G441 A442	T109-G414 WeakPolarHBondContact OG1-CA 3.24Å; V412-G414 PolarHBondContact O-N 3.3Å; G414-G441 WeakPolarHBondContact O-CA 3.37Å; G414-A442 PolarHBondContact O-N 2.96Å
415	D	78.4	Confident	84.6	Confident	34 Å²	34	22.3 Å²	22.3	18%	0.182	10%	0.102	C	C	.	.			trans	-118.7	-175.5	-175.2	61.6	6.3	0	0	0	112.2	T109 F417 T418 L419	T109-D415 HydrophobicContact CG2-CB 4.44Å; T109-D415 WeakPolarHBondContact CG2-OD2 3.46Å; D415-F417 PolarHBondContact O-N 3Å; D415-F417 WeakPolarHBondContact OD1-CB 3.19Å; D415-F417 PolarHBondContact OD1-N 3.41Å; D415-F417 VanDerWaalsContact OD1-N 3.16Å; D415-F417 WeakPolarHBondContact OD2-CD2 3.38Å; D415-T418 PolarHBondContact N-OG1 3.47Å; D415-T418 VanDerWaalsContact N-OG1 3.14Å; D415-T418 WeakPolarHBondContact O-CA 3.37Å; D415-T418 WeakPolarHBondContact O-CB 3.25Å; D415-T418 PolarHBondContact O-N 3.23Å; D415-T418 WeakPolarHBondContact OD1-CB 3.37Å; D415-T418 PolarHBondContact OD1-N 3.46Å; D415-T418 PolarHBondContact OD1-OG1 3.16Å; D415-L419 PolarHBondContact O-N 2.91Å
416	R	78.5	Confident	85.1	Confident	68 Å²	68	21.4 Å²	21.4	26%	0.257	10%	0.097	S	C	.	.	H	α-helix	trans	-56.1	-32	174.6	66.7	176.1	-179.3	-171.8	-5	113.9	T418 L419 R420 E495	R416-T418 VanDerWaalsContact C-N 3.35Å; R416-L419 PolarHBondContact O-N 3.46Å; R416-R420 PolarHBondContact O-N 3.4Å; R416-E495 HydrophobicContact CB-CG 4.22Å; R416-E495 WeakPolarHBondContact CB-OE1 3.49Å; R416-E495 WeakPolarHBondContact CD-OE1 3.42Å
417	F	79.7	Confident	85.3	Confident	45 Å²	45	22.9 Å²	22.9	20%	0.197	10%	0.102	C	C	.	.	H	α-helix	trans	-71.4	-34.7	176.7	-58.2	-76.5	0	0	0	110.9	K249 D415 R420 Q421	K249-F417 HydrophobicContact CB-CD1 4.44Å; K249-F417 HydrophobicContact CB-CE1 4.14Å; K249-F417 HydrophobicContact CB-CE2 4.48Å; K249-F417 HydrophobicContact CB-CZ 4.16Å; K249-F417 VanDerWaalsContact O-CE1 3.26Å; K249-F417 WeakPolarHBondContact O-CE1 3.34Å; D415-F417 PolarHBondContact O-N 3Å; D415-F417 WeakPolarHBondContact OD1-CB 3.19Å; D415-F417 PolarHBondContact OD1-N 3.41Å; D415-F417 VanDerWaalsContact OD1-N 3.16Å; D415-F417 WeakPolarHBondContact OD2-CD2 3.38Å; F417-R420 PolarHBondContact O-N 3.38Å; F417-Q421 WeakPolarHBondContact O-CG 3.34Å; F417-Q421 PolarHBondContact O-N 2.96Å
418	T	85.5	Confident	85.1	Confident	5 Å²	5	26.2 Å²	26.2	3%	0.031	11%	0.114	C	C	.	.	H	α-helix	trans	-63.2	-46.2	172.4	-51.3	0	0	0	0	110.9	F107 V411 D415 R416 R420 Q421 V422	F107-T418 HydrophobicContact CB-CG2 3.83Å; V411-T418 HydrophobicContact CG1-CG2 4.4Å; D415-T418 PolarHBondContact N-OG1 3.47Å; D415-T418 VanDerWaalsContact N-OG1 3.14Å; D415-T418 WeakPolarHBondContact O-CA 3.37Å; D415-T418 WeakPolarHBondContact O-CB 3.25Å; D415-T418 PolarHBondContact O-N 3.23Å; D415-T418 WeakPolarHBondContact OD1-CB 3.37Å; D415-T418 PolarHBondContact OD1-N 3.46Å; D415-T418 PolarHBondContact OD1-OG1 3.16Å; R416-T418 VanDerWaalsContact C-N 3.35Å; T418-R420 VanDerWaalsContact C-N 3.31Å; T418-R420 PolarHBondContact O-N 2.98Å; T418-Q421 PolarHBondContact O-N 2.94Å; T418-V422 WeakPolarHBondContact O-CB 3.42Å; T418-V422 WeakPolarHBondContact O-CG2 3.18Å; T418-V422 PolarHBondContact O-N 2.72Å
419	L	84.8	Confident	84.6	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-58.3	-42	173.8	-174.4	67.6	0	0	0	111.7	D415 R416 V422 Y423 A442 L446 E495	D415-L419 PolarHBondContact O-N 2.91Å; R416-L419 PolarHBondContact O-N 3.46Å; L419-V422 WeakPolarHBondContact O-CB 3.49Å; L419-V422 PolarHBondContact O-N 3.46Å; L419-Y423 WeakPolarHBondContact O-CB 3.49Å; L419-Y423 PolarHBondContact O-N 3.32Å; L419-A442 HydrophobicContact CB-CB 4.44Å; L419-L446 HydrophobicContact CD1-CD1 4.21Å; L419-L446 HydrophobicContact CD1-CD2 4Å; L419-L446 HydrophobicContact CD1-CG 4.08Å; L419-E495 HydrophobicContact CD2-CB 3.92Å; L419-E495 HydrophobicContact CD2-CG 4.04Å
420	R	85.4	Confident	84.1	Confident	140 Å²	140	35.3 Å²	35.3	53%	0.528	15%	0.151	S	C	.	.	H	α-helix	trans	-67	-38.6	175.8	-176.6	174.5	175.1	154.1	0.7	113.7	R416 F417 T418 C424	R416-R420 PolarHBondContact O-N 3.4Å; F417-R420 PolarHBondContact O-N 3.38Å; T418-R420 VanDerWaalsContact C-N 3.31Å; T418-R420 PolarHBondContact O-N 2.98Å; R420-C424 WeakPolarHBondContact O-CB 3.31Å; R420-C424 PolarHBondContact O-N 2.94Å; R420-C424 PolarHBondContact O-SG 2.61Å
421	Q	86.4	Confident	83.7	Confident	19 Å²	19	35.3 Å²	35.3	9%	0.089	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-43.7	173.4	-76.6	-175.5	10	0	0	110.9	F107 E252 A253 F417 T418 C424 S425	F107-Q421 HydrophobicContact CD1-CB 3.89Å; F107-Q421 HydrophobicContact CE1-CB 3.85Å; E252-Q421 PolarHBondContact OE1-NE2 3.46Å; A253-Q421 HydrophobicContact CB-CG 3.81Å; F417-Q421 WeakPolarHBondContact O-CG 3.34Å; F417-Q421 PolarHBondContact O-N 2.96Å; T418-Q421 PolarHBondContact O-N 2.94Å; Q421-C424 PolarHBondContact O-N 3.24Å; Q421-S425 PolarHBondContact O-N 2.88Å
422	V	87.1	Confident	83.5	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-55.1	-56.1	173.4	157.9	0	0	0	0	111	F107 V411 T418 L419 C424 S425 M426 I433 L446 I502	F107-V422 HydrophobicContact CB-CG2 4.33Å; F107-V422 HydrophobicContact CD2-CG2 3.99Å; F107-V422 HydrophobicContact CE2-CG2 4.34Å; F107-V422 HydrophobicContact CG-CG2 4.07Å; V411-V422 HydrophobicContact CG2-CG2 3.42Å; V411-V422 VanDerWaalsContact CG2-CG2 3.42Å; T418-V422 WeakPolarHBondContact O-CB 3.42Å; T418-V422 WeakPolarHBondContact O-CG2 3.18Å; T418-V422 PolarHBondContact O-N 2.72Å; L419-V422 WeakPolarHBondContact O-CB 3.49Å; L419-V422 PolarHBondContact O-N 3.46Å; V422-C424 VanDerWaalsContact C-N 3.3Å; V422-C424 PolarHBondContact O-N 3.01Å; V422-S425 PolarHBondContact O-N 2.89Å; V422-M426 HydrophobicContact CG1-SD 3.74Å; V422-M426 VanDerWaalsContact O-CG 3.29Å; V422-M426 WeakPolarHBondContact O-CG 3.28Å; V422-M426 PolarHBondContact O-N 3.18Å; V422-I433 HydrophobicContact CB-CD1 4.28Å; V422-I433 HydrophobicContact CG1-CD1 3.75Å; V422-I433 HydrophobicContact CG2-CD1 4.25Å; V422-L446 HydrophobicContact CG1-CD1 4.28Å; V422-I502 HydrophobicContact CG1-CD1 4.39Å
423	Y	87.6	Confident	83.6	Confident	57 Å²	57	35.3 Å²	35.3	22%	0.224	15%	0.151	C	C	.	.	H	α-helix	trans	-53.1	-44.9	177.4	177.9	-96.5	0	0	0	112.3	L419 M426 I427 M498 E501 I502	L419-Y423 WeakPolarHBondContact O-CB 3.49Å; L419-Y423 PolarHBondContact O-N 3.32Å; Y423-M426 PolarHBondContact O-N 2.83Å; Y423-I427 HydrophobicContact CD1-CD1 4.09Å; Y423-I427 HydrophobicContact CD2-CD1 3.82Å; Y423-I427 HydrophobicContact CE1-CD1 3.67Å; Y423-I427 HydrophobicContact CE2-CD1 3.37Å; Y423-I427 HydrophobicContact CG-CD1 4.15Å; Y423-I427 PolarHBondContact O-N 3.13Å; Y423-I427 VanDerWaalsContact O-N 3.08Å; Y423-M498 HydrophobicContact CD1-CG 4.31Å; Y423-M498 HydrophobicContact CD1-SD 4.04Å; Y423-M498 HydrophobicContact CD2-CB 3.8Å; Y423-M498 HydrophobicContact CD2-CG 3.74Å; Y423-M498 HydrophobicContact CD2-SD 4.31Å; Y423-M498 HydrophobicContact CE1-CG 4.31Å; Y423-M498 HydrophobicContact CE1-SD 4.42Å; Y423-M498 HydrophobicContact CE2-CB 4.04Å; Y423-M498 HydrophobicContact CE2-CG 3.75Å; Y423-M498 HydrophobicContact CG-CB 4.37Å; Y423-M498 HydrophobicContact CG-CG 4.04Å; Y423-M498 HydrophobicContact CG-SD 3.98Å; Y423-E501 HydrophobicContact CE2-CB 4.38Å; Y423-E501 HydrophobicContact CE2-CG 4.5Å; Y423-E501 VanDerWaalsContact CE2-OE2 3.29Å; Y423-E501 WeakPolarHBondContact CE2-OE2 3.29Å; Y423-E501 PolarHBondContact OH-OE2 2.85Å; Y423-I502 HydrophobicContact CD2-CD1 4.24Å; Y423-I502 HydrophobicContact CD2-CG1 4.33Å
424	C	85.6	Confident	83.9	Confident	20 Å²	20	35.3 Å²	35.3	14%	0.135	15%	0.151	C	C	.	.	H	α-helix	trans	-65.8	-42.4	179.3	-71.3	0	0	0	0	113.2	R420 Q421 V422 R428	R420-C424 WeakPolarHBondContact O-CB 3.31Å; R420-C424 PolarHBondContact O-N 2.94Å; R420-C424 PolarHBondContact O-SG 2.61Å; Q421-C424 PolarHBondContact O-N 3.24Å; V422-C424 VanDerWaalsContact C-N 3.3Å; V422-C424 PolarHBondContact O-N 3.01Å; C424-R428 WeakPolarHBondContact O-CB 3.2Å; C424-R428 WeakPolarHBondContact O-CD 3.38Å; C424-R428 WeakPolarHBondContact O-CG 3.48Å; C424-R428 PolarHBondContact O-N 2.78Å; C424-R428 VanDerWaalsContact O-N 3.12Å
425	S	85.3	Confident	84.4	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.014	15%	0.149	C	C	.	.	H	α-helix	trans	-73.3	-31.8	178	-68.1	0	0	0	0	112.5	E260 Q421 V422 N429	E260-S425 PolarHBondContact OE2-OG 2.82Å; Q421-S425 PolarHBondContact O-N 2.88Å; V422-S425 PolarHBondContact O-N 2.89Å; S425-N429 WeakPolarHBondContact O-CB 3.33Å; S425-N429 PolarHBondContact O-N 2.97Å
426	M	84.8	Confident	84.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.4	-57.9	172.3	-71.3	175.8	63.6	0	0	111.6	V422 Y423 R430 I433 I502 Y506 L509 V510	V422-M426 HydrophobicContact CG1-SD 3.74Å; V422-M426 VanDerWaalsContact O-CG 3.29Å; V422-M426 WeakPolarHBondContact O-CG 3.28Å; V422-M426 PolarHBondContact O-N 3.18Å; Y423-M426 PolarHBondContact O-N 2.83Å; M426-R430 WeakPolarHBondContact O-CA 3.12Å; M426-R430 PolarHBondContact O-N 2.57Å; M426-I433 HydrophobicContact CG-CD1 3.49Å; M426-I433 VanDerWaalsContact CG-CD1 3.49Å; M426-I433 HydrophobicContact CG-CG1 4.31Å; M426-I433 HydrophobicContact SD-CD1 3.91Å; M426-I502 HydrophobicContact CE-CB 4.34Å; M426-I502 HydrophobicContact CE-CD1 4.5Å; M426-I502 HydrophobicContact CE-CG1 3.83Å; M426-I502 HydrophobicContact CE-CG2 4.01Å; M426-I502 HydrophobicContact SD-CD1 3.99Å; M426-I502 HydrophobicContact SD-CG1 3.96Å; M426-Y506 VanDerWaalsContact CE-CB 3.42Å; M426-Y506 HydrophobicContact CE-CG 4.04Å; M426-L509 HydrophobicContact CB-CD1 3.76Å; M426-L509 HydrophobicContact CE-CB 3.78Å; M426-L509 HydrophobicContact CE-CD1 3.79Å; M426-L509 HydrophobicContact CE-CG 4.4Å; M426-L509 HydrophobicContact CG-CD1 3.85Å; M426-V510 HydrophobicContact CE-CG2 3.46Å; M426-V510 VanDerWaalsContact CE-CG2 3.46Å; M426-V510 HydrophobicContact SD-CG2 3.83Å
427	I	83.8	Confident	85.3	Confident	62 Å²	62	32 Å²	32	32%	0.318	14%	0.136	S	C	.	.	H	α-helix	trans	-70	-39	-173.1	-67.5	169.9	0	0	0	112	Y423 E501 Y506	Y423-I427 HydrophobicContact CD1-CD1 4.09Å; Y423-I427 HydrophobicContact CD2-CD1 3.82Å; Y423-I427 HydrophobicContact CE1-CD1 3.67Å; Y423-I427 HydrophobicContact CE2-CD1 3.37Å; Y423-I427 HydrophobicContact CG-CD1 4.15Å; Y423-I427 PolarHBondContact O-N 3.13Å; Y423-I427 VanDerWaalsContact O-N 3.08Å; I427-E501 VanDerWaalsContact CD1-OE1 3.25Å; I427-E501 WeakPolarHBondContact CD1-OE1 3.29Å; I427-Y506 HydrophobicContact CG1-CE2 4.11Å
428	R	81	Confident	85.3	Confident	86 Å²	86	31.2 Å²	31.2	33%	0.325	14%	0.141	S	C	.	.	H	α-helix	trans	-82	-31.7	-174.3	-64.1	172.7	170.4	-136.3	-4.4	114.2	E254 A257 R261 C424	E254-R428 VanDerWaalsContact CD-NH2 3.35Å; E254-R428 PolarHBondContact O-NH1 2.81Å; E254-R428 IonicContact OE1-CZ 3.27Å; E254-R428 IonicContact OE1-NH1 3.68Å; E254-R428 PolarHBondContact OE1-NH1 3.41Å; E254-R428 IonicContact OE1-NH2 3.68Å; E254-R428 PolarHBondContact OE1-NH2 2.75Å; E254-R428 IonicContact OE2-CZ 2.98Å; E254-R428 IonicContact OE2-NH1 2.79Å; E254-R428 PolarHBondContact OE2-NH1 2.64Å; E254-R428 IonicContact OE2-NH2 2.69Å; E254-R428 PolarHBondContact OE2-NH2 3.1Å; A257-R428 HydrophobicContact CB-CB 4.41Å; R261-R428 PolarHBondContact NH1-O 2.76Å; C424-R428 WeakPolarHBondContact O-CB 3.2Å; C424-R428 WeakPolarHBondContact O-CD 3.38Å; C424-R428 WeakPolarHBondContact O-CG 3.48Å; C424-R428 PolarHBondContact O-N 2.78Å; C424-R428 VanDerWaalsContact O-N 3.12Å
429	N	77.3	Confident	85	Confident	36 Å²	36	31.3 Å²	31.3	19%	0.193	14%	0.141	C	C	.	.	H	α-helix	trans	-120	-13	-171	-59.5	-15.2	0	0	0	113.9	A257 R261 S425 C431	A257-N429 PolarHBondContact O-ND2 3.49Å; A257-N429 PolarHBondContact O-OD1 3.47Å; R261-N429 WeakPolarHBondContact CB-OD1 3.1Å; S425-N429 WeakPolarHBondContact O-CB 3.33Å; S425-N429 PolarHBondContact O-N 2.97Å; N429-C431 HydrophobicContact CB-CB 4.46Å; N429-C431 PolarHBondContact O-N 2.77Å
430	R	79.5	Confident	84.8	Confident	155 Å²	155	33.8 Å²	33.8	59%	0.585	16%	0.158	S	C	*	.			trans	53.7	39.4	-168	-62.5	-173.9	172.5	-161.6	-6.8	112.7	M426 P432	M426-R430 WeakPolarHBondContact O-CA 3.12Å; M426-R430 PolarHBondContact O-N 2.57Å; R430-P432 WeakPolarHBondContact O-CD 3.21Å
431	C	83.5	Confident	84.7	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.02	13%	0.134	C	C	.	.			trans	-70.4	120.5	179.4	-172.5	0	0	0	0	110.2	M407 G409 N429	M407-C431 HydrophobicContact SD-CB 4.12Å; G409-C431 PolarHBondContact N-SG 2.67Å; N429-C431 HydrophobicContact CB-CB 4.46Å; N429-C431 PolarHBondContact O-N 2.77Å
432	P	87.8	Confident	84.7	Confident	4 Å²	4	26.3 Å²	26.3	3%	0.026	13%	0.13	C	C	.	.			trans	-67.2	140.5	170.6	30.2	-35.8	0	0	0	110.1	M407 C408 G409 R430 L509 L529	M407-P432 VanDerWaalsContact O-CD 3.29Å; M407-P432 WeakPolarHBondContact O-CD 3.16Å; M407-P432 WeakPolarHBondContact O-CG 3.46Å; C408-P432 CarbonylContact C-O 3.54Å; C408-P432 WeakPolarHBondContact CA-O 3.17Å; G409-P432 PolarHBondContact N-O 2.75Å; R430-P432 WeakPolarHBondContact O-CD 3.21Å; P432-L509 HydrophobicContact CB-CD2 4.35Å; P432-L529 HydrophobicContact CG-CD2 4.44Å
433	I	89.7	Confident	84.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.6	-171.8	-64.7	-173	0	0	0	110.2	F107 G409 V411 V422 M426 V435 L509 S511	F107-I433 HydrophobicContact CE2-CD1 4.33Å; G409-I433 WeakPolarHBondContact O-CA 3.13Å; V411-I433 HydrophobicContact CG2-CG2 3.5Å; V422-I433 HydrophobicContact CB-CD1 4.28Å; V422-I433 HydrophobicContact CG1-CD1 3.75Å; V422-I433 HydrophobicContact CG2-CD1 4.25Å; M426-I433 HydrophobicContact CG-CD1 3.49Å; M426-I433 VanDerWaalsContact CG-CD1 3.49Å; M426-I433 HydrophobicContact CG-CG1 4.31Å; M426-I433 HydrophobicContact SD-CD1 3.91Å; I433-V435 HydrophobicContact CG2-CG2 4.03Å; I433-L509 PolarHBondContact N-O 3.35Å; I433-S511 PolarHBondContact O-N 3.41Å; I433-S511 PolarHBondContact O-OG 2.86Å
434	V	90.4	Very high	84.7	Confident	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.6	166.6	-177.5	0	0	0	0	108.7	G409 L410 V411 S511 F513 L521 V525	G409-V434 PolarHBondContact O-N 2.77Å; L410-V434 CarbonylContact C-O 3.23Å; L410-V434 WeakPolarHBondContact CA-O 3.44Å; L410-V434 HydrophobicContact CD1-CB 3.97Å; L410-V434 HydrophobicContact CD1-CG1 4.01Å; V411-V434 PolarHBondContact N-O 3Å; V434-S511 CarbonylContact C-O 2.93Å; V434-S511 WeakPolarHBondContact CA-O 2.95Å; V434-S511 WeakPolarHBondContact CA-OG 3.45Å; V434-F513 HydrophobicContact CG1-CB 3.9Å; V434-L521 HydrophobicContact CG1-CD1 4.1Å; V434-V525 HydrophobicContact CG2-CG2 3.92Å
435	V	90.5	Very high	84.8	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.9	-178.3	177.3	0	0	0	0	107.7	V411 I433 K437 A443 L446 A447 V510 S511 V512 F513	V411-V435 HydrophobicContact CB-CG2 4.39Å; I433-V435 HydrophobicContact CG2-CG2 4.03Å; V435-K437 PolarHBondContact O-N 2.92Å; V435-A443 HydrophobicContact CG1-CB 4.11Å; V435-A443 WeakPolarHBondContact CG1-O 3.16Å; V435-L446 HydrophobicContact CG1-CB 4.06Å; V435-L446 HydrophobicContact CG2-CB 4.24Å; V435-L446 HydrophobicContact CG2-CD1 4.18Å; V435-A447 HydrophobicContact CG1-CB 4.31Å; V435-V510 HydrophobicContact CG2-CG1 3.51Å; V435-S511 PolarHBondContact N-O 3.16Å; V435-V512 WeakPolarHBondContact O-CA 3.26Å; V435-F513 PolarHBondContact O-N 2.94Å
436	T	88	Confident	84.9	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.006	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	105.4	-178.4	59.7	0	0	0	0	111.3	L410 V411 V412 T439 F513 M515 L521	L410-T436 HydrophobicContact CD1-CG2 3.95Å; V411-T436 PolarHBondContact O-N 3.09Å; V411-T436 PolarHBondContact O-OG1 2.88Å; V412-T436 WeakPolarHBondContact CA-OG1 3.33Å; V412-T436 HydrophobicContact CG2-CG2 3.94Å; T436-T439 WeakPolarHBondContact O-CG2 3.45Å; T436-T439 PolarHBondContact O-OG1 3.14Å; T436-T439 WeakPolarHBondContact OG1-CG2 3.42Å; T436-T439 PolarHBondContact OG1-OG1 2.96Å; T436-T439 VanDerWaalsContact OG1-OG1 3.14Å; T436-F513 CarbonylContact C-O 3.17Å; T436-F513 WeakPolarHBondContact CA-O 3.5Å; T436-F513 HydrophobicContact CG2-CD1 4.07Å; T436-M515 HydrophobicContact CG2-SD 4.04Å; T436-L521 HydrophobicContact CG2-CD1 4.42Å
437	K	86.6	Confident	85	Confident	35 Å²	35	23.2 Å²	23.2	15%	0.152	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	138.8	178.6	176.5	173.8	173.2	177.8	0	111	V435 D444 A447 D451 V512 F513 D514 M515	V435-K437 PolarHBondContact O-N 2.92Å; K437-D444 WeakPolarHBondContact CA-OD1 3.34Å; K437-A447 HydrophobicContact CB-CB 4.01Å; K437-A447 HydrophobicContact CD-CB 4.23Å; K437-A447 HydrophobicContact CG-CB 4.17Å; K437-D451 IonicContact NZ-OD2 3.77Å; K437-D451 PolarHBondContact NZ-OD2 2.89Å; K437-V512 HydrophobicContact CB-CG1 3.56Å; K437-V512 HydrophobicContact CD-CG1 3.84Å; K437-V512 HydrophobicContact CG-CG1 4.34Å; K437-F513 PolarHBondContact N-O 3.22Å; K437-D514 WeakPolarHBondContact CD-OD2 2.91Å; K437-M515 PolarHBondContact O-N 2.97Å
438	G	80.3	Confident	85.1	Confident	29 Å²	29	23.7 Å²	23.7	30%	0.299	12%	0.116	S	C	.	.	S	Bend	trans	86.7	30.3	-171.9	0	0	0	0	0	113.3	D444	G438-D444 PolarHBondContact N-OD1 2.9Å; G438-D444 PolarHBondContact N-OD2 3.45Å
439	T	79.7	Confident	85.3	Confident	7 Å²	7	19.6 Å²	19.6	4%	0.043	10%	0.1	C	C	.	.	S	Bend	trans	-123.8	6.8	179	66.2	0	0	0	0	115.4	L117 V412 G413 T436 A443 D444 M515	L117-T439 HydrophobicContact CD1-CG2 3.97Å; L117-T439 HydrophobicContact CD2-CG2 3.97Å; L117-T439 HydrophobicContact CG-CG2 4.45Å; V412-T439 HydrophobicContact CG1-CG2 4.22Å; G413-T439 WeakPolarHBondContact CA-O 3.41Å; G413-T439 PolarHBondContact N-OG1 3.49Å; T436-T439 WeakPolarHBondContact O-CG2 3.45Å; T436-T439 PolarHBondContact O-OG1 3.14Å; T436-T439 WeakPolarHBondContact OG1-CG2 3.42Å; T436-T439 PolarHBondContact OG1-OG1 2.96Å; T436-T439 VanDerWaalsContact OG1-OG1 3.14Å; T439-A443 WeakPolarHBondContact OG1-CB 3.28Å; T439-D444 PolarHBondContact N-OD1 2.91Å; T439-D444 VanDerWaalsContact N-OD1 3.15Å; T439-D444 PolarHBondContact N-OD2 3.11Å; T439-D444 VanDerWaalsContact N-OD2 3.15Å; T439-M515 HydrophobicContact CG2-SD 3.88Å
440	S	80.7	Confident	85.6	Confident	53 Å²	53	18.4 Å²	18.4	37%	0.371	9%	0.094	S	C	.	.			trans	56.8	-179	-176.6	76.9	0	0	0	0	115.4	G413 D444	G413-S440 CarbonylContact C-O 3.56Å; G413-S440 WeakPolarHBondContact CA-O 3.34Å; S440-D444 VanDerWaalsContact CA-OD2 3.26Å; S440-D444 WeakPolarHBondContact CA-OD2 3.1Å; S440-D444 VanDerWaalsContact N-CG 3.29Å; S440-D444 PolarHBondContact N-OD2 3.31Å
441	G	83.1	Confident	85.8	Confident	2 Å²	2	12 Å²	12	2%	0.021	7%	0.072	C	C	.	.	H	α-helix	trans	59.1	-146.1	178.8	0	0	0	0	0	114.2	G414 A443 D444 V445 F481	G414-G441 WeakPolarHBondContact O-CA 3.37Å; G441-A443 PolarHBondContact O-N 2.86Å; G441-D444 PolarHBondContact O-N 3.44Å; G441-D444 VanDerWaalsContact O-N 3.15Å; G441-V445 WeakPolarHBondContact O-CG2 3.45Å; G441-V445 PolarHBondContact O-N 3.38Å; G441-F481 WeakPolarHBondContact CA-O 3.33Å
442	A	85.5	Confident	85.7	Confident	1 Å²	1	12.2 Å²	12.2	1%	0.008	7%	0.073	C	C	.	.	H	α-helix	trans	-58.5	-29.5	-174.2	0	0	0	0	0	114.4	G414 L419 L446	G414-A442 PolarHBondContact O-N 2.96Å; L419-A442 HydrophobicContact CB-CB 4.44Å; A442-L446 WeakPolarHBondContact O-CD1 3.37Å; A442-L446 WeakPolarHBondContact O-CG 3.42Å; A442-L446 PolarHBondContact O-N 3.29Å; A442-L446 VanDerWaalsContact O-N 3.15Å
443	A	87.7	Confident	85.2	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-64.4	-51.7	174.7	0	0	0	0	0	111.7	V411 G413 V435 T439 G441 L446 A447	V411-A443 HydrophobicContact CG1-CB 4.08Å; G413-A443 WeakPolarHBondContact O-CB 3.45Å; G413-A443 PolarHBondContact O-N 2.9Å; V435-A443 HydrophobicContact CG1-CB 4.11Å; V435-A443 WeakPolarHBondContact CG1-O 3.16Å; T439-A443 WeakPolarHBondContact OG1-CB 3.28Å; G441-A443 PolarHBondContact O-N 2.86Å; A443-L446 PolarHBondContact O-N 2.83Å; A443-A447 PolarHBondContact O-N 2.95Å
444	D	87.5	Confident	84.6	Confident	9 Å²	9	15 Å²	15	5%	0.048	9%	0.091	C	C	.	.	H	α-helix	trans	-71.6	-32.3	-178.3	-74.2	-3.1	0	0	0	111.3	K437 G438 T439 S440 G441 L446 A447 F448 F481	K437-D444 WeakPolarHBondContact CA-OD1 3.34Å; G438-D444 PolarHBondContact N-OD1 2.9Å; G438-D444 PolarHBondContact N-OD2 3.45Å; T439-D444 PolarHBondContact N-OD1 2.91Å; T439-D444 VanDerWaalsContact N-OD1 3.15Å; T439-D444 PolarHBondContact N-OD2 3.11Å; T439-D444 VanDerWaalsContact N-OD2 3.15Å; S440-D444 VanDerWaalsContact CA-OD2 3.26Å; S440-D444 WeakPolarHBondContact CA-OD2 3.1Å; S440-D444 VanDerWaalsContact N-CG 3.29Å; S440-D444 PolarHBondContact N-OD2 3.31Å; G441-D444 PolarHBondContact O-N 3.44Å; G441-D444 VanDerWaalsContact O-N 3.15Å; D444-L446 PolarHBondContact O-N 3.05Å; D444-A447 PolarHBondContact O-N 3.26Å; D444-F448 HydrophobicContact CB-CD2 4.01Å; D444-F448 HydrophobicContact CB-CE2 4.08Å; D444-F448 WeakPolarHBondContact O-CB 3.45Å; D444-F448 VanDerWaalsContact O-CD2 3.25Å; D444-F448 WeakPolarHBondContact O-CD2 3.42Å; D444-F448 PolarHBondContact O-N 2.95Å; D444-F481 HydrophobicContact CB-CD1 3.73Å; D444-F481 HydrophobicContact CB-CE1 3.84Å; D444-F481 HydrophobicContact CB-CG 4.19Å; D444-F481 HydrophobicContact CB-CZ 4.4Å
445	V	87.1	Confident	83.9	Confident	1 Å²	1	19.2 Å²	19.2	1%	0.006	11%	0.109	C	C	.	.	H	α-helix	trans	-56.6	-46.4	169.4	171	0	0	0	0	112.1	G441 G449 I478 F481 L482 L499	G441-V445 WeakPolarHBondContact O-CG2 3.45Å; G441-V445 PolarHBondContact O-N 3.38Å; V445-G449 PolarHBondContact O-N 3.46Å; V445-I478 HydrophobicContact CG1-CD1 4.5Å; V445-I478 HydrophobicContact CG1-CG1 3.73Å; V445-I478 HydrophobicContact CG2-CG1 4.48Å; V445-F481 HydrophobicContact CG2-CB 3.62Å; V445-L482 HydrophobicContact CG2-CD1 3.94Å; V445-L482 HydrophobicContact CG2-CG 4.11Å; V445-L499 HydrophobicContact CG1-CD2 3.66Å
446	L	87.5	Confident	82.9	Confident	3 Å²	3	21.4 Å²	21.4	2%	0.016	12%	0.12	C	C	.	.	H	α-helix	trans	-65.5	-40.7	176.6	-77	164	0	0	0	111.7	L419 V422 V435 A442 A443 D444 L450 L499 I502 V510	L419-L446 HydrophobicContact CD1-CD1 4.21Å; L419-L446 HydrophobicContact CD1-CD2 4Å; L419-L446 HydrophobicContact CD1-CG 4.08Å; V422-L446 HydrophobicContact CG1-CD1 4.28Å; V435-L446 HydrophobicContact CG1-CB 4.06Å; V435-L446 HydrophobicContact CG2-CB 4.24Å; V435-L446 HydrophobicContact CG2-CD1 4.18Å; A442-L446 WeakPolarHBondContact O-CD1 3.37Å; A442-L446 WeakPolarHBondContact O-CG 3.42Å; A442-L446 PolarHBondContact O-N 3.29Å; A442-L446 VanDerWaalsContact O-N 3.15Å; A443-L446 PolarHBondContact O-N 2.83Å; D444-L446 PolarHBondContact O-N 3.05Å; L446-L450 VanDerWaalsContact O-CB 3.3Å; L446-L450 WeakPolarHBondContact O-CB 3.28Å; L446-L450 PolarHBondContact O-N 3.01Å; L446-L450 VanDerWaalsContact O-N 3.1Å; L446-L499 HydrophobicContact CD2-CD1 3.72Å; L446-I502 HydrophobicContact CD2-CD1 4.43Å; L446-I502 HydrophobicContact CD2-CG2 4.1Å; L446-V510 HydrophobicContact CD2-CG1 4.41Å
447	A	87.3	Confident	81.9	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-68.9	-52	-179.3	0	0	0	0	0	112.7	V435 K437 A443 D444 L450 D451 V512	V435-A447 HydrophobicContact CG1-CB 4.31Å; K437-A447 HydrophobicContact CB-CB 4.01Å; K437-A447 HydrophobicContact CD-CB 4.23Å; K437-A447 HydrophobicContact CG-CB 4.17Å; A443-A447 PolarHBondContact O-N 2.95Å; D444-A447 PolarHBondContact O-N 3.26Å; A447-L450 PolarHBondContact O-N 2.72Å; A447-D451 PolarHBondContact O-N 3.15Å; A447-V512 HydrophobicContact CB-CG1 3.75Å; A447-V512 HydrophobicContact CB-CG2 4.15Å
448	F	86.6	Confident	80.8	Confident	72 Å²	72	26.1 Å²	26.1	32%	0.316	16%	0.162	S	C	.	.	H	α-helix	trans	-70.2	-33.4	179.1	-73.2	-67.5	0	0	0	112.4	D444 D451 A452 I477 F481	D444-F448 HydrophobicContact CB-CD2 4.01Å; D444-F448 HydrophobicContact CB-CE2 4.08Å; D444-F448 WeakPolarHBondContact O-CB 3.45Å; D444-F448 VanDerWaalsContact O-CD2 3.25Å; D444-F448 WeakPolarHBondContact O-CD2 3.42Å; D444-F448 PolarHBondContact O-N 2.95Å; F448-D451 PolarHBondContact O-N 3.12Å; F448-A452 VanDerWaalsContact O-CB 3.28Å; F448-A452 WeakPolarHBondContact O-CB 3.49Å; F448-A452 PolarHBondContact O-N 2.64Å; F448-I477 HydrophobicContact CB-CD1 4.17Å; F448-I477 HydrophobicContact CB-CG1 4.4Å; F448-I477 HydrophobicContact CB-CG2 3.88Å; F448-F481 HydrophobicContact CD2-CD2 4.27Å; F448-F481 HydrophobicContact CD2-CE1 4.32Å; F448-F481 AromaticContact CD2-CE2 3.47Å; F448-F481 HydrophobicContact CD2-CE2 3.47Å; F448-F481 VanDerWaalsContact CD2-CE2 3.47Å; F448-F481 AromaticContact CD2-CZ 3.5Å; F448-F481 HydrophobicContact CD2-CZ 3.5Å; F448-F481 HydrophobicContact CE2-CE1 4.01Å; F448-F481 AromaticContact CE2-CE2 3.82Å; F448-F481 HydrophobicContact CE2-CE2 3.82Å; F448-F481 AromaticContact CE2-CZ 3.32Å; F448-F481 HydrophobicContact CE2-CZ 3.32Å; F448-F481 HydrophobicContact CG-CE2 4.23Å; F448-F481 HydrophobicContact CZ-CZ 4.23Å
449	G	84.1	Confident	79.8	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-43.3	172	0	0	0	0	0	112.4	V445 A452 A453 L474	V445-G449 PolarHBondContact O-N 3.46Å; G449-A452 PolarHBondContact O-N 2.99Å; G449-A453 PolarHBondContact O-N 2.86Å; G449-A453 VanDerWaalsContact O-N 3.11Å; G449-L474 VanDerWaalsContact CA-CD2 3.41Å
450	L	84.5	Confident	78.5	Confident	12 Å²	12	35.6 Å²	35.6	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-46.1	173.8	-166.8	72.1	0	0	0	111.2	L446 A447 A452 A453 N454 V512	L446-L450 VanDerWaalsContact O-CB 3.3Å; L446-L450 WeakPolarHBondContact O-CB 3.28Å; L446-L450 PolarHBondContact O-N 3.01Å; L446-L450 VanDerWaalsContact O-N 3.1Å; A447-L450 PolarHBondContact O-N 2.72Å; L450-A452 VanDerWaalsContact C-N 3.33Å; L450-A452 PolarHBondContact O-N 2.8Å; L450-A453 PolarHBondContact O-N 3.14Å; L450-N454 WeakPolarHBondContact O-CB 3.18Å; L450-N454 PolarHBondContact O-N 2.94Å; L450-N454 PolarHBondContact O-ND2 3.09Å; L450-V512 HydrophobicContact CD2-CG2 3.82Å
451	D	83.6	Confident	77.1	Confident	21 Å²	21	39.3 Å²	39.3	11%	0.112	22%	0.218	C	C	.	.	H	α-helix	trans	-61.7	-37	176.6	-78.9	-14.6	0	0	0	112.5	K437 A447 F448 N454 K455	K437-D451 IonicContact NZ-OD2 3.77Å; K437-D451 PolarHBondContact NZ-OD2 2.89Å; A447-D451 PolarHBondContact O-N 3.15Å; F448-D451 PolarHBondContact O-N 3.12Å; D451-N454 PolarHBondContact O-N 3.46Å; D451-K455 WeakPolarHBondContact O-CG 2.93Å; D451-K455 PolarHBondContact O-N 3.2Å
452	A	81.1	Confident	75.5	Confident	6 Å²	6	44.3 Å²	44.3	5%	0.05	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-47.2	176.2	0	0	0	0	0	112.2	F448 G449 L450 N454 K455 M456 R473 I477	F448-A452 VanDerWaalsContact O-CB 3.28Å; F448-A452 WeakPolarHBondContact O-CB 3.49Å; F448-A452 PolarHBondContact O-N 2.64Å; G449-A452 PolarHBondContact O-N 2.99Å; L450-A452 VanDerWaalsContact C-N 3.33Å; L450-A452 PolarHBondContact O-N 2.8Å; A452-N454 VanDerWaalsContact C-N 3.3Å; A452-N454 PolarHBondContact O-N 2.91Å; A452-K455 PolarHBondContact O-N 3.17Å; A452-M456 WeakPolarHBondContact O-CG 3.27Å; A452-M456 PolarHBondContact O-N 3.32Å; A452-R473 HydrophobicContact CB-CG 4.43Å; A452-I477 HydrophobicContact CB-CD1 3.97Å
453	A	77.7	Confident	73.7	Confident	23 Å²	23	48.5 Å²	48.5	19%	0.19	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-38	174.6	0	0	0	0	0	112	G449 L450 A457 L470 I503	G449-A453 PolarHBondContact O-N 2.86Å; G449-A453 VanDerWaalsContact O-N 3.11Å; L450-A453 PolarHBondContact O-N 3.14Å; A453-A457 WeakPolarHBondContact O-CB 3.31Å; A453-A457 PolarHBondContact O-N 3.39Å; A453-A457 VanDerWaalsContact O-N 3.16Å; A453-L470 HydrophobicContact CB-CD1 4.1Å; A453-L470 HydrophobicContact CB-CD2 4.4Å; A453-I503 HydrophobicContact CB-CG2 3.61Å
454	N	77.1	Confident	72	Confident	39 Å²	39	57 Å²	57	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-65.6	-39.2	175.6	-75.5	-54	0	0	0	113.3	L450 D451 A452 S458 K1876	L450-N454 WeakPolarHBondContact O-CB 3.18Å; L450-N454 PolarHBondContact O-N 2.94Å; L450-N454 PolarHBondContact O-ND2 3.09Å; D451-N454 PolarHBondContact O-N 3.46Å; A452-N454 VanDerWaalsContact C-N 3.3Å; A452-N454 PolarHBondContact O-N 2.91Å; N454-S458 PolarHBondContact O-OG 2.9Å; N454-K1876 WeakPolarHBondContact ND2-CD 3.17Å; N454-K1876 PolarHBondContact OD1-NZ 3.42Å
455	K	76	Confident	70.2	Confident	89 Å²	89	64 Å²	64	39%	0.387	35%	0.346	S	S	.	.	H	α-helix	trans	-69.2	-46.1	178.3	-77.2	179.8	-179	-174.2	0	111.8	D451 A452 A457 S458 E459	D451-K455 WeakPolarHBondContact O-CG 2.93Å; D451-K455 PolarHBondContact O-N 3.2Å; A452-K455 PolarHBondContact O-N 3.17Å; K455-A457 VanDerWaalsContact C-N 3.26Å; K455-A457 PolarHBondContact O-N 3Å; K455-S458 CarbonylContact O-C 3.06Å; K455-S458 WeakPolarHBondContact O-CA 3.18Å; K455-S458 PolarHBondContact O-N 3.47Å; K455-S458 PolarHBondContact O-OG 2.9Å; K455-E459 WeakPolarHBondContact O-CG 3.5Å; K455-E459 PolarHBondContact O-N 3.09Å
456	M	68.8	Low	68.7	Low	47 Å²	47	71.3 Å²	71.3	23%	0.232	39%	0.385	C	S	.	.	H	α-helix	trans	-54	-42.8	172.9	-73.5	-177.6	167.9	0	0	112.1	A452 S458 V468 L470 R473	A452-M456 WeakPolarHBondContact O-CG 3.27Å; A452-M456 PolarHBondContact O-N 3.32Å; M456-S458 PolarHBondContact O-N 2.91Å; M456-V468 WeakPolarHBondContact CE-O 3.42Å; M456-L470 HydrophobicContact SD-CB 3.84Å; M456-L470 HydrophobicContact SD-CD1 3.78Å; M456-L470 HydrophobicContact SD-CG 4.39Å; M456-R473 HydrophobicContact CE-CB 4.21Å
457	A	66.5	Low	67.2	Low	82 Å²	82	79.5 Å²	79.5	68%	0.678	42%	0.424	S	S	*	.	H	α-helix	trans	-70	4.2	175.6	0	0	0	0	0	115.2	A453 K455	A453-A457 WeakPolarHBondContact O-CB 3.31Å; A453-A457 PolarHBondContact O-N 3.39Å; A453-A457 VanDerWaalsContact O-N 3.16Å; K455-A457 VanDerWaalsContact C-N 3.26Å; K455-A457 PolarHBondContact O-N 3Å
458	S	63.6	Low	66.1	Low	52 Å²	52	83.6 Å²	83.6	36%	0.364	45%	0.448	S	S	.	.	H	α-helix	trans	-129	-19.6	179.8	68.3	0	0	0	0	115	N454 K455 M456	N454-S458 PolarHBondContact O-OG 2.9Å; K455-S458 CarbonylContact O-C 3.06Å; K455-S458 WeakPolarHBondContact O-CA 3.18Å; K455-S458 PolarHBondContact O-N 3.47Å; K455-S458 PolarHBondContact O-OG 2.9Å; M456-S458 PolarHBondContact O-N 2.91Å
459	E	59.3	Low	65.4	Low	80 Å²	80	84.2 Å²	84.2	37%	0.374	46%	0.459	S	S	.	.	H	α-helix	trans	-90.8	-5.3	-173.1	-76.1	165	-178	0	0	114.3	K455 V461 V1871	K455-E459 WeakPolarHBondContact O-CG 3.5Å; K455-E459 PolarHBondContact O-N 3.09Å; E459-V461 PolarHBondContact O-N 3.01Å; E459-V1871 HydrophobicContact CG-CG1 3.77Å
460	E	53.1	Low	64.9	Low	156 Å²	156	86.2 Å²	86.2	73%	0.729	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	20.7	-174	-60.1	-167.1	125.7	0	0	117.4
461	V	51.9	Low	64.5	Low	130 Å²	130	91.7 Å²	91.7	79%	0.788	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.3	-12	-167.1	-170.4	0	0	0	0	114.8	E459	E459-V461 PolarHBondContact O-N 3.01Å
462	V	48.7	Very low	64.2	Low	108 Å²	108	92.5 Å²	92.5	66%	0.655	51%	0.505	S	S	*	.	S	Bend	trans	-139.6	138.2	-175.9	-169.9	0	0	0	0	112.8
463	D	48.6	Very low	64	Low	89 Å²	89	96.4 Å²	96.4	48%	0.476	52%	0.518	S	S	.	.			trans	64.4	119.4	174.6	-117.6	47.7	0	0	0	119.1	K465	D463-K465 VanDerWaalsContact C-N 3.35Å; D463-K465 PolarHBondContact O-N 2.92Å; D463-K465 IonicContact OD2-NZ 3.28Å; D463-K465 PolarHBondContact OD2-NZ 3.37Å
464	D	52.1	Low	64.1	Low	177 Å²	177	95.3 Å²	95.3	95%	0.947	51%	0.509	S	S	*	.			trans	-75.8	68.1	-178.1	-72.4	-56.3	0	0	0	113.1
465	K	49.7	Very low	64.2	Low	156 Å²	156	97.7 Å²	97.7	68%	0.678	52%	0.519	S	S	*	.	S	Bend	trans	-137.2	113.3	172.7	-60.3	-168.4	-170.2	86.2	0	113.8	D463	D463-K465 VanDerWaalsContact C-N 3.35Å; D463-K465 PolarHBondContact O-N 2.92Å; D463-K465 IonicContact OD2-NZ 3.28Å; D463-K465 PolarHBondContact OD2-NZ 3.37Å
466	D	55.6	Low	64.4	Low	156 Å²	156	96.2 Å²	96.2	83%	0.834	52%	0.52	S	S	*	.			trans	37.2	81.6	157.8	-57.4	-24.7	0	0	0	117.4	V468	D466-V468 PolarHBondContact O-N 3.32Å
467	Q	56	Low	65	Low	175 Å²	175	94.6 Å²	94.6	82%	0.818	51%	0.512	S	S	*	.			trans	-64.4	114.1	170.9	-69.1	-176.4	-20.8	0	0	111.6
468	V	64.3	Low	65.6	Low	86 Å²	86	90.8 Å²	90.8	52%	0.521	48%	0.481	S	S	.	.			trans	-80.4	132.2	173.2	-179.8	0	0	0	0	109.7	M456 D466 A472	M456-V468 WeakPolarHBondContact CE-O 3.42Å; D466-V468 PolarHBondContact O-N 3.32Å; V468-A472 HydrophobicContact CG1-CB 4.34Å
469	P	71.3	Confident	66.3	Low	84 Å²	84	93 Å²	93	55%	0.545	49%	0.485	S	S	.	.			trans	-68.5	150.9	178.6	27.5	-34.2	0	0	0	112.5	E471 A472 R473	P469-E471 VanDerWaalsContact C-N 3.31Å; P469-E471 PolarHBondContact O-N 3.5Å; P469-A472 HydrophobicContact CG-CB 4.01Å; P469-A472 PolarHBondContact O-N 3.04Å; P469-R473 PolarHBondContact O-N 2.78Å
470	L	74	Confident	67.2	Low	42 Å²	42	95.6 Å²	95.6	22%	0.22	50%	0.497	C	S	.	.	H	α-helix	trans	-57.2	-42.9	-177.8	-179.9	62.4	0	0	0	112.3	A453 M456 A472 R473 L474	A453-L470 HydrophobicContact CB-CD1 4.1Å; A453-L470 HydrophobicContact CB-CD2 4.4Å; M456-L470 HydrophobicContact SD-CB 3.84Å; M456-L470 HydrophobicContact SD-CD1 3.78Å; M456-L470 HydrophobicContact SD-CG 4.39Å; L470-A472 PolarHBondContact O-N 2.88Å; L470-R473 PolarHBondContact O-N 3.09Å; L470-R473 VanDerWaalsContact O-N 3.09Å; L470-L474 HydrophobicContact CD1-CD1 4.29Å; L470-L474 HydrophobicContact CD1-CD2 4.46Å; L470-L474 HydrophobicContact CD1-CG 4.12Å; L470-L474 HydrophobicContact CD2-CD1 4.43Å; L470-L474 HydrophobicContact CG-CD1 3.93Å; L470-L474 HydrophobicContact CG-CG 4.19Å; L470-L474 WeakPolarHBondContact O-CG 3.43Å; L470-L474 PolarHBondContact O-N 2.73Å
471	E	75.7	Confident	68.2	Low	128 Å²	128	90 Å²	90	60%	0.598	47%	0.47	S	S	*	.	H	α-helix	trans	-56.5	-50.9	-179.2	-66.3	171	176.6	0	0	111.6	P469 R473 L474 E475	P469-E471 VanDerWaalsContact C-N 3.31Å; P469-E471 PolarHBondContact O-N 3.5Å; E471-R473 VanDerWaalsContact C-N 3.26Å; E471-R473 PolarHBondContact O-N 3.39Å; E471-L474 PolarHBondContact O-N 3.33Å; E471-L474 VanDerWaalsContact O-N 3.1Å; E471-E475 WeakPolarHBondContact O-CG 3.48Å; E471-E475 PolarHBondContact O-N 3.26Å
472	A	76.8	Confident	69.2	Low	38 Å²	38	84.1 Å²	84.1	31%	0.314	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-30	177.1	0	0	0	0	0	113.3	V468 P469 L470 S476	V468-A472 HydrophobicContact CG1-CB 4.34Å; P469-A472 HydrophobicContact CG-CB 4.01Å; P469-A472 PolarHBondContact O-N 3.04Å; L470-A472 PolarHBondContact O-N 2.88Å; A472-S476 PolarHBondContact O-N 3.28Å; A472-S476 VanDerWaalsContact O-N 3.1Å
473	R	77.1	Confident	69.9	Low	88 Å²	88	80.2 Å²	80.2	33%	0.332	42%	0.417	S	S	.	.	H	α-helix	trans	-74.6	-36.7	174.9	-155.8	169.3	-172.7	172.8	3.3	111.2	A452 M456 P469 L470 E471 S476 I477	A452-R473 HydrophobicContact CB-CG 4.43Å; M456-R473 HydrophobicContact CE-CB 4.21Å; P469-R473 PolarHBondContact O-N 2.78Å; L470-R473 PolarHBondContact O-N 3.09Å; L470-R473 VanDerWaalsContact O-N 3.09Å; E471-R473 VanDerWaalsContact C-N 3.26Å; E471-R473 PolarHBondContact O-N 3.39Å; R473-S476 PolarHBondContact O-N 3.35Å; R473-S476 PolarHBondContact O-OG 3.37Å; R473-I477 WeakPolarHBondContact O-CD1 3.44Å; R473-I477 VanDerWaalsContact O-CG1 3.3Å; R473-I477 WeakPolarHBondContact O-CG1 3.37Å; R473-I477 PolarHBondContact O-N 2.86Å; R473-I477 VanDerWaalsContact O-N 3.15Å
474	L	80.6	Confident	70.4	Confident	0 Å²	0	83.9 Å²	83.9	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-68.9	-38.8	172.9	-66.4	175.7	0	0	0	112.2	G449 L470 E471 I477 I478 L499 C500 I503	G449-L474 VanDerWaalsContact CA-CD2 3.41Å; L470-L474 HydrophobicContact CD1-CD1 4.29Å; L470-L474 HydrophobicContact CD1-CD2 4.46Å; L470-L474 HydrophobicContact CD1-CG 4.12Å; L470-L474 HydrophobicContact CD2-CD1 4.43Å; L470-L474 HydrophobicContact CG-CD1 3.93Å; L470-L474 HydrophobicContact CG-CG 4.19Å; L470-L474 WeakPolarHBondContact O-CG 3.43Å; L470-L474 PolarHBondContact O-N 2.73Å; E471-L474 PolarHBondContact O-N 3.33Å; E471-L474 VanDerWaalsContact O-N 3.1Å; L474-I477 PolarHBondContact O-N 2.69Å; L474-I478 WeakPolarHBondContact O-CG1 3.3Å; L474-I478 PolarHBondContact O-N 3.35Å; L474-L499 HydrophobicContact CB-CD2 4.38Å; L474-L499 HydrophobicContact CD1-CG 4.48Å; L474-L499 HydrophobicContact CD2-CD2 3.93Å; L474-L499 HydrophobicContact CD2-CG 4.36Å; L474-C500 VanDerWaalsContact CD1-SG 3.54Å; L474-I503 HydrophobicContact CD1-CD1 4.22Å; L474-I503 HydrophobicContact CD2-CD1 3.81Å
475	E	79.1	Confident	70.6	Confident	88 Å²	88	80.3 Å²	80.3	41%	0.411	42%	0.417	S	S	.	.	H	α-helix	trans	-56.3	-49.6	170.1	-74.3	175.9	154.1	0	0	110.5	E471 I477 I478 E479 V496	E471-E475 WeakPolarHBondContact O-CG 3.48Å; E471-E475 PolarHBondContact O-N 3.26Å; E475-I477 VanDerWaalsContact C-N 3.29Å; E475-I477 PolarHBondContact O-N 3.45Å; E475-I478 PolarHBondContact O-N 3.25Å; E475-I478 VanDerWaalsContact O-N 3.12Å; E475-E479 WeakPolarHBondContact O-CG 3.43Å; E475-E479 PolarHBondContact O-N 2.83Å; E475-V496 HydrophobicContact CG-CG2 3.86Å
476	S	79.9	Confident	70.9	Confident	59 Å²	59	76.6 Å²	76.6	41%	0.413	40%	0.401	S	S	.	.	H	α-helix	trans	-61.7	-32.7	178.3	69.9	0	0	0	0	114.1	A472 R473 E480	A472-S476 PolarHBondContact O-N 3.28Å; A472-S476 VanDerWaalsContact O-N 3.1Å; R473-S476 PolarHBondContact O-N 3.35Å; R473-S476 PolarHBondContact O-OG 3.37Å; S476-E480 WeakPolarHBondContact O-CB 2.97Å; S476-E480 PolarHBondContact O-N 3.45Å
477	I	81.1	Confident	70.8	Confident	13 Å²	13	74.8 Å²	74.8	7%	0.067	40%	0.398	C	S	.	.	H	α-helix	trans	-74.4	-36.6	176.2	-69.5	162.2	0	0	0	110.8	F448 A452 R473 L474 E475 E480 F481	F448-I477 HydrophobicContact CB-CD1 4.17Å; F448-I477 HydrophobicContact CB-CG1 4.4Å; F448-I477 HydrophobicContact CB-CG2 3.88Å; A452-I477 HydrophobicContact CB-CD1 3.97Å; R473-I477 WeakPolarHBondContact O-CD1 3.44Å; R473-I477 VanDerWaalsContact O-CG1 3.3Å; R473-I477 WeakPolarHBondContact O-CG1 3.37Å; R473-I477 PolarHBondContact O-N 2.86Å; R473-I477 VanDerWaalsContact O-N 3.15Å; L474-I477 PolarHBondContact O-N 2.69Å; E475-I477 VanDerWaalsContact C-N 3.29Å; E475-I477 PolarHBondContact O-N 3.45Å; I477-E480 PolarHBondContact O-N 2.95Å; I477-F481 HydrophobicContact CG2-CD2 4.11Å; I477-F481 WeakPolarHBondContact O-CD2 3.34Å; I477-F481 PolarHBondContact O-N 3.48Å; I477-F481 VanDerWaalsContact O-N 3.09Å
478	I	80	Confident	70.9	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.01	39%	0.386	C	S	.	.	H	α-helix	trans	-67.4	-41.4	173.9	-76.1	165.2	0	0	0	110.4	V445 L474 E475 L482 G483 Y492 V496 L499	V445-I478 HydrophobicContact CG1-CD1 4.5Å; V445-I478 HydrophobicContact CG1-CG1 3.73Å; V445-I478 HydrophobicContact CG2-CG1 4.48Å; L474-I478 WeakPolarHBondContact O-CG1 3.3Å; L474-I478 PolarHBondContact O-N 3.35Å; E475-I478 PolarHBondContact O-N 3.25Å; E475-I478 VanDerWaalsContact O-N 3.12Å; I478-L482 HydrophobicContact CG2-CD1 4.14Å; I478-L482 WeakPolarHBondContact O-CA 3.27Å; I478-L482 WeakPolarHBondContact O-CB 3.35Å; I478-L482 PolarHBondContact O-N 3.04Å; I478-G483 PolarHBondContact O-N 3.31Å; I478-Y492 HydrophobicContact CG2-CD1 3.5Å; I478-Y492 VanDerWaalsContact CG2-CD1 3.5Å; I478-Y492 HydrophobicContact CG2-CD2 4.25Å; I478-Y492 HydrophobicContact CG2-CE1 4.01Å; I478-Y492 HydrophobicContact CG2-CG 3.64Å; I478-V496 HydrophobicContact CD1-CB 4.47Å; I478-V496 HydrophobicContact CD1-CG2 3.59Å; I478-L499 HydrophobicContact CD1-CD2 3.92Å; I478-L499 HydrophobicContact CG1-CD2 4.34Å
479	E	77.7	Confident	70.3	Confident	99 Å²	99	75.7 Å²	75.7	46%	0.463	39%	0.394	S	S	.	.	H	α-helix	trans	-61.1	-43.6	172.8	-71.8	-177.8	178.7	0	0	112	E475 G483 Y489	E475-E479 WeakPolarHBondContact O-CG 3.43Å; E475-E479 PolarHBondContact O-N 2.83Å; E479-G483 VanDerWaalsContact O-CA 3.31Å; E479-G483 WeakPolarHBondContact O-CA 3.24Å; E479-G483 PolarHBondContact O-N 3.41Å; E479-G483 VanDerWaalsContact O-N 3.09Å; E479-Y489 WeakPolarHBondContact OE1-CE2 3.49Å
480	E	77.3	Confident	69.6	Low	133 Å²	133	77.6 Å²	77.6	62%	0.621	40%	0.404	S	S	*	.	H	α-helix	trans	-63.7	-41.6	179.4	-175	174.2	-158.9	0	0	113.4	S476 I477	S476-E480 WeakPolarHBondContact O-CB 2.97Å; S476-E480 PolarHBondContact O-N 3.45Å; I477-E480 PolarHBondContact O-N 2.95Å
481	F	74.1	Confident	69.1	Low	38 Å²	38	79.5 Å²	79.5	17%	0.167	42%	0.415	C	S	.	.	H	α-helix	trans	-108.2	-13.6	-170.8	-69.5	-80.1	0	0	0	115.7	G441 D444 V445 F448 I477	G441-F481 WeakPolarHBondContact CA-O 3.33Å; D444-F481 HydrophobicContact CB-CD1 3.73Å; D444-F481 HydrophobicContact CB-CE1 3.84Å; D444-F481 HydrophobicContact CB-CG 4.19Å; D444-F481 HydrophobicContact CB-CZ 4.4Å; V445-F481 HydrophobicContact CG2-CB 3.62Å; F448-F481 HydrophobicContact CD2-CD2 4.27Å; F448-F481 HydrophobicContact CD2-CE1 4.32Å; F448-F481 AromaticContact CD2-CE2 3.47Å; F448-F481 HydrophobicContact CD2-CE2 3.47Å; F448-F481 VanDerWaalsContact CD2-CE2 3.47Å; F448-F481 AromaticContact CD2-CZ 3.5Å; F448-F481 HydrophobicContact CD2-CZ 3.5Å; F448-F481 HydrophobicContact CE2-CE1 4.01Å; F448-F481 AromaticContact CE2-CE2 3.82Å; F448-F481 HydrophobicContact CE2-CE2 3.82Å; F448-F481 AromaticContact CE2-CZ 3.32Å; F448-F481 HydrophobicContact CE2-CZ 3.32Å; F448-F481 HydrophobicContact CG-CE2 4.23Å; F448-F481 HydrophobicContact CZ-CZ 4.23Å; I477-F481 HydrophobicContact CG2-CD2 4.11Å; I477-F481 WeakPolarHBondContact O-CD2 3.34Å; I477-F481 PolarHBondContact O-N 3.48Å; I477-F481 VanDerWaalsContact O-N 3.09Å
482	L	74.5	Confident	68.7	Low	7 Å²	7	75 Å²	75	4%	0.037	39%	0.392	C	S	.	.	H	α-helix	trans	-118.7	-18.2	174.9	-69.8	161.1	0	0	0	113.4	V445 I478 D484 L485 H486 Y492	V445-L482 HydrophobicContact CG2-CD1 3.94Å; V445-L482 HydrophobicContact CG2-CG 4.11Å; I478-L482 HydrophobicContact CG2-CD1 4.14Å; I478-L482 WeakPolarHBondContact O-CA 3.27Å; I478-L482 WeakPolarHBondContact O-CB 3.35Å; I478-L482 PolarHBondContact O-N 3.04Å; L482-D484 VanDerWaalsContact C-N 3.34Å; L482-D484 PolarHBondContact O-N 2.88Å; L482-L485 PolarHBondContact O-N 3.12Å; L482-H486 PolarHBondContact O-N 3.11Å; L482-Y492 HydrophobicContact CB-CE1 4.16Å; L482-Y492 PolarHBondContact O-OH 2.95Å
483	G	62.6	Low	68.5	Low	27 Å²	27	77.1 Å²	77.1	28%	0.278	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-39	-177.5	0	0	0	0	0	114.2	I478 E479 L485 H486	I478-G483 PolarHBondContact O-N 3.31Å; E479-G483 VanDerWaalsContact O-CA 3.31Å; E479-G483 WeakPolarHBondContact O-CA 3.24Å; E479-G483 PolarHBondContact O-N 3.41Å; E479-G483 VanDerWaalsContact O-N 3.09Å; G483-L485 PolarHBondContact O-N 2.99Å; G483-H486 CarbonylContact O-C 3.58Å; G483-H486 PolarHBondContact O-N 2.9Å
484	D	59.1	Low	68.4	Low	165 Å²	165	77.8 Å²	77.8	88%	0.882	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-23	176	-83.9	-8.2	0	0	0	113.6	L482	L482-D484 VanDerWaalsContact C-N 3.34Å; L482-D484 PolarHBondContact O-N 2.88Å
485	L	56	Low	68.2	Low	103 Å²	103	78.5 Å²	78.5	54%	0.539	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-30.6	-179	-78	135	0	0	0	113.1	L482 G483	L482-L485 PolarHBondContact O-N 3.12Å; G483-L485 PolarHBondContact O-N 2.99Å
486	H	56.1	Low	68.3	Low	77 Å²	77	74.9 Å²	74.9	36%	0.356	40%	0.399	S	S	.	.			trans	-149.1	117.5	175.7	-85.6	-71.8	0	0	0	112.6	L482 G483 D488 Y492	L482-H486 PolarHBondContact O-N 3.11Å; G483-H486 CarbonylContact O-C 3.58Å; G483-H486 PolarHBondContact O-N 2.9Å; H486-D488 PolarHBondContact O-N 3.41Å; H486-D488 VanDerWaalsContact O-N 3.14Å; H486-Y492 PolarHBondContact O-OH 2.89Å
487	P	53.8	Low	68.4	Low	119 Å²	119	77 Å²	77	77%	0.773	41%	0.406	S	S	*	.			trans	-79.1	10.1	-176.7	33.2	-37.6	0	0	0	115	Y489	P487-Y489 PolarHBondContact O-N 3.04Å
488	D	58.3	Low	68.5	Low	105 Å²	105	77.9 Å²	77.9	56%	0.561	41%	0.41	S	S	*	.			trans	-81.2	67.8	-179.2	-75.9	-32.5	0	0	0	111.7	H486 T490 N491	H486-D488 PolarHBondContact O-N 3.41Å; H486-D488 VanDerWaalsContact O-N 3.14Å; D488-T490 PolarHBondContact O-N 2.87Å; D488-N491 PolarHBondContact O-N 3.12Å
489	Y	51	Low	68.6	Low	174 Å²	174	77.8 Å²	77.8	68%	0.682	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-38.6	-32.7	179.1	176.1	-100	0	0	0	115.8	E479 P487 N491	E479-Y489 WeakPolarHBondContact OE1-CE2 3.49Å; P487-Y489 PolarHBondContact O-N 3.04Å; Y489-N491 PolarHBondContact O-N 3.25Å
490	T	57.3	Low	68.9	Low	124 Å²	124	73.9 Å²	73.9	76%	0.761	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-83.5	0.8	-170.8	57	0	0	0	0	115.8	D488	D488-T490 PolarHBondContact O-N 2.87Å
491	N	62.4	Low	69.2	Low	82 Å²	82	70.4 Å²	70.4	44%	0.439	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-112.3	-8.4	-167.6	-151.8	97.1	0	0	0	115.9	D488 Y489 T493	D488-N491 PolarHBondContact O-N 3.12Å; Y489-N491 PolarHBondContact O-N 3.25Å; N491-T493 PolarHBondContact O-N 2.72Å; N491-T493 VanDerWaalsContact O-N 3.13Å
492	Y	67.6	Low	69.6	Low	34 Å²	34	68.8 Å²	68.8	13%	0.133	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-0.8	-172.3	-68.4	-68.1	0	0	0	115.7	I478 L482 H486 D494 E495 V496	I478-Y492 HydrophobicContact CG2-CD1 3.5Å; I478-Y492 VanDerWaalsContact CG2-CD1 3.5Å; I478-Y492 HydrophobicContact CG2-CD2 4.25Å; I478-Y492 HydrophobicContact CG2-CE1 4.01Å; I478-Y492 HydrophobicContact CG2-CG 3.64Å; L482-Y492 HydrophobicContact CB-CE1 4.16Å; L482-Y492 PolarHBondContact O-OH 2.95Å; H486-Y492 PolarHBondContact O-OH 2.89Å; Y492-D494 VanDerWaalsContact C-N 3.31Å; Y492-D494 PolarHBondContact O-N 3.11Å; Y492-E495 PolarHBondContact O-N 2.91Å; Y492-V496 WeakPolarHBondContact O-CG2 3.49Å; Y492-V496 PolarHBondContact O-N 2.8Å
493	T	72.9	Confident	70	Confident	82 Å²	82	68.9 Å²	68.9	50%	0.503	37%	0.37	S	S	.	.	H	α-helix	trans	-64.4	-31.8	-178	47.3	0	0	0	0	113.4	N491 N497	N491-T493 PolarHBondContact O-N 2.72Å; N491-T493 VanDerWaalsContact O-N 3.13Å; T493-N497 WeakPolarHBondContact O-CB 3.45Å; T493-N497 PolarHBondContact O-N 3.02Å; T493-N497 VanDerWaalsContact O-N 3.1Å; T493-N497 PolarHBondContact O-ND2 3.42Å
494	D	75.3	Confident	70.8	Confident	102 Å²	102	72.9 Å²	72.9	55%	0.545	39%	0.385	S	S	.	.	H	α-helix	trans	-69.3	-42.9	174.7	-80.5	-5.8	0	0	0	110.5	Y492 N497 M498	Y492-D494 VanDerWaalsContact C-N 3.31Å; Y492-D494 PolarHBondContact O-N 3.11Å; D494-N497 PolarHBondContact O-N 3.27Å; D494-M498 HydrophobicContact CB-CE 3.99Å; D494-M498 WeakPolarHBondContact O-CE 3.45Å; D494-M498 WeakPolarHBondContact O-CG 3.4Å; D494-M498 PolarHBondContact O-N 3.28Å
495	E	76.9	Confident	71.7	Confident	16 Å²	16	71.1 Å²	71.1	8%	0.075	37%	0.371	C	S	.	.	H	α-helix	trans	-65	-41.5	176.2	-70.1	85.5	167.2	0	0	112.8	R416 L419 Y492 M498 L499	R416-E495 HydrophobicContact CB-CG 4.22Å; R416-E495 WeakPolarHBondContact CB-OE1 3.49Å; R416-E495 WeakPolarHBondContact CD-OE1 3.42Å; L419-E495 HydrophobicContact CD2-CB 3.92Å; L419-E495 HydrophobicContact CD2-CG 4.04Å; Y492-E495 PolarHBondContact O-N 2.91Å; E495-M498 PolarHBondContact O-N 3Å; E495-L499 VanDerWaalsContact O-CB 3.3Å; E495-L499 WeakPolarHBondContact O-CB 3.47Å; E495-L499 PolarHBondContact O-N 3.18Å
496	V	80.5	Confident	72.7	Confident	12 Å²	12	67.9 Å²	67.9	7%	0.073	35%	0.352	C	S	.	.	H	α-helix	trans	-59.9	-45.4	172.7	171.8	0	0	0	0	110.5	E475 I478 Y492 L499 C500	E475-V496 HydrophobicContact CG-CG2 3.86Å; I478-V496 HydrophobicContact CD1-CB 4.47Å; I478-V496 HydrophobicContact CD1-CG2 3.59Å; Y492-V496 WeakPolarHBondContact O-CG2 3.49Å; Y492-V496 PolarHBondContact O-N 2.8Å; V496-L499 PolarHBondContact O-N 2.72Å; V496-C500 WeakPolarHBondContact O-CB 3.35Å; V496-C500 PolarHBondContact O-N 3.13Å; V496-C500 PolarHBondContact O-SG 2.88Å; V496-C500 VanDerWaalsContact O-SG 3.4Å
497	N	81.7	Confident	73.9	Confident	103 Å²	103	67.3 Å²	67.3	55%	0.551	35%	0.354	S	S	*	.	H	α-helix	trans	-63.1	-44	177.2	-81.4	-65.6	0	0	0	112.2	T493 D494 L499 C500 E501	T493-N497 WeakPolarHBondContact O-CB 3.45Å; T493-N497 PolarHBondContact O-N 3.02Å; T493-N497 VanDerWaalsContact O-N 3.1Å; T493-N497 PolarHBondContact O-ND2 3.42Å; D494-N497 PolarHBondContact O-N 3.27Å; N497-L499 VanDerWaalsContact C-N 3.33Å; N497-L499 PolarHBondContact O-N 3.27Å; N497-C500 PolarHBondContact O-N 2.89Å; N497-E501 PolarHBondContact O-N 3.31Å
498	M	82.8	Confident	74.9	Confident	31 Å²	31	63.9 Å²	63.9	15%	0.153	33%	0.33	C	S	.	.	H	α-helix	trans	-61.4	-40.6	174.8	-73.3	-177.6	-117.3	0	0	112	Y423 D494 E495 E501 I502	Y423-M498 HydrophobicContact CD1-CG 4.31Å; Y423-M498 HydrophobicContact CD1-SD 4.04Å; Y423-M498 HydrophobicContact CD2-CB 3.8Å; Y423-M498 HydrophobicContact CD2-CG 3.74Å; Y423-M498 HydrophobicContact CD2-SD 4.31Å; Y423-M498 HydrophobicContact CE1-CG 4.31Å; Y423-M498 HydrophobicContact CE1-SD 4.42Å; Y423-M498 HydrophobicContact CE2-CB 4.04Å; Y423-M498 HydrophobicContact CE2-CG 3.75Å; Y423-M498 HydrophobicContact CG-CB 4.37Å; Y423-M498 HydrophobicContact CG-CG 4.04Å; Y423-M498 HydrophobicContact CG-SD 3.98Å; D494-M498 HydrophobicContact CB-CE 3.99Å; D494-M498 WeakPolarHBondContact O-CE 3.45Å; D494-M498 WeakPolarHBondContact O-CG 3.4Å; D494-M498 PolarHBondContact O-N 3.28Å; E495-M498 PolarHBondContact O-N 3Å; M498-E501 PolarHBondContact O-N 2.92Å; M498-I502 WeakPolarHBondContact O-CB 3.46Å; M498-I502 VanDerWaalsContact O-CG1 3.27Å; M498-I502 WeakPolarHBondContact O-CG1 3.43Å; M498-I502 PolarHBondContact O-N 3.11Å
499	L	83.4	Confident	76.1	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.3	-40.9	177.5	-174.1	57.9	0	0	0	111.6	V445 L446 L474 I478 E495 V496 N497 I502 I503	V445-L499 HydrophobicContact CG1-CD2 3.66Å; L446-L499 HydrophobicContact CD2-CD1 3.72Å; L474-L499 HydrophobicContact CB-CD2 4.38Å; L474-L499 HydrophobicContact CD1-CG 4.48Å; L474-L499 HydrophobicContact CD2-CD2 3.93Å; L474-L499 HydrophobicContact CD2-CG 4.36Å; I478-L499 HydrophobicContact CD1-CD2 3.92Å; I478-L499 HydrophobicContact CG1-CD2 4.34Å; E495-L499 VanDerWaalsContact O-CB 3.3Å; E495-L499 WeakPolarHBondContact O-CB 3.47Å; E495-L499 PolarHBondContact O-N 3.18Å; V496-L499 PolarHBondContact O-N 2.72Å; N497-L499 VanDerWaalsContact C-N 3.33Å; N497-L499 PolarHBondContact O-N 3.27Å; L499-I502 PolarHBondContact O-N 3.11Å; L499-I503 HydrophobicContact CD1-CD1 3.78Å; L499-I503 HydrophobicContact CD1-CG1 4.26Å; L499-I503 HydrophobicContact CG-CD1 3.8Å; L499-I503 VanDerWaalsContact O-CB 3.29Å; L499-I503 WeakPolarHBondContact O-CB 3.28Å; L499-I503 VanDerWaalsContact O-CG1 3.26Å; L499-I503 WeakPolarHBondContact O-CG1 3.24Å; L499-I503 PolarHBondContact O-N 2.97Å
500	C	83.1	Confident	77.8	Confident	17 Å²	17	50.7 Å²	50.7	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-40.6	172.5	-76.8	0	0	0	0	112.8	L474 V496 N497 I503 N504	L474-C500 VanDerWaalsContact CD1-SG 3.54Å; V496-C500 WeakPolarHBondContact O-CB 3.35Å; V496-C500 PolarHBondContact O-N 3.13Å; V496-C500 PolarHBondContact O-SG 2.88Å; V496-C500 VanDerWaalsContact O-SG 3.4Å; N497-C500 PolarHBondContact O-N 2.89Å; C500-I503 PolarHBondContact O-N 2.9Å; C500-N504 VanDerWaalsContact O-CB 3.29Å; C500-N504 WeakPolarHBondContact O-CB 3.35Å; C500-N504 PolarHBondContact O-N 3.21Å; C500-N504 PolarHBondContact O-ND2 2.94Å
501	E	83.3	Confident	79.2	Confident	60 Å²	60	44.8 Å²	44.8	28%	0.28	24%	0.235	S	C	.	.	H	α-helix	trans	-64.3	-45	175.5	-169.5	-177.4	153.9	0	0	110.9	Y423 I427 N497 M498 I503 N504 E505 Y506	Y423-E501 HydrophobicContact CE2-CB 4.38Å; Y423-E501 HydrophobicContact CE2-CG 4.5Å; Y423-E501 VanDerWaalsContact CE2-OE2 3.29Å; Y423-E501 WeakPolarHBondContact CE2-OE2 3.29Å; Y423-E501 PolarHBondContact OH-OE2 2.85Å; I427-E501 VanDerWaalsContact CD1-OE1 3.25Å; I427-E501 WeakPolarHBondContact CD1-OE1 3.29Å; N497-E501 PolarHBondContact O-N 3.31Å; M498-E501 PolarHBondContact O-N 2.92Å; E501-I503 PolarHBondContact O-N 3.39Å; E501-N504 PolarHBondContact O-N 2.77Å; E501-E505 PolarHBondContact O-N 2.76Å; E501-Y506 HydrophobicContact CG-CE2 4.41Å
502	I	83.5	Confident	80.4	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-58.1	-47.9	173.9	-75.8	169.4	0	0	0	111.4	V422 Y423 M426 L446 M498 L499 Y506 T507 V510	V422-I502 HydrophobicContact CG1-CD1 4.39Å; Y423-I502 HydrophobicContact CD2-CD1 4.24Å; Y423-I502 HydrophobicContact CD2-CG1 4.33Å; M426-I502 HydrophobicContact CE-CB 4.34Å; M426-I502 HydrophobicContact CE-CD1 4.5Å; M426-I502 HydrophobicContact CE-CG1 3.83Å; M426-I502 HydrophobicContact CE-CG2 4.01Å; M426-I502 HydrophobicContact SD-CD1 3.99Å; M426-I502 HydrophobicContact SD-CG1 3.96Å; L446-I502 HydrophobicContact CD2-CD1 4.43Å; L446-I502 HydrophobicContact CD2-CG2 4.1Å; M498-I502 WeakPolarHBondContact O-CB 3.46Å; M498-I502 VanDerWaalsContact O-CG1 3.27Å; M498-I502 WeakPolarHBondContact O-CG1 3.43Å; M498-I502 PolarHBondContact O-N 3.11Å; L499-I502 PolarHBondContact O-N 3.11Å; I502-Y506 CarbonylContact O-C 3.59Å; I502-Y506 VanDerWaalsContact O-CA 3.29Å; I502-Y506 WeakPolarHBondContact O-CA 3.2Å; I502-Y506 PolarHBondContact O-N 2.78Å; I502-Y506 VanDerWaalsContact O-N 3.15Å; I502-T507 PolarHBondContact O-N 2.84Å; I502-T507 VanDerWaalsContact O-N 3.08Å; I502-V510 HydrophobicContact CG2-CG2 3.75Å
503	I	81.9	Confident	81.3	Confident	8 Å²	8	39.5 Å²	39.5	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-74.6	-23.1	-176.9	-71.6	172.4	0	0	0	112.7	A453 L474 L499 C500 E501 T507	A453-I503 HydrophobicContact CB-CG2 3.61Å; L474-I503 HydrophobicContact CD1-CD1 4.22Å; L474-I503 HydrophobicContact CD2-CD1 3.81Å; L499-I503 HydrophobicContact CD1-CD1 3.78Å; L499-I503 HydrophobicContact CD1-CG1 4.26Å; L499-I503 HydrophobicContact CG-CD1 3.8Å; L499-I503 VanDerWaalsContact O-CB 3.29Å; L499-I503 WeakPolarHBondContact O-CB 3.28Å; L499-I503 VanDerWaalsContact O-CG1 3.26Å; L499-I503 WeakPolarHBondContact O-CG1 3.24Å; L499-I503 PolarHBondContact O-N 2.97Å; C500-I503 PolarHBondContact O-N 2.9Å; E501-I503 PolarHBondContact O-N 3.39Å; I503-T507 WeakPolarHBondContact O-CG2 3.44Å
504	N	80.4	Confident	81.9	Confident	112 Å²	112	37 Å²	37	60%	0.599	19%	0.192	S	C	*	.	H	α-helix	trans	-95.5	-51.8	179.3	-73.5	-62.1	0	0	0	113.3	C500 E501	C500-N504 VanDerWaalsContact O-CB 3.29Å; C500-N504 WeakPolarHBondContact O-CB 3.35Å; C500-N504 PolarHBondContact O-N 3.21Å; C500-N504 PolarHBondContact O-ND2 2.94Å; E501-N504 PolarHBondContact O-N 2.77Å
505	E	76.5	Confident	81.8	Confident	127 Å²	127	32.5 Å²	32.5	59%	0.593	17%	0.168	S	C	*	.	H	α-helix	trans	-88	-34.6	-176.1	-63.5	-158.6	166.1	0	0	112.8	E501	E501-E505 PolarHBondContact O-N 2.76Å
506	Y	78.6	Confident	81.8	Confident	35 Å²	35	37.3 Å²	37.3	14%	0.137	19%	0.191	C	C	.	.			trans	-115.1	26.3	-172.1	-53.6	-87.5	0	0	0	112.8	M426 I427 E501 I502 N508 L509	M426-Y506 VanDerWaalsContact CE-CB 3.42Å; M426-Y506 HydrophobicContact CE-CG 4.04Å; I427-Y506 HydrophobicContact CG1-CE2 4.11Å; E501-Y506 HydrophobicContact CG-CE2 4.41Å; I502-Y506 CarbonylContact O-C 3.59Å; I502-Y506 VanDerWaalsContact O-CA 3.29Å; I502-Y506 WeakPolarHBondContact O-CA 3.2Å; I502-Y506 PolarHBondContact O-N 2.78Å; I502-Y506 VanDerWaalsContact O-N 3.15Å; Y506-N508 PolarHBondContact O-N 3.25Å; Y506-L509 HydrophobicContact CD1-CD1 3.81Å; Y506-L509 HydrophobicContact CD1-CG 4.35Å; Y506-L509 HydrophobicContact CG-CD1 4.41Å; Y506-L509 PolarHBondContact O-N 3.22Å
507	T	79.7	Confident	81.5	Confident	65 Å²	65	45.1 Å²	45.1	40%	0.399	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-39	-40.6	168.2	43.9	0	0	0	0	111.9	I502 I503 H1880	I502-T507 PolarHBondContact O-N 2.84Å; I502-T507 VanDerWaalsContact O-N 3.08Å; I503-T507 WeakPolarHBondContact O-CG2 3.44Å; T507-H1880 PolarHBondContact O-CE1 2.66Å
508	N	76.5	Confident	81.2	Confident	48 Å²	48	42.7 Å²	42.7	26%	0.257	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	23.7	-174.4	55.6	15.9	0	0	0	113.4	Y506 H1880 Q1881	Y506-N508 PolarHBondContact O-N 3.25Å; N508-H1880 VanDerWaalsContact CA-CE1 3.47Å; N508-H1880 WeakPolarHBondContact CA-CE1 3.4Å; N508-H1880 WeakPolarHBondContact CA-ND1 3.5Å; N508-H1880 CarbonylContact O-C 3.56Å; N508-H1880 WeakPolarHBondContact O-CB 3Å; N508-H1880 VanDerWaalsContact O-CG 3.26Å; N508-H1880 PolarHBondContact O-ND1 3.05Å; N508-H1880 VanDerWaalsContact O-ND1 3.08Å; N508-Q1881 WeakPolarHBondContact O-CA 3.04Å; N508-Q1881 WeakPolarHBondContact O-CB 3.26Å; N508-Q1881 WeakPolarHBondContact O-CG 3.38Å; N508-Q1881 PolarHBondContact O-N 2.96Å; N508-Q1881 PolarHBondContact OD1-NE2 2.65Å
509	L	82.5	Confident	80.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-28.4	162.8	-89.1	-172.1	0	0	0	114.9	M426 P432 I433 Y506 H1880 Q1881	M426-L509 HydrophobicContact CB-CD1 3.76Å; M426-L509 HydrophobicContact CE-CB 3.78Å; M426-L509 HydrophobicContact CE-CD1 3.79Å; M426-L509 HydrophobicContact CE-CG 4.4Å; M426-L509 HydrophobicContact CG-CD1 3.85Å; P432-L509 HydrophobicContact CB-CD2 4.35Å; I433-L509 PolarHBondContact N-O 3.35Å; Y506-L509 HydrophobicContact CD1-CD1 3.81Å; Y506-L509 HydrophobicContact CD1-CG 4.35Å; Y506-L509 HydrophobicContact CG-CD1 4.41Å; Y506-L509 PolarHBondContact O-N 3.22Å; L509-H1880 WeakPolarHBondContact O-CB 3.28Å; L509-H1880 PolarHBondContact O-CD2 2.9Å; L509-H1880 VanDerWaalsContact O-CD2 3.28Å; L509-Q1881 HydrophobicContact CD2-CB 4Å; L509-Q1881 VanDerWaalsContact CD2-CD 3.47Å; L509-Q1881 HydrophobicContact CD2-CG 4.25Å
510	V	86.6	Confident	80.6	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	104.6	-162.8	-175.1	0	0	0	0	113.6	M426 V435 L446 I502 H1880	M426-V510 HydrophobicContact CE-CG2 3.46Å; M426-V510 VanDerWaalsContact CE-CG2 3.46Å; M426-V510 HydrophobicContact SD-CG2 3.83Å; V435-V510 HydrophobicContact CG2-CG1 3.51Å; L446-V510 HydrophobicContact CD2-CG1 4.41Å; I502-V510 HydrophobicContact CG2-CG2 3.75Å; V510-H1880 PolarHBondContact N-CD2 2.9Å; V510-H1880 PolarHBondContact N-NE2 3.48Å; V510-H1880 PolarHBondContact O-CD2 3.44Å; V510-H1880 PolarHBondContact O-NE2 3.09Å
511	S	86.6	Confident	80.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.2	-166.8	46	0	0	0	0	113	I433 V434 V435 T1878 T1879 H1880	I433-S511 PolarHBondContact O-N 3.41Å; I433-S511 PolarHBondContact O-OG 2.86Å; V434-S511 CarbonylContact C-O 2.93Å; V434-S511 WeakPolarHBondContact CA-O 2.95Å; V434-S511 WeakPolarHBondContact CA-OG 3.45Å; V435-S511 PolarHBondContact N-O 3.16Å; S511-T1878 WeakPolarHBondContact CA-OG1 3.09Å; S511-T1878 WeakPolarHBondContact CB-O 3.18Å; S511-T1878 VanDerWaalsContact CB-OG1 3.31Å; S511-T1878 WeakPolarHBondContact CB-OG1 3.16Å; S511-T1879 WeakPolarHBondContact CB-O 3.24Å; S511-T1879 PolarHBondContact OG-O 2.94Å; S511-H1880 VanDerWaalsContact CA-CD2 3.46Å; S511-H1880 WeakPolarHBondContact CA-CD2 3.26Å; S511-H1880 WeakPolarHBondContact CB-CD2 3.34Å; S511-H1880 PolarHBondContact N-CD2 2.96Å; S511-H1880 PolarHBondContact N-NE2 2.89Å
512	V	87.7	Confident	80.5	Confident	4 Å²	4	44 Å²	44	2%	0.024	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	119.1	-174.3	-169.7	0	0	0	0	111.5	V435 K437 A447 L450 Y524 K1876 S1877 T1878	V435-V512 WeakPolarHBondContact O-CA 3.26Å; K437-V512 HydrophobicContact CB-CG1 3.56Å; K437-V512 HydrophobicContact CD-CG1 3.84Å; K437-V512 HydrophobicContact CG-CG1 4.34Å; A447-V512 HydrophobicContact CB-CG1 3.75Å; A447-V512 HydrophobicContact CB-CG2 4.15Å; L450-V512 HydrophobicContact CD2-CG2 3.82Å; V512-Y524 WeakPolarHBondContact O-CE1 3.15Å; V512-K1876 CarbonylContact C-O 3.09Å; V512-K1876 WeakPolarHBondContact CA-O 3.43Å; V512-K1876 VanDerWaalsContact CB-O 3.23Å; V512-K1876 WeakPolarHBondContact CB-O 3.43Å; V512-K1876 PolarHBondContact N-O 2.99Å; V512-K1876 CarbonylContact O-C 3.55Å; V512-S1877 PolarHBondContact O-N 2.8Å; V512-T1878 PolarHBondContact N-OG1 3.47Å; V512-T1878 VanDerWaalsContact N-OG1 3.11Å
513	F	87	Confident	80.3	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	113.5	172.1	174.1	-105.1	0	0	0	109	I120 V434 V435 T436 K437 M515 D518 L521 Y524	I120-F513 HydrophobicContact CG2-CE1 4.07Å; I120-F513 HydrophobicContact CG2-CZ 4.05Å; V434-F513 HydrophobicContact CG1-CB 3.9Å; V435-F513 PolarHBondContact O-N 2.94Å; T436-F513 CarbonylContact C-O 3.17Å; T436-F513 WeakPolarHBondContact CA-O 3.5Å; T436-F513 HydrophobicContact CG2-CD1 4.07Å; K437-F513 PolarHBondContact N-O 3.22Å; F513-M515 HydrophobicContact CD1-CG 3.78Å; F513-M515 HydrophobicContact CE1-CE 4.13Å; F513-M515 HydrophobicContact CE1-CG 3.74Å; F513-M515 HydrophobicContact CE1-SD 4.34Å; F513-D518 HydrophobicContact CD2-CB 4.27Å; F513-D518 HydrophobicContact CE2-CB 3.78Å; F513-D518 HydrophobicContact CZ-CB 4.36Å; F513-L521 HydrophobicContact CB-CD1 4.46Å; F513-L521 HydrophobicContact CD1-CD1 3.72Å; F513-L521 HydrophobicContact CD2-CD1 4.41Å; F513-L521 HydrophobicContact CE1-CB 4.01Å; F513-L521 HydrophobicContact CE1-CD1 3.99Å; F513-L521 HydrophobicContact CE1-CG 4.48Å; F513-L521 HydrophobicContact CE2-CB 4.15Å; F513-L521 HydrophobicContact CG-CD1 3.94Å; F513-L521 HydrophobicContact CZ-CB 3.79Å; F513-L521 HydrophobicContact CZ-CD1 4.46Å; F513-Y524 HydrophobicContact CB-CD1 4.18Å; F513-Y524 HydrophobicContact CB-CG 4.36Å; F513-Y524 HydrophobicContact CD2-CD1 4.16Å; F513-Y524 AromaticContact CD2-CD2 3.5Å; F513-Y524 HydrophobicContact CD2-CD2 3.5Å; F513-Y524 VanDerWaalsContact CD2-CD2 3.5Å; F513-Y524 HydrophobicContact CD2-CE1 4.37Å; F513-Y524 AromaticContact CD2-CE2 3.76Å; F513-Y524 HydrophobicContact CD2-CE2 3.76Å; F513-Y524 AromaticContact CD2-CG 3.71Å; F513-Y524 HydrophobicContact CD2-CG 3.71Å; F513-Y524 AromaticContact CE2-CD2 3.96Å; F513-Y524 HydrophobicContact CE2-CD2 3.96Å; F513-Y524 HydrophobicContact CE2-CE2 4.16Å; F513-Y524 HydrophobicContact CG-CG 4.48Å
514	D	84.6	Confident	80.4	Confident	30 Å²	30	45.9 Å²	45.9	16%	0.16	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.9	177.7	-164.4	-68	0	0	0	110.9	K437 E516 E517 D518	K437-D514 WeakPolarHBondContact CD-OD2 2.91Å; D514-E516 VanDerWaalsContact C-N 3.32Å; D514-E516 WeakPolarHBondContact OD1-CA 3.08Å; D514-E516 WeakPolarHBondContact OD1-CB 3.5Å; D514-E516 PolarHBondContact OD1-N 3.22Å; D514-E517 HydrophobicContact CB-CB 4.39Å; D514-E517 PolarHBondContact OD1-N 3.15Å; D514-E517 VanDerWaalsContact OD1-N 3.07Å; D514-D518 WeakPolarHBondContact O-CA 3.38Å; D514-D518 VanDerWaalsContact O-CB 3.24Å; D514-D518 WeakPolarHBondContact O-CB 3.31Å; D514-D518 PolarHBondContact O-N 3.16Å
515	M	75.2	Confident	80.5	Confident	7 Å²	7	40.9 Å²	40.9	3%	0.034	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-8.1	-176.1	-62.4	-147.1	61.7	0	0	114.1	K116 L117 I120 T436 K437 T439 F513	K116-M515 PolarHBondContact NZ-O 3.08Å; L117-M515 HydrophobicContact CB-CE 4.44Å; L117-M515 HydrophobicContact CD1-CB 3.97Å; L117-M515 HydrophobicContact CD1-CE 3.72Å; L117-M515 HydrophobicContact CD1-CG 4.27Å; L117-M515 HydrophobicContact CD1-SD 3.46Å; L117-M515 WeakPolarHBondContact CD1-SD 3.28Å; L117-M515 HydrophobicContact CD2-SD 4.45Å; L117-M515 HydrophobicContact CG-CE 3.66Å; L117-M515 HydrophobicContact CG-SD 3.72Å; I120-M515 HydrophobicContact CB-CE 3.8Å; I120-M515 HydrophobicContact CD1-CE 4.25Å; I120-M515 HydrophobicContact CG2-CE 3.7Å; T436-M515 HydrophobicContact CG2-SD 4.04Å; K437-M515 PolarHBondContact O-N 2.97Å; T439-M515 HydrophobicContact CG2-SD 3.88Å; F513-M515 HydrophobicContact CD1-CG 3.78Å; F513-M515 HydrophobicContact CE1-CE 4.13Å; F513-M515 HydrophobicContact CE1-CG 3.74Å; F513-M515 HydrophobicContact CE1-SD 4.34Å
516	E	75.2	Confident	80.6	Confident	118 Å²	118	35.4 Å²	35.4	55%	0.551	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-49.2	177.6	-54.8	-106.2	124.1	0	0	108.9	K114 K116 D514	K114-E516 IonicContact NZ-OE1 3.01Å; K114-E516 PolarHBondContact NZ-OE1 2.7Å; K116-E516 PolarHBondContact NZ-O 3.18Å; D514-E516 VanDerWaalsContact C-N 3.32Å; D514-E516 WeakPolarHBondContact OD1-CA 3.08Å; D514-E516 WeakPolarHBondContact OD1-CB 3.5Å; D514-E516 PolarHBondContact OD1-N 3.22Å
517	E	76	Confident	80.6	Confident	176 Å²	176	34.3 Å²	34.3	82%	0.822	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-47.9	177	-62.2	-169.9	172	0	0	113.7	D514	D514-E517 HydrophobicContact CB-CB 4.39Å; D514-E517 PolarHBondContact OD1-N 3.15Å; D514-E517 VanDerWaalsContact OD1-N 3.07Å
518	D	75.3	Confident	80.7	Confident	52 Å²	52	31.2 Å²	31.2	28%	0.278	16%	0.163	S	C	.	.			trans	-106.1	164.8	-159.9	-127.3	-35.7	0	0	0	114.1	F513 D514 Y524	F513-D518 HydrophobicContact CD2-CB 4.27Å; F513-D518 HydrophobicContact CE2-CB 3.78Å; F513-D518 HydrophobicContact CZ-CB 4.36Å; D514-D518 WeakPolarHBondContact O-CA 3.38Å; D514-D518 VanDerWaalsContact O-CB 3.24Å; D514-D518 WeakPolarHBondContact O-CB 3.31Å; D514-D518 PolarHBondContact O-N 3.16Å; D518-Y524 WeakPolarHBondContact OD2-CE2 3.37Å; D518-Y524 VanDerWaalsContact OD2-CZ 3.24Å; D518-Y524 PolarHBondContact OD2-OH 3.25Å
519	S	74.1	Confident	80.8	Confident	70 Å²	70	29.1 Å²	29.1	49%	0.49	15%	0.152	S	C	.	.			trans	-144.3	-3	-177.8	69.8	0	0	0	0	117.2
520	D	78	Confident	80.5	Confident	55 Å²	55	29.4 Å²	29.4	29%	0.294	15%	0.154	S	C	.	.			trans	-101.7	58.9	-179.8	-143.8	68.1	0	0	0	111.6	K127 D522 G523 Y524 R555	K127-D520 IonicContact NZ-OD1 3.09Å; K127-D520 PolarHBondContact NZ-OD1 2.8Å; K127-D520 IonicContact NZ-OD2 2.67Å; D520-D522 PolarHBondContact O-N 2.66Å; D520-D522 VanDerWaalsContact O-N 3.13Å; D520-G523 WeakPolarHBondContact O-CA 3.35Å; D520-G523 PolarHBondContact O-N 2.82Å; D520-G523 WeakPolarHBondContact OD2-CA 3.49Å; D520-G523 PolarHBondContact OD2-N 3.39Å; D520-Y524 PolarHBondContact O-N 2.66Å; D520-R555 IonicContact OD2-NH1 3.95Å; D520-R555 IonicContact OD2-NH2 3.61Å; D520-R555 PolarHBondContact OD2-NH2 3.37Å
521	L	84.1	Confident	79.8	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-50.8	-37.8	-178.8	175	61.2	0	0	0	112.8	I120 L410 V434 T436 F513 Y524 V525	I120-L521 HydrophobicContact CG2-CB 4.42Å; L410-L521 HydrophobicContact CD1-CD1 4.07Å; L410-L521 HydrophobicContact CD2-CD2 4.46Å; V434-L521 HydrophobicContact CG1-CD1 4.1Å; T436-L521 HydrophobicContact CG2-CD1 4.42Å; F513-L521 HydrophobicContact CB-CD1 4.46Å; F513-L521 HydrophobicContact CD1-CD1 3.72Å; F513-L521 HydrophobicContact CD2-CD1 4.41Å; F513-L521 HydrophobicContact CE1-CB 4.01Å; F513-L521 HydrophobicContact CE1-CD1 3.99Å; F513-L521 HydrophobicContact CE1-CG 4.48Å; F513-L521 HydrophobicContact CE2-CB 4.15Å; F513-L521 HydrophobicContact CG-CD1 3.94Å; F513-L521 HydrophobicContact CZ-CB 3.79Å; F513-L521 HydrophobicContact CZ-CD1 4.46Å; L521-Y524 WeakPolarHBondContact O-CB 3.47Å; L521-Y524 PolarHBondContact O-N 2.75Å; L521-V525 WeakPolarHBondContact O-CG2 3.42Å; L521-V525 PolarHBondContact O-N 3.12Å
522	D	80.8	Confident	79.2	Confident	5 Å²	5	31.7 Å²	31.7	3%	0.027	17%	0.172	C	C	.	.	H	α-helix	trans	-65.1	-36.8	172.9	53.9	-71.7	0	0	0	113.5	K127 D520 Y524 V525 I526 R555	K127-D522 HydrophobicContact CB-CB 4.18Å; K127-D522 HydrophobicContact CD-CB 4.11Å; K127-D522 WeakPolarHBondContact CD-OD1 3.24Å; K127-D522 WeakPolarHBondContact CD-OD2 3.44Å; K127-D522 WeakPolarHBondContact CE-OD1 3.32Å; K127-D522 IonicContact NZ-OD1 3.08Å; K127-D522 PolarHBondContact NZ-OD1 3.35Å; K127-D522 IonicContact NZ-OD2 2.75Å; K127-D522 PolarHBondContact NZ-OD2 3.5Å; D520-D522 PolarHBondContact O-N 2.66Å; D520-D522 VanDerWaalsContact O-N 3.13Å; D522-Y524 VanDerWaalsContact C-N 3.27Å; D522-Y524 PolarHBondContact O-N 3.26Å; D522-V525 PolarHBondContact O-N 3.31Å; D522-I526 WeakPolarHBondContact O-CB 3.32Å; D522-I526 VanDerWaalsContact O-CG1 3.25Å; D522-I526 WeakPolarHBondContact O-CG1 3.33Å; D522-I526 PolarHBondContact O-N 2.83Å; D522-R555 IonicContact OD2-CZ 3.39Å; D522-R555 IonicContact OD2-NH1 2.78Å; D522-R555 PolarHBondContact OD2-NH1 2.9Å
523	G	79.6	Confident	78.2	Confident	10 Å²	10	32.1 Å²	32.1	10%	0.103	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-34.9	172.2	0	0	0	0	0	112.3	D520 S527	D520-G523 WeakPolarHBondContact O-CA 3.35Å; D520-G523 PolarHBondContact O-N 2.82Å; D520-G523 WeakPolarHBondContact OD2-CA 3.49Å; D520-G523 PolarHBondContact OD2-N 3.39Å; G523-S527 WeakPolarHBondContact O-CB 3.5Å; G523-S527 PolarHBondContact O-N 3Å
524	Y	83.2	Confident	76.9	Confident	43 Å²	43	32.9 Å²	32.9	17%	0.169	18%	0.183	C	C	.	.	H	α-helix	trans	-71.2	-48.4	172.9	-82.8	-105.7	0	0	0	112.3	V512 F513 D518 D520 L521 D522 I526 S527 S528 S1877	V512-Y524 WeakPolarHBondContact O-CE1 3.15Å; F513-Y524 HydrophobicContact CB-CD1 4.18Å; F513-Y524 HydrophobicContact CB-CG 4.36Å; F513-Y524 HydrophobicContact CD2-CD1 4.16Å; F513-Y524 AromaticContact CD2-CD2 3.5Å; F513-Y524 HydrophobicContact CD2-CD2 3.5Å; F513-Y524 VanDerWaalsContact CD2-CD2 3.5Å; F513-Y524 HydrophobicContact CD2-CE1 4.37Å; F513-Y524 AromaticContact CD2-CE2 3.76Å; F513-Y524 HydrophobicContact CD2-CE2 3.76Å; F513-Y524 AromaticContact CD2-CG 3.71Å; F513-Y524 HydrophobicContact CD2-CG 3.71Å; F513-Y524 AromaticContact CE2-CD2 3.96Å; F513-Y524 HydrophobicContact CE2-CD2 3.96Å; F513-Y524 HydrophobicContact CE2-CE2 4.16Å; F513-Y524 HydrophobicContact CG-CG 4.48Å; D518-Y524 WeakPolarHBondContact OD2-CE2 3.37Å; D518-Y524 VanDerWaalsContact OD2-CZ 3.24Å; D518-Y524 PolarHBondContact OD2-OH 3.25Å; D520-Y524 PolarHBondContact O-N 2.66Å; L521-Y524 WeakPolarHBondContact O-CB 3.47Å; L521-Y524 PolarHBondContact O-N 2.75Å; D522-Y524 VanDerWaalsContact C-N 3.27Å; D522-Y524 PolarHBondContact O-N 3.26Å; Y524-I526 VanDerWaalsContact C-N 3.28Å; Y524-I526 PolarHBondContact O-N 3.18Å; Y524-S527 CarbonylContact O-C 3.53Å; Y524-S527 WeakPolarHBondContact O-CA 3.38Å; Y524-S527 VanDerWaalsContact O-CB 3.28Å; Y524-S527 WeakPolarHBondContact O-CB 3.39Å; Y524-S527 PolarHBondContact O-N 2.7Å; Y524-S527 PolarHBondContact O-OG 3.39Å; Y524-S528 PolarHBondContact O-N 2.95Å; Y524-S1877 WeakPolarHBondContact CD1-O 3.44Å; Y524-S1877 WeakPolarHBondContact CE1-O 3.45Å
525	V	83.6	Confident	75.9	Confident	8 Å²	8	32.1 Å²	32.1	5%	0.048	18%	0.18	C	C	.	.	H	α-helix	trans	-55.9	-41.9	173.6	168.8	0	0	0	0	111.5	C408 V434 L521 D522 S528 L529	C408-V525 HydrophobicContact CB-CG1 4.13Å; V434-V525 HydrophobicContact CG2-CG2 3.92Å; L521-V525 WeakPolarHBondContact O-CG2 3.42Å; L521-V525 PolarHBondContact O-N 3.12Å; D522-V525 PolarHBondContact O-N 3.31Å; V525-S528 PolarHBondContact O-N 2.89Å; V525-S528 PolarHBondContact O-OG 3.4Å; V525-L529 HydrophobicContact CG1-CD1 4.39Å; V525-L529 WeakPolarHBondContact O-CG 3.25Å; V525-L529 PolarHBondContact O-N 2.9Å; V525-L529 VanDerWaalsContact O-N 3.15Å
526	I	79.1	Confident	75.2	Confident	12 Å²	12	35.7 Å²	35.7	6%	0.062	20%	0.202	C	C	.	.	H	α-helix	trans	-75.4	-29.4	177.5	-61.5	175.7	0	0	0	111.1	D522 Y524 S528 L530 L553 R555 I558	D522-I526 WeakPolarHBondContact O-CB 3.32Å; D522-I526 VanDerWaalsContact O-CG1 3.25Å; D522-I526 WeakPolarHBondContact O-CG1 3.33Å; D522-I526 PolarHBondContact O-N 2.83Å; Y524-I526 VanDerWaalsContact C-N 3.28Å; Y524-I526 PolarHBondContact O-N 3.18Å; I526-S528 PolarHBondContact O-N 2.69Å; I526-L530 HydrophobicContact CG2-CD1 3.78Å; I526-L530 HydrophobicContact CG2-CG 4.14Å; I526-L530 VanDerWaalsContact O-CB 3.31Å; I526-L530 WeakPolarHBondContact O-CB 3.3Å; I526-L530 WeakPolarHBondContact O-CD1 3.17Å; I526-L530 WeakPolarHBondContact O-CG 3.3Å; I526-L530 PolarHBondContact O-N 2.78Å; I526-L553 HydrophobicContact CD1-CB 4.24Å; I526-L553 HydrophobicContact CD1-CD1 3.88Å; I526-L553 HydrophobicContact CG1-CD1 3.78Å; I526-L553 HydrophobicContact CG2-CD1 4.2Å; I526-R555 HydrophobicContact CD1-CG 3.67Å; I526-I558 HydrophobicContact CB-CD1 3.84Å; I526-I558 HydrophobicContact CD1-CD1 4.42Å; I526-I558 HydrophobicContact CG2-CD1 3.66Å; I526-I558 HydrophobicContact CG2-CG2 4.35Å
527	S	77.5	Confident	74.3	Confident	11 Å²	11	31.9 Å²	31.9	8%	0.077	19%	0.187	C	C	.	.	H	α-helix	trans	-61.4	-35.7	167.6	98.3	0	0	0	0	112.1	G523 Y524 A531 T1878 T1879	G523-S527 WeakPolarHBondContact O-CB 3.5Å; G523-S527 PolarHBondContact O-N 3Å; Y524-S527 CarbonylContact O-C 3.53Å; Y524-S527 WeakPolarHBondContact O-CA 3.38Å; Y524-S527 VanDerWaalsContact O-CB 3.28Å; Y524-S527 WeakPolarHBondContact O-CB 3.39Å; Y524-S527 PolarHBondContact O-N 2.7Å; Y524-S527 PolarHBondContact O-OG 3.39Å; S527-A531 WeakPolarHBondContact O-CB 3.01Å; S527-A531 PolarHBondContact O-N 3.02Å; S527-T1878 PolarHBondContact OG-O 2.99Å; S527-T1879 PolarHBondContact OG-N 3.09Å
528	S	80.9	Confident	73.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-72.4	-49.4	-175.7	84.3	0	0	0	0	111.6	C408 Y524 V525 I526 L530 S532 T1879 H1880	C408-S528 PolarHBondContact SG-OG 3.32Å; Y524-S528 PolarHBondContact O-N 2.95Å; V525-S528 PolarHBondContact O-N 2.89Å; V525-S528 PolarHBondContact O-OG 3.4Å; I526-S528 PolarHBondContact O-N 2.69Å; S528-L530 PolarHBondContact O-N 2.76Å; S528-S532 VanDerWaalsContact O-CB 3.23Å; S528-S532 WeakPolarHBondContact O-CB 3.48Å; S528-S532 PolarHBondContact O-N 2.79Å; S528-T1879 WeakPolarHBondContact CA-O 3.29Å; S528-T1879 VanDerWaalsContact CB-O 3.24Å; S528-T1879 WeakPolarHBondContact CB-O 3.33Å; S528-H1880 PolarHBondContact O-N 3.48Å
529	L	79.4	Confident	72.1	Confident	5 Å²	5	24.8 Å²	24.8	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-56.1	-45.9	171.8	-63.7	172.7	0	0	0	113.1	L102 P406 M407 C408 P432 V525 S532 A533 L553	L102-L529 HydrophobicContact CD1-CD1 3.48Å; L102-L529 VanDerWaalsContact CD1-CD1 3.48Å; L102-L529 HydrophobicContact CD1-CD2 4.11Å; L102-L529 HydrophobicContact CD1-CG 4.41Å; L102-L529 HydrophobicContact CD2-CD1 4.36Å; P406-L529 HydrophobicContact CB-CD2 3.92Å; M407-L529 WeakPolarHBondContact O-CD2 3.24Å; C408-L529 HydrophobicContact CB-CD2 3.91Å; C408-L529 HydrophobicContact CB-CG 4.31Å; P432-L529 HydrophobicContact CG-CD2 4.44Å; V525-L529 HydrophobicContact CG1-CD1 4.39Å; V525-L529 WeakPolarHBondContact O-CG 3.25Å; V525-L529 PolarHBondContact O-N 2.9Å; V525-L529 VanDerWaalsContact O-N 3.15Å; L529-S532 WeakPolarHBondContact O-CB 3.36Å; L529-S532 PolarHBondContact O-N 2.81Å; L529-A533 PolarHBondContact O-N 3.21Å; L529-L553 HydrophobicContact CD1-CD1 4.25Å
530	L	76.1	Confident	71	Confident	5 Å²	5	29.3 Å²	29.3	3%	0.026	18%	0.181	C	C	.	.	H	α-helix	trans	-72	-43.2	-175.6	-72.3	174.2	0	0	0	112.6	I526 S528 S532 A533 G534 Q546 I549 T550 I558	I526-L530 HydrophobicContact CG2-CD1 3.78Å; I526-L530 HydrophobicContact CG2-CG 4.14Å; I526-L530 VanDerWaalsContact O-CB 3.31Å; I526-L530 WeakPolarHBondContact O-CB 3.3Å; I526-L530 WeakPolarHBondContact O-CD1 3.17Å; I526-L530 WeakPolarHBondContact O-CG 3.3Å; I526-L530 PolarHBondContact O-N 2.78Å; S528-L530 PolarHBondContact O-N 2.76Å; L530-S532 VanDerWaalsContact C-N 3.26Å; L530-S532 PolarHBondContact O-N 3.04Å; L530-A533 PolarHBondContact O-N 3.47Å; L530-G534 PolarHBondContact O-N 3.45Å; L530-Q546 HydrophobicContact CD2-CB 3.85Å; L530-Q546 HydrophobicContact CD2-CG 4.14Å; L530-Q546 VanDerWaalsContact CD2-O 3.26Å; L530-Q546 WeakPolarHBondContact CD2-O 3.45Å; L530-Q546 WeakPolarHBondContact O-CG 3Å; L530-Q546 PolarHBondContact O-NE2 3.16Å; L530-I549 HydrophobicContact CD2-CB 3.97Å; L530-I549 HydrophobicContact CD2-CG2 3.84Å; L530-I549 HydrophobicContact CG-CG2 4.44Å; L530-T550 HydrophobicContact CD1-CG2 3.6Å; L530-T550 HydrophobicContact CD2-CG2 3.89Å; L530-T550 HydrophobicContact CG-CG2 4.35Å; L530-I558 HydrophobicContact CD1-CG2 3.37Å
531	A	72.9	Confident	70	Confident	28 Å²	28	32.5 Å²	32.5	23%	0.231	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-34.2	173.9	0	0	0	0	0	110.4	S527 G534 T1879 H1880 Q1881	S527-A531 WeakPolarHBondContact O-CB 3.01Å; S527-A531 PolarHBondContact O-N 3.02Å; A531-G534 WeakPolarHBondContact O-CA 3.43Å; A531-G534 PolarHBondContact O-N 2.98Å; A531-T1879 HydrophobicContact CB-CG2 4.4Å; A531-H1880 VanDerWaalsContact CB-N 3.29Å; A531-Q1881 CarbonylContact C-O 3.54Å; A531-Q1881 CarbonylContact O-C 3.52Å; A531-Q1881 PolarHBondContact O-N 3.45Å
532	S	72.9	Confident	68.7	Low	23 Å²	23	34.1 Å²	34.1	16%	0.161	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-44.6	175.8	-171.4	0	0	0	0	113.2	S528 L529 L530 G534 S535 H1880 Q1881	S528-S532 VanDerWaalsContact O-CB 3.23Å; S528-S532 WeakPolarHBondContact O-CB 3.48Å; S528-S532 PolarHBondContact O-N 2.79Å; L529-S532 WeakPolarHBondContact O-CB 3.36Å; L529-S532 PolarHBondContact O-N 2.81Å; L530-S532 VanDerWaalsContact C-N 3.26Å; L530-S532 PolarHBondContact O-N 3.04Å; S532-G534 PolarHBondContact O-N 2.73Å; S532-S535 PolarHBondContact O-N 3.12Å; S532-S535 VanDerWaalsContact O-N 3.16Å; S532-S535 PolarHBondContact O-OG 3.16Å; S532-H1880 WeakPolarHBondContact CA-O 3.15Å; S532-H1880 WeakPolarHBondContact CB-O 3.38Å; S532-H1880 VanDerWaalsContact N-C 3.35Å; S532-H1880 PolarHBondContact N-O 3.23Å; S532-Q1881 CarbonylContact C-O 3.55Å; S532-Q1881 VanDerWaalsContact CA-O 3.22Å; S532-Q1881 WeakPolarHBondContact CA-O 3.02Å
533	A	66.7	Low	67.8	Low	12 Å²	12	34.6 Å²	34.6	10%	0.099	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	9.4	166.8	0	0	0	0	0	113.3	L529 L530 N543 E545 Q546 I549	L529-A533 PolarHBondContact O-N 3.21Å; L530-A533 PolarHBondContact O-N 3.47Å; A533-N543 PolarHBondContact O-ND2 2.63Å; A533-E545 HydrophobicContact CB-CB 4.5Å; A533-Q546 HydrophobicContact CB-CG 3.93Å; A533-I549 HydrophobicContact CB-CD1 3.96Å
534	G	59.1	Low	67.4	Low	16 Å²	16	36.9 Å²	36.9	17%	0.165	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-39.3	167.5	0	0	0	0	0	113.4	L530 A531 S532 T536 V537 N543	L530-G534 PolarHBondContact O-N 3.45Å; A531-G534 WeakPolarHBondContact O-CA 3.43Å; A531-G534 PolarHBondContact O-N 2.98Å; S532-G534 PolarHBondContact O-N 2.73Å; G534-T536 PolarHBondContact O-N 2.75Å; G534-V537 PolarHBondContact O-N 2.79Å; G534-N543 WeakPolarHBondContact CA-ND2 3.22Å
535	S	64.3	Low	66.8	Low	15 Å²	15	39 Å²	39	11%	0.105	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-47.6	-170.8	48.8	0	0	0	0	115.5	S532 V537 Q1881 T1882 D1883	S532-S535 PolarHBondContact O-N 3.12Å; S532-S535 VanDerWaalsContact O-N 3.16Å; S532-S535 PolarHBondContact O-OG 3.16Å; S535-V537 VanDerWaalsContact C-N 3.27Å; S535-V537 PolarHBondContact O-N 2.76Å; S535-Q1881 VanDerWaalsContact CA-O 3.25Å; S535-Q1881 WeakPolarHBondContact CA-O 3.21Å; S535-Q1881 WeakPolarHBondContact CB-O 3.19Å; S535-Q1881 PolarHBondContact N-O 2.96Å; S535-Q1881 PolarHBondContact OG-O 3.12Å; S535-T1882 VanDerWaalsContact CA-N 3.26Å; S535-T1882 VanDerWaalsContact CA-OG1 3.22Å; S535-T1882 WeakPolarHBondContact CA-OG1 3.34Å; S535-T1882 VanDerWaalsContact CB-N 3.31Å; S535-T1882 WeakPolarHBondContact CB-OG1 3.44Å; S535-D1883 WeakPolarHBondContact O-CB 3.46Å
536	T	60.4	Low	66.4	Low	81 Å²	81	39.9 Å²	39.9	50%	0.497	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-14.4	-164	52.1	0	0	0	0	113.5	G534	G534-T536 PolarHBondContact O-N 2.75Å
537	V	56.1	Low	66.4	Low	39 Å²	39	39.3 Å²	39.3	24%	0.236	23%	0.227	C	C	.	.	S	Bend	trans	-129.6	120.9	-167.4	180	0	0	0	0	110.5	G534 S535 S539 Q541 N543	G534-V537 PolarHBondContact O-N 2.79Å; S535-V537 VanDerWaalsContact C-N 3.27Å; S535-V537 PolarHBondContact O-N 2.76Å; V537-S539 PolarHBondContact O-N 2.74Å; V537-Q541 HydrophobicContact CG1-CB 3.58Å; V537-N543 VanDerWaalsContact CB-OD1 3.32Å; V537-N543 WeakPolarHBondContact CB-OD1 3.47Å; V537-N543 WeakPolarHBondContact CG1-OD1 3.44Å
538	A	53.7	Low	66.4	Low	19 Å²	19	41.5 Å²	41.5	16%	0.157	24%	0.236	C	C	.	.			trans	-51.4	131.4	175.9	0	0	0	0	0	111.9	D540 Q541	A538-D540 PolarHBondContact O-N 3.05Å; A538-Q541 PolarHBondContact O-N 3.31Å
539	S	52	Low	66.2	Low	60 Å²	60	42.5 Å²	42.5	42%	0.42	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-13.8	-167.5	43.1	0	0	0	0	117.3	N352 V537 S1884	N352-S539 PolarHBondContact O-OG 2.83Å; V537-S539 PolarHBondContact O-N 2.74Å; S539-S1884 PolarHBondContact OG-O 2.97Å
540	D	51.3	Low	66.2	Low	165 Å²	165	42.3 Å²	42.3	88%	0.882	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74	-18.7	168.4	-95.3	-21.4	0	0	0	114.2	A538	A538-D540 PolarHBondContact O-N 3.05Å
541	Q	57	Low	66.3	Low	121 Å²	121	42.1 Å²	42.1	57%	0.565	24%	0.239	S	C	*	.	S	Bend	trans	-96	152.4	176	-70.8	-172.8	95.2	0	0	110.7	V537 A538 N543	V537-Q541 HydrophobicContact CG1-CB 3.58Å; A538-Q541 PolarHBondContact O-N 3.31Å; Q541-N543 PolarHBondContact O-OD1 3.42Å
542	I	54.9	Low	66.4	Low	38 Å²	38	43.1 Å²	43.1	20%	0.195	24%	0.242	C	C	.	.			trans	-96.2	118.5	-174.5	-58.6	176.1	0	0	0	108.5	L544 W570	I542-L544 PolarHBondContact O-N 3.35Å; I542-W570 HydrophobicContact CD1-CD2 4.12Å; I542-W570 HydrophobicContact CD1-CE3 4.04Å; I542-W570 HydrophobicContact CD1-CZ3 4.39Å; I542-W570 HydrophobicContact CG2-CE3 4.15Å; I542-W570 HydrophobicContact CG2-CH2 3.55Å; I542-W570 HydrophobicContact CG2-CZ2 4.34Å; I542-W570 HydrophobicContact CG2-CZ3 3.46Å; I542-W570 VanDerWaalsContact CG2-CZ3 3.46Å
543	N	62.8	Low	66.4	Low	15 Å²	15	43 Å²	43	8%	0.08	24%	0.24	C	C	.	.			trans	-78.2	94.6	-177	-58.7	3.6	0	0	0	108.5	A533 G534 V537 Q541 E545 Q546 L547	A533-N543 PolarHBondContact O-ND2 2.63Å; G534-N543 WeakPolarHBondContact CA-ND2 3.22Å; V537-N543 VanDerWaalsContact CB-OD1 3.32Å; V537-N543 WeakPolarHBondContact CB-OD1 3.47Å; V537-N543 WeakPolarHBondContact CG1-OD1 3.44Å; Q541-N543 PolarHBondContact O-OD1 3.42Å; N543-E545 PolarHBondContact O-N 2.89Å; N543-Q546 HydrophobicContact CB-CB 4.14Å; N543-Q546 HydrophobicContact CB-CG 3.78Å; N543-Q546 WeakPolarHBondContact O-CB 3.38Å; N543-Q546 PolarHBondContact O-N 3.45Å; N543-Q546 VanDerWaalsContact O-N 3.12Å; N543-L547 PolarHBondContact O-N 2.94Å
544	L	71.8	Confident	66.9	Low	58 Å²	58	45.3 Å²	45.3	30%	0.304	25%	0.25	S	S	.	.	H	α-helix	trans	-60.9	-30.1	176.5	-63	179.8	0	0	0	111	I542 Q546 L547 E548 Y578	I542-L544 PolarHBondContact O-N 3.35Å; L544-Q546 PolarHBondContact O-N 3.23Å; L544-L547 WeakPolarHBondContact O-CB 3.42Å; L544-L547 PolarHBondContact O-N 2.84Å; L544-L547 VanDerWaalsContact O-N 3.13Å; L544-E548 PolarHBondContact O-N 2.83Å; L544-Y578 HydrophobicContact CB-CE2 4.4Å; L544-Y578 HydrophobicContact CD2-CE2 4.13Å
545	E	69.3	Low	67.9	Low	89 Å²	89	46.7 Å²	46.7	42%	0.416	25%	0.251	S	S	.	.	H	α-helix	trans	-58	-43.6	171.3	-62.8	172	-171.9	0	0	112.7	A533 N543 L547 E548 I549	A533-E545 HydrophobicContact CB-CB 4.5Å; N543-E545 PolarHBondContact O-N 2.89Å; E545-L547 VanDerWaalsContact C-N 3.28Å; E545-L547 PolarHBondContact O-N 3.22Å; E545-E548 PolarHBondContact O-N 3.12Å; E545-I549 VanDerWaalsContact O-CG1 3.29Å; E545-I549 WeakPolarHBondContact O-CG1 3.01Å; E545-I549 PolarHBondContact O-N 3.15Å
546	Q	76.5	Confident	68.8	Low	25 Å²	25	46.3 Å²	46.3	12%	0.117	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-37.2	174.8	-72	175.3	-13.5	0	0	111.8	L530 A533 N543 L544 T550 I563	L530-Q546 HydrophobicContact CD2-CB 3.85Å; L530-Q546 HydrophobicContact CD2-CG 4.14Å; L530-Q546 VanDerWaalsContact CD2-O 3.26Å; L530-Q546 WeakPolarHBondContact CD2-O 3.45Å; L530-Q546 WeakPolarHBondContact O-CG 3Å; L530-Q546 PolarHBondContact O-NE2 3.16Å; A533-Q546 HydrophobicContact CB-CG 3.93Å; N543-Q546 HydrophobicContact CB-CB 4.14Å; N543-Q546 HydrophobicContact CB-CG 3.78Å; N543-Q546 WeakPolarHBondContact O-CB 3.38Å; N543-Q546 PolarHBondContact O-N 3.45Å; N543-Q546 VanDerWaalsContact O-N 3.12Å; L544-Q546 PolarHBondContact O-N 3.23Å; Q546-T550 PolarHBondContact O-N 2.98Å; Q546-T550 PolarHBondContact O-OG1 3.35Å; Q546-I563 HydrophobicContact CB-CD1 3.93Å; Q546-I563 HydrophobicContact CB-CG1 4.31Å; Q546-I563 VanDerWaalsContact O-CD1 3.28Å; Q546-I563 WeakPolarHBondContact O-CD1 3.4Å
547	L	79.5	Confident	69.9	Low	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-71	-34.7	176.5	-175.8	59.5	0	0	0	111.8	N543 L544 E545 T550 L551 I563 F564 W570 L575 Y578 F594	N543-L547 PolarHBondContact O-N 2.94Å; L544-L547 WeakPolarHBondContact O-CB 3.42Å; L544-L547 PolarHBondContact O-N 2.84Å; L544-L547 VanDerWaalsContact O-N 3.13Å; E545-L547 VanDerWaalsContact C-N 3.28Å; E545-L547 PolarHBondContact O-N 3.22Å; L547-T550 WeakPolarHBondContact CA-OG1 3.03Å; L547-T550 PolarHBondContact O-OG1 2.93Å; L547-L551 WeakPolarHBondContact O-CB 3.41Å; L547-L551 PolarHBondContact O-N 3.49Å; L547-I563 HydrophobicContact CB-CD1 4.5Å; L547-F564 HydrophobicContact CD1-CE2 3.69Å; L547-F564 HydrophobicContact CD1-CZ 4Å; L547-F564 HydrophobicContact CD2-CZ 4.41Å; L547-W570 HydrophobicContact CD2-CH2 4.26Å; L547-W570 HydrophobicContact CD2-CZ3 4.14Å; L547-L575 HydrophobicContact CD2-CD2 3.47Å; L547-L575 VanDerWaalsContact CD2-CD2 3.47Å; L547-Y578 HydrophobicContact CD2-CD1 4.21Å; L547-Y578 HydrophobicContact CD2-CD2 3.96Å; L547-Y578 HydrophobicContact CD2-CE2 4.46Å; L547-Y578 HydrophobicContact CD2-CG 3.84Å; L547-Y578 HydrophobicContact CG-CD1 4.1Å; L547-Y578 HydrophobicContact CG-CE1 4.48Å; L547-Y578 HydrophobicContact CG-CG 4.23Å; L547-F594 HydrophobicContact CD1-CE1 4.09Å; L547-F594 HydrophobicContact CD1-CZ 4.38Å
548	E	75.9	Confident	71.1	Confident	57 Å²	57	43.8 Å²	43.8	27%	0.266	23%	0.23	S	C	.	.	H	α-helix	trans	-69.1	-41.8	175.6	-161.2	158.3	160.1	0	0	111.9	L544 E545 L551 T552 Y578	L544-E548 PolarHBondContact O-N 2.83Å; E545-E548 PolarHBondContact O-N 3.12Å; E548-L551 PolarHBondContact O-N 3.48Å; E548-T552 WeakPolarHBondContact O-CB 3.43Å; E548-T552 WeakPolarHBondContact O-CG2 3.37Å; E548-T552 PolarHBondContact O-N 2.96Å; E548-T552 PolarHBondContact O-OG1 3.08Å; E548-Y578 HydrophobicContact CB-CE1 3.89Å; E548-Y578 HydrophobicContact CG-CE1 4.2Å; E548-Y578 PolarHBondContact OE2-OH 3.35Å
549	I	76.5	Confident	72.4	Confident	22 Å²	22	42.9 Å²	42.9	11%	0.113	22%	0.223	C	C	.	.	H	α-helix	trans	-63	-49.4	174.8	-68.2	164.5	0	0	0	110.1	L530 A533 E545 L551 T552 L553	L530-I549 HydrophobicContact CD2-CB 3.97Å; L530-I549 HydrophobicContact CD2-CG2 3.84Å; L530-I549 HydrophobicContact CG-CG2 4.44Å; A533-I549 HydrophobicContact CB-CD1 3.96Å; E545-I549 VanDerWaalsContact O-CG1 3.29Å; E545-I549 WeakPolarHBondContact O-CG1 3.01Å; E545-I549 PolarHBondContact O-N 3.15Å; I549-L551 VanDerWaalsContact C-N 3.35Å; I549-L551 PolarHBondContact O-N 3.13Å; I549-T552 PolarHBondContact O-N 2.81Å; I549-T552 PolarHBondContact O-OG1 2.81Å; I549-L553 HydrophobicContact CG2-CD1 3.69Å; I549-L553 HydrophobicContact CG2-CG 4.36Å; I549-L553 VanDerWaalsContact O-CB 3.3Å; I549-L553 WeakPolarHBondContact O-CB 3.39Å; I549-L553 WeakPolarHBondContact O-CG 3.17Å; I549-L553 PolarHBondContact O-N 2.92Å
550	T	80.1	Confident	73.9	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-38.3	177.4	43.3	0	0	0	0	113.2	L530 Q546 L547 N554 R555 I558 A559 I563 F590	L530-T550 HydrophobicContact CD1-CG2 3.6Å; L530-T550 HydrophobicContact CD2-CG2 3.89Å; L530-T550 HydrophobicContact CG-CG2 4.35Å; Q546-T550 PolarHBondContact O-N 2.98Å; Q546-T550 PolarHBondContact O-OG1 3.35Å; L547-T550 WeakPolarHBondContact CA-OG1 3.03Å; L547-T550 PolarHBondContact O-OG1 2.93Å; T550-N554 PolarHBondContact O-N 3.29Å; T550-R555 PolarHBondContact O-N 3.35Å; T550-I558 HydrophobicContact CG2-CG2 4.47Å; T550-A559 HydrophobicContact CG2-CB 4.11Å; T550-I563 HydrophobicContact CG2-CD1 3.75Å; T550-I563 VanDerWaalsContact OG1-CD1 3.28Å; T550-I563 WeakPolarHBondContact OG1-CD1 3.41Å; T550-F590 VanDerWaalsContact O-CZ 3.25Å; T550-F590 WeakPolarHBondContact O-CZ 3.4Å
551	L	79.1	Confident	75.2	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-72.7	-35.1	-178.9	-178	61.5	0	0	0	113.3	L547 E548 I549 Y578 Q581 A582 R587 F590	L547-L551 WeakPolarHBondContact O-CB 3.41Å; L547-L551 PolarHBondContact O-N 3.49Å; E548-L551 PolarHBondContact O-N 3.48Å; I549-L551 VanDerWaalsContact C-N 3.35Å; I549-L551 PolarHBondContact O-N 3.13Å; L551-Y578 HydrophobicContact CD2-CD1 3.94Å; L551-Q581 HydrophobicContact CD2-CB 3.98Å; L551-Q581 HydrophobicContact CD2-CG 3.97Å; L551-A582 HydrophobicContact CD1-CB 3.92Å; L551-R587 HydrophobicContact CD1-CG 4.33Å; L551-F590 HydrophobicContact CB-CE1 4.28Å; L551-F590 HydrophobicContact CB-CZ 4.44Å; L551-F590 HydrophobicContact CD1-CB 3.99Å; L551-F590 HydrophobicContact CD1-CD1 3.84Å; L551-F590 HydrophobicContact CD1-CD2 3.79Å; L551-F590 HydrophobicContact CD1-CE1 4.27Å; L551-F590 HydrophobicContact CD1-CE2 4.22Å; L551-F590 HydrophobicContact CD1-CG 3.59Å; L551-F590 HydrophobicContact CD1-CZ 4.46Å
552	T	74.1	Confident	76.1	Confident	48 Å²	48	41.5 Å²	41.5	29%	0.294	20%	0.199	S	C	.	.	H	α-helix	trans	-69.9	-45.6	173.1	50	0	0	0	0	111.1	E548 I549 N554	E548-T552 WeakPolarHBondContact O-CB 3.43Å; E548-T552 WeakPolarHBondContact O-CG2 3.37Å; E548-T552 PolarHBondContact O-N 2.96Å; E548-T552 PolarHBondContact O-OG1 3.08Å; I549-T552 PolarHBondContact O-N 2.81Å; I549-T552 PolarHBondContact O-OG1 2.81Å; T552-N554 VanDerWaalsContact C-N 3.26Å; T552-N554 PolarHBondContact O-N 2.84Å
553	L	73.8	Confident	77.1	Confident	21 Å²	21	39.9 Å²	39.9	11%	0.11	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	1.4	177.3	-57.8	-178.6	0	0	0	115.1	L102 S131 I526 L529 I549 R555	L102-L553 HydrophobicContact CD2-CD2 4.42Å; S131-L553 VanDerWaalsContact CB-CD2 3.4Å; I526-L553 HydrophobicContact CD1-CB 4.24Å; I526-L553 HydrophobicContact CD1-CD1 3.88Å; I526-L553 HydrophobicContact CG1-CD1 3.78Å; I526-L553 HydrophobicContact CG2-CD1 4.2Å; L529-L553 HydrophobicContact CD1-CD1 4.25Å; I549-L553 HydrophobicContact CG2-CD1 3.69Å; I549-L553 HydrophobicContact CG2-CG 4.36Å; I549-L553 VanDerWaalsContact O-CB 3.3Å; I549-L553 WeakPolarHBondContact O-CB 3.39Å; I549-L553 WeakPolarHBondContact O-CG 3.17Å; I549-L553 PolarHBondContact O-N 2.92Å; L553-R555 VanDerWaalsContact C-N 3.29Å; L553-R555 PolarHBondContact O-N 2.93Å
554	N	77.5	Confident	77.8	Confident	60 Å²	60	39.4 Å²	39.4	32%	0.321	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	18	177.7	-161.6	37	0	0	0	116.7	T550 T552 A556 R587	T550-N554 PolarHBondContact O-N 3.29Å; T552-N554 VanDerWaalsContact C-N 3.26Å; T552-N554 PolarHBondContact O-N 2.84Å; N554-A556 PolarHBondContact O-N 3.44Å; N554-R587 VanDerWaalsContact CG-CZ 3.46Å; N554-R587 WeakPolarHBondContact OD1-CD 3.33Å; N554-R587 PolarHBondContact OD1-NE 3.47Å; N554-R587 PolarHBondContact OD1-NH1 3.49Å
555	R	80.1	Confident	77.8	Confident	46 Å²	46	41.1 Å²	41.1	17%	0.174	20%	0.197	C	C	.	.			trans	-96	77.5	-175.6	-66.1	-61.3	-72.6	-98.6	7.4	113.2	D520 D522 I526 T550 L553 D557 I558 A559	D520-R555 IonicContact OD2-NH1 3.95Å; D520-R555 IonicContact OD2-NH2 3.61Å; D520-R555 PolarHBondContact OD2-NH2 3.37Å; D522-R555 IonicContact OD2-CZ 3.39Å; D522-R555 IonicContact OD2-NH1 2.78Å; D522-R555 PolarHBondContact OD2-NH1 2.9Å; I526-R555 HydrophobicContact CD1-CG 3.67Å; T550-R555 PolarHBondContact O-N 3.35Å; L553-R555 VanDerWaalsContact C-N 3.29Å; L553-R555 PolarHBondContact O-N 2.93Å; R555-D557 VanDerWaalsContact C-N 3.29Å; R555-D557 WeakPolarHBondContact CA-OD1 3.37Å; R555-D557 VanDerWaalsContact CB-OD1 3.25Å; R555-D557 WeakPolarHBondContact CB-OD1 3.13Å; R555-D557 WeakPolarHBondContact CD-OD1 3.4Å; R555-D557 IonicContact CZ-OD2 3.13Å; R555-D557 VanDerWaalsContact CZ-OD2 3.24Å; R555-D557 VanDerWaalsContact NE-CG 3.34Å; R555-D557 IonicContact NE-OD1 2.83Å; R555-D557 PolarHBondContact NE-OD1 3.24Å; R555-D557 IonicContact NE-OD2 2.74Å; R555-D557 PolarHBondContact NE-OD2 2.82Å; R555-D557 IonicContact NH2-OD2 3.81Å; R555-D557 PolarHBondContact NH2-OD2 3.16Å; R555-I558 HydrophobicContact CB-CB 4Å; R555-I558 HydrophobicContact CB-CD1 3.89Å; R555-I558 HydrophobicContact CB-CG1 3.94Å; R555-I558 HydrophobicContact CG-CD1 3.97Å; R555-I558 HydrophobicContact CG-CG1 4.47Å; R555-I558 PolarHBondContact O-N 2.78Å; R555-A559 WeakPolarHBondContact O-CB 3.47Å; R555-A559 PolarHBondContact O-N 3.4Å
556	A	83.3	Confident	77.2	Confident	7 Å²	7	45.9 Å²	45.9	6%	0.058	22%	0.219	C	C	.	.	H	α-helix	trans	-70.1	-24.3	176.4	0	0	0	0	0	113.4	N554 R560 D589 F590	N554-A556 PolarHBondContact O-N 3.44Å; A556-R560 WeakPolarHBondContact O-CB 3.5Å; A556-R560 PolarHBondContact O-N 2.92Å; A556-D589 HydrophobicContact CB-CB 3.75Å; A556-F590 HydrophobicContact CB-CD2 3.76Å; A556-F590 HydrophobicContact CB-CE2 3.65Å; A556-F590 HydrophobicContact CB-CG 4.24Å; A556-F590 HydrophobicContact CB-CZ 4.04Å
557	D	82.6	Confident	76.4	Confident	61 Å²	61	51.7 Å²	51.7	33%	0.326	25%	0.251	S	S	.	.	H	α-helix	trans	-58.3	-59.6	165.5	55.5	-30.9	0	0	0	110.7	R555 A559 R560 E561	R555-D557 VanDerWaalsContact C-N 3.29Å; R555-D557 WeakPolarHBondContact CA-OD1 3.37Å; R555-D557 VanDerWaalsContact CB-OD1 3.25Å; R555-D557 WeakPolarHBondContact CB-OD1 3.13Å; R555-D557 WeakPolarHBondContact CD-OD1 3.4Å; R555-D557 IonicContact CZ-OD2 3.13Å; R555-D557 VanDerWaalsContact CZ-OD2 3.24Å; R555-D557 VanDerWaalsContact NE-CG 3.34Å; R555-D557 IonicContact NE-OD1 2.83Å; R555-D557 PolarHBondContact NE-OD1 3.24Å; R555-D557 IonicContact NE-OD2 2.74Å; R555-D557 PolarHBondContact NE-OD2 2.82Å; R555-D557 IonicContact NH2-OD2 3.81Å; R555-D557 PolarHBondContact NH2-OD2 3.16Å; D557-A559 VanDerWaalsContact C-N 3.28Å; D557-A559 PolarHBondContact O-N 3.32Å; D557-R560 WeakPolarHBondContact O-CB 3.39Å; D557-R560 PolarHBondContact O-N 3.5Å; D557-E561 PolarHBondContact O-N 3.43Å
558	I	80.7	Confident	75.7	Confident	5 Å²	5	55.1 Å²	55.1	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-34.6	-178	-55.6	-179.5	0	0	0	110.9	I526 L530 T550 R555 E561 K562	I526-I558 HydrophobicContact CB-CD1 3.84Å; I526-I558 HydrophobicContact CD1-CD1 4.42Å; I526-I558 HydrophobicContact CG2-CD1 3.66Å; I526-I558 HydrophobicContact CG2-CG2 4.35Å; L530-I558 HydrophobicContact CD1-CG2 3.37Å; T550-I558 HydrophobicContact CG2-CG2 4.47Å; R555-I558 HydrophobicContact CB-CB 4Å; R555-I558 HydrophobicContact CB-CD1 3.89Å; R555-I558 HydrophobicContact CB-CG1 3.94Å; R555-I558 HydrophobicContact CG-CD1 3.97Å; R555-I558 HydrophobicContact CG-CG1 4.47Å; R555-I558 PolarHBondContact O-N 2.78Å; I558-E561 PolarHBondContact O-N 3.15Å; I558-K562 HydrophobicContact CG2-CD 3.71Å; I558-K562 HydrophobicContact CG2-CG 4.16Å; I558-K562 WeakPolarHBondContact O-CB 2.82Å; I558-K562 PolarHBondContact O-N 2.94Å
559	A	82.4	Confident	75.1	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	29%	0.293	C	S	.	.	I	π-helix	trans	-61.4	-44.9	171.9	0	0	0	0	0	112.2	T550 R555 D557 I563 F564 F590 L593	T550-A559 HydrophobicContact CG2-CB 4.11Å; R555-A559 WeakPolarHBondContact O-CB 3.47Å; R555-A559 PolarHBondContact O-N 3.4Å; D557-A559 VanDerWaalsContact C-N 3.28Å; D557-A559 PolarHBondContact O-N 3.32Å; A559-I563 HydrophobicContact CB-CD1 4.35Å; A559-I563 WeakPolarHBondContact O-CA 3.44Å; A559-I563 WeakPolarHBondContact O-CB 3.15Å; A559-I563 PolarHBondContact O-N 3.43Å; A559-F564 HydrophobicContact CB-CD2 4.27Å; A559-F564 HydrophobicContact CB-CE2 4.43Å; A559-F564 WeakPolarHBondContact O-CD2 3.01Å; A559-F564 PolarHBondContact O-N 2.92Å; A559-F590 HydrophobicContact CB-CE1 3.74Å; A559-F590 HydrophobicContact CB-CZ 4.13Å; A559-L593 HydrophobicContact CB-CD2 3.94Å
560	R	82.9	Confident	74.8	Confident	104 Å²	104	62.7 Å²	62.7	39%	0.392	30%	0.296	S	S	.	.	I	π-helix	trans	-61.1	-44.9	177.1	-177.5	179.8	-73.4	102.2	-0.2	111.4	A556 D557 L593 E596	A556-R560 WeakPolarHBondContact O-CB 3.5Å; A556-R560 PolarHBondContact O-N 2.92Å; D557-R560 WeakPolarHBondContact O-CB 3.39Å; D557-R560 PolarHBondContact O-N 3.5Å; R560-L593 HydrophobicContact CB-CD1 4.07Å; R560-L593 HydrophobicContact CB-CD2 4.32Å; R560-L593 HydrophobicContact CG-CD1 4.18Å; R560-E596 IonicContact CZ-OE2 3.14Å; R560-E596 IonicContact NE-OE2 2.73Å; R560-E596 IonicContact NH2-OE2 3.5Å; R560-E596 PolarHBondContact NH2-OE2 3.26Å
561	E	79.2	Confident	74.2	Confident	126 Å²	126	69.8 Å²	69.8	59%	0.589	33%	0.327	S	S	*	.	I	π-helix	trans	-74.7	-42	-175.7	-69.8	173.9	-176	0	0	114.1	D557 I558 L565	D557-E561 PolarHBondContact O-N 3.43Å; I558-E561 PolarHBondContact O-N 3.15Å; E561-L565 WeakPolarHBondContact O-CD2 3.04Å
562	K	74.6	Confident	73.6	Confident	88 Å²	88	78.1 Å²	78.1	38%	0.383	36%	0.363	S	S	.	.	I	π-helix	trans	-106.8	-27.8	-167.5	-54.7	-173.9	-170.3	172.4	0	113.5	I558	I558-K562 HydrophobicContact CG2-CD 3.71Å; I558-K562 HydrophobicContact CG2-CG 4.16Å; I558-K562 WeakPolarHBondContact O-CB 2.82Å; I558-K562 PolarHBondContact O-N 2.94Å
563	I	77.5	Confident	73.5	Confident	3 Å²	3	77.7 Å²	77.7	2%	0.015	37%	0.368	C	S	.	.	I	π-helix	trans	-103.1	-49.8	-175.8	-53.1	177.3	0	0	0	111.2	Q546 L547 T550 A559 L565 W570	Q546-I563 HydrophobicContact CB-CD1 3.93Å; Q546-I563 HydrophobicContact CB-CG1 4.31Å; Q546-I563 VanDerWaalsContact O-CD1 3.28Å; Q546-I563 WeakPolarHBondContact O-CD1 3.4Å; L547-I563 HydrophobicContact CB-CD1 4.5Å; T550-I563 HydrophobicContact CG2-CD1 3.75Å; T550-I563 VanDerWaalsContact OG1-CD1 3.28Å; T550-I563 WeakPolarHBondContact OG1-CD1 3.41Å; A559-I563 HydrophobicContact CB-CD1 4.35Å; A559-I563 WeakPolarHBondContact O-CA 3.44Å; A559-I563 WeakPolarHBondContact O-CB 3.15Å; A559-I563 PolarHBondContact O-N 3.43Å; I563-L565 VanDerWaalsContact C-N 3.29Å; I563-L565 PolarHBondContact O-N 3.4Å; I563-W570 HydrophobicContact CG2-CH2 4.01Å; I563-W570 HydrophobicContact CG2-CZ2 4.29Å
564	F	77.3	Confident	73.6	Confident	5 Å²	5	79.4 Å²	79.4	2%	0.022	38%	0.375	C	S	.	.	S	Bend	trans	-90.9	36.6	-172.7	-72.5	-79.3	0	0	0	114.4	L547 A559 W570 L575 L593 F594 Q597	L547-F564 HydrophobicContact CD1-CE2 3.69Å; L547-F564 HydrophobicContact CD1-CZ 4Å; L547-F564 HydrophobicContact CD2-CZ 4.41Å; A559-F564 HydrophobicContact CB-CD2 4.27Å; A559-F564 HydrophobicContact CB-CE2 4.43Å; A559-F564 WeakPolarHBondContact O-CD2 3.01Å; A559-F564 PolarHBondContact O-N 2.92Å; F564-W570 AromaticContact CD1-CE2 3.75Å; F564-W570 HydrophobicContact CD1-CH2 4.41Å; F564-W570 AromaticContact CD1-CZ2 3.44Å; F564-W570 HydrophobicContact CD1-CZ2 3.44Å; F564-W570 VanDerWaalsContact CD1-CZ2 3.44Å; F564-W570 AromaticContact CD1-NE1 3.69Å; F564-W570 HydrophobicContact CE1-CD2 4.35Å; F564-W570 AromaticContact CE1-CE2 3.43Å; F564-W570 VanDerWaalsContact CE1-CE2 3.43Å; F564-W570 AromaticContact CE1-CH2 3.8Å; F564-W570 HydrophobicContact CE1-CH2 3.8Å; F564-W570 AromaticContact CE1-CZ2 3.14Å; F564-W570 HydrophobicContact CE1-CZ2 3.14Å; F564-W570 AromaticContact CE1-NE1 3.67Å; F564-W570 HydrophobicContact CG-CZ2 4.27Å; F564-W570 AromaticContact CZ-CH2 3.96Å; F564-W570 HydrophobicContact CZ-CH2 3.96Å; F564-W570 AromaticContact CZ-CZ2 3.76Å; F564-W570 HydrophobicContact CZ-CZ2 3.76Å; F564-L575 HydrophobicContact CZ-CD2 4.41Å; F564-L593 HydrophobicContact CB-CD1 4.41Å; F564-L593 HydrophobicContact CD2-CD1 4.43Å; F564-L593 HydrophobicContact CD2-CD2 3.61Å; F564-L593 HydrophobicContact CD2-CG 4.01Å; F564-L593 HydrophobicContact CE2-CD2 3.87Å; F564-L593 HydrophobicContact CE2-CG 4.25Å; F564-L593 HydrophobicContact CG-CD1 4.43Å; F564-L593 HydrophobicContact CG-CD2 4.4Å; F564-L593 HydrophobicContact CG-CG 4.39Å; F564-F594 HydrophobicContact CE1-CD1 4.47Å; F564-F594 HydrophobicContact CE2-CD1 4.33Å; F564-F594 AromaticContact CE2-CE1 3.99Å; F564-F594 HydrophobicContact CE2-CE1 3.99Å; F564-F594 AromaticContact CZ-CD1 3.75Å; F564-F594 HydrophobicContact CZ-CD1 3.75Å; F564-F594 AromaticContact CZ-CE1 3.66Å; F564-F594 HydrophobicContact CZ-CE1 3.66Å; F564-Q597 HydrophobicContact CB-CG 4.4Å; F564-Q597 HydrophobicContact CD1-CB 4.26Å; F564-Q597 HydrophobicContact CD1-CG 3.52Å; F564-Q597 HydrophobicContact CE1-CB 4.37Å; F564-Q597 HydrophobicContact CE1-CG 4.03Å; F564-Q597 HydrophobicContact CG-CG 4.16Å; F564-Q597 PolarHBondContact O-NE2 2.96Å
565	L	70.7	Confident	73.9	Confident	95 Å²	95	77.1 Å²	77.1	50%	0.497	36%	0.363	S	S	.	.			trans	-54.3	135.6	172.1	-67.4	170.4	0	0	0	111.4	E561 I563 N567 K568	E561-L565 WeakPolarHBondContact O-CD2 3.04Å; I563-L565 VanDerWaalsContact C-N 3.29Å; I563-L565 PolarHBondContact O-N 3.4Å; L565-N567 PolarHBondContact O-N 3.34Å; L565-K568 PolarHBondContact O-N 2.84Å; L565-K568 VanDerWaalsContact O-N 3.14Å
566	E	57.6	Low	74.1	Confident	188 Å²	188	77.1 Å²	77.1	88%	0.879	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-6	-160.7	-58.3	-172.6	132.5	0	0	117.7
567	N	60.1	Low	74.1	Confident	148 Å²	148	82.2 Å²	82.2	79%	0.791	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-10.5	-176.2	-71.2	-76	0	0	0	114.9	L565	L565-N567 PolarHBondContact O-N 3.34Å
568	K	64.4	Low	74.3	Confident	72 Å²	72	80.5 Å²	80.5	31%	0.313	38%	0.382	S	S	.	.			trans	-77.9	128.8	-177.4	-73.7	-175.9	176.5	178.2	0	112.1	L565	L565-K568 PolarHBondContact O-N 2.84Å; L565-K568 VanDerWaalsContact O-N 3.14Å
569	K	63.2	Low	74.6	Confident	195 Å²	195	80.3 Å²	80.3	85%	0.848	38%	0.381	S	S	*	.			trans	-110	108.7	-178.7	-73.4	179.1	-179.6	169.6	0	112.5
570	W	70	Confident	75	Confident	43 Å²	43	81.4 Å²	81.4	16%	0.163	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-69.9	141.5	178.8	-54.1	85.5	0	0	0	112.2	I542 L547 I563 F564 L575	I542-W570 HydrophobicContact CD1-CD2 4.12Å; I542-W570 HydrophobicContact CD1-CE3 4.04Å; I542-W570 HydrophobicContact CD1-CZ3 4.39Å; I542-W570 HydrophobicContact CG2-CE3 4.15Å; I542-W570 HydrophobicContact CG2-CH2 3.55Å; I542-W570 HydrophobicContact CG2-CZ2 4.34Å; I542-W570 HydrophobicContact CG2-CZ3 3.46Å; I542-W570 VanDerWaalsContact CG2-CZ3 3.46Å; L547-W570 HydrophobicContact CD2-CH2 4.26Å; L547-W570 HydrophobicContact CD2-CZ3 4.14Å; I563-W570 HydrophobicContact CG2-CH2 4.01Å; I563-W570 HydrophobicContact CG2-CZ2 4.29Å; F564-W570 AromaticContact CD1-CE2 3.75Å; F564-W570 HydrophobicContact CD1-CH2 4.41Å; F564-W570 AromaticContact CD1-CZ2 3.44Å; F564-W570 HydrophobicContact CD1-CZ2 3.44Å; F564-W570 VanDerWaalsContact CD1-CZ2 3.44Å; F564-W570 AromaticContact CD1-NE1 3.69Å; F564-W570 HydrophobicContact CE1-CD2 4.35Å; F564-W570 AromaticContact CE1-CE2 3.43Å; F564-W570 VanDerWaalsContact CE1-CE2 3.43Å; F564-W570 AromaticContact CE1-CH2 3.8Å; F564-W570 HydrophobicContact CE1-CH2 3.8Å; F564-W570 AromaticContact CE1-CZ2 3.14Å; F564-W570 HydrophobicContact CE1-CZ2 3.14Å; F564-W570 AromaticContact CE1-NE1 3.67Å; F564-W570 HydrophobicContact CG-CZ2 4.27Å; F564-W570 AromaticContact CZ-CH2 3.96Å; F564-W570 HydrophobicContact CZ-CH2 3.96Å; F564-W570 AromaticContact CZ-CZ2 3.76Å; F564-W570 HydrophobicContact CZ-CZ2 3.76Å; W570-L575 HydrophobicContact CB-CD1 4.25Å; W570-L575 HydrophobicContact CD2-CD1 3.9Å; W570-L575 HydrophobicContact CD2-CD2 4.34Å; W570-L575 HydrophobicContact CD2-CG 4.22Å; W570-L575 HydrophobicContact CE3-CD1 3.99Å; W570-L575 HydrophobicContact CE3-CD2 3.67Å; W570-L575 HydrophobicContact CE3-CG 3.77Å; W570-L575 HydrophobicContact CG-CD1 3.97Å; W570-L575 HydrophobicContact CH2-CD2 4.36Å; W570-L575 HydrophobicContact CZ3-CD2 3.65Å; W570-L575 HydrophobicContact CZ3-CG 4.28Å
571	K	67.5	Low	75.1	Confident	149 Å²	149	79.8 Å²	79.8	65%	0.648	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-78.9	137.2	171.3	-51.2	165.7	-166.4	155.4	0	108.7	G573 Q574	K571-G573 PolarHBondContact O-N 2.74Å; K571-Q574 HydrophobicContact CB-CG 4.08Å; K571-Q574 PolarHBondContact O-N 3.28Å; K571-Q574 VanDerWaalsContact O-N 3.13Å
572	K	67.1	Low	75.6	Confident	177 Å²	177	73.8 Å²	73.8	77%	0.77	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.3	126.5	174.2	-77.6	-161	166.4	-146.6	0	110.7	D603	K572-D603 IonicContact NZ-OD2 2.79Å; K572-D603 PolarHBondContact NZ-OD2 3.1Å
573	G	70.9	Confident	76.2	Confident	39 Å²	39	69.6 Å²	69.6	40%	0.402	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.8	-23.3	179.4	0	0	0	0	0	115.9	K571 L575 N576	K571-G573 PolarHBondContact O-N 2.74Å; G573-L575 VanDerWaalsContact C-N 3.29Å; G573-L575 PolarHBondContact O-N 3Å; G573-N576 WeakPolarHBondContact CA-OD1 3.49Å; G573-N576 WeakPolarHBondContact O-CB 3.46Å; G573-N576 PolarHBondContact O-N 3.46Å; G573-N576 PolarHBondContact O-OD1 2.89Å
574	Q	76.3	Confident	76.6	Confident	57 Å²	57	71.3 Å²	71.3	27%	0.266	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-28.2	-175.7	-73.3	-172.7	-80.8	0	0	114.2	K571	K571-Q574 HydrophobicContact CB-CG 4.08Å; K571-Q574 PolarHBondContact O-N 3.28Å; K571-Q574 VanDerWaalsContact O-N 3.13Å
575	L	83.2	Confident	76.7	Confident	11 Å²	11	73.7 Å²	73.7	6%	0.058	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	0.3	179.6	-72.2	171.8	0	0	0	113.3	L547 F564 W570 G573 D577 Y578 M579 F599	L547-L575 HydrophobicContact CD2-CD2 3.47Å; L547-L575 VanDerWaalsContact CD2-CD2 3.47Å; F564-L575 HydrophobicContact CZ-CD2 4.41Å; W570-L575 HydrophobicContact CB-CD1 4.25Å; W570-L575 HydrophobicContact CD2-CD1 3.9Å; W570-L575 HydrophobicContact CD2-CD2 4.34Å; W570-L575 HydrophobicContact CD2-CG 4.22Å; W570-L575 HydrophobicContact CE3-CD1 3.99Å; W570-L575 HydrophobicContact CE3-CD2 3.67Å; W570-L575 HydrophobicContact CE3-CG 3.77Å; W570-L575 HydrophobicContact CG-CD1 3.97Å; W570-L575 HydrophobicContact CH2-CD2 4.36Å; W570-L575 HydrophobicContact CZ3-CD2 3.65Å; W570-L575 HydrophobicContact CZ3-CG 4.28Å; G573-L575 VanDerWaalsContact C-N 3.29Å; G573-L575 PolarHBondContact O-N 3Å; L575-D577 PolarHBondContact O-N 3.36Å; L575-Y578 PolarHBondContact O-N 2.96Å; L575-M579 WeakPolarHBondContact O-CB 3.12Å; L575-M579 PolarHBondContact O-N 3.1Å; L575-F599 HydrophobicContact CB-CD2 3.72Å; L575-F599 HydrophobicContact CB-CE2 3.73Å; L575-F599 HydrophobicContact CD1-CD2 4.38Å
576	N	84.6	Confident	77.3	Confident	46 Å²	46	72.3 Å²	72.3	25%	0.246	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-41.9	-170.5	-74.3	17.8	0	0	0	112.7	G573 M579 Y580 F599 F604	G573-N576 WeakPolarHBondContact CA-OD1 3.49Å; G573-N576 WeakPolarHBondContact O-CB 3.46Å; G573-N576 PolarHBondContact O-N 3.46Å; G573-N576 PolarHBondContact O-OD1 2.89Å; N576-M579 PolarHBondContact O-N 3.36Å; N576-Y580 PolarHBondContact O-N 2.87Å; N576-F599 WeakPolarHBondContact OD1-CE2 3.42Å; N576-F604 HydrophobicContact CB-CD2 4.11Å; N576-F604 HydrophobicContact CB-CE2 4.45Å; N576-F604 VanDerWaalsContact O-CE2 3.31Å; N576-F604 WeakPolarHBondContact O-CE2 3.41Å
577	D	84.2	Confident	78.7	Confident	115 Å²	115	66.8 Å²	66.8	62%	0.615	33%	0.326	S	S	*	.	H	α-helix	trans	-75.1	-35.4	-178.2	-59.8	-58.8	0	0	0	111.5	L575 Y580 Q581	L575-D577 PolarHBondContact O-N 3.36Å; D577-Y580 WeakPolarHBondContact O-CB 3.15Å; D577-Y580 PolarHBondContact O-N 3.19Å; D577-Q581 WeakPolarHBondContact O-CB 3.39Å; D577-Q581 PolarHBondContact O-N 2.85Å
578	Y	85.9	Confident	80.1	Confident	25 Å²	25	62.1 Å²	62.1	10%	0.098	30%	0.299	C	S	.	.	H	α-helix	trans	-64	-40.7	169.9	-62.1	-73.7	0	0	0	112.5	L544 L547 E548 L551 L575 Q581 A582	L544-Y578 HydrophobicContact CB-CE2 4.4Å; L544-Y578 HydrophobicContact CD2-CE2 4.13Å; L547-Y578 HydrophobicContact CD2-CD1 4.21Å; L547-Y578 HydrophobicContact CD2-CD2 3.96Å; L547-Y578 HydrophobicContact CD2-CE2 4.46Å; L547-Y578 HydrophobicContact CD2-CG 3.84Å; L547-Y578 HydrophobicContact CG-CD1 4.1Å; L547-Y578 HydrophobicContact CG-CE1 4.48Å; L547-Y578 HydrophobicContact CG-CG 4.23Å; E548-Y578 HydrophobicContact CB-CE1 3.89Å; E548-Y578 HydrophobicContact CG-CE1 4.2Å; E548-Y578 PolarHBondContact OE2-OH 3.35Å; L551-Y578 HydrophobicContact CD2-CD1 3.94Å; L575-Y578 PolarHBondContact O-N 2.96Å; Y578-Q581 PolarHBondContact O-N 3.21Å; Y578-A582 WeakPolarHBondContact O-CB 3.07Å; Y578-A582 PolarHBondContact O-N 3.26Å
579	M	88.1	Confident	81.2	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-42.3	171.4	177.1	62.1	81.6	0	0	111.1	L575 N576 Q581 A582 L583 V591 F594 F599 F604	L575-M579 WeakPolarHBondContact O-CB 3.12Å; L575-M579 PolarHBondContact O-N 3.1Å; N576-M579 PolarHBondContact O-N 3.36Å; M579-Q581 PolarHBondContact O-N 3.13Å; M579-A582 PolarHBondContact O-N 2.68Å; M579-L583 HydrophobicContact CG-CD1 3.99Å; M579-L583 HydrophobicContact CG-CG 4.46Å; M579-L583 WeakPolarHBondContact O-CB 3.36Å; M579-L583 WeakPolarHBondContact O-CG 3.25Å; M579-L583 PolarHBondContact O-N 3.42Å; M579-L583 HydrophobicContact SD-CD1 4.06Å; M579-L583 HydrophobicContact SD-CD2 4.46Å; M579-L583 HydrophobicContact SD-CG 4.02Å; M579-V591 HydrophobicContact CE-CG1 4.34Å; M579-V591 HydrophobicContact SD-CB 4.46Å; M579-V591 HydrophobicContact SD-CG1 4.04Å; M579-V591 HydrophobicContact SD-CG2 4.07Å; M579-F594 HydrophobicContact CB-CD2 4.3Å; M579-F594 HydrophobicContact CE-CB 3.62Å; M579-F594 HydrophobicContact CE-CD2 3.86Å; M579-F594 HydrophobicContact CE-CG 4.26Å; M579-F594 HydrophobicContact SD-CD2 4.18Å; M579-F599 HydrophobicContact CB-CE1 4.17Å; M579-F599 HydrophobicContact CB-CE2 4.07Å; M579-F599 HydrophobicContact CB-CZ 3.71Å; M579-F599 HydrophobicContact CE-CB 4.38Å; M579-F599 HydrophobicContact CE-CD1 3.48Å; M579-F599 VanDerWaalsContact CE-CD1 3.48Å; M579-F599 HydrophobicContact CE-CD2 4.5Å; M579-F599 HydrophobicContact CE-CE1 3.76Å; M579-F599 HydrophobicContact CE-CG 3.88Å; M579-F599 HydrophobicContact CE-CZ 4.39Å; M579-F599 HydrophobicContact CG-CD1 4.43Å; M579-F599 HydrophobicContact CG-CE1 3.72Å; M579-F599 HydrophobicContact CG-CZ 3.78Å; M579-F604 HydrophobicContact CB-CE2 4.3Å; M579-F604 HydrophobicContact CB-CZ 4.37Å; M579-F604 HydrophobicContact CG-CD1 4.24Å; M579-F604 HydrophobicContact CG-CD2 4.49Å; M579-F604 HydrophobicContact CG-CE1 3.87Å; M579-F604 HydrophobicContact CG-CE2 4.14Å; M579-F604 HydrophobicContact CG-CZ 3.81Å
580	Y	89.4	Confident	82.5	Confident	23 Å²	23	53.2 Å²	53.2	9%	0.09	26%	0.264	C	S	.	.	H	α-helix	trans	-58.9	-47.8	174.5	-174.4	-99.2	0	0	0	111.7	N576 D577 L583 M584 M609 K612 L613 D616	N576-Y580 PolarHBondContact O-N 2.87Å; D577-Y580 WeakPolarHBondContact O-CB 3.15Å; D577-Y580 PolarHBondContact O-N 3.19Å; Y580-L583 PolarHBondContact O-N 2.89Å; Y580-M584 HydrophobicContact CD1-CG 4.09Å; Y580-M584 HydrophobicContact CE1-CG 3.66Å; Y580-M584 HydrophobicContact CE1-SD 4.44Å; Y580-M584 HydrophobicContact CE2-CG 4.37Å; Y580-M584 WeakPolarHBondContact O-CB 3.32Å; Y580-M584 VanDerWaalsContact O-CG 3.26Å; Y580-M584 WeakPolarHBondContact O-CG 3.29Å; Y580-M584 PolarHBondContact O-N 3.08Å; Y580-M609 HydrophobicContact CD2-CG 4.5Å; Y580-M609 HydrophobicContact CD2-SD 3.41Å; Y580-M609 WeakPolarHBondContact CD2-SD 3.45Å; Y580-M609 HydrophobicContact CE2-SD 3.62Å; Y580-M609 HydrophobicContact CG-SD 4.41Å; Y580-K612 HydrophobicContact CE1-CD 4.36Å; Y580-K612 HydrophobicContact CE2-CD 3.68Å; Y580-K612 HydrophobicContact CE2-CG 4.24Å; Y580-K612 VanDerWaalsContact CZ-CE 3.41Å; Y580-K612 VanDerWaalsContact CZ-NZ 3.28Å; Y580-K612 WeakPolarHBondContact OH-CD 3.48Å; Y580-K612 VanDerWaalsContact OH-CE 3.27Å; Y580-K612 WeakPolarHBondContact OH-CE 3.43Å; Y580-K612 WeakPolarHBondContact OH-CG 3.07Å; Y580-L613 HydrophobicContact CD2-CD2 3.82Å; Y580-L613 HydrophobicContact CD2-CG 4.28Å; Y580-L613 HydrophobicContact CE2-CD2 3.5Å; Y580-L613 HydrophobicContact CE2-CG 3.84Å; Y580-D616 WeakPolarHBondContact OH-CB 3.22Å; Y580-D616 PolarHBondContact OH-OD2 2.92Å
581	Q	86.2	Confident	83.4	Confident	69 Å²	69	51.2 Å²	51.2	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-62.7	-46.1	178.7	-173.5	176.1	9.5	0	0	111.8	L551 D577 Y578 M579 L583 M584 S585	L551-Q581 HydrophobicContact CD2-CB 3.98Å; L551-Q581 HydrophobicContact CD2-CG 3.97Å; D577-Q581 WeakPolarHBondContact O-CB 3.39Å; D577-Q581 PolarHBondContact O-N 2.85Å; Y578-Q581 PolarHBondContact O-N 3.21Å; M579-Q581 PolarHBondContact O-N 3.13Å; Q581-L583 PolarHBondContact O-N 3.36Å; Q581-M584 WeakPolarHBondContact O-CB 3.29Å; Q581-M584 PolarHBondContact O-N 2.73Å; Q581-M584 VanDerWaalsContact O-N 3.12Å; Q581-S585 PolarHBondContact O-N 3.41Å; Q581-S585 PolarHBondContact O-OG 3.46Å
582	A	88.3	Confident	84.4	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.1	-41	178.2	0	0	0	0	0	113.2	L551 Y578 M579 M584 D586 R587 F590 V591 F594	L551-A582 HydrophobicContact CD1-CB 3.92Å; Y578-A582 WeakPolarHBondContact O-CB 3.07Å; Y578-A582 PolarHBondContact O-N 3.26Å; M579-A582 PolarHBondContact O-N 2.68Å; A582-M584 VanDerWaalsContact C-N 3.35Å; A582-D586 PolarHBondContact O-N 2.93Å; A582-D586 VanDerWaalsContact O-N 3.15Å; A582-R587 HydrophobicContact CB-CB 4.42Å; A582-R587 PolarHBondContact O-N 3.47Å; A582-F590 HydrophobicContact CB-CB 4.09Å; A582-V591 HydrophobicContact CB-CG2 3.85Å; A582-F594 HydrophobicContact CB-CE2 4.02Å
583	L	88.6	Confident	85.4	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-41.5	172.1	-69.1	169.6	0	0	0	111.2	M579 Y580 Q581 V591 F604 L613 L1176 W1179 K1185 F1192	M579-L583 HydrophobicContact CG-CD1 3.99Å; M579-L583 HydrophobicContact CG-CG 4.46Å; M579-L583 WeakPolarHBondContact O-CB 3.36Å; M579-L583 WeakPolarHBondContact O-CG 3.25Å; M579-L583 PolarHBondContact O-N 3.42Å; M579-L583 HydrophobicContact SD-CD1 4.06Å; M579-L583 HydrophobicContact SD-CD2 4.46Å; M579-L583 HydrophobicContact SD-CG 4.02Å; Y580-L583 PolarHBondContact O-N 2.89Å; Q581-L583 PolarHBondContact O-N 3.36Å; L583-V591 HydrophobicContact CD2-CG1 4.22Å; L583-V591 HydrophobicContact CD2-CG2 3.89Å; L583-V591 HydrophobicContact CG-CG2 4.22Å; L583-F604 HydrophobicContact CD1-CE1 3.62Å; L583-F604 HydrophobicContact CD1-CZ 3.92Å; L583-L613 HydrophobicContact CB-CD2 4.25Å; L583-L613 HydrophobicContact CD1-CD1 4.44Å; L583-L1176 HydrophobicContact CD1-CD2 4.43Å; L583-W1179 HydrophobicContact CB-CH2 4.04Å; L583-W1179 HydrophobicContact CD2-CH2 4.49Å; L583-W1179 HydrophobicContact CD2-CZ3 4.22Å; L583-W1179 WeakPolarHBondContact O-CH2 3.39Å; L583-K1185 PolarHBondContact O-NZ 2.67Å; L583-F1192 HydrophobicContact CD2-CE2 4.17Å; L583-F1192 HydrophobicContact CD2-CZ 3.71Å
584	M	85.1	Confident	86.2	Confident	39 Å²	39	37.8 Å²	37.8	19%	0.192	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-46.7	179.7	-77.2	-60.8	-58.3	0	0	112.3	Y580 Q581 A582 D586 L613 D616 Q617 K1185	Y580-M584 HydrophobicContact CD1-CG 4.09Å; Y580-M584 HydrophobicContact CE1-CG 3.66Å; Y580-M584 HydrophobicContact CE1-SD 4.44Å; Y580-M584 HydrophobicContact CE2-CG 4.37Å; Y580-M584 WeakPolarHBondContact O-CB 3.32Å; Y580-M584 VanDerWaalsContact O-CG 3.26Å; Y580-M584 WeakPolarHBondContact O-CG 3.29Å; Y580-M584 PolarHBondContact O-N 3.08Å; Q581-M584 WeakPolarHBondContact O-CB 3.29Å; Q581-M584 PolarHBondContact O-N 2.73Å; Q581-M584 VanDerWaalsContact O-N 3.12Å; A582-M584 VanDerWaalsContact C-N 3.35Å; M584-D586 PolarHBondContact O-N 3.17Å; M584-L613 HydrophobicContact CG-CD2 4.49Å; M584-L613 HydrophobicContact SD-CD2 4.16Å; M584-D616 HydrophobicContact CE-CB 3.6Å; M584-D616 HydrophobicContact SD-CB 4.02Å; M584-Q617 HydrophobicContact CE-CG 4.34Å; M584-Q617 PolarHBondContact O-NE2 3.03Å; M584-Q617 HydrophobicContact SD-CG 4.09Å; M584-Q617 PolarHBondContact SD-NE2 3.22Å; M584-K1185 PolarHBondContact O-NZ 2.87Å
585	S	79.9	Confident	86.7	Confident	56 Å²	56	36.7 Å²	36.7	39%	0.392	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	10.5	-178.9	52.6	0	0	0	0	115.6	Q581 R587	Q581-S585 PolarHBondContact O-N 3.41Å; Q581-S585 PolarHBondContact O-OG 3.46Å; S585-R587 VanDerWaalsContact C-N 3.31Å; S585-R587 PolarHBondContact O-N 3.07Å; S585-R587 WeakPolarHBondContact OG-CG 3.4Å
586	D	83.9	Confident	86.7	Confident	66 Å²	66	41.1 Å²	41.1	35%	0.353	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	28.8	176.1	-147.2	30.5	0	0	0	115.6	A582 M584 H588 K1185 M1188	A582-D586 PolarHBondContact O-N 2.93Å; A582-D586 VanDerWaalsContact O-N 3.15Å; M584-D586 PolarHBondContact O-N 3.17Å; D586-H588 VanDerWaalsContact C-N 3.32Å; D586-H588 PolarHBondContact O-N 3.21Å; D586-K1185 HydrophobicContact CB-CD 4.34Å; D586-K1185 WeakPolarHBondContact OD1-CB 3.35Å; D586-K1185 VanDerWaalsContact OD1-CD 3.25Å; D586-K1185 WeakPolarHBondContact OD1-CD 3.38Å; D586-K1185 WeakPolarHBondContact OD1-CG 3.26Å; D586-K1185 IonicContact OD1-NZ 2.66Å; D586-M1188 WeakPolarHBondContact OD1-CG 3.43Å
587	R	87	Confident	86.5	Confident	72 Å²	72	42.3 Å²	42.3	27%	0.272	21%	0.207	S	C	.	.			trans	-79.4	77	-178.5	-50.5	-53.2	-151	-177.7	0.9	111.2	L551 N554 A582 S585 D589 F590 V591	L551-R587 HydrophobicContact CD1-CG 4.33Å; N554-R587 VanDerWaalsContact CG-CZ 3.46Å; N554-R587 WeakPolarHBondContact OD1-CD 3.33Å; N554-R587 PolarHBondContact OD1-NE 3.47Å; N554-R587 PolarHBondContact OD1-NH1 3.49Å; A582-R587 HydrophobicContact CB-CB 4.42Å; A582-R587 PolarHBondContact O-N 3.47Å; S585-R587 VanDerWaalsContact C-N 3.31Å; S585-R587 PolarHBondContact O-N 3.07Å; S585-R587 WeakPolarHBondContact OG-CG 3.4Å; R587-D589 PolarHBondContact O-N 2.78Å; R587-F590 HydrophobicContact CB-CB 4.13Å; R587-F590 HydrophobicContact CB-CD2 4.03Å; R587-F590 PolarHBondContact O-N 3.41Å; R587-V591 PolarHBondContact O-N 2.78Å; R587-V591 VanDerWaalsContact O-N 3.15Å
588	H	89.1	Confident	86.2	Confident	49 Å²	49	39.9 Å²	39.9	23%	0.227	21%	0.21	C	C	.	.	H	α-helix	trans	-43	-50.1	179.6	162.8	-95.8	0	0	0	112.7	D586 F590 V591 K592 M1188	D586-H588 VanDerWaalsContact C-N 3.32Å; D586-H588 PolarHBondContact O-N 3.21Å; H588-F590 PolarHBondContact O-N 2.76Å; H588-V591 PolarHBondContact O-N 2.86Å; H588-K592 WeakPolarHBondContact O-CB 3.27Å; H588-K592 PolarHBondContact O-N 3.16Å; H588-M1188 HydrophobicContact CB-CE 4.48Å
589	D	87.6	Confident	86.1	Confident	80 Å²	80	39.9 Å²	39.9	43%	0.428	21%	0.21	S	C	.	.	H	α-helix	trans	-73.1	-27.9	-170.7	-54.5	-70.7	0	0	0	113.1	A556 R587 L593	A556-D589 HydrophobicContact CB-CB 3.75Å; R587-D589 PolarHBondContact O-N 2.78Å; D589-L593 WeakPolarHBondContact O-CB 3.47Å; D589-L593 PolarHBondContact O-N 3.01Å
590	F	89.6	Confident	85.8	Confident	1 Å²	1	42 Å²	42	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-71.3	-43.2	169.1	-84.2	-83.3	0	0	0	111.9	T550 L551 A556 A559 A582 R587 H588 K592 L593 F594	T550-F590 VanDerWaalsContact O-CZ 3.25Å; T550-F590 WeakPolarHBondContact O-CZ 3.4Å; L551-F590 HydrophobicContact CB-CE1 4.28Å; L551-F590 HydrophobicContact CB-CZ 4.44Å; L551-F590 HydrophobicContact CD1-CB 3.99Å; L551-F590 HydrophobicContact CD1-CD1 3.84Å; L551-F590 HydrophobicContact CD1-CD2 3.79Å; L551-F590 HydrophobicContact CD1-CE1 4.27Å; L551-F590 HydrophobicContact CD1-CE2 4.22Å; L551-F590 HydrophobicContact CD1-CG 3.59Å; L551-F590 HydrophobicContact CD1-CZ 4.46Å; A556-F590 HydrophobicContact CB-CD2 3.76Å; A556-F590 HydrophobicContact CB-CE2 3.65Å; A556-F590 HydrophobicContact CB-CG 4.24Å; A556-F590 HydrophobicContact CB-CZ 4.04Å; A559-F590 HydrophobicContact CB-CE1 3.74Å; A559-F590 HydrophobicContact CB-CZ 4.13Å; A582-F590 HydrophobicContact CB-CB 4.09Å; R587-F590 HydrophobicContact CB-CB 4.13Å; R587-F590 HydrophobicContact CB-CD2 4.03Å; R587-F590 PolarHBondContact O-N 3.41Å; H588-F590 PolarHBondContact O-N 2.76Å; F590-K592 VanDerWaalsContact C-N 3.32Å; F590-K592 PolarHBondContact O-N 3.09Å; F590-L593 PolarHBondContact O-N 3.41Å; F590-F594 HydrophobicContact CB-CE2 4.29Å; F590-F594 HydrophobicContact CB-CZ 4.21Å; F590-F594 HydrophobicContact CD1-CE1 4.03Å; F590-F594 AromaticContact CD1-CZ 3.85Å; F590-F594 HydrophobicContact CD1-CZ 3.85Å; F590-F594 WeakPolarHBondContact O-CD1 3.41Å; F590-F594 WeakPolarHBondContact O-CD2 3.42Å; F590-F594 WeakPolarHBondContact O-CG 3.33Å; F590-F594 PolarHBondContact O-N 3.14Å
591	V	89.7	Confident	85.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.2	-43.6	176.2	176.7	0	0	0	0	110.2	M579 A582 L583 R587 H588 F594 L595 M1188 L1191 F1192	M579-V591 HydrophobicContact CE-CG1 4.34Å; M579-V591 HydrophobicContact SD-CB 4.46Å; M579-V591 HydrophobicContact SD-CG1 4.04Å; M579-V591 HydrophobicContact SD-CG2 4.07Å; A582-V591 HydrophobicContact CB-CG2 3.85Å; L583-V591 HydrophobicContact CD2-CG1 4.22Å; L583-V591 HydrophobicContact CD2-CG2 3.89Å; L583-V591 HydrophobicContact CG-CG2 4.22Å; R587-V591 PolarHBondContact O-N 2.78Å; R587-V591 VanDerWaalsContact O-N 3.15Å; H588-V591 PolarHBondContact O-N 2.86Å; V591-F594 PolarHBondContact O-N 3.17Å; V591-L595 HydrophobicContact CG1-CD1 3.95Å; V591-L595 WeakPolarHBondContact O-CD1 3.42Å; V591-L595 WeakPolarHBondContact O-CG 3.35Å; V591-L595 PolarHBondContact O-N 3.03Å; V591-L595 VanDerWaalsContact O-N 3.09Å; V591-M1188 HydrophobicContact CB-CE 4.22Å; V591-M1188 HydrophobicContact CB-SD 4.24Å; V591-M1188 HydrophobicContact CG1-SD 4.41Å; V591-M1188 HydrophobicContact CG2-CE 3.65Å; V591-M1188 HydrophobicContact CG2-SD 4.17Å; V591-L1191 HydrophobicContact CB-CD2 4.24Å; V591-L1191 HydrophobicContact CG1-CD2 3.85Å; V591-F1192 HydrophobicContact CG1-CZ 4.23Å
592	K	88.9	Confident	85.4	Confident	82 Å²	82	42.7 Å²	42.7	36%	0.357	23%	0.23	S	C	.	.	H	α-helix	trans	-59.3	-49.2	172.8	-179	175.1	169.5	-179	0	111.8	H588 F590 F594 L595 E596 L1191	H588-K592 WeakPolarHBondContact O-CB 3.27Å; H588-K592 PolarHBondContact O-N 3.16Å; F590-K592 VanDerWaalsContact C-N 3.32Å; F590-K592 PolarHBondContact O-N 3.09Å; K592-F594 PolarHBondContact O-N 3.29Å; K592-L595 PolarHBondContact O-N 3.19Å; K592-L595 VanDerWaalsContact O-N 3.14Å; K592-E596 WeakPolarHBondContact CE-OE1 2.98Å; K592-E596 HydrophobicContact CG-CG 4.39Å; K592-E596 WeakPolarHBondContact O-CG 3.18Å; K592-E596 PolarHBondContact O-N 2.71Å; K592-L1191 HydrophobicContact CB-CD1 4.41Å; K592-L1191 HydrophobicContact CB-CD2 4.15Å; K592-L1191 HydrophobicContact CG-CD1 4.5Å
593	L	87.2	Confident	85	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-41.9	178	-179.8	60.6	0	0	0	112.5	A559 R560 F564 D589 F590 L595 E596 Q597	A559-L593 HydrophobicContact CB-CD2 3.94Å; R560-L593 HydrophobicContact CB-CD1 4.07Å; R560-L593 HydrophobicContact CB-CD2 4.32Å; R560-L593 HydrophobicContact CG-CD1 4.18Å; F564-L593 HydrophobicContact CB-CD1 4.41Å; F564-L593 HydrophobicContact CD2-CD1 4.43Å; F564-L593 HydrophobicContact CD2-CD2 3.61Å; F564-L593 HydrophobicContact CD2-CG 4.01Å; F564-L593 HydrophobicContact CE2-CD2 3.87Å; F564-L593 HydrophobicContact CE2-CG 4.25Å; F564-L593 HydrophobicContact CG-CD1 4.43Å; F564-L593 HydrophobicContact CG-CD2 4.4Å; F564-L593 HydrophobicContact CG-CG 4.39Å; D589-L593 WeakPolarHBondContact O-CB 3.47Å; D589-L593 PolarHBondContact O-N 3.01Å; F590-L593 PolarHBondContact O-N 3.41Å; L593-L595 VanDerWaalsContact C-N 3.32Å; L593-L595 PolarHBondContact O-N 3.04Å; L593-E596 PolarHBondContact O-N 2.94Å; L593-Q597 HydrophobicContact CD1-CG 4.39Å; L593-Q597 WeakPolarHBondContact O-CB 3.41Å; L593-Q597 WeakPolarHBondContact O-CG 3.16Å; L593-Q597 PolarHBondContact O-N 3.3Å
594	F	88.2	Confident	84.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.2	-35.9	176.3	-60.3	-20.7	0	0	0	112.2	L547 F564 M579 A582 F590 V591 K592 Q597 G598 F599	L547-F594 HydrophobicContact CD1-CE1 4.09Å; L547-F594 HydrophobicContact CD1-CZ 4.38Å; F564-F594 HydrophobicContact CE1-CD1 4.47Å; F564-F594 HydrophobicContact CE2-CD1 4.33Å; F564-F594 AromaticContact CE2-CE1 3.99Å; F564-F594 HydrophobicContact CE2-CE1 3.99Å; F564-F594 AromaticContact CZ-CD1 3.75Å; F564-F594 HydrophobicContact CZ-CD1 3.75Å; F564-F594 AromaticContact CZ-CE1 3.66Å; F564-F594 HydrophobicContact CZ-CE1 3.66Å; M579-F594 HydrophobicContact CB-CD2 4.3Å; M579-F594 HydrophobicContact CE-CB 3.62Å; M579-F594 HydrophobicContact CE-CD2 3.86Å; M579-F594 HydrophobicContact CE-CG 4.26Å; M579-F594 HydrophobicContact SD-CD2 4.18Å; A582-F594 HydrophobicContact CB-CE2 4.02Å; F590-F594 HydrophobicContact CB-CE2 4.29Å; F590-F594 HydrophobicContact CB-CZ 4.21Å; F590-F594 HydrophobicContact CD1-CE1 4.03Å; F590-F594 AromaticContact CD1-CZ 3.85Å; F590-F594 HydrophobicContact CD1-CZ 3.85Å; F590-F594 WeakPolarHBondContact O-CD1 3.41Å; F590-F594 WeakPolarHBondContact O-CD2 3.42Å; F590-F594 WeakPolarHBondContact O-CG 3.33Å; F590-F594 PolarHBondContact O-N 3.14Å; V591-F594 PolarHBondContact O-N 3.17Å; K592-F594 PolarHBondContact O-N 3.29Å; F594-Q597 PolarHBondContact O-N 2.84Å; F594-G598 PolarHBondContact O-N 3.22Å; F594-F599 HydrophobicContact CB-CB 4.26Å; F594-F599 WeakPolarHBondContact O-CB 3.33Å; F594-F599 PolarHBondContact O-N 3.45Å
595	L	85.9	Confident	84.9	Confident	35 Å²	35	44.8 Å²	44.8	18%	0.183	24%	0.241	C	C	.	.	H	α-helix	trans	-72.2	-41.5	176.1	-66.8	164.1	0	0	0	112.1	V591 K592 L593 Q597 G598 L601 L1191 M1195	V591-L595 HydrophobicContact CG1-CD1 3.95Å; V591-L595 WeakPolarHBondContact O-CD1 3.42Å; V591-L595 WeakPolarHBondContact O-CG 3.35Å; V591-L595 PolarHBondContact O-N 3.03Å; V591-L595 VanDerWaalsContact O-N 3.09Å; K592-L595 PolarHBondContact O-N 3.19Å; K592-L595 VanDerWaalsContact O-N 3.14Å; L593-L595 VanDerWaalsContact C-N 3.32Å; L593-L595 PolarHBondContact O-N 3.04Å; L595-Q597 PolarHBondContact O-N 3.33Å; L595-G598 PolarHBondContact O-N 3.06Å; L595-L601 HydrophobicContact CD2-CD1 3.85Å; L595-L601 HydrophobicContact CD2-CD2 4.09Å; L595-L601 HydrophobicContact CD2-CG 3.76Å; L595-L1191 HydrophobicContact CD1-CD2 4.16Å; L595-L1191 HydrophobicContact CD1-CG 4.35Å; L595-M1195 HydrophobicContact CD1-CE 3.48Å; L595-M1195 VanDerWaalsContact CD1-CE 3.48Å; L595-M1195 HydrophobicContact CD1-SD 3.77Å; L595-M1195 HydrophobicContact CD2-CE 4.38Å; L595-M1195 HydrophobicContact CD2-SD 3.85Å; L595-M1195 HydrophobicContact CG-SD 4.34Å
596	E	83.8	Confident	85	Confident	104 Å²	104	43.1 Å²	43.1	49%	0.486	23%	0.229	S	C	.	.	H	α-helix	trans	-54.6	-37.9	170.5	-73.3	170.6	168.6	0	0	111	R560 K592 L593 G598	R560-E596 IonicContact CZ-OE2 3.14Å; R560-E596 IonicContact NE-OE2 2.73Å; R560-E596 IonicContact NH2-OE2 3.5Å; R560-E596 PolarHBondContact NH2-OE2 3.26Å; K592-E596 WeakPolarHBondContact CE-OE1 2.98Å; K592-E596 HydrophobicContact CG-CG 4.39Å; K592-E596 WeakPolarHBondContact O-CG 3.18Å; K592-E596 PolarHBondContact O-N 2.71Å; L593-E596 PolarHBondContact O-N 2.94Å; E596-G598 VanDerWaalsContact C-N 3.26Å; E596-G598 PolarHBondContact O-N 3.38Å
597	Q	80.8	Confident	84.9	Confident	70 Å²	70	40 Å²	40	33%	0.327	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	9.1	178.2	-64.3	-77.9	-31.3	0	0	114.1	F564 L593 F594 L595	F564-Q597 HydrophobicContact CB-CG 4.4Å; F564-Q597 HydrophobicContact CD1-CB 4.26Å; F564-Q597 HydrophobicContact CD1-CG 3.52Å; F564-Q597 HydrophobicContact CE1-CB 4.37Å; F564-Q597 HydrophobicContact CE1-CG 4.03Å; F564-Q597 HydrophobicContact CG-CG 4.16Å; F564-Q597 PolarHBondContact O-NE2 2.96Å; L593-Q597 HydrophobicContact CD1-CG 4.39Å; L593-Q597 WeakPolarHBondContact O-CB 3.41Å; L593-Q597 WeakPolarHBondContact O-CG 3.16Å; L593-Q597 PolarHBondContact O-N 3.3Å; F594-Q597 PolarHBondContact O-N 2.84Å; L595-Q597 PolarHBondContact O-N 3.33Å
598	G	76.1	Confident	84.6	Confident	64 Å²	64	39.6 Å²	39.6	66%	0.66	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	84	24.6	171	0	0	0	0	0	115.8	F594 L595 E596 S600	F594-G598 PolarHBondContact O-N 3.22Å; L595-G598 PolarHBondContact O-N 3.06Å; E596-G598 VanDerWaalsContact C-N 3.26Å; E596-G598 PolarHBondContact O-N 3.38Å; G598-S600 PolarHBondContact O-N 3.08Å
599	F	84	Confident	84.4	Confident	25 Å²	25	38.7 Å²	38.7	11%	0.11	21%	0.207	C	C	.	.			trans	-62.4	128.5	175.9	-175.2	-88.4	0	0	0	112.6	L575 N576 M579 F594 L601 F604	L575-F599 HydrophobicContact CB-CD2 3.72Å; L575-F599 HydrophobicContact CB-CE2 3.73Å; L575-F599 HydrophobicContact CD1-CD2 4.38Å; N576-F599 WeakPolarHBondContact OD1-CE2 3.42Å; M579-F599 HydrophobicContact CB-CE1 4.17Å; M579-F599 HydrophobicContact CB-CE2 4.07Å; M579-F599 HydrophobicContact CB-CZ 3.71Å; M579-F599 HydrophobicContact CE-CB 4.38Å; M579-F599 HydrophobicContact CE-CD1 3.48Å; M579-F599 VanDerWaalsContact CE-CD1 3.48Å; M579-F599 HydrophobicContact CE-CD2 4.5Å; M579-F599 HydrophobicContact CE-CE1 3.76Å; M579-F599 HydrophobicContact CE-CG 3.88Å; M579-F599 HydrophobicContact CE-CZ 4.39Å; M579-F599 HydrophobicContact CG-CD1 4.43Å; M579-F599 HydrophobicContact CG-CE1 3.72Å; M579-F599 HydrophobicContact CG-CZ 3.78Å; F594-F599 HydrophobicContact CB-CB 4.26Å; F594-F599 WeakPolarHBondContact O-CB 3.33Å; F594-F599 PolarHBondContact O-N 3.45Å; F599-L601 HydrophobicContact CD1-CD2 4.26Å; F599-L601 HydrophobicContact CE1-CD2 4.28Å; F599-L601 PolarHBondContact O-N 2.76Å; F599-F604 HydrophobicContact CE1-CB 3.52Å; F599-F604 HydrophobicContact CE1-CD1 4.13Å; F599-F604 HydrophobicContact CE1-CD2 4.26Å; F599-F604 AromaticContact CE1-CG 3.72Å; F599-F604 HydrophobicContact CE1-CG 3.72Å; F599-F604 HydrophobicContact CZ-CB 3.64Å; F599-F604 HydrophobicContact CZ-CD1 4.46Å; F599-F604 AromaticContact CZ-CD2 3.79Å; F599-F604 HydrophobicContact CZ-CD2 3.79Å; F599-F604 AromaticContact CZ-CG 3.72Å; F599-F604 HydrophobicContact CZ-CG 3.72Å
600	S	82.9	Confident	84.3	Confident	46 Å²	46	34.9 Å²	34.9	32%	0.322	19%	0.187	S	C	.	.			trans	-87	101.4	-177	-174.8	0	0	0	0	112.4	G598 E602 D603 F604	G598-S600 PolarHBondContact O-N 3.08Å; S600-E602 PolarHBondContact O-N 3.03Å; S600-D603 WeakPolarHBondContact CB-OD2 3.5Å; S600-D603 PolarHBondContact O-N 3.3Å; S600-D603 PolarHBondContact OG-N 3.11Å; S600-D603 PolarHBondContact OG-OD2 3.5Å; S600-F604 PolarHBondContact O-N 2.91Å; S600-F604 VanDerWaalsContact O-N 3.16Å
601	L	84.3	Confident	84.1	Confident	15 Å²	15	37.2 Å²	37.2	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-60.2	-29.2	172.3	-67.6	178.3	0	0	0	113.3	L595 F599 F604 L605 P1172 L1176 F1192 M1195	L595-L601 HydrophobicContact CD2-CD1 3.85Å; L595-L601 HydrophobicContact CD2-CD2 4.09Å; L595-L601 HydrophobicContact CD2-CG 3.76Å; F599-L601 HydrophobicContact CD1-CD2 4.26Å; F599-L601 HydrophobicContact CE1-CD2 4.28Å; F599-L601 PolarHBondContact O-N 2.76Å; L601-F604 PolarHBondContact O-N 3.09Å; L601-L605 PolarHBondContact O-N 2.8Å; L601-P1172 HydrophobicContact CB-CB 4.22Å; L601-P1172 HydrophobicContact CB-CG 3.84Å; L601-L1176 HydrophobicContact CD2-CD1 4.07Å; L601-F1192 HydrophobicContact CD1-CE1 4.29Å; L601-M1195 HydrophobicContact CD1-CE 3.91Å; L601-M1195 HydrophobicContact CD1-SD 3.8Å
602	E	82	Confident	83.9	Confident	91 Å²	91	40.2 Å²	40.2	43%	0.425	21%	0.211	S	C	.	.	H	α-helix	trans	-73.1	-27.2	178.2	-66.8	-176.7	173.1	0	0	112.6	S600 Q1168 P1172 K1197	S600-E602 PolarHBondContact O-N 3.03Å; E602-Q1168 PolarHBondContact O-NE2 3.33Å; E602-P1172 HydrophobicContact CG-CG 3.72Å; E602-K1197 IonicContact OE1-NZ 2.62Å; E602-K1197 PolarHBondContact OE1-NZ 3.17Å
603	D	81.3	Confident	83.8	Confident	74 Å²	74	36.3 Å²	36.3	40%	0.396	19%	0.194	S	C	.	.	H	α-helix	trans	-83.2	-24.9	171.3	-70.1	-32.9	0	0	0	112.7	K572 S600	K572-D603 IonicContact NZ-OD2 2.79Å; K572-D603 PolarHBondContact NZ-OD2 3.1Å; S600-D603 WeakPolarHBondContact CB-OD2 3.5Å; S600-D603 PolarHBondContact O-N 3.3Å; S600-D603 PolarHBondContact OG-N 3.11Å; S600-D603 PolarHBondContact OG-OD2 3.5Å
604	F	85.4	Confident	83.8	Confident	8 Å²	8	36.3 Å²	36.3	4%	0.035	19%	0.194	C	C	.	.	H	α-helix	trans	-88.3	-50	-176.3	170.3	-106.3	0	0	0	113.8	N576 M579 L583 F599 S600 L601 T606 M609	N576-F604 HydrophobicContact CB-CD2 4.11Å; N576-F604 HydrophobicContact CB-CE2 4.45Å; N576-F604 VanDerWaalsContact O-CE2 3.31Å; N576-F604 WeakPolarHBondContact O-CE2 3.41Å; M579-F604 HydrophobicContact CB-CE2 4.3Å; M579-F604 HydrophobicContact CB-CZ 4.37Å; M579-F604 HydrophobicContact CG-CD1 4.24Å; M579-F604 HydrophobicContact CG-CD2 4.49Å; M579-F604 HydrophobicContact CG-CE1 3.87Å; M579-F604 HydrophobicContact CG-CE2 4.14Å; M579-F604 HydrophobicContact CG-CZ 3.81Å; L583-F604 HydrophobicContact CD1-CE1 3.62Å; L583-F604 HydrophobicContact CD1-CZ 3.92Å; F599-F604 HydrophobicContact CE1-CB 3.52Å; F599-F604 HydrophobicContact CE1-CD1 4.13Å; F599-F604 HydrophobicContact CE1-CD2 4.26Å; F599-F604 AromaticContact CE1-CG 3.72Å; F599-F604 HydrophobicContact CE1-CG 3.72Å; F599-F604 HydrophobicContact CZ-CB 3.64Å; F599-F604 HydrophobicContact CZ-CD1 4.46Å; F599-F604 AromaticContact CZ-CD2 3.79Å; F599-F604 HydrophobicContact CZ-CD2 3.79Å; F599-F604 AromaticContact CZ-CG 3.72Å; F599-F604 HydrophobicContact CZ-CG 3.72Å; S600-F604 PolarHBondContact O-N 2.91Å; S600-F604 VanDerWaalsContact O-N 3.16Å; L601-F604 PolarHBondContact O-N 3.09Å; F604-T606 PolarHBondContact O-N 3.26Å; F604-M609 HydrophobicContact CE1-CG 4.49Å; F604-M609 HydrophobicContact CE2-CG 4.27Å; F604-M609 HydrophobicContact CZ-CG 4.08Å
605	L	85.2	Confident	83.6	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	20%	0.196	C	C	.	.			trans	-84.4	81.5	-169.9	-162.4	79.3	0	0	0	111.9	L601 L610 L613 L1169 P1172 E1175 L1176	L601-L605 PolarHBondContact O-N 2.8Å; L605-L610 HydrophobicContact CD1-CB 4.4Å; L605-L610 HydrophobicContact CD1-CD1 4.34Å; L605-L613 HydrophobicContact CD1-CD1 3.96Å; L605-L1169 HydrophobicContact CD2-CD1 3.77Å; L605-L1169 HydrophobicContact CG-CD1 3.95Å; L605-P1172 HydrophobicContact CB-CB 3.78Å; L605-P1172 HydrophobicContact CD2-CB 3.63Å; L605-P1172 WeakPolarHBondContact CD2-O 3.39Å; L605-P1172 HydrophobicContact CG-CB 4.36Å; L605-E1175 HydrophobicContact CD2-CB 4.15Å; L605-L1176 HydrophobicContact CD1-CD1 4.24Å; L605-L1176 HydrophobicContact CD1-CD2 3.97Å; L605-L1176 HydrophobicContact CD1-CG 4.06Å; L605-L1176 HydrophobicContact CD2-CD1 4.11Å; L605-L1176 HydrophobicContact CD2-CG 3.87Å
606	T	82.9	Confident	83.4	Confident	21 Å²	21	36.8 Å²	36.8	13%	0.129	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-79.8	160.6	166.2	60.9	0	0	0	0	111.1	F604 Y608 M609 L610 K1165 I1167	F604-T606 PolarHBondContact O-N 3.26Å; T606-Y608 PolarHBondContact O-N 3.29Å; T606-M609 PolarHBondContact O-N 3.26Å; T606-M609 PolarHBondContact OG1-N 3.49Å; T606-L610 PolarHBondContact O-N 3.11Å; T606-K1165 WeakPolarHBondContact CG2-O 3.49Å; T606-I1167 WeakPolarHBondContact CA-O 3.47Å
607	I	81.5	Confident	83.3	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-55.2	-42.1	174.6	-65.5	-173.7	0	0	0	111.6	M609 L610 E611 L656 F680 L684 I1167 L1169	I607-M609 VanDerWaalsContact C-N 3.34Å; I607-M609 PolarHBondContact O-N 3.33Å; I607-L610 PolarHBondContact O-N 3.01Å; I607-E611 PolarHBondContact O-N 2.85Å; I607-L656 HydrophobicContact CG2-CD1 3.94Å; I607-F680 HydrophobicContact CD1-CE2 3.94Å; I607-F680 HydrophobicContact CD1-CZ 3.9Å; I607-F680 HydrophobicContact CG1-CZ 4.46Å; I607-L684 HydrophobicContact CD1-CD1 3.67Å; I607-L684 HydrophobicContact CD1-CG 4.23Å; I607-L684 HydrophobicContact CG2-CD2 4.43Å; I607-L684 HydrophobicContact CG2-CG 4.5Å; I607-I1167 HydrophobicContact CD1-CB 3.88Å; I607-I1167 HydrophobicContact CD1-CD1 4.36Å; I607-I1167 HydrophobicContact CD1-CG2 3.44Å; I607-I1167 VanDerWaalsContact CD1-CG2 3.44Å; I607-I1167 HydrophobicContact CG1-CB 4.17Å; I607-I1167 HydrophobicContact CG1-CG2 4.09Å; I607-I1167 PolarHBondContact N-O 3.04Å; I607-L1169 HydrophobicContact CD1-CD2 4.48Å; I607-L1169 HydrophobicContact CG1-CD2 3.96Å; I607-L1169 HydrophobicContact CG1-CG 4.08Å
608	Y	80.9	Confident	83.1	Confident	62 Å²	62	29.1 Å²	29.1	24%	0.243	16%	0.161	C	C	.	.	H	α-helix	trans	-58.3	-43.1	174.3	172.8	-96	0	0	0	112.4	V310 T606 E611 K612 K1165	V310-Y608 WeakPolarHBondContact O-CD2 3.08Å; V310-Y608 WeakPolarHBondContact O-CE2 3.1Å; T606-Y608 PolarHBondContact O-N 3.29Å; Y608-E611 PolarHBondContact O-N 2.84Å; Y608-K612 WeakPolarHBondContact O-CB 3.44Å; Y608-K612 PolarHBondContact O-N 2.88Å; Y608-K1165 HydrophobicContact CD1-CG 4.09Å; Y608-K1165 HydrophobicContact CG-CG 4.23Å
609	M	83.9	Confident	82.9	Confident	31 Å²	31	32.4 Å²	32.4	15%	0.153	16%	0.157	C	C	.	.	H	α-helix	trans	-69.7	-35	-179.5	-165	52.6	55.6	0	0	112.2	Y580 F604 T606 I607 K612 L613	Y580-M609 HydrophobicContact CD2-CG 4.5Å; Y580-M609 HydrophobicContact CD2-SD 3.41Å; Y580-M609 WeakPolarHBondContact CD2-SD 3.45Å; Y580-M609 HydrophobicContact CE2-SD 3.62Å; Y580-M609 HydrophobicContact CG-SD 4.41Å; F604-M609 HydrophobicContact CE1-CG 4.49Å; F604-M609 HydrophobicContact CE2-CG 4.27Å; F604-M609 HydrophobicContact CZ-CG 4.08Å; T606-M609 PolarHBondContact O-N 3.26Å; T606-M609 PolarHBondContact OG1-N 3.49Å; I607-M609 VanDerWaalsContact C-N 3.34Å; I607-M609 PolarHBondContact O-N 3.33Å; M609-K612 HydrophobicContact CE-CD 4.27Å; M609-K612 WeakPolarHBondContact O-CB 3.1Å; M609-K612 PolarHBondContact O-N 2.72Å; M609-K612 HydrophobicContact SD-CB 4.37Å; M609-K612 HydrophobicContact SD-CD 3.86Å; M609-L613 WeakPolarHBondContact O-CB 2.96Å; M609-L613 WeakPolarHBondContact O-CG 3.37Å; M609-L613 PolarHBondContact O-N 2.88Å
610	L	86.4	Confident	82.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-67.6	-42.4	174.8	-172.4	65.1	0	0	0	112	L605 T606 I607 K612 L613 Y614 L656 Y675 L1169 E1175 W1179	L605-L610 HydrophobicContact CD1-CB 4.4Å; L605-L610 HydrophobicContact CD1-CD1 4.34Å; T606-L610 PolarHBondContact O-N 3.11Å; I607-L610 PolarHBondContact O-N 3.01Å; L610-K612 VanDerWaalsContact C-N 3.31Å; L610-K612 PolarHBondContact O-N 3.4Å; L610-L613 PolarHBondContact O-N 3.14Å; L610-Y614 HydrophobicContact CD1-CD2 4.27Å; L610-Y614 HydrophobicContact CD1-CE2 3.9Å; L610-Y614 HydrophobicContact CD2-CE2 4.49Å; L610-Y614 HydrophobicContact CG-CD2 4.14Å; L610-Y614 HydrophobicContact CG-CE2 3.95Å; L610-Y614 WeakPolarHBondContact O-CD2 3.46Å; L610-Y614 PolarHBondContact O-N 3.33Å; L610-L656 HydrophobicContact CD2-CD1 4.04Å; L610-L656 HydrophobicContact CD2-CD2 3.79Å; L610-L656 HydrophobicContact CG-CD2 3.94Å; L610-Y675 HydrophobicContact CD2-CE1 4.48Å; L610-L1169 HydrophobicContact CB-CD1 4.41Å; L610-L1169 HydrophobicContact CD2-CD1 3.93Å; L610-E1175 HydrophobicContact CD1-CB 4.35Å; L610-E1175 HydrophobicContact CD2-CB 3.84Å; L610-E1175 HydrophobicContact CD2-CG 4.35Å; L610-W1179 HydrophobicContact CD1-CB 4.45Å
611	E	84.8	Confident	81.1	Confident	50 Å²	50	38.5 Å²	38.5	23%	0.234	19%	0.187	C	C	.	.	H	α-helix	trans	-65.6	-34	173.4	-71.4	-169.5	149.2	0	0	112.3	I607 Y608 T615 A655 L656	I607-E611 PolarHBondContact O-N 2.85Å; Y608-E611 PolarHBondContact O-N 2.84Å; E611-T615 WeakPolarHBondContact O-CB 3.44Å; E611-T615 PolarHBondContact O-N 2.85Å; E611-T615 PolarHBondContact O-OG1 2.97Å; E611-A655 WeakPolarHBondContact OE1-CA 3.16Å; E611-L656 HydrophobicContact CG-CD1 4.22Å; E611-L656 HydrophobicContact CG-CD2 4.03Å; E611-L656 HydrophobicContact CG-CG 3.61Å; E611-L656 PolarHBondContact OE1-N 3.32Å
612	K	85.9	Confident	80.2	Confident	62 Å²	62	40 Å²	40	27%	0.27	20%	0.195	S	C	.	.	H	α-helix	trans	-63.9	-47.8	171.3	-162.5	-161	171.6	-158.3	0	111.4	Y580 Y608 M609 L610 Y614 T615 D616	Y580-K612 HydrophobicContact CE1-CD 4.36Å; Y580-K612 HydrophobicContact CE2-CD 3.68Å; Y580-K612 HydrophobicContact CE2-CG 4.24Å; Y580-K612 VanDerWaalsContact CZ-CE 3.41Å; Y580-K612 VanDerWaalsContact CZ-NZ 3.28Å; Y580-K612 WeakPolarHBondContact OH-CD 3.48Å; Y580-K612 VanDerWaalsContact OH-CE 3.27Å; Y580-K612 WeakPolarHBondContact OH-CE 3.43Å; Y580-K612 WeakPolarHBondContact OH-CG 3.07Å; Y608-K612 WeakPolarHBondContact O-CB 3.44Å; Y608-K612 PolarHBondContact O-N 2.88Å; M609-K612 HydrophobicContact CE-CD 4.27Å; M609-K612 WeakPolarHBondContact O-CB 3.1Å; M609-K612 PolarHBondContact O-N 2.72Å; M609-K612 HydrophobicContact SD-CB 4.37Å; M609-K612 HydrophobicContact SD-CD 3.86Å; L610-K612 VanDerWaalsContact C-N 3.31Å; L610-K612 PolarHBondContact O-N 3.4Å; K612-Y614 PolarHBondContact O-N 3.16Å; K612-T615 PolarHBondContact O-N 2.85Å; K612-T615 VanDerWaalsContact O-N 3.16Å; K612-D616 PolarHBondContact O-N 3.03Å
613	L	87.3	Confident	79.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.6	-41.5	178.2	-78.1	169.1	0	0	0	113	Y580 L583 M584 L605 M609 L610 Q617 L1176 W1179	Y580-L613 HydrophobicContact CD2-CD2 3.82Å; Y580-L613 HydrophobicContact CD2-CG 4.28Å; Y580-L613 HydrophobicContact CE2-CD2 3.5Å; Y580-L613 HydrophobicContact CE2-CG 3.84Å; L583-L613 HydrophobicContact CB-CD2 4.25Å; L583-L613 HydrophobicContact CD1-CD1 4.44Å; M584-L613 HydrophobicContact CG-CD2 4.49Å; M584-L613 HydrophobicContact SD-CD2 4.16Å; L605-L613 HydrophobicContact CD1-CD1 3.96Å; M609-L613 WeakPolarHBondContact O-CB 2.96Å; M609-L613 WeakPolarHBondContact O-CG 3.37Å; M609-L613 PolarHBondContact O-N 2.88Å; L610-L613 PolarHBondContact O-N 3.14Å; L613-Q617 WeakPolarHBondContact O-CB 3.41Å; L613-Q617 VanDerWaalsContact O-CG 3.22Å; L613-Q617 WeakPolarHBondContact O-CG 3.28Å; L613-Q617 PolarHBondContact O-N 3.29Å; L613-L1176 HydrophobicContact CD1-CD2 4.09Å; L613-W1179 HydrophobicContact CB-CZ2 4.5Å; L613-W1179 HydrophobicContact CD2-CZ2 4.11Å; L613-W1179 PolarHBondContact O-NE1 2.71Å
614	Y	86.3	Confident	78.8	Confident	1 Å²	1	35.9 Å²	35.9	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-68	-40.7	172.6	-81.7	-70	0	0	0	112.1	L610 K612 L618 F628 V654 L656 V659 W1179 L1182	L610-Y614 HydrophobicContact CD1-CD2 4.27Å; L610-Y614 HydrophobicContact CD1-CE2 3.9Å; L610-Y614 HydrophobicContact CD2-CE2 4.49Å; L610-Y614 HydrophobicContact CG-CD2 4.14Å; L610-Y614 HydrophobicContact CG-CE2 3.95Å; L610-Y614 WeakPolarHBondContact O-CD2 3.46Å; L610-Y614 PolarHBondContact O-N 3.33Å; K612-Y614 PolarHBondContact O-N 3.16Å; Y614-L618 PolarHBondContact O-N 2.98Å; Y614-F628 HydrophobicContact CD1-CE1 4.03Å; Y614-F628 HydrophobicContact CD1-CZ 4.04Å; Y614-F628 HydrophobicContact CE1-CE1 4.42Å; Y614-F628 HydrophobicContact CE1-CZ 4.11Å; Y614-V654 HydrophobicContact CG-CG1 4.49Å; Y614-L656 HydrophobicContact CD2-CD2 3.95Å; Y614-L656 HydrophobicContact CE2-CD2 3.95Å; Y614-V659 HydrophobicContact CD1-CG2 4.35Å; Y614-V659 HydrophobicContact CD2-CG2 4.28Å; Y614-V659 HydrophobicContact CE1-CG1 3.99Å; Y614-V659 HydrophobicContact CE1-CG2 4.42Å; Y614-V659 HydrophobicContact CE2-CG1 4.25Å; Y614-V659 HydrophobicContact CE2-CG2 4.35Å; Y614-V659 HydrophobicContact CG-CG2 4.28Å; Y614-W1179 AromaticContact CD1-CD1 3.72Å; Y614-W1179 HydrophobicContact CE1-CB 4.21Å; Y614-W1179 AromaticContact CE1-CD1 3.71Å; Y614-W1179 HydrophobicContact CE1-CG 4.34Å; Y614-W1179 HydrophobicContact CE2-CB 4.3Å; Y614-W1179 AromaticContact CG-CD1 3.96Å; Y614-W1179 AromaticContact CZ-CD1 3.95Å; Y614-W1179 WeakPolarHBondContact OH-CA 3.31Å; Y614-W1179 PolarHBondContact OH-N 2.82Å; Y614-L1182 HydrophobicContact CE1-CD1 4.3Å
615	T	84.1	Confident	78.1	Confident	9 Å²	9	35.6 Å²	35.6	6%	0.055	18%	0.177	C	C	.	.	H	α-helix	trans	-69.2	-42.7	-177	-62.1	0	0	0	0	112.8	E611 K612 S652 K653 V654	E611-T615 WeakPolarHBondContact O-CB 3.44Å; E611-T615 PolarHBondContact O-N 2.85Å; E611-T615 PolarHBondContact O-OG1 2.97Å; K612-T615 PolarHBondContact O-N 2.85Å; K612-T615 VanDerWaalsContact O-N 3.16Å; T615-S652 VanDerWaalsContact CG2-O 3.31Å; T615-S652 WeakPolarHBondContact CG2-O 3.49Å; T615-K653 HydrophobicContact CG2-CG 3.98Å; T615-V654 PolarHBondContact OG1-N 3.04Å
616	D	82.2	Confident	77.2	Confident	36 Å²	36	37.3 Å²	37.3	19%	0.193	19%	0.192	C	C	.	.	H	α-helix	trans	-78.2	-30.2	-178.3	-73.9	-7.8	0	0	0	112	Y580 M584 K612 K619	Y580-D616 WeakPolarHBondContact OH-CB 3.22Å; Y580-D616 PolarHBondContact OH-OD2 2.92Å; M584-D616 HydrophobicContact CE-CB 3.6Å; M584-D616 HydrophobicContact SD-CB 4.02Å; K612-D616 PolarHBondContact O-N 3.03Å; D616-K619 PolarHBondContact O-N 2.91Å; D616-K619 WeakPolarHBondContact OD1-CE 3.47Å; D616-K619 IonicContact OD1-NZ 3.44Å; D616-K619 PolarHBondContact OD1-NZ 2.73Å
617	Q	81.6	Confident	76.8	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-64.1	-40.3	170	-74.6	-65.8	-51.2	0	0	111.7	M584 L613 K619 N620 W1179 V1183 K1185	M584-Q617 HydrophobicContact CE-CG 4.34Å; M584-Q617 PolarHBondContact O-NE2 3.03Å; M584-Q617 HydrophobicContact SD-CG 4.09Å; M584-Q617 PolarHBondContact SD-NE2 3.22Å; L613-Q617 WeakPolarHBondContact O-CB 3.41Å; L613-Q617 VanDerWaalsContact O-CG 3.22Å; L613-Q617 WeakPolarHBondContact O-CG 3.28Å; L613-Q617 PolarHBondContact O-N 3.29Å; Q617-K619 PolarHBondContact O-N 3.37Å; Q617-K619 VanDerWaalsContact O-N 3.15Å; Q617-N620 CarbonylContact O-C 3.31Å; Q617-N620 PolarHBondContact O-N 3.2Å; Q617-W1179 HydrophobicContact CG-CZ2 3.8Å; Q617-V1183 HydrophobicContact CB-CG1 4.22Å; Q617-V1183 HydrophobicContact CB-CG2 4.31Å; Q617-V1183 HydrophobicContact CG-CG1 4.02Å; Q617-V1183 HydrophobicContact CG-CG2 4.38Å; Q617-V1183 VanDerWaalsContact OE1-CG1 3.3Å; Q617-K1185 VanDerWaalsContact OE1-CE 3.29Å
618	L	75.7	Confident	76.8	Confident	11 Å²	11	37.5 Å²	37.5	6%	0.058	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-4.1	177.7	-90	166.2	0	0	0	114.9	Y614 V625 F628 N629 W632 V654	Y614-L618 PolarHBondContact O-N 2.98Å; L618-V625 HydrophobicContact CD2-CG1 3.91Å; L618-V625 HydrophobicContact CG-CG1 4.33Å; L618-F628 HydrophobicContact CD1-CD1 3.92Å; L618-F628 HydrophobicContact CD1-CE1 3.56Å; L618-F628 HydrophobicContact CD2-CD1 4.19Å; L618-F628 HydrophobicContact CG-CD1 4.14Å; L618-F628 HydrophobicContact CG-CE1 4.2Å; L618-N629 HydrophobicContact CD2-CB 3.54Å; L618-N629 WeakPolarHBondContact CD2-OD1 3.24Å; L618-W632 HydrophobicContact CD1-CD2 4.32Å; L618-W632 HydrophobicContact CD1-CE3 4.2Å; L618-V654 HydrophobicContact CB-CG2 4.5Å; L618-V654 HydrophobicContact CD1-CG1 4.47Å; L618-V654 HydrophobicContact CD1-CG2 3.51Å
619	K	73.1	Confident	76.6	Confident	133 Å²	133	35.7 Å²	35.7	58%	0.578	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-17.6	166.1	-63.1	169.1	-171.1	165.4	0	112.7	D616 Q617	D616-K619 PolarHBondContact O-N 2.91Å; D616-K619 WeakPolarHBondContact OD1-CE 3.47Å; D616-K619 IonicContact OD1-NZ 3.44Å; D616-K619 PolarHBondContact OD1-NZ 2.73Å; Q617-K619 PolarHBondContact O-N 3.37Å; Q617-K619 VanDerWaalsContact O-N 3.15Å
620	N	67.2	Low	76.2	Confident	84 Å²	84	40 Å²	40	45%	0.449	20%	0.204	S	C	.	.	S	Bend	trans	-106.2	82.6	-176.2	-159.1	38.7	0	0	0	108.4	Q617 N622	Q617-N620 CarbonylContact O-C 3.31Å; Q617-N620 PolarHBondContact O-N 3.2Å; N620-N622 PolarHBondContact O-N 3.47Å
621	L	60.6	Low	75.7	Confident	115 Å²	115	41.2 Å²	41.2	60%	0.602	21%	0.21	S	C	*	.			trans	-73.2	62.3	-165	-66.6	171.3	0	0	0	114
622	N	65.6	Low	75.3	Confident	48 Å²	48	39 Å²	39	26%	0.257	20%	0.199	S	C	.	.			trans	-68	149.6	169.1	-66.4	-19.7	0	0	0	110.7	N620 K624 V625 A626	N620-N622 PolarHBondContact O-N 3.47Å; N622-K624 VanDerWaalsContact C-N 3.31Å; N622-K624 PolarHBondContact O-N 3.44Å; N622-V625 HydrophobicContact CB-CB 4.49Å; N622-V625 HydrophobicContact CB-CG2 4.17Å; N622-V625 CarbonylContact O-C 3.46Å; N622-V625 WeakPolarHBondContact O-CA 3.26Å; N622-V625 WeakPolarHBondContact O-CB 3.24Å; N622-V625 PolarHBondContact O-N 3.19Å; N622-A626 PolarHBondContact O-N 3.21Å
623	S	63.5	Low	74.7	Confident	46 Å²	46	40.5 Å²	40.5	32%	0.322	21%	0.207	S	C	.	.	H	α-helix	trans	-51.4	-45.3	-178	63.5	0	0	0	0	113.7	Q295 V625 A626 I627	Q295-S623 PolarHBondContact NE2-OG 3.36Å; S623-V625 VanDerWaalsContact C-N 3.27Å; S623-V625 PolarHBondContact O-N 3Å; S623-A626 WeakPolarHBondContact O-CB 3.26Å; S623-A626 PolarHBondContact O-N 2.72Å; S623-A626 VanDerWaalsContact O-N 3.07Å; S623-I627 PolarHBondContact O-N 2.83Å
624	K	69.9	Low	74	Confident	32 Å²	32	45 Å²	45	14%	0.139	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-34.1	176.3	-71.3	-179.4	174.8	-179.1	0	113.1	N622 D1222 D1225	N622-K624 VanDerWaalsContact C-N 3.31Å; N622-K624 PolarHBondContact O-N 3.44Å; K624-D1222 WeakPolarHBondContact CE-OD1 3.44Å; K624-D1222 WeakPolarHBondContact CG-OD2 3.28Å; K624-D1222 IonicContact NZ-OD1 2.7Å; K624-D1225 IonicContact NZ-OD2 3.42Å; K624-D1225 PolarHBondContact NZ-OD2 2.82Å
625	V	71.7	Confident	73.1	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-78.3	-29.6	175.7	-177	0	0	0	0	111.2	L618 N622 S623 I627 F628 N629 V1183	L618-V625 HydrophobicContact CD2-CG1 3.91Å; L618-V625 HydrophobicContact CG-CG1 4.33Å; N622-V625 HydrophobicContact CB-CB 4.49Å; N622-V625 HydrophobicContact CB-CG2 4.17Å; N622-V625 CarbonylContact O-C 3.46Å; N622-V625 WeakPolarHBondContact O-CA 3.26Å; N622-V625 WeakPolarHBondContact O-CB 3.24Å; N622-V625 PolarHBondContact O-N 3.19Å; S623-V625 VanDerWaalsContact C-N 3.27Å; S623-V625 PolarHBondContact O-N 3Å; V625-I627 VanDerWaalsContact C-N 3.28Å; V625-I627 PolarHBondContact O-N 2.76Å; V625-F628 CarbonylContact O-C 3.56Å; V625-F628 PolarHBondContact O-N 3.46Å; V625-N629 PolarHBondContact O-N 3.38Å; V625-V1183 HydrophobicContact CG2-CG1 3.83Å
626	A	66.8	Low	72.4	Confident	38 Å²	38	49.7 Å²	49.7	31%	0.314	24%	0.244	S	C	.	.	H	α-helix	trans	-61.2	-34	177.1	0	0	0	0	0	112.5	N622 S623 N629 K630	N622-A626 PolarHBondContact O-N 3.21Å; S623-A626 WeakPolarHBondContact O-CB 3.26Å; S623-A626 PolarHBondContact O-N 2.72Å; S623-A626 VanDerWaalsContact O-N 3.07Å; A626-N629 PolarHBondContact O-N 2.87Å; A626-K630 WeakPolarHBondContact O-CB 3.45Å; A626-K630 PolarHBondContact O-N 2.88Å
627	I	74.5	Confident	71.2	Confident	23 Å²	23	51.2 Å²	51.2	12%	0.118	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-48.1	171.6	-57.4	160.4	0	0	0	110.4	S623 V625 K630 M631 L1213 T1217 Y1226	S623-I627 PolarHBondContact O-N 2.83Å; V625-I627 VanDerWaalsContact C-N 3.28Å; V625-I627 PolarHBondContact O-N 2.76Å; I627-K630 PolarHBondContact O-N 3.13Å; I627-M631 WeakPolarHBondContact O-CB 3.42Å; I627-M631 WeakPolarHBondContact O-CG 3.47Å; I627-M631 PolarHBondContact O-N 3.22Å; I627-L1213 HydrophobicContact CG2-CD2 4.3Å; I627-T1217 WeakPolarHBondContact CD1-OG1 3.41Å; I627-Y1226 HydrophobicContact CD1-CE2 3.92Å
628	F	80.2	Confident	70	Confident	3 Å²	3	53.3 Å²	53.3	1%	0.013	27%	0.267	C	S	.	.	H	α-helix	trans	-67	-35.8	176.4	178	-112.5	0	0	0	112.2	Y614 L618 V625 M631 W632 V659 V662 L1182	Y614-F628 HydrophobicContact CD1-CE1 4.03Å; Y614-F628 HydrophobicContact CD1-CZ 4.04Å; Y614-F628 HydrophobicContact CE1-CE1 4.42Å; Y614-F628 HydrophobicContact CE1-CZ 4.11Å; L618-F628 HydrophobicContact CD1-CD1 3.92Å; L618-F628 HydrophobicContact CD1-CE1 3.56Å; L618-F628 HydrophobicContact CD2-CD1 4.19Å; L618-F628 HydrophobicContact CG-CD1 4.14Å; L618-F628 HydrophobicContact CG-CE1 4.2Å; V625-F628 CarbonylContact O-C 3.56Å; V625-F628 PolarHBondContact O-N 3.46Å; F628-M631 PolarHBondContact O-N 3.33Å; F628-W632 VanDerWaalsContact O-CB 3.23Å; F628-W632 WeakPolarHBondContact O-CB 3.23Å; F628-W632 PolarHBondContact O-N 3.09Å; F628-V659 HydrophobicContact CZ-CG1 4.39Å; F628-V659 HydrophobicContact CZ-CG2 4.39Å; F628-V662 HydrophobicContact CD2-CG1 4.11Å; F628-V662 HydrophobicContact CE2-CB 4.39Å; F628-V662 HydrophobicContact CE2-CG1 3.93Å; F628-L1182 VanDerWaalsContact CB-O 3.25Å; F628-L1182 WeakPolarHBondContact CB-O 3.29Å; F628-L1182 HydrophobicContact CD2-CB 4.03Å; F628-L1182 HydrophobicContact CD2-CD2 4.17Å; F628-L1182 HydrophobicContact CE2-CB 4.1Å; F628-L1182 HydrophobicContact CE2-CD1 4.04Å; F628-L1182 HydrophobicContact CE2-CD2 4.28Å; F628-L1182 HydrophobicContact CE2-CG 4.38Å
629	N	77	Confident	69.1	Low	25 Å²	25	58 Å²	58	13%	0.134	28%	0.284	C	S	.	.	H	α-helix	trans	-62.4	-53.3	173.2	-166.3	46.5	0	0	0	110.6	L618 V625 A626 M631 W632 E633	L618-N629 HydrophobicContact CD2-CB 3.54Å; L618-N629 WeakPolarHBondContact CD2-OD1 3.24Å; V625-N629 PolarHBondContact O-N 3.38Å; A626-N629 PolarHBondContact O-N 2.87Å; N629-M631 VanDerWaalsContact C-N 3.26Å; N629-M631 PolarHBondContact O-N 3.47Å; N629-W632 CarbonylContact O-C 3.25Å; N629-W632 PolarHBondContact O-N 3.02Å; N629-E633 PolarHBondContact ND2-OE1 3.29Å; N629-E633 VanDerWaalsContact O-CB 3.29Å; N629-E633 WeakPolarHBondContact O-CB 3.34Å; N629-E633 WeakPolarHBondContact O-CG 3.36Å; N629-E633 PolarHBondContact O-N 2.78Å; N629-E633 PolarHBondContact OD1-OE1 3.36Å
630	K	75.9	Confident	68.1	Low	122 Å²	122	57.4 Å²	57.4	53%	0.53	28%	0.281	S	S	.	.	H	α-helix	trans	-54	-41.3	176.7	-168.4	170.1	-175	172	0	111.7	A626 I627 Y634	A626-K630 WeakPolarHBondContact O-CB 3.45Å; A626-K630 PolarHBondContact O-N 2.88Å; I627-K630 PolarHBondContact O-N 3.13Å; K630-Y634 VanDerWaalsContact O-CB 3.25Å; K630-Y634 WeakPolarHBondContact O-CB 3.19Å; K630-Y634 PolarHBondContact O-N 2.82Å
631	M	74.9	Confident	67.3	Low	25 Å²	25	56.8 Å²	56.8	12%	0.123	28%	0.277	C	S	.	.	H	α-helix	trans	-70.8	-39	175	-72.9	-161.5	69.6	0	0	114.4	I627 F628 N629 N635 V662 L666 L1213 K1216	I627-M631 WeakPolarHBondContact O-CB 3.42Å; I627-M631 WeakPolarHBondContact O-CG 3.47Å; I627-M631 PolarHBondContact O-N 3.22Å; F628-M631 PolarHBondContact O-N 3.33Å; N629-M631 VanDerWaalsContact C-N 3.26Å; N629-M631 PolarHBondContact O-N 3.47Å; M631-N635 WeakPolarHBondContact O-CB 3.19Å; M631-N635 PolarHBondContact O-N 3.45Å; M631-N635 VanDerWaalsContact O-N 3.13Å; M631-N635 PolarHBondContact O-ND2 3.08Å; M631-V662 HydrophobicContact CB-CG1 4.25Å; M631-V662 HydrophobicContact CE-CG1 4.32Å; M631-L666 HydrophobicContact CE-CD1 4.49Å; M631-L666 HydrophobicContact CE-CD2 3.77Å; M631-L666 HydrophobicContact CE-CG 3.81Å; M631-L666 HydrophobicContact SD-CD2 3.86Å; M631-L666 HydrophobicContact SD-CG 4.3Å; M631-L1213 HydrophobicContact SD-CD2 4.45Å; M631-K1216 HydrophobicContact CE-CD 3.89Å; M631-K1216 HydrophobicContact SD-CD 3.82Å
632	W	77.3	Confident	66.8	Low	3 Å²	3	51.4 Å²	51.4	1%	0.011	25%	0.249	C	C	.	.	H	α-helix	trans	-70	-44.3	176.6	174	70	0	0	0	111.2	L618 F628 N629 N635 R636 S652 V654 V662	L618-W632 HydrophobicContact CD1-CD2 4.32Å; L618-W632 HydrophobicContact CD1-CE3 4.2Å; F628-W632 VanDerWaalsContact O-CB 3.23Å; F628-W632 WeakPolarHBondContact O-CB 3.23Å; F628-W632 PolarHBondContact O-N 3.09Å; N629-W632 CarbonylContact O-C 3.25Å; N629-W632 PolarHBondContact O-N 3.02Å; W632-N635 CarbonylContact O-C 3.58Å; W632-N635 PolarHBondContact O-N 3.29Å; W632-R636 WeakPolarHBondContact O-CB 3.48Å; W632-R636 PolarHBondContact O-N 2.93Å; W632-S652 WeakPolarHBondContact CH2-OG 3.35Å; W632-V654 HydrophobicContact CH2-CG2 4.23Å; W632-V654 HydrophobicContact CZ2-CB 4.49Å; W632-V654 HydrophobicContact CZ2-CG2 3.9Å; W632-V662 HydrophobicContact CB-CG2 4.37Å
633	E	74.1	Confident	66.2	Low	94 Å²	94	54.6 Å²	54.6	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-63.2	-41.6	174.5	-72.8	-170.3	176.7	0	0	111.9	N629 N635 R636 S637	N629-E633 PolarHBondContact ND2-OE1 3.29Å; N629-E633 VanDerWaalsContact O-CB 3.29Å; N629-E633 WeakPolarHBondContact O-CB 3.34Å; N629-E633 WeakPolarHBondContact O-CG 3.36Å; N629-E633 PolarHBondContact O-N 2.78Å; N629-E633 PolarHBondContact OD1-OE1 3.36Å; E633-N635 PolarHBondContact O-N 2.78Å; E633-R636 CarbonylContact O-C 3.37Å; E633-R636 PolarHBondContact O-N 3.06Å; E633-R636 VanDerWaalsContact O-N 3.13Å; E633-S637 WeakPolarHBondContact O-CA 2.84Å; E633-S637 WeakPolarHBondContact O-CB 3.14Å; E633-S637 PolarHBondContact O-N 2.82Å
634	Y	71.7	Confident	64.8	Low	93 Å²	93	57.2 Å²	57.2	37%	0.365	27%	0.272	S	S	.	.	H	α-helix	trans	-57.1	-50	170.2	-175.9	-93.9	0	0	0	111.3	K630 R636 S637 H638 L871	K630-Y634 VanDerWaalsContact O-CB 3.25Å; K630-Y634 WeakPolarHBondContact O-CB 3.19Å; K630-Y634 PolarHBondContact O-N 2.82Å; Y634-R636 PolarHBondContact O-N 3.08Å; Y634-S637 PolarHBondContact O-N 2.84Å; Y634-H638 AromaticContact CE1-CD2 3.8Å; Y634-H638 AromaticContact CE1-NE2 3.64Å; Y634-H638 AromaticContact CE2-NE2 3.89Å; Y634-H638 AromaticContact CZ-CD2 3.87Å; Y634-H638 AromaticContact CZ-NE2 3.31Å; Y634-H638 VanDerWaalsContact CZ-NE2 3.31Å; Y634-H638 PolarHBondContact O-CD2 3.5Å; Y634-H638 PolarHBondContact O-N 3.43Å; Y634-H638 PolarHBondContact OH-NE2 2.83Å; Y634-L871 HydrophobicContact CE2-CD1 3.79Å
635	N	66.8	Low	63.3	Low	25 Å²	25	60.2 Å²	60.2	13%	0.134	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-19.9	177.3	-85.3	-89.3	0	0	0	114.4	M631 W632 E633 V662	M631-N635 WeakPolarHBondContact O-CB 3.19Å; M631-N635 PolarHBondContact O-N 3.45Å; M631-N635 VanDerWaalsContact O-N 3.13Å; M631-N635 PolarHBondContact O-ND2 3.08Å; W632-N635 CarbonylContact O-C 3.58Å; W632-N635 PolarHBondContact O-N 3.29Å; E633-N635 PolarHBondContact O-N 2.78Å; N635-V662 HydrophobicContact CB-CG2 4.28Å
636	R	69	Low	61.8	Low	85 Å²	85	61.2 Å²	61.2	32%	0.321	30%	0.3	S	S	.	.	H	α-helix	trans	-93.3	-31.6	176.9	-173.4	179.8	-179.5	-157.4	-0.4	112.2	W632 E633 Y634 R639	W632-R636 WeakPolarHBondContact O-CB 3.48Å; W632-R636 PolarHBondContact O-N 2.93Å; E633-R636 CarbonylContact O-C 3.37Å; E633-R636 PolarHBondContact O-N 3.06Å; E633-R636 VanDerWaalsContact O-N 3.13Å; Y634-R636 PolarHBondContact O-N 3.08Å; R636-R639 WeakPolarHBondContact O-CB 3.29Å; R636-R639 PolarHBondContact O-N 3.1Å; R636-R639 VanDerWaalsContact O-N 3.09Å
637	S	58.9	Low	60.1	Low	68 Å²	68	62.2 Å²	62.2	48%	0.476	30%	0.297	S	S	.	.	H	α-helix	trans	-64.8	-41.6	-179.3	-171.8	0	0	0	0	111.1	E633 Y634 R639 K640	E633-S637 WeakPolarHBondContact O-CA 2.84Å; E633-S637 WeakPolarHBondContact O-CB 3.14Å; E633-S637 PolarHBondContact O-N 2.82Å; Y634-S637 PolarHBondContact O-N 2.84Å; S637-R639 PolarHBondContact O-N 3.36Å; S637-K640 PolarHBondContact O-N 3.47Å
638	H	56.1	Low	58.2	Low	45 Å²	45	63.5 Å²	63.5	21%	0.208	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-5.5	170.4	-82.8	-79.5	0	0	0	115.1	Y634	Y634-H638 AromaticContact CE1-CD2 3.8Å; Y634-H638 AromaticContact CE1-NE2 3.64Å; Y634-H638 AromaticContact CE2-NE2 3.89Å; Y634-H638 AromaticContact CZ-CD2 3.87Å; Y634-H638 AromaticContact CZ-NE2 3.31Å; Y634-H638 VanDerWaalsContact CZ-NE2 3.31Å; Y634-H638 PolarHBondContact O-CD2 3.5Å; Y634-H638 PolarHBondContact O-N 3.43Å; Y634-H638 PolarHBondContact OH-NE2 2.83Å
639	R	56	Low	56.1	Low	111 Å²	111	67.8 Å²	67.8	42%	0.419	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-19	166.8	-67.2	-170.4	-179.9	129.4	3.7	115	R636 S637 D658	R636-R639 WeakPolarHBondContact O-CB 3.29Å; R636-R639 PolarHBondContact O-N 3.1Å; R636-R639 VanDerWaalsContact O-N 3.09Å; S637-R639 PolarHBondContact O-N 3.36Å; R639-D658 IonicContact CZ-OD1 3.54Å; R639-D658 VanDerWaalsContact CZ-OD1 3.28Å; R639-D658 IonicContact CZ-OD2 2.84Å; R639-D658 IonicContact NH1-OD1 3.68Å; R639-D658 PolarHBondContact NH1-OD1 3.39Å; R639-D658 IonicContact NH1-OD2 2.68Å; R639-D658 PolarHBondContact NH1-OD2 3.24Å; R639-D658 IonicContact NH2-OD1 3.38Å; R639-D658 PolarHBondContact NH2-OD1 2.77Å; R639-D658 IonicContact NH2-OD2 3.45Å
640	K	53.1	Low	54.3	Low	120 Å²	120	73.4 Å²	73.4	52%	0.522	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-77.6	-32.5	-169.6	-76.5	-174.9	175.9	177.9	0	113.9	S637 G642	S637-K640 PolarHBondContact O-N 3.47Å; K640-G642 PolarHBondContact O-N 3.3Å
641	L	49.5	Very low	52.9	Low	71 Å²	71	71.2 Å²	71.2	37%	0.372	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-70	-2.4	-167.3	-153.8	68.5	0	0	0	115.7	K741 V866 S867	L641-K741 PolarHBondContact O-N 3.2Å; L641-V866 HydrophobicContact CB-CG1 4.31Å; L641-S867 WeakPolarHBondContact CD2-OG 3.15Å
642	G	51.1	Low	52.1	Low	1 Å²	1	72 Å²	72	1%	0.01	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-123	18.1	-168.7	0	0	0	0	0	116.7	K640 L740	K640-G642 PolarHBondContact O-N 3.3Å; G642-L740 CarbonylContact C-O 3.46Å; G642-L740 VanDerWaalsContact CA-O 3.23Å; G642-L740 WeakPolarHBondContact CA-O 3.28Å
643	R	52.3	Low	51.6	Low	115 Å²	115	76.7 Å²	76.7	43%	0.434	37%	0.371	S	S	.	.			trans	-157.1	101.6	-175.9	-132.3	160.3	176.2	167.3	3.8	114	L761	R643-L761 PolarHBondContact NE-O 3.34Å; R643-L761 PolarHBondContact NH2-O 3.44Å
644	T	33.8	Very low	51.5	Low	101 Å²	101	72.4 Å²	72.4	62%	0.62	35%	0.351	S	S	*	.			trans	-80.8	179.8	174.2	52.5	0	0	0	0	112.8
645	V	37.9	Very low	51.7	Low	96 Å²	96	70 Å²	70	58%	0.582	35%	0.35	S	S	*	.	S	Bend	trans	82.7	113	173.9	-171.6	0	0	0	0	118.2	N759	V645-N759 PolarHBondContact N-ND2 2.91Å; V645-N759 WeakPolarHBondContact O-CB 3.44Å; V645-N759 VanDerWaalsContact O-CG 3.22Å; V645-N759 PolarHBondContact O-ND2 3.13Å
646	S	39.8	Very low	52.4	Low	21 Å²	21	68.9 Å²	68.9	15%	0.147	34%	0.344	C	S	.	.			trans	72.9	108.6	164.5	66.2	0	0	0	0	120	N759 S765 P766	S646-N759 PolarHBondContact N-ND2 3.27Å; S646-N759 WeakPolarHBondContact O-CB 3.46Å; S646-N759 PolarHBondContact O-ND2 2.56Å; S646-N759 PolarHBondContact O-OD1 3.49Å; S646-S765 WeakPolarHBondContact CB-OG 3.38Å; S646-S765 WeakPolarHBondContact O-CB 3.29Å; S646-S765 WeakPolarHBondContact OG-CB 3.37Å; S646-S765 PolarHBondContact OG-OG 3.24Å; S646-P766 CarbonylContact C-O 3.59Å
647	K	32.8	Very low	52.9	Low	59 Å²	59	71 Å²	71	26%	0.257	35%	0.352	S	S	.	.			trans	-81.5	-84.1	-154.2	-157.9	157.7	173.7	-174.3	0	119.8	M756 N757 L758 N759 P766 P767 P769	K647-M756 PolarHBondContact NZ-SD 2.89Å; K647-N757 VanDerWaalsContact C-CG 3.49Å; K647-N757 HydrophobicContact CB-CB 4.13Å; K647-N757 HydrophobicContact CD-CB 4.23Å; K647-N757 HydrophobicContact CG-CB 3.18Å; K647-N757 VanDerWaalsContact O-CB 3.25Å; K647-N757 WeakPolarHBondContact O-CB 3.5Å; K647-N757 PolarHBondContact O-OD1 3.23Å; K647-L758 HydrophobicContact CB-CG 4.39Å; K647-L758 HydrophobicContact CD-CD1 3.5Å; K647-L758 VanDerWaalsContact CD-CD1 3.5Å; K647-L758 HydrophobicContact CD-CG 4.17Å; K647-L758 VanDerWaalsContact CE-CD1 3.46Å; K647-L758 HydrophobicContact CG-CD1 3.67Å; K647-L758 HydrophobicContact CG-CG 3.9Å; K647-N759 WeakPolarHBondContact CA-OD1 3.47Å; K647-N759 PolarHBondContact N-OD1 3.28Å; K647-P766 CarbonylContact C-O 3.59Å; K647-P766 WeakPolarHBondContact CA-O 3.46Å; K647-P766 PolarHBondContact N-O 3.03Å; K647-P767 HydrophobicContact CB-CB 3.99Å; K647-P767 VanDerWaalsContact N-CB 3.33Å; K647-P769 VanDerWaalsContact CD-CD 3.44Å; K647-P769 HydrophobicContact CD-CG 3.76Å; K647-P769 HydrophobicContact CG-CG 4.36Å
648	E	33.2	Very low	53.9	Low	50 Å²	50	68.7 Å²	68.7	23%	0.234	34%	0.335	C	S	.	.			trans	-23.8	157.3	177.4	-96.6	176.7	-170.3	0	0	124.1	N757 S765 P766	E648-N757 VanDerWaalsContact CA-CG 3.43Å; E648-N757 WeakPolarHBondContact CA-ND2 3.3Å; E648-N757 WeakPolarHBondContact CA-OD1 3.22Å; E648-N757 PolarHBondContact N-ND2 2.99Å; E648-S765 CarbonylContact O-C 3.52Å; E648-S765 VanDerWaalsContact O-C 3.28Å; E648-S765 VanDerWaalsContact O-CA 3.29Å; E648-S765 WeakPolarHBondContact O-CA 3.35Å; E648-P766 VanDerWaalsContact CA-O 3.31Å; E648-P766 WeakPolarHBondContact CA-O 3.48Å; E648-P766 VanDerWaalsContact CB-O 3.25Å; E648-P766 WeakPolarHBondContact CB-O 3.43Å; E648-P766 PolarHBondContact N-O 3.37Å
649	H	35.9	Very low	55.2	Low	94 Å²	94	66.5 Å²	66.5	44%	0.435	33%	0.325	S	S	.	.			trans	74.9	28.5	138.5	-81.7	34.8	0	0	0	122.7	N757	H649-N757 PolarHBondContact N-OD1 3.49Å
650	K	39.2	Very low	56.6	Low	142 Å²	142	61.2 Å²	61.2	62%	0.617	31%	0.305	S	S	*	.			trans	-128.4	115.4	156.2	-74	-164.4	180	104.5	0	113.1	T764	K650-T764 PolarHBondContact NZ-O 3.12Å; K650-T764 PolarHBondContact NZ-OG1 3.31Å
651	T	47.4	Very low	58	Low	76 Å²	76	59.3 Å²	59.3	47%	0.466	30%	0.296	S	S	.	.			trans	-71.5	164.5	-169.5	-1.7	0	0	0	0	114	V306 N307 K653	V306-T651 VanDerWaalsContact O-CG2 3.3Å; V306-T651 WeakPolarHBondContact O-CG2 3.27Å; V306-T651 PolarHBondContact O-OG1 3.44Å; N307-T651 PolarHBondContact N-OG1 2.8Å; N307-T651 PolarHBondContact O-OG1 2.83Å; T651-K653 PolarHBondContact O-N 3.39Å
652	S	58.3	Low	59.7	Low	42 Å²	42	55.9 Å²	55.9	29%	0.294	28%	0.279	S	S	.	.			trans	-57.8	123.1	179.7	-163.2	0	0	0	0	111.9	T615 W632	T615-S652 VanDerWaalsContact CG2-O 3.31Å; T615-S652 WeakPolarHBondContact CG2-O 3.49Å; W632-S652 WeakPolarHBondContact CH2-OG 3.35Å
653	K	66.6	Low	61.3	Low	102 Å²	102	56 Å²	56	44%	0.443	28%	0.279	S	S	.	.			trans	-147.6	135.8	176.5	-101.4	-179.6	163.6	179.8	0	110	N308 N309 T615 T651	N308-K653 WeakPolarHBondContact O-CE 3.44Å; N308-K653 PolarHBondContact O-NZ 3Å; N309-K653 VanDerWaalsContact N-NZ 3.19Å; N309-K653 PolarHBondContact O-NZ 2.89Å; T615-K653 HydrophobicContact CG2-CG 3.98Å; T651-K653 PolarHBondContact O-N 3.39Å
654	V	72.7	Confident	62.9	Low	3 Å²	3	53.5 Å²	53.5	2%	0.018	27%	0.271	C	S	.	.			trans	-109	102.3	-168.2	-174.3	0	0	0	0	109.6	Y614 T615 L618 W632 V659	Y614-V654 HydrophobicContact CG-CG1 4.49Å; T615-V654 PolarHBondContact OG1-N 3.04Å; L618-V654 HydrophobicContact CB-CG2 4.5Å; L618-V654 HydrophobicContact CD1-CG1 4.47Å; L618-V654 HydrophobicContact CD1-CG2 3.51Å; W632-V654 HydrophobicContact CH2-CG2 4.23Å; W632-V654 HydrophobicContact CZ2-CB 4.49Å; W632-V654 HydrophobicContact CZ2-CG2 3.9Å; V654-V659 HydrophobicContact CG1-CG2 3.61Å
655	A	75.2	Confident	65.2	Low	42 Å²	42	51 Å²	51	35%	0.347	26%	0.26	S	S	.	.			trans	-77.3	136.6	175.7	0	0	0	0	0	111	E611 R657 D658 V659	E611-A655 WeakPolarHBondContact OE1-CA 3.16Å; A655-R657 PolarHBondContact O-N 3.48Å; A655-R657 VanDerWaalsContact O-N 3.07Å; A655-D658 PolarHBondContact O-N 3.49Å; A655-V659 PolarHBondContact O-N 3Å
656	L	80.7	Confident	67.4	Low	2 Å²	2	46.8 Å²	46.8	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-57.8	-29	-178.8	-65.4	178.4	0	0	0	113.4	I607 L610 E611 Y614 D658 V659 G660 Y675 F680	I607-L656 HydrophobicContact CG2-CD1 3.94Å; L610-L656 HydrophobicContact CD2-CD1 4.04Å; L610-L656 HydrophobicContact CD2-CD2 3.79Å; L610-L656 HydrophobicContact CG-CD2 3.94Å; E611-L656 HydrophobicContact CG-CD1 4.22Å; E611-L656 HydrophobicContact CG-CD2 4.03Å; E611-L656 HydrophobicContact CG-CG 3.61Å; E611-L656 PolarHBondContact OE1-N 3.32Å; Y614-L656 HydrophobicContact CD2-CD2 3.95Å; Y614-L656 HydrophobicContact CE2-CD2 3.95Å; L656-D658 PolarHBondContact O-N 2.96Å; L656-V659 PolarHBondContact O-N 3.35Å; L656-G660 PolarHBondContact O-N 2.93Å; L656-Y675 HydrophobicContact CB-CD1 4.09Å; L656-Y675 HydrophobicContact CB-CD2 4.27Å; L656-Y675 HydrophobicContact CB-CG 3.94Å; L656-Y675 HydrophobicContact CD1-CD1 4.27Å; L656-Y675 HydrophobicContact CD1-CE1 4.2Å; L656-Y675 HydrophobicContact CD2-CE1 4.47Å; L656-Y675 HydrophobicContact CD2-CE2 4.41Å; L656-Y675 WeakPolarHBondContact O-CB 3.02Å; L656-Y675 WeakPolarHBondContact O-CD2 3.43Å; L656-F680 HydrophobicContact CB-CE1 4.36Å; L656-F680 HydrophobicContact CD1-CE1 3.99Å; L656-F680 HydrophobicContact CD1-CZ 3.68Å
657	R	80.2	Confident	69.4	Low	129 Å²	129	46.3 Å²	46.3	49%	0.487	23%	0.231	S	C	.	.	H	α-helix	trans	-58.5	-34.3	174.4	-179.7	-177.2	-91.2	177.6	-7.4	112.3	A655 G660 K661 L676 Q681	A655-R657 PolarHBondContact O-N 3.48Å; A655-R657 VanDerWaalsContact O-N 3.07Å; R657-G660 PolarHBondContact O-N 3.28Å; R657-K661 PolarHBondContact O-N 2.94Å; R657-K661 VanDerWaalsContact O-N 3.1Å; R657-L676 HydrophobicContact CG-CD2 3.97Å; R657-L676 WeakPolarHBondContact O-CD2 3.5Å; R657-Q681 VanDerWaalsContact NH2-CD 3.32Å
658	D	80.9	Confident	71.5	Confident	20 Å²	20	44.8 Å²	44.8	11%	0.107	23%	0.232	C	C	.	.	H	α-helix	trans	-83.8	-34.2	-178.3	-64.7	-17.2	0	0	0	111.3	R639 A655 L656 G660 K661 V662	R639-D658 IonicContact CZ-OD1 3.54Å; R639-D658 VanDerWaalsContact CZ-OD1 3.28Å; R639-D658 IonicContact CZ-OD2 2.84Å; R639-D658 IonicContact NH1-OD1 3.68Å; R639-D658 PolarHBondContact NH1-OD1 3.39Å; R639-D658 IonicContact NH1-OD2 2.68Å; R639-D658 PolarHBondContact NH1-OD2 3.24Å; R639-D658 IonicContact NH2-OD1 3.38Å; R639-D658 PolarHBondContact NH2-OD1 2.77Å; R639-D658 IonicContact NH2-OD2 3.45Å; A655-D658 PolarHBondContact O-N 3.49Å; L656-D658 PolarHBondContact O-N 2.96Å; D658-G660 PolarHBondContact O-N 3.43Å; D658-K661 WeakPolarHBondContact O-CB 3.25Å; D658-K661 PolarHBondContact O-N 3.18Å; D658-K661 VanDerWaalsContact O-N 3.14Å; D658-V662 PolarHBondContact O-N 3.05Å; D658-V662 VanDerWaalsContact O-N 3.08Å
659	V	83.3	Confident	73.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-57.7	-40.8	163.1	-171.2	0	0	0	0	110.3	Y614 F628 V654 A655 L656 K661 V662 I663 Y675 L1182	Y614-V659 HydrophobicContact CD1-CG2 4.35Å; Y614-V659 HydrophobicContact CD2-CG2 4.28Å; Y614-V659 HydrophobicContact CE1-CG1 3.99Å; Y614-V659 HydrophobicContact CE1-CG2 4.42Å; Y614-V659 HydrophobicContact CE2-CG1 4.25Å; Y614-V659 HydrophobicContact CE2-CG2 4.35Å; Y614-V659 HydrophobicContact CG-CG2 4.28Å; F628-V659 HydrophobicContact CZ-CG1 4.39Å; F628-V659 HydrophobicContact CZ-CG2 4.39Å; V654-V659 HydrophobicContact CG1-CG2 3.61Å; A655-V659 PolarHBondContact O-N 3Å; L656-V659 PolarHBondContact O-N 3.35Å; V659-K661 VanDerWaalsContact C-N 3.32Å; V659-K661 PolarHBondContact O-N 2.77Å; V659-V662 PolarHBondContact O-N 3.16Å; V659-V662 VanDerWaalsContact O-N 3.13Å; V659-I663 HydrophobicContact CG1-CD1 4.04Å; V659-I663 HydrophobicContact CG1-CG1 4.46Å; V659-I663 WeakPolarHBondContact O-CG1 3.25Å; V659-I663 PolarHBondContact O-N 3.31Å; V659-Y675 HydrophobicContact CB-CD2 4.27Å; V659-Y675 HydrophobicContact CB-CE2 4.35Å; V659-Y675 HydrophobicContact CG1-CD2 4.41Å; V659-Y675 HydrophobicContact CG1-CE2 4.09Å; V659-L1182 HydrophobicContact CG1-CD1 3.79Å
660	G	84.6	Confident	74.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-37.5	174.5	0	0	0	0	0	113.4	L656 R657 D658 K664 P673	L656-G660 PolarHBondContact O-N 2.93Å; R657-G660 PolarHBondContact O-N 3.28Å; D658-G660 PolarHBondContact O-N 3.43Å; G660-K664 PolarHBondContact O-N 3.39Å; G660-P673 WeakPolarHBondContact O-CG 3.08Å
661	K	83.1	Confident	76.8	Confident	79 Å²	79	39.9 Å²	39.9	34%	0.343	21%	0.214	S	C	.	.	H	α-helix	trans	-64.1	-46.9	170.7	-76	-176	151.4	-146	0	111.8	R657 D658 V659 I663 K664 A665 L676	R657-K661 PolarHBondContact O-N 2.94Å; R657-K661 VanDerWaalsContact O-N 3.1Å; D658-K661 WeakPolarHBondContact O-CB 3.25Å; D658-K661 PolarHBondContact O-N 3.18Å; D658-K661 VanDerWaalsContact O-N 3.14Å; V659-K661 VanDerWaalsContact C-N 3.32Å; V659-K661 PolarHBondContact O-N 2.77Å; K661-I663 VanDerWaalsContact C-N 3.33Å; K661-I663 PolarHBondContact O-N 3.18Å; K661-K664 PolarHBondContact O-N 2.89Å; K661-K664 VanDerWaalsContact O-N 3.15Å; K661-A665 WeakPolarHBondContact O-CB 3.31Å; K661-A665 PolarHBondContact O-N 3.15Å; K661-L676 HydrophobicContact CG-CD2 4.5Å
662	V	84.2	Confident	78.1	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-59.5	-43.3	178.7	175.2	0	0	0	0	111.1	F628 M631 W632 N635 D658 V659 K664 A665 L666	F628-V662 HydrophobicContact CD2-CG1 4.11Å; F628-V662 HydrophobicContact CE2-CB 4.39Å; F628-V662 HydrophobicContact CE2-CG1 3.93Å; M631-V662 HydrophobicContact CB-CG1 4.25Å; M631-V662 HydrophobicContact CE-CG1 4.32Å; W632-V662 HydrophobicContact CB-CG2 4.37Å; N635-V662 HydrophobicContact CB-CG2 4.28Å; D658-V662 PolarHBondContact O-N 3.05Å; D658-V662 VanDerWaalsContact O-N 3.08Å; V659-V662 PolarHBondContact O-N 3.16Å; V659-V662 VanDerWaalsContact O-N 3.13Å; V662-K664 PolarHBondContact O-N 2.94Å; V662-A665 CarbonylContact O-C 3.58Å; V662-A665 PolarHBondContact O-N 2.97Å; V662-L666 HydrophobicContact CG1-CD1 3.99Å; V662-L666 WeakPolarHBondContact O-CG 3.4Å; V662-L666 PolarHBondContact O-N 2.88Å
663	I	86.2	Confident	79	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-61.7	-44.1	175	-63.8	163.4	0	0	0	110.9	V659 K661 A665 L666 V667 Y671 P673 Y675 I1178 L1182 L1209	V659-I663 HydrophobicContact CG1-CD1 4.04Å; V659-I663 HydrophobicContact CG1-CG1 4.46Å; V659-I663 WeakPolarHBondContact O-CG1 3.25Å; V659-I663 PolarHBondContact O-N 3.31Å; K661-I663 VanDerWaalsContact C-N 3.33Å; K661-I663 PolarHBondContact O-N 3.18Å; I663-A665 VanDerWaalsContact C-N 3.3Å; I663-A665 PolarHBondContact O-N 3.19Å; I663-L666 PolarHBondContact O-N 3.3Å; I663-L666 VanDerWaalsContact O-N 3.14Å; I663-V667 HydrophobicContact CG2-CG2 4.12Å; I663-V667 WeakPolarHBondContact O-CG2 3.48Å; I663-V667 PolarHBondContact O-N 2.94Å; I663-Y671 HydrophobicContact CG2-CD1 4.17Å; I663-Y671 HydrophobicContact CG2-CE1 3.76Å; I663-P673 HydrophobicContact CB-CB 4.42Å; I663-P673 HydrophobicContact CB-CG 4.03Å; I663-P673 HydrophobicContact CG2-CB 4.27Å; I663-P673 HydrophobicContact CG2-CG 3.81Å; I663-Y675 HydrophobicContact CD1-CD2 4.07Å; I663-Y675 HydrophobicContact CD1-CE2 3.83Å; I663-I1178 HydrophobicContact CD1-CG2 3.75Å; I663-I1178 HydrophobicContact CG1-CG2 4.4Å; I663-L1182 HydrophobicContact CD1-CD1 4.32Å; I663-L1182 HydrophobicContact CG1-CD1 4.01Å; I663-L1209 HydrophobicContact CG2-CD2 4.47Å
664	K	85	Confident	79.5	Confident	62 Å²	62	34.9 Å²	34.9	27%	0.27	18%	0.184	S	C	.	.	H	α-helix	trans	-64	-35.1	176.3	-168.6	166.1	-179.2	-76.6	0	112.3	G660 K661 V662 L666 G668 D669 P673 L676	G660-K664 PolarHBondContact O-N 3.39Å; K661-K664 PolarHBondContact O-N 2.89Å; K661-K664 VanDerWaalsContact O-N 3.15Å; V662-K664 PolarHBondContact O-N 2.94Å; K664-L666 VanDerWaalsContact C-N 3.3Å; K664-L666 PolarHBondContact O-N 3.3Å; K664-G668 WeakPolarHBondContact O-CA 3.26Å; K664-G668 PolarHBondContact O-N 2.91Å; K664-D669 IonicContact NZ-OD1 3.24Å; K664-D669 PolarHBondContact NZ-OD1 2.92Å; K664-P673 HydrophobicContact CB-CG 4.03Å; K664-L676 HydrophobicContact CB-CD1 4.28Å; K664-L676 HydrophobicContact CD-CD1 3.92Å
665	A	82.3	Confident	79.8	Confident	47 Å²	47	35 Å²	35	39%	0.388	18%	0.184	S	C	.	.	H	α-helix	trans	-80.1	-3.8	175.2	0	0	0	0	0	114.5	K661 V662 I663 K1216	K661-A665 WeakPolarHBondContact O-CB 3.31Å; K661-A665 PolarHBondContact O-N 3.15Å; V662-A665 CarbonylContact O-C 3.58Å; V662-A665 PolarHBondContact O-N 2.97Å; I663-A665 VanDerWaalsContact C-N 3.3Å; I663-A665 PolarHBondContact O-N 3.19Å; A665-K1216 PolarHBondContact O-NZ 3.48Å
666	L	83.8	Confident	79.9	Confident	9 Å²	9	34.6 Å²	34.6	5%	0.047	18%	0.176	C	C	.	.	H	α-helix	trans	-100.4	-45	169.1	-77.9	166.1	0	0	0	111.4	M631 V662 I663 K664 L1182 L1209 S1212 L1213 K1216	M631-L666 HydrophobicContact CE-CD1 4.49Å; M631-L666 HydrophobicContact CE-CD2 3.77Å; M631-L666 HydrophobicContact CE-CG 3.81Å; M631-L666 HydrophobicContact SD-CD2 3.86Å; M631-L666 HydrophobicContact SD-CG 4.3Å; V662-L666 HydrophobicContact CG1-CD1 3.99Å; V662-L666 WeakPolarHBondContact O-CG 3.4Å; V662-L666 PolarHBondContact O-N 2.88Å; I663-L666 PolarHBondContact O-N 3.3Å; I663-L666 VanDerWaalsContact O-N 3.14Å; K664-L666 VanDerWaalsContact C-N 3.3Å; K664-L666 PolarHBondContact O-N 3.3Å; L666-L1182 HydrophobicContact CD1-CD2 3.58Å; L666-L1209 HydrophobicContact CB-CD2 3.85Å; L666-L1209 HydrophobicContact CD1-CD2 4.06Å; L666-S1212 WeakPolarHBondContact O-CB 3.43Å; L666-S1212 PolarHBondContact O-OG 3.33Å; L666-L1213 HydrophobicContact CD1-CD2 4.19Å; L666-L1213 HydrophobicContact CD1-CG 4.43Å; L666-L1213 HydrophobicContact CD2-CD2 4.04Å; L666-L1213 HydrophobicContact CD2-CG 4.16Å; L666-K1216 HydrophobicContact CD2-CD 4.14Å
667	V	82.7	Confident	79.4	Confident	11 Å²	11	35.2 Å²	35.2	7%	0.067	18%	0.18	C	C	.	.	H	α-helix	trans	-86	-33.9	-174.7	-177.3	0	0	0	0	112.6	I663 F670 Y671 L1205 I1208 L1209	I663-V667 HydrophobicContact CG2-CG2 4.12Å; I663-V667 WeakPolarHBondContact O-CG2 3.48Å; I663-V667 PolarHBondContact O-N 2.94Å; V667-F670 HydrophobicContact CG1-CE1 3.96Å; V667-F670 HydrophobicContact CG1-CE2 4Å; V667-F670 HydrophobicContact CG1-CZ 3.43Å; V667-F670 VanDerWaalsContact CG1-CZ 3.43Å; V667-F670 WeakPolarHBondContact O-CE1 3.18Å; V667-Y671 HydrophobicContact CB-CD1 4.25Å; V667-Y671 HydrophobicContact CB-CG 4.31Å; V667-Y671 VanDerWaalsContact CG1-CB 3.42Å; V667-Y671 HydrophobicContact CG1-CD1 4.17Å; V667-Y671 HydrophobicContact CG1-CD2 4.29Å; V667-Y671 HydrophobicContact CG1-CG 3.74Å; V667-Y671 HydrophobicContact CG2-CD1 4.38Å; V667-L1205 HydrophobicContact CG2-CD1 4Å; V667-I1208 HydrophobicContact CG1-CG2 4.2Å; V667-I1208 HydrophobicContact CG2-CG2 4.38Å; V667-L1209 HydrophobicContact CG2-CD2 3.61Å; V667-L1209 HydrophobicContact CG2-CG 4.2Å
668	G	76.3	Confident	78.9	Confident	26 Å²	26	34.4 Å²	34.4	27%	0.268	18%	0.18	S	C	.	.			trans	104.1	173.2	-175.4	0	0	0	0	0	114	K664 F670 Y671	K664-G668 WeakPolarHBondContact O-CA 3.26Å; K664-G668 PolarHBondContact O-N 2.91Å; G668-F670 VanDerWaalsContact C-N 3.31Å; G668-F670 PolarHBondContact O-N 2.94Å; G668-Y671 PolarHBondContact O-N 3.23Å
669	D	69.4	Low	78.3	Confident	131 Å²	131	38.6 Å²	38.6	70%	0.701	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-23.8	-170.4	-73.8	-70.4	0	0	0	115.4	K664 Y671	K664-D669 IonicContact NZ-OD1 3.24Å; K664-D669 PolarHBondContact NZ-OD1 2.92Å; D669-Y671 PolarHBondContact O-N 2.89Å
670	F	71.6	Confident	77.7	Confident	48 Å²	48	39.1 Å²	39.1	21%	0.211	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-20	178.5	74.5	-95.4	0	0	0	113.3	V667 G668 L1271 E1274	V667-F670 HydrophobicContact CG1-CE1 3.96Å; V667-F670 HydrophobicContact CG1-CE2 4Å; V667-F670 HydrophobicContact CG1-CZ 3.43Å; V667-F670 VanDerWaalsContact CG1-CZ 3.43Å; V667-F670 WeakPolarHBondContact O-CE1 3.18Å; G668-F670 VanDerWaalsContact C-N 3.31Å; G668-F670 PolarHBondContact O-N 2.94Å; F670-L1271 HydrophobicContact CE2-CD1 4.17Å; F670-E1274 HydrophobicContact CB-CG 4.41Å; F670-E1274 WeakPolarHBondContact CB-OE1 3.45Å; F670-E1274 HydrophobicContact CD1-CB 3.72Å; F670-E1274 HydrophobicContact CD1-CG 3.89Å; F670-E1274 HydrophobicContact CD2-CB 4.12Å; F670-E1274 HydrophobicContact CD2-CG 3.92Å; F670-E1274 HydrophobicContact CE1-CB 3.4Å; F670-E1274 HydrophobicContact CE1-CG 4.09Å; F670-E1274 HydrophobicContact CE2-CB 3.85Å; F670-E1274 HydrophobicContact CE2-CG 4.13Å; F670-E1274 HydrophobicContact CG-CB 4.07Å; F670-E1274 HydrophobicContact CG-CG 3.81Å; F670-E1274 HydrophobicContact CZ-CB 3.47Å; F670-E1274 VanDerWaalsContact CZ-CB 3.47Å; F670-E1274 HydrophobicContact CZ-CG 4.21Å
671	Y	77.7	Confident	77	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.016	21%	0.212	C	C	.	.			trans	-102.7	129.5	-179.2	-173	-100.2	0	0	0	110.2	I663 V667 G668 D669 P673 L1205	I663-Y671 HydrophobicContact CG2-CD1 4.17Å; I663-Y671 HydrophobicContact CG2-CE1 3.76Å; V667-Y671 HydrophobicContact CB-CD1 4.25Å; V667-Y671 HydrophobicContact CB-CG 4.31Å; V667-Y671 VanDerWaalsContact CG1-CB 3.42Å; V667-Y671 HydrophobicContact CG1-CD1 4.17Å; V667-Y671 HydrophobicContact CG1-CD2 4.29Å; V667-Y671 HydrophobicContact CG1-CG 3.74Å; V667-Y671 HydrophobicContact CG2-CD1 4.38Å; G668-Y671 PolarHBondContact O-N 3.23Å; D669-Y671 PolarHBondContact O-N 2.89Å; Y671-P673 HydrophobicContact CD1-CG 3.74Å; Y671-P673 HydrophobicContact CE1-CB 4.13Å; Y671-P673 HydrophobicContact CE1-CG 3.82Å; Y671-P673 VanDerWaalsContact O-CD 3.3Å; Y671-P673 WeakPolarHBondContact O-CD 3.46Å; Y671-L1205 HydrophobicContact CE1-CD1 4.47Å; Y671-L1205 HydrophobicContact CE2-CD1 3.95Å; Y671-L1205 WeakPolarHBondContact OH-CD2 3.05Å
672	H	75.7	Confident	76	Confident	80 Å²	80	41.1 Å²	41.1	37%	0.37	22%	0.224	S	C	.	.			trans	-108.5	95.2	173.8	-166.4	80.4	0	0	0	110.8	L674 S677 G1264	H672-L674 PolarHBondContact O-N 3.4Å; H672-S677 WeakPolarHBondContact NE2-CA 2.9Å; H672-S677 PolarHBondContact NE2-N 3.03Å; H672-G1264 WeakPolarHBondContact O-CA 3.4Å
673	P	77.1	Confident	75.1	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.013	24%	0.244	C	C	.	.			trans	-54.2	139.2	-178.8	-26.7	33.8	0	0	0	112.6	G660 I663 K664 Y671 Y675 L676 S677	G660-P673 WeakPolarHBondContact O-CG 3.08Å; I663-P673 HydrophobicContact CB-CB 4.42Å; I663-P673 HydrophobicContact CB-CG 4.03Å; I663-P673 HydrophobicContact CG2-CB 4.27Å; I663-P673 HydrophobicContact CG2-CG 3.81Å; K664-P673 HydrophobicContact CB-CG 4.03Å; Y671-P673 HydrophobicContact CD1-CG 3.74Å; Y671-P673 HydrophobicContact CE1-CB 4.13Å; Y671-P673 HydrophobicContact CE1-CG 3.82Å; Y671-P673 VanDerWaalsContact O-CD 3.3Å; Y671-P673 WeakPolarHBondContact O-CD 3.46Å; P673-Y675 PolarHBondContact O-N 3.33Å; P673-Y675 VanDerWaalsContact O-N 3.11Å; P673-L676 HydrophobicContact CB-CG 4.45Å; P673-L676 HydrophobicContact CG-CD1 4.38Å; P673-L676 PolarHBondContact O-N 3.07Å; P673-S677 PolarHBondContact O-N 2.77Å
674	L	77.3	Confident	73.9	Confident	33 Å²	33	47.8 Å²	47.8	17%	0.173	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-53.4	-38.3	-178.9	-175.8	63.6	0	0	0	112.1	H672 L676 S677 F680 R1174 Y1262	H672-L674 PolarHBondContact O-N 3.4Å; L674-L676 PolarHBondContact O-N 3.45Å; L674-S677 VanDerWaalsContact O-CB 3.23Å; L674-S677 WeakPolarHBondContact O-CB 3.38Å; L674-S677 PolarHBondContact O-N 2.99Å; L674-F680 HydrophobicContact CD1-CB 4.3Å; L674-F680 HydrophobicContact CD2-CD2 4.18Å; L674-F680 HydrophobicContact CG-CB 4.23Å; L674-F680 HydrophobicContact CG-CD2 4Å; L674-F680 HydrophobicContact CG-CG 4.27Å; L674-F680 WeakPolarHBondContact O-CB 3.11Å; L674-R1174 VanDerWaalsContact CD2-NH2 3.3Å; L674-Y1262 HydrophobicContact CD2-CD1 4.37Å
675	Y	79.2	Confident	72.4	Confident	5 Å²	5	52.3 Å²	52.3	2%	0.02	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-62	-22.2	178.3	-47.5	-34.3	0	0	0	114.5	L610 L656 V659 I663 P673 F680 Q681 E1175	L610-Y675 HydrophobicContact CD2-CE1 4.48Å; L656-Y675 HydrophobicContact CB-CD1 4.09Å; L656-Y675 HydrophobicContact CB-CD2 4.27Å; L656-Y675 HydrophobicContact CB-CG 3.94Å; L656-Y675 HydrophobicContact CD1-CD1 4.27Å; L656-Y675 HydrophobicContact CD1-CE1 4.2Å; L656-Y675 HydrophobicContact CD2-CE1 4.47Å; L656-Y675 HydrophobicContact CD2-CE2 4.41Å; L656-Y675 WeakPolarHBondContact O-CB 3.02Å; L656-Y675 WeakPolarHBondContact O-CD2 3.43Å; V659-Y675 HydrophobicContact CB-CD2 4.27Å; V659-Y675 HydrophobicContact CB-CE2 4.35Å; V659-Y675 HydrophobicContact CG1-CD2 4.41Å; V659-Y675 HydrophobicContact CG1-CE2 4.09Å; I663-Y675 HydrophobicContact CD1-CD2 4.07Å; I663-Y675 HydrophobicContact CD1-CE2 3.83Å; P673-Y675 PolarHBondContact O-N 3.33Å; P673-Y675 VanDerWaalsContact O-N 3.11Å; Y675-F680 HydrophobicContact CD1-CD1 4.38Å; Y675-F680 AromaticContact CD1-CE1 3.78Å; Y675-F680 HydrophobicContact CD1-CE1 3.78Å; Y675-F680 HydrophobicContact CD1-CE2 4.46Å; Y675-F680 AromaticContact CD1-CZ 3.84Å; Y675-F680 HydrophobicContact CD1-CZ 3.84Å; Y675-F680 HydrophobicContact CE1-CZ 4.31Å; Y675-Q681 PolarHBondContact O-NE2 2.75Å; Y675-E1175 WeakPolarHBondContact CE1-OE1 3.31Å
676	L	75.9	Confident	70.6	Confident	35 Å²	35	53.6 Å²	53.6	18%	0.183	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-90	-16.4	174	-60.9	-173.6	0	0	0	113	R657 K661 K664 P673 L674 Q681	R657-L676 HydrophobicContact CG-CD2 3.97Å; R657-L676 WeakPolarHBondContact O-CD2 3.5Å; K661-L676 HydrophobicContact CG-CD2 4.5Å; K664-L676 HydrophobicContact CB-CD1 4.28Å; K664-L676 HydrophobicContact CD-CD1 3.92Å; P673-L676 HydrophobicContact CB-CG 4.45Å; P673-L676 HydrophobicContact CG-CD1 4.38Å; P673-L676 PolarHBondContact O-N 3.07Å; L674-L676 PolarHBondContact O-N 3.45Å; L676-Q681 PolarHBondContact O-NE2 2.88Å
677	S	71.7	Confident	68.3	Low	15 Å²	15	61.7 Å²	61.7	11%	0.105	32%	0.321	C	S	.	.	S	Bend	trans	-64.1	139.6	-178.4	-179.8	0	0	0	0	112.7	H672 P673 L674 E679 F680 Q681	H672-S677 WeakPolarHBondContact NE2-CA 2.9Å; H672-S677 PolarHBondContact NE2-N 3.03Å; P673-S677 PolarHBondContact O-N 2.77Å; L674-S677 VanDerWaalsContact O-CB 3.23Å; L674-S677 WeakPolarHBondContact O-CB 3.38Å; L674-S677 PolarHBondContact O-N 2.99Å; S677-E679 PolarHBondContact O-N 3.21Å; S677-E679 PolarHBondContact OG-N 2.76Å; S677-F680 PolarHBondContact O-N 2.86Å; S677-Q681 WeakPolarHBondContact O-CG 3.43Å; S677-Q681 PolarHBondContact O-N 3.32Å
678	K	68.5	Low	65.9	Low	112 Å²	112	65.7 Å²	65.7	49%	0.487	34%	0.338	S	S	.	.	H	α-helix	trans	-59	-30.4	170.8	-67.6	-179.4	-177.6	171.7	0	112.5	Q681 A682 P974 L975	K678-Q681 PolarHBondContact O-N 2.77Å; K678-A682 WeakPolarHBondContact O-CB 3.11Å; K678-A682 PolarHBondContact O-N 3.35Å; K678-P974 VanDerWaalsContact CE-CB 3.45Å; K678-L975 PolarHBondContact NZ-O 3.16Å
679	E	68.7	Low	63.9	Low	108 Å²	108	75 Å²	75	51%	0.505	37%	0.365	S	S	.	.	H	α-helix	trans	-70.9	-39.2	-179.6	-69.5	163.3	-173.5	0	0	111.2	S677 K683 R1265	S677-E679 PolarHBondContact O-N 3.21Å; S677-E679 PolarHBondContact OG-N 2.76Å; E679-K683 PolarHBondContact O-N 3.09Å; E679-R1265 IonicContact OE1-CZ 3.23Å; E679-R1265 IonicContact OE1-NH2 2.72Å; E679-R1265 PolarHBondContact OE1-NH2 3.31Å; E679-R1265 IonicContact OE2-NH2 2.8Å; E679-R1265 PolarHBondContact OE2-NH2 2.87Å
680	F	70.6	Confident	62.2	Low	10 Å²	10	74.7 Å²	74.7	4%	0.044	36%	0.362	C	S	.	.	H	α-helix	trans	-69.1	-42.8	172.8	-171.1	-106.1	0	0	0	111.3	I607 L656 L674 Y675 S677 A682 K683 L684 L1169	I607-F680 HydrophobicContact CD1-CE2 3.94Å; I607-F680 HydrophobicContact CD1-CZ 3.9Å; I607-F680 HydrophobicContact CG1-CZ 4.46Å; L656-F680 HydrophobicContact CB-CE1 4.36Å; L656-F680 HydrophobicContact CD1-CE1 3.99Å; L656-F680 HydrophobicContact CD1-CZ 3.68Å; L674-F680 HydrophobicContact CD1-CB 4.3Å; L674-F680 HydrophobicContact CD2-CD2 4.18Å; L674-F680 HydrophobicContact CG-CB 4.23Å; L674-F680 HydrophobicContact CG-CD2 4Å; L674-F680 HydrophobicContact CG-CG 4.27Å; L674-F680 WeakPolarHBondContact O-CB 3.11Å; Y675-F680 HydrophobicContact CD1-CD1 4.38Å; Y675-F680 AromaticContact CD1-CE1 3.78Å; Y675-F680 HydrophobicContact CD1-CE1 3.78Å; Y675-F680 HydrophobicContact CD1-CE2 4.46Å; Y675-F680 AromaticContact CD1-CZ 3.84Å; Y675-F680 HydrophobicContact CD1-CZ 3.84Å; Y675-F680 HydrophobicContact CE1-CZ 4.31Å; S677-F680 PolarHBondContact O-N 2.86Å; F680-A682 VanDerWaalsContact C-N 3.31Å; F680-A682 PolarHBondContact O-N 3.41Å; F680-K683 WeakPolarHBondContact O-CA 3.22Å; F680-K683 WeakPolarHBondContact O-CB 3.03Å; F680-K683 PolarHBondContact O-N 3.41Å; F680-L684 HydrophobicContact CD1-CD1 3.57Å; F680-L684 HydrophobicContact CD2-CD1 4.37Å; F680-L684 HydrophobicContact CE1-CD1 3.38Å; F680-L684 HydrophobicContact CE2-CD1 4.19Å; F680-L684 HydrophobicContact CG-CD1 4.08Å; F680-L684 HydrophobicContact CZ-CD1 3.71Å; F680-L684 WeakPolarHBondContact O-CD1 3.19Å; F680-L684 PolarHBondContact O-N 3.08Å; F680-L1169 HydrophobicContact CE2-CD2 3.88Å; F680-L1169 HydrophobicContact CZ-CD2 4.4Å
681	Q	69.8	Low	60.3	Low	49 Å²	49	82.2 Å²	82.2	23%	0.229	40%	0.398	C	S	.	.	H	α-helix	trans	-66.9	-31.9	178	-67.5	169.6	23.1	0	0	112.4	R657 Y675 L676 S677 K678 L684 M685	R657-Q681 VanDerWaalsContact NH2-CD 3.32Å; Y675-Q681 PolarHBondContact O-NE2 2.75Å; L676-Q681 PolarHBondContact O-NE2 2.88Å; S677-Q681 WeakPolarHBondContact O-CG 3.43Å; S677-Q681 PolarHBondContact O-N 3.32Å; K678-Q681 PolarHBondContact O-N 2.77Å; Q681-L684 PolarHBondContact O-N 3.03Å; Q681-M685 PolarHBondContact O-N 2.69Å; Q681-M685 VanDerWaalsContact O-N 3.15Å
682	A	61.7	Low	58.1	Low	72 Å²	72	84.8 Å²	84.8	60%	0.595	43%	0.426	S	S	*	.	H	α-helix	trans	-70.6	-31.4	169.4	0	0	0	0	0	113	K678 F680	K678-A682 WeakPolarHBondContact O-CB 3.11Å; K678-A682 PolarHBondContact O-N 3.35Å; F680-A682 VanDerWaalsContact C-N 3.31Å; F680-A682 PolarHBondContact O-N 3.41Å
683	K	66.8	Low	56	Low	94 Å²	94	84.4 Å²	84.4	41%	0.409	44%	0.437	S	S	.	.	H	α-helix	trans	-65.3	-36.7	167.9	-77.1	-176.3	169.8	-168.2	0	112	E679 F680 I1167 D1170	E679-K683 PolarHBondContact O-N 3.09Å; F680-K683 WeakPolarHBondContact O-CA 3.22Å; F680-K683 WeakPolarHBondContact O-CB 3.03Å; F680-K683 PolarHBondContact O-N 3.41Å; K683-I1167 WeakPolarHBondContact O-CD1 3.45Å; K683-D1170 IonicContact NZ-OD1 2.63Å; K683-D1170 PolarHBondContact NZ-OD1 2.85Å; K683-D1170 IonicContact NZ-OD2 3.27Å; K683-D1170 PolarHBondContact NZ-OD2 3.4Å
684	L	60.8	Low	54	Low	51 Å²	51	87.6 Å²	87.6	27%	0.267	45%	0.454	S	S	.	.	H	α-helix	trans	-74.7	-24.6	178.5	-90.4	85.3	0	0	0	114.9	I607 F680 Q681 P686	I607-L684 HydrophobicContact CD1-CD1 3.67Å; I607-L684 HydrophobicContact CD1-CG 4.23Å; I607-L684 HydrophobicContact CG2-CD2 4.43Å; I607-L684 HydrophobicContact CG2-CG 4.5Å; F680-L684 HydrophobicContact CD1-CD1 3.57Å; F680-L684 HydrophobicContact CD2-CD1 4.37Å; F680-L684 HydrophobicContact CE1-CD1 3.38Å; F680-L684 HydrophobicContact CE2-CD1 4.19Å; F680-L684 HydrophobicContact CG-CD1 4.08Å; F680-L684 HydrophobicContact CZ-CD1 3.71Å; F680-L684 WeakPolarHBondContact O-CD1 3.19Å; F680-L684 PolarHBondContact O-N 3.08Å; Q681-L684 PolarHBondContact O-N 3.03Å; L684-P686 WeakPolarHBondContact O-CD 3.1Å
685	M	51.9	Low	52.1	Low	157 Å²	157	92.4 Å²	92.4	77%	0.773	48%	0.478	S	S	*	.			trans	-113.2	88.4	-171.1	-74.2	-169	155.6	0	0	113.5	Q681	Q681-M685 PolarHBondContact O-N 2.69Å; Q681-M685 VanDerWaalsContact O-N 3.15Å
686	P	45.5	Very low	49.6	Very low	73 Å²	73	94.9 Å²	94.9	47%	0.474	50%	0.496	S	S	.	.			trans	-67.7	140.9	166.3	28.8	-33.6	0	0	0	111.7	L684 K688 Q1163	L684-P686 WeakPolarHBondContact O-CD 3.1Å; P686-K688 PolarHBondContact O-N 3.21Å; P686-Q1163 HydrophobicContact CG-CB 4.47Å
687	E	34.7	Very low	47.4	Very low	180 Å²	180	99.7 Å²	99.7	84%	0.841	52%	0.517	S	S	*	.			trans	-74.6	75.1	-166.1	-165.1	177.1	-166.9	0	0	114
688	K	33.4	Very low	45.5	Very low	94 Å²	94	107.2 Å²	107.2	41%	0.409	54%	0.543	S	S	.	.			trans	-91.8	105.4	174.4	-85.6	173.1	168.4	167.1	0	112.6	P686 P1159 D1160	P686-K688 PolarHBondContact O-N 3.21Å; K688-P1159 PolarHBondContact NZ-O 3.49Å; K688-D1160 IonicContact NZ-OD1 2.68Å; K688-D1160 PolarHBondContact NZ-OD1 3.41Å
689	R	33.1	Very low	43.6	Very low	222 Å²	222	107.9 Å²	107.9	84%	0.838	55%	0.551	S	S	*	*			trans	118.7	139.1	172	-71.1	167.8	176.9	162.7	2.1	110.5
690	L	35.1	Very low	41.8	Very low	124 Å²	124	108 Å²	108	65%	0.649	56%	0.555	S	S	*	*			cis	-158.6	109.1	33.1	-168.3	67.9	0	0	0	113.7	A693	L690-A693 HydrophobicContact CD2-CB 3.58Å; L690-A693 HydrophobicContact CG-CB 4.38Å
691	E	30.7	Very low	40	Very low	206 Å²	206	109.6 Å²	109.6	96%	0.963	58%	0.575	S	S	*	*	S	Bend	trans	-94.4	121.7	144.7	-75.3	-163.4	134.8	0	0	107.2
692	G	32.3	Very low	38.4	Very low	58 Å²	58	111.5 Å²	111.5	60%	0.598	59%	0.593	S	S	*	*	S	Bend	trans	158.4	-48.5	177.4	0	0	0	0	0	115.9	D694	G692-D694 VanDerWaalsContact C-N 3.26Å; G692-D694 PolarHBondContact O-N 2.94Å; G692-D694 VanDerWaalsContact O-N 3.11Å
693	A	31	Very low	37	Very low	72 Å²	72	113.7 Å²	113.7	60%	0.595	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	32.4	-172.1	0	0	0	0	0	115.1	L690	L690-A693 HydrophobicContact CD2-CB 3.58Å; L690-A693 HydrophobicContact CG-CB 4.38Å
694	D	34.9	Very low	35.4	Very low	69 Å²	69	116.7 Å²	116.7	37%	0.369	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.1	6.7	179.4	-161.6	62.6	0	0	0	112.3	G692 C696 R698	G692-D694 VanDerWaalsContact C-N 3.26Å; G692-D694 PolarHBondContact O-N 2.94Å; G692-D694 VanDerWaalsContact O-N 3.11Å; D694-C696 VanDerWaalsContact C-N 3.32Å; D694-R698 VanDerWaalsContact O-CD 3.24Å; D694-R698 WeakPolarHBondContact O-CD 3.26Å; D694-R698 VanDerWaalsContact O-CG 3.28Å; D694-R698 WeakPolarHBondContact O-CG 3.15Å; D694-R698 PolarHBondContact O-NE 2.85Å; D694-R698 VanDerWaalsContact O-NE 3.11Å; D694-R698 IonicContact OD2-CZ 3.34Å; D694-R698 IonicContact OD2-NE 2.8Å; D694-R698 PolarHBondContact OD2-NE 3.04Å; D694-R698 VanDerWaalsContact OD2-NE 3.12Å; D694-R698 IonicContact OD2-NH2 3.76Å; D694-R698 PolarHBondContact OD2-NH2 3.11Å
695	I	37.1	Very low	34	Very low	135 Å²	135	119.5 Å²	119.5	69%	0.692	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-74.3	-26	172.5	-68.3	176.4	0	0	0	111.1
696	C	26.9	Very low	33	Very low	57 Å²	57	122.1 Å²	122.1	39%	0.385	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-95.6	20.6	-175.3	-69.7	0	0	0	0	114.9	D694 G731 A732	D694-C696 VanDerWaalsContact C-N 3.32Å; C696-G731 CarbonylContact O-C 3.11Å; C696-G731 VanDerWaalsContact O-CA 3.24Å; C696-G731 WeakPolarHBondContact O-CA 3.47Å; C696-A732 WeakPolarHBondContact CB-O 2.88Å; C696-A732 PolarHBondContact O-N 3.05Å; C696-A732 PolarHBondContact SG-O 3.42Å
697	Q	31.2	Very low	32.5	Very low	136 Å²	136	122.8 Å²	122.8	64%	0.636	63%	0.63	S	S	*	*	G	3₁₀ helix	trans	-151	44.4	159.9	-121.9	166.7	12.9	0	0	114.4	N730	Q697-N730 CarbonylContact C-O 3.12Å; Q697-N730 VanDerWaalsContact CA-O 3.31Å; Q697-N730 WeakPolarHBondContact CA-O 3.12Å; Q697-N730 WeakPolarHBondContact CG-O 2.99Å
698	R	30.2	Very low	32.5	Very low	172 Å²	172	118.4 Å²	118.4	65%	0.649	62%	0.62	S	S	*	*			trans	-103.9	8.4	179.8	-85.1	177.5	-173	-168.8	4	115.6	D694	D694-R698 VanDerWaalsContact O-CD 3.24Å; D694-R698 WeakPolarHBondContact O-CD 3.26Å; D694-R698 VanDerWaalsContact O-CG 3.28Å; D694-R698 WeakPolarHBondContact O-CG 3.15Å; D694-R698 PolarHBondContact O-NE 2.85Å; D694-R698 VanDerWaalsContact O-NE 3.11Å; D694-R698 IonicContact OD2-CZ 3.34Å; D694-R698 IonicContact OD2-NE 2.8Å; D694-R698 PolarHBondContact OD2-NE 3.04Å; D694-R698 VanDerWaalsContact OD2-NE 3.12Å; D694-R698 IonicContact OD2-NH2 3.76Å; D694-R698 PolarHBondContact OD2-NH2 3.11Å
699	L	29.7	Very low	32.6	Very low	126 Å²	126	120.8 Å²	120.8	66%	0.66	63%	0.632	S	S	*	*	S	Bend	trans	-106.2	121.8	177.9	-83.8	170.3	0	0	0	110.9	H729 N730	L699-H729 CarbonylContact O-C 3.59Å; L699-N730 PolarHBondContact N-O 2.99Å; L699-N730 CarbonylContact O-C 3.56Å; L699-N730 WeakPolarHBondContact O-CB 3.29Å
700	L	30.3	Very low	32.5	Very low	110 Å²	110	114.3 Å²	114.3	58%	0.576	61%	0.614	S	S	*	*	S	Bend	trans	60.8	102.5	-169.7	-54	134	0	0	0	110.9	H729 N730	L700-H729 HydrophobicContact CB-CB 3.51Å; L700-H729 HydrophobicContact CD1-CB 4.11Å; L700-H729 HydrophobicContact CG-CB 4.43Å; L700-H729 CarbonylContact O-C 3.22Å; L700-H729 WeakPolarHBondContact O-CA 3.44Å; L700-H729 PolarHBondContact O-N 3.27Å; L700-N730 HydrophobicContact CD1-CB 4.27Å
701	G	32.2	Very low	32.2	Very low	45 Å²	45	116 Å²	116	46%	0.464	61%	0.613	S	S	.	*				121.2	45.3	67.5	0	0	0	0	0	108
702	S	36.6	Very low	32.1	Very low	89 Å²	89	109.6 Å²	109.6	62%	0.622	59%	0.591	S	S	*	*				65.1	155.7	76.2	-61.5	0	0	0	0	112.5
703	N	32.5	Very low	31.9	Very low	118 Å²	118	114.6 Å²	114.6	63%	0.631	60%	0.604	S	S	*	*			trans	71.4	151.8	168.4	-56	-51.8	0	0	0	115.9
704	K	32.7	Very low	32.1	Very low	157 Å²	157	119.2 Å²	119.2	68%	0.683	62%	0.616	S	S	*	*			cis	-134.2	128.9	-24.7	-114.3	146.7	-174.4	157.8	0	105.4
705	L	31.3	Very low	31.9	Very low	109 Å²	109	119 Å²	119	57%	0.571	62%	0.62	S	S	*	*				54.6	151.5	76.8	-93.3	82.6	0	0	0	113.1
706	R	31.3	Very low	31.6	Very low	212 Å²	212	117 Å²	117	80%	0.8	62%	0.615	S	S	*	*			trans	66.6	157.8	156.3	-73.5	174.2	-178	-161	-0.8	115.3
707	S	36.2	Very low	31.7	Very low	87 Å²	87	119 Å²	119	61%	0.608	63%	0.629	S	S	*	*			cis	-161.9	-164.5	-24.6	47.5	0	0	0	0	107.3
708	S	34.8	Very low	31.6	Very low	88 Å²	88	117.2 Å²	117.2	62%	0.615	63%	0.633	S	S	*	*			trans	80	140.7	148.9	-55.1	0	0	0	0	116.7
709	Q	35	Very low	31.7	Very low	145 Å²	145	113.3 Å²	113.3	68%	0.678	63%	0.632	S	S	*	*			cis	-171.4	167.4	-27.1	-121.5	160.7	-90.4	0	0	108.8
710	D	31.7	Very low	31.8	Very low	86 Å²	86	110.5 Å²	110.5	46%	0.46	62%	0.622	S	S	.	*			trans	63.8	119	136	-62.8	-8.7	0	0	0	124.2
711	Y	28.6	Very low	31.9	Very low	159 Å²	159	108.7 Å²	108.7	62%	0.624	62%	0.619	S	S	*	*				72.6	143	128	-57.3	-48.8	0	0	0	124	S715 P716	Y711-S715 VanDerWaalsContact CA-OG 3.28Å; Y711-S715 WeakPolarHBondContact CA-OG 3.35Å; Y711-P716 WeakPolarHBondContact O-CD 3.47Å
712	S	28.6	Very low	31.8	Very low	71 Å²	71	110 Å²	110	50%	0.497	62%	0.621	S	S	.	*	S	Bend	trans	67.9	124.8	179.8	71.6	0	0	0	0	116.6	S715 P716	S712-S715 PolarHBondContact N-OG 3Å; S712-S715 WeakPolarHBondContact O-CA 3.45Å; S712-P716 WeakPolarHBondContact O-CD 3.46Å
713	N	26.8	Very low	31.5	Very low	164 Å²	164	110.5 Å²	110.5	88%	0.877	62%	0.62	S	S	*	*	S	Bend	cis	-133.8	79.4	-7.9	-81	-26.7	0	0	0	110.3
714	M	35.6	Very low	31.5	Very low	169 Å²	169	109.8 Å²	109.8	83%	0.833	62%	0.624	S	S	*	*	S	Bend	cis	-133.3	103.3	-8.7	-58.7	171.3	85.1	0	0	105.9
715	S	30.4	Very low	31.3	Very low	65 Å²	65	107.8 Å²	107.8	46%	0.455	63%	0.631	S	S	.	*			cis	-152.5	-179.6	15.4	-53.2	0	0	0	0	110.8	Y711 S712	Y711-S715 VanDerWaalsContact CA-OG 3.28Å; Y711-S715 WeakPolarHBondContact CA-OG 3.35Å; S712-S715 PolarHBondContact N-OG 3Å; S712-S715 WeakPolarHBondContact O-CA 3.45Å
716	P	31.1	Very low	31.3	Very low	92 Å²	92	108.5 Å²	108.5	60%	0.597	65%	0.645	S	S	*	*			trans	-90.2	-167.5	-136.8	37.3	-41.5	0	0	0	118.1	Y711 S712	Y711-P716 WeakPolarHBondContact O-CD 3.47Å; S712-P716 WeakPolarHBondContact O-CD 3.46Å
717	S	28.1	Very low	31.7	Very low	98 Å²	98	103.1 Å²	103.1	69%	0.685	64%	0.64	S	S	*	*			trans	-88.8	165.4	-162.1	53.6	0	0	0	0	117.8
718	S	29.9	Very low	31.7	Very low	100 Å²	100	105.7 Å²	105.7	70%	0.699	64%	0.641	S	S	*	*			trans	68.5	168.2	140.6	64.5	0	0	0	0	121.2
719	S	32.6	Very low	31.6	Very low	90 Å²	90	105.5 Å²	105.5	63%	0.629	63%	0.631	S	S	*	*			trans	68.6	160.3	170.6	16.2	0	0	0	0	117.8
720	S	31.4	Very low	31.4	Very low	66 Å²	66	102.2 Å²	102.2	46%	0.462	62%	0.618	S	S	.	*			cis	-156.8	165.1	-19.9	60.5	0	0	0	0	112.1	S950	S720-S950 PolarHBondContact O-OG 2.96Å
721	S	32.4	Very low	31.2	Very low	73 Å²	73	99.6 Å²	99.6	51%	0.51	61%	0.611	S	S	.	*			trans	-41.8	161.2	151.1	44.5	0	0	0	0	114.9
722	S	30.7	Very low	31.3	Very low	72 Å²	72	95 Å²	95	50%	0.503	61%	0.606	S	S	.	*			cis	-150.9	-119.6	-9.4	39.4	0	0	0	0	110.6
723	T	30.6	Very low	31.2	Very low	99 Å²	99	98.9 Å²	98.9	61%	0.607	62%	0.619	S	S	*	*			cis	-139.9	-98.2	-14.2	-38.3	0	0	0	0	111.4	R952	T723-R952 PolarHBondContact O-NH2 3.27Å; T723-R952 VanDerWaalsContact O-NH2 3.1Å
724	S	31.2	Very low	31.3	Very low	103 Å²	103	96.7 Å²	96.7	72%	0.72	62%	0.616	S	S	*	*			trans	-163.2	163.3	-165.5	50.8	0	0	0	0	110.2
725	S	30.1	Very low	31.3	Very low	116 Å²	116	94.6 Å²	94.6	81%	0.811	62%	0.615	S	S	*	*			cis	-162.5	152.9	-11.8	38.4	0	0	0	0	108.2
726	S	30.3	Very low	31.2	Very low	124 Å²	124	102.3 Å²	102.3	87%	0.867	63%	0.634	S	S	*	*			trans	-131.7	144.1	-164.3	57	0	0	0	0	115.8
727	S	39	Very low	31.2	Very low	99 Å²	99	102.9 Å²	102.9	69%	0.692	64%	0.636	S	S	*	*			trans	-148.2	162.3	-178.6	52.6	0	0	0	0	112.8
728	H	37.4	Very low	31.3	Very low	140 Å²	140	103.5 Å²	103.5	65%	0.648	63%	0.631	S	S	*	*			trans	69.1	146.2	-179.5	-63.4	-96.8	0	0	0	116.3
729	H	32	Very low	31.3	Very low	85 Å²	85	99.2 Å²	99.2	39%	0.394	60%	0.603	S	S	.	*			cis	-152.9	171.5	-0.1	-116.2	-55.5	0	0	0	112.4	L699 L700	L699-H729 CarbonylContact O-C 3.59Å; L700-H729 HydrophobicContact CB-CB 3.51Å; L700-H729 HydrophobicContact CD1-CB 4.11Å; L700-H729 HydrophobicContact CG-CB 4.43Å; L700-H729 CarbonylContact O-C 3.22Å; L700-H729 WeakPolarHBondContact O-CA 3.44Å; L700-H729 PolarHBondContact O-N 3.27Å
730	N	30.2	Very low	31.5	Very low	75 Å²	75	100.5 Å²	100.5	40%	0.401	60%	0.602	S	S	.	*			trans	42.6	142.2	141.5	-58.1	-6.4	0	0	0	126.2	Q697 L699 L700	Q697-N730 CarbonylContact C-O 3.12Å; Q697-N730 VanDerWaalsContact CA-O 3.31Å; Q697-N730 WeakPolarHBondContact CA-O 3.12Å; Q697-N730 WeakPolarHBondContact CG-O 2.99Å; L699-N730 PolarHBondContact N-O 2.99Å; L699-N730 CarbonylContact O-C 3.56Å; L699-N730 WeakPolarHBondContact O-CB 3.29Å; L700-N730 HydrophobicContact CD1-CB 4.27Å
731	G	28.9	Very low	31.6	Very low	31 Å²	31	103.8 Å²	103.8	32%	0.32	61%	0.608	S	S	.	*			trans	172.5	-39	157.5	0	0	0	0	0	115.9	C696	C696-G731 CarbonylContact O-C 3.11Å; C696-G731 VanDerWaalsContact O-CA 3.24Å; C696-G731 WeakPolarHBondContact O-CA 3.47Å
732	A	29.3	Very low	31.7	Very low	62 Å²	62	105.1 Å²	105.1	51%	0.512	61%	0.609	S	S	.	*			trans	57	155.3	168.8	0	0	0	0	0	120	C696	C696-A732 WeakPolarHBondContact CB-O 2.88Å; C696-A732 PolarHBondContact O-N 3.05Å; C696-A732 PolarHBondContact SG-O 3.42Å
733	I	27.3	Very low	31.9	Very low	153 Å²	153	107.4 Å²	107.4	79%	0.785	62%	0.616	S	S	*	*				159.7	133.6	127	-80.5	157.4	0	0	0	111.9
734	C	29.5	Very low	31.9	Very low	119 Å²	119	106.6 Å²	106.6	80%	0.804	61%	0.611	S	S	*	*			trans	-130.2	174.2	-169.4	-57	0	0	0	0	114.5
735	P	35.4	Very low	31.8	Very low	124 Å²	124	112.1 Å²	112.1	81%	0.805	62%	0.616	S	S	*	*			trans	-113.1	-167.3	165	42	-32.1	0	0	0	114.6
736	R	28.5	Very low	31.9	Very low	227 Å²	227	114 Å²	114	86%	0.857	61%	0.609	S	S	*	*			trans	-153.9	173.6	-177.1	-57.5	-178	-178.7	146.8	-1.3	114.8
737	T	30.2	Very low	31.9	Very low	105 Å²	105	115.9 Å²	115.9	64%	0.644	61%	0.608	S	S	*	*			trans	72.3	156.2	161.5	64.5	0	0	0	0	119.3
738	L	29.4	Very low	31.5	Very low	110 Å²	110	117.8 Å²	117.8	58%	0.576	61%	0.611	S	S	*	*			cis	-167	177.5	-20	-100.1	169.1	0	0	0	107.4	M863	L738-M863 HydrophobicContact CD2-CE 3.98Å; L738-M863 HydrophobicContact CG-CE 4.12Å
739	G	31.6	Very low	31.5	Very low	11 Å²	11	119.6 Å²	119.6	11%	0.113	61%	0.613	C	S	.	*			cis	151.3	146.6	-6.5	0	0	0	0	0	114.9
740	L	35.3	Very low	31.3	Very low	117 Å²	117	122 Å²	122	61%	0.613	63%	0.629	S	S	*	*			trans	68.3	150.9	166.6	-76.8	72.1	0	0	0	118.7	G642	G642-L740 CarbonylContact C-O 3.46Å; G642-L740 VanDerWaalsContact CA-O 3.23Å; G642-L740 WeakPolarHBondContact CA-O 3.28Å
741	K	34.1	Very low	31.9	Very low	134 Å²	134	127 Å²	127	58%	0.583	65%	0.65	S	S	*	*			cis	-167.6	149.2	-14.7	179.5	170.3	-174.8	-173.7	0	112.3	L641	L641-K741 PolarHBondContact O-N 3.2Å
742	D	35.3	Very low	32.2	Very low	101 Å²	101	131.3 Å²	131.3	54%	0.54	67%	0.666	S	S	.	*			trans	-1.3	162.2	161.6	-39.7	-6.6	0	0	0	124.1
743	N	33.5	Very low	32.2	Very low	121 Å²	121	134.6 Å²	134.6	65%	0.647	67%	0.666	S	S	*	*			trans	81.7	149.6	162.5	-60.1	-20.4	0	0	0	118.5
744	V	30.6	Very low	32.2	Very low	82 Å²	82	132.5 Å²	132.5	50%	0.497	66%	0.656	S	S	.	*			cis	149.6	130.3	-16.5	150.2	0	0	0	0	109.6	E869	V744-E869 VanDerWaalsContact CA-OE1 3.27Å; V744-E869 WeakPolarHBondContact CA-OE1 3.44Å; V744-E869 HydrophobicContact CG2-CG 4.34Å
745	R	29.2	Very low	32.7	Very low	219 Å²	219	132.6 Å²	132.6	83%	0.826	65%	0.648	S	S	*	*			trans	76.7	158.7	173.4	-67	162.8	-172.8	-173.2	1.7	118.7
746	F	33.8	Very low	32.7	Very low	154 Å²	154	131 Å²	131	68%	0.675	63%	0.631	S	S	*	*			cis	178	121.2	-43.3	-118	-61.9	0	0	0	109.1	L871	F746-L871 HydrophobicContact CZ-CD2 3.88Å
747	I	29.6	Very low	33.7	Very low	165 Å²	165	122.6 Å²	122.6	85%	0.846	60%	0.603	S	S	*	*			trans	153.3	114.7	157	-85.4	159.5	0	0	0	107.4
748	D	30.1	Very low	33.8	Very low	139 Å²	139	121.8 Å²	121.8	74%	0.743	59%	0.594	S	S	*	*			trans	-125.4	123.2	-173.1	-60.1	-58	0	0	0	111.9
749	Y	37	Very low	34.4	Very low	178 Å²	178	117.9 Å²	117.9	70%	0.698	57%	0.574	S	S	*	*			trans	175.9	77.3	145.6	-105	-65.9	0	0	0	109.2	D1218	Y749-D1218 PolarHBondContact OH-OD2 2.68Å
750	N	29.6	Very low	34.9	Very low	136 Å²	136	119.7 Å²	119.7	73%	0.727	59%	0.585	S	S	*	*			trans	-155.4	94.8	175.4	-139.9	82.8	0	0	0	108	D752	N750-D752 PolarHBondContact ND2-OD2 3.15Å; N750-D752 PolarHBondContact O-N 3.07Å
751	E	42.1	Very low	34.9	Very low	180 Å²	180	119.7 Å²	119.7	84%	0.841	59%	0.585	S	S	*	*			trans	-96.5	87.7	179.6	-71.8	-168	-172.4	0	0	110.3
752	D	34.4	Very low	35.4	Very low	121 Å²	121	118.2 Å²	118.2	65%	0.647	58%	0.58	S	S	*	*			trans	-87.1	169.6	174.2	-87.1	-65.9	0	0	0	113	N750	N750-D752 PolarHBondContact ND2-OD2 3.15Å; N750-D752 PolarHBondContact O-N 3.07Å
753	Y	29.9	Very low	35	Very low	131 Å²	131	119 Å²	119	51%	0.514	58%	0.583	S	S	.	*			trans	-49.3	169.6	168.6	-66.4	-105.2	0	0	0	115.4	I300	I300-Y753 HydrophobicContact CB-CE1 4.37Å; I300-Y753 WeakPolarHBondContact CB-OH 3.45Å; I300-Y753 HydrophobicContact CG2-CE1 4.08Å; I300-Y753 WeakPolarHBondContact CG2-OH 3.23Å
754	D	27	Very low	34.7	Very low	108 Å²	108	115.4 Å²	115.4	58%	0.578	57%	0.566	S	S	*	*			trans	86	135	146.3	-94.4	-35.9	0	0	0	120.7
755	L	39.9	Very low	34.7	Very low	121 Å²	121	111.9 Å²	111.9	63%	0.634	55%	0.545	S	S	*	.				37.9	150.1	125.2	-133.4	77.6	0	0	0	121.3	P769	L755-P769 HydrophobicContact CD2-CB 4.19Å
756	M	36.2	Very low	35.4	Very low	91 Å²	91	104.7 Å²	104.7	45%	0.448	53%	0.527	S	S	.	.			trans	99.1	106.3	163	-48.9	177.9	-141.2	0	0	116.3	K647 P769	K647-M756 PolarHBondContact NZ-SD 2.89Å; M756-P769 HydrophobicContact CE-CB 3.89Å; M756-P769 HydrophobicContact CE-CG 4.15Å; M756-P769 HydrophobicContact CG-CB 3.99Å; M756-P769 HydrophobicContact CG-CG 3.8Å; M756-P769 HydrophobicContact SD-CB 3.84Å; M756-P769 HydrophobicContact SD-CG 3.43Å; M756-P769 WeakPolarHBondContact SD-CG 3.19Å
757	N	48	Very low	35.8	Very low	50 Å²	50	100.3 Å²	100.3	27%	0.267	51%	0.514	S	S	.	.				58.3	125.4	79	-51.3	-29	0	0	0	112.4	K647 E648 H649	K647-N757 VanDerWaalsContact C-CG 3.49Å; K647-N757 HydrophobicContact CB-CB 4.13Å; K647-N757 HydrophobicContact CD-CB 4.23Å; K647-N757 HydrophobicContact CG-CB 3.18Å; K647-N757 VanDerWaalsContact O-CB 3.25Å; K647-N757 WeakPolarHBondContact O-CB 3.5Å; K647-N757 PolarHBondContact O-OD1 3.23Å; E648-N757 VanDerWaalsContact CA-CG 3.43Å; E648-N757 WeakPolarHBondContact CA-ND2 3.3Å; E648-N757 WeakPolarHBondContact CA-OD1 3.22Å; E648-N757 PolarHBondContact N-ND2 2.99Å; H649-N757 PolarHBondContact N-OD1 3.49Å
758	L	33.7	Very low	36.5	Very low	88 Å²	88	96.2 Å²	96.2	46%	0.461	50%	0.498	S	S	.	.				-145.3	122.6	73.3	-95.8	84.2	0	0	0	114.6	K647	K647-L758 HydrophobicContact CB-CG 4.39Å; K647-L758 HydrophobicContact CD-CD1 3.5Å; K647-L758 VanDerWaalsContact CD-CD1 3.5Å; K647-L758 HydrophobicContact CD-CG 4.17Å; K647-L758 VanDerWaalsContact CE-CD1 3.46Å; K647-L758 HydrophobicContact CG-CD1 3.67Å; K647-L758 HydrophobicContact CG-CG 3.9Å
759	N	42.3	Very low	37.1	Very low	28 Å²	28	90.4 Å²	90.4	15%	0.15	47%	0.468	C	S	.	.				79.6	172.6	125	-40.5	2.1	0	0	0	123.8	V645 S646 K647	V645-N759 PolarHBondContact N-ND2 2.91Å; V645-N759 WeakPolarHBondContact O-CB 3.44Å; V645-N759 VanDerWaalsContact O-CG 3.22Å; V645-N759 PolarHBondContact O-ND2 3.13Å; S646-N759 PolarHBondContact N-ND2 3.27Å; S646-N759 WeakPolarHBondContact O-CB 3.46Å; S646-N759 PolarHBondContact O-ND2 2.56Å; S646-N759 PolarHBondContact O-OD1 3.49Å; K647-N759 WeakPolarHBondContact CA-OD1 3.47Å; K647-N759 PolarHBondContact N-OD1 3.28Å
760	S	42.3	Very low	37.1	Very low	50 Å²	50	89.5 Å²	89.5	35%	0.35	47%	0.474	S	S	.	.			trans	91.3	145.5	176.1	79.1	0	0	0	0	114.2	H762 L763 T764	S760-H762 VanDerWaalsContact C-C 3.46Å; S760-H762 CarbonylContact C-O 3.38Å; S760-H762 WeakPolarHBondContact CA-O 3.29Å; S760-L763 CarbonylContact C-O 3.41Å; S760-L763 CarbonylContact O-C 3.48Å; S760-T764 PolarHBondContact O-N 2.91Å
761	L	35.4	Very low	37.5	Very low	117 Å²	117	88.2 Å²	88.2	61%	0.613	47%	0.473	S	S	*	.	S	Bend	cis	-54.8	-40.6	23.1	-177.3	155.6	0	0	0	121.2	R643 L763	R643-L761 PolarHBondContact NE-O 3.34Å; R643-L761 PolarHBondContact NH2-O 3.44Å; L761-L763 HydrophobicContact CB-CB 4.42Å; L761-L763 WeakPolarHBondContact CB-O 3.29Å; L761-L763 VanDerWaalsContact N-C 3.28Å; L761-L763 PolarHBondContact N-O 2.97Å
762	H	43.7	Very low	37.7	Very low	102 Å²	102	83.1 Å²	83.1	47%	0.472	46%	0.455	S	S	.	.	S	Bend	cis	25.3	-97.1	-16.3	-174	-140.4	0	0	0	119.3	S760 T764	S760-H762 VanDerWaalsContact C-C 3.46Å; S760-H762 CarbonylContact C-O 3.38Å; S760-H762 WeakPolarHBondContact CA-O 3.29Å; H762-T764 WeakPolarHBondContact O-CA 3.21Å; H762-T764 PolarHBondContact O-N 3.42Å; H762-T764 VanDerWaalsContact O-N 3.16Å
763	L	26.4	Very low	37.9	Very low	117 Å²	117	83.2 Å²	83.2	61%	0.613	46%	0.463	S	S	*	.	S	Bend	trans	-56.1	108.6	-172.3	-63.8	177.2	0	0	0	112.2	S760 L761	S760-L763 CarbonylContact C-O 3.41Å; S760-L763 CarbonylContact O-C 3.48Å; L761-L763 HydrophobicContact CB-CB 4.42Å; L761-L763 WeakPolarHBondContact CB-O 3.29Å; L761-L763 VanDerWaalsContact N-C 3.28Å; L761-L763 PolarHBondContact N-O 2.97Å
764	T	28	Very low	38.1	Very low	46 Å²	46	82.6 Å²	82.6	28%	0.282	48%	0.475	S	S	.	.	S	Bend	cis	-162.3	157.9	-9.1	17.7	0	0	0	0	107	K650 S760 H762	K650-T764 PolarHBondContact NZ-O 3.12Å; K650-T764 PolarHBondContact NZ-OG1 3.31Å; S760-T764 PolarHBondContact O-N 2.91Å; H762-T764 WeakPolarHBondContact O-CA 3.21Å; H762-T764 PolarHBondContact O-N 3.42Å; H762-T764 VanDerWaalsContact O-N 3.16Å
765	S	30.7	Very low	38.9	Very low	9 Å²	9	82.9 Å²	82.9	6%	0.063	48%	0.483	C	S	.	.			cis	70.2	-174.6	24.1	95.1	0	0	0	0	113.7	S646 E648	S646-S765 WeakPolarHBondContact CB-OG 3.38Å; S646-S765 WeakPolarHBondContact O-CB 3.29Å; S646-S765 WeakPolarHBondContact OG-CB 3.37Å; S646-S765 PolarHBondContact OG-OG 3.24Å; E648-S765 CarbonylContact O-C 3.52Å; E648-S765 VanDerWaalsContact O-C 3.28Å; E648-S765 VanDerWaalsContact O-CA 3.29Å; E648-S765 WeakPolarHBondContact O-CA 3.35Å
766	P	43.2	Very low	38.9	Very low	67 Å²	67	83 Å²	83	44%	0.435	49%	0.489	S	S	.	.			cis	-65.7	-165.2	7	-21.6	36.9	0	0	0	114.5	S646 K647 E648	S646-P766 CarbonylContact C-O 3.59Å; K647-P766 CarbonylContact C-O 3.59Å; K647-P766 WeakPolarHBondContact CA-O 3.46Å; K647-P766 PolarHBondContact N-O 3.03Å; E648-P766 VanDerWaalsContact CA-O 3.31Å; E648-P766 WeakPolarHBondContact CA-O 3.48Å; E648-P766 VanDerWaalsContact CB-O 3.25Å; E648-P766 WeakPolarHBondContact CB-O 3.43Å; E648-P766 PolarHBondContact N-O 3.37Å
767	P	43.2	Very low	39	Very low	62 Å²	62	82.8 Å²	82.8	40%	0.403	50%	0.496	S	S	.	.			trans	-92.4	172.2	151.2	22.8	-5.3	0	0	0	111.5	K647	K647-P767 HydrophobicContact CB-CB 3.99Å; K647-P767 VanDerWaalsContact N-CB 3.33Å
768	P	42.7	Very low	38.5	Very low	79 Å²	79	86.3 Å²	86.3	51%	0.513	52%	0.519	S	S	.	.			cis	-143.3	-179.9	-6	32.9	-8.8	0	0	0	116.9
769	P	42.6	Very low	38.6	Very low	17 Å²	17	87.9 Å²	87.9	11%	0.11	53%	0.533	C	S	.	.			trans	-93.3	178	153.4	39.1	-32.8	0	0	0	112	K647 L755 M756	K647-P769 VanDerWaalsContact CD-CD 3.44Å; K647-P769 HydrophobicContact CD-CG 3.76Å; K647-P769 HydrophobicContact CG-CG 4.36Å; L755-P769 HydrophobicContact CD2-CB 4.19Å; M756-P769 HydrophobicContact CE-CB 3.89Å; M756-P769 HydrophobicContact CE-CG 4.15Å; M756-P769 HydrophobicContact CG-CB 3.99Å; M756-P769 HydrophobicContact CG-CG 3.8Å; M756-P769 HydrophobicContact SD-CB 3.84Å; M756-P769 HydrophobicContact SD-CG 3.43Å; M756-P769 WeakPolarHBondContact SD-CG 3.19Å
770	L	37.8	Very low	38.1	Very low	159 Å²	159	92 Å²	92	83%	0.832	56%	0.559	S	S	*	*			trans	103.8	157.9	177.7	-63	159.5	0	0	0	114.1
771	P	37.1	Very low	37.5	Very low	110 Å²	110	95.8 Å²	95.8	71%	0.714	58%	0.58	S	S	*	*			cis	-130.5	170.6	-10.7	27.8	-5.7	0	0	0	116.3
772	P	46.9	Very low	37.2	Very low	72 Å²	72	96 Å²	96	47%	0.468	58%	0.58	S	S	.	*			trans	-99.7	165.2	173.1	39.5	-35.4	0	0	0	114.6	T278 V279	T278-P772 HydrophobicContact CG2-CB 4.04Å; V279-P772 HydrophobicContact CG1-CB 4.42Å
773	P	38.2	Very low	36.3	Very low	123 Å²	123	98.7 Å²	98.7	80%	0.799	59%	0.593	S	S	*	*				-156.6	-156.7	112.1	37.2	-14.6	0	0	0	114.3
774	P	35.9	Very low	36.2	Very low	118 Å²	118	100.3 Å²	100.3	77%	0.766	60%	0.598	S	S	*	*				-126.7	-179.3	-66.9	39	-21.8	0	0	0	115.7
775	P	42.8	Very low	36.1	Very low	115 Å²	115	105 Å²	105	75%	0.747	62%	0.62	S	S	*	*			trans	-129.2	-178.2	-166.8	45.3	-33.2	0	0	0	119.7
776	T	40.5	Very low	35.8	Very low	123 Å²	123	108.2 Å²	108.2	76%	0.755	65%	0.654	S	S	*	*			trans	-154.5	149.8	167.7	46.7	0	0	0	0	109.8
777	S	38.2	Very low	35.1	Very low	86 Å²	86	113.2 Å²	113.2	60%	0.601	67%	0.669	S	S	*	*			cis	93.6	133.5	17.2	74.9	0	0	0	0	116.1
778	T	36.9	Very low	34.3	Very low	124 Å²	124	120.5 Å²	120.5	76%	0.761	69%	0.688	S	S	*	*			cis	-179.7	159.8	-5.5	26.5	0	0	0	0	107.8
779	T	36.5	Very low	33.9	Very low	121 Å²	121	124.1 Å²	124.1	74%	0.742	70%	0.704	S	S	*	*			cis	-140	-111.2	-2.5	15.3	0	0	0	0	110.6
780	T	32.1	Very low	33.4	Very low	115 Å²	115	128.7 Å²	128.7	71%	0.706	73%	0.733	S	S	*	*			cis	-172.3	163.7	-4.7	-23	0	0	0	0	111.6
781	V	29.7	Very low	32.8	Very low	130 Å²	130	124.4 Å²	124.4	79%	0.788	72%	0.721	S	S	*	*			trans	71.9	138.5	161.7	157.4	0	0	0	0	117.4
782	I	27.3	Very low	32.2	Very low	121 Å²	121	125.8 Å²	125.8	62%	0.621	72%	0.716	S	S	*	*			cis	-165.3	150.3	-15.4	-137.8	169.5	0	0	0	111.3
783	E	24.6	Very low	31.4	Very low	158 Å²	158	129.1 Å²	129.1	74%	0.738	73%	0.729	S	S	*	*			trans	50.7	161.9	153.5	-70.8	162.6	175.1	0	0	122.2
784	E	24.7	Very low	31.1	Very low	152 Å²	152	130.3 Å²	130.3	71%	0.71	72%	0.724	S	S	*	*			cis	-151.9	159.8	-2	-131.4	-169.1	167.2	0	0	113.9
785	I	25.6	Very low	30.6	Very low	145 Å²	145	130.5 Å²	130.5	74%	0.744	73%	0.726	S	S	*	*			trans	39.4	126.3	153	-68.1	163	0	0	0	122.2
786	G	26.1	Very low	29.8	Very low	75 Å²	75	130.3 Å²	130.3	77%	0.773	72%	0.719	S	S	*	*			trans	-167	48.6	174.2	0	0	0	0	0	119.3
787	F	26.8	Very low	29.1	Very low	173 Å²	173	131.7 Å²	131.7	76%	0.759	72%	0.715	S	S	*	*			trans	66.1	104.2	164.1	-97.2	-114.8	0	0	0	122.4
788	R	26.6	Very low	28.6	Very low	215 Å²	215	132 Å²	132	81%	0.811	70%	0.704	S	S	*	*			trans	73	89.6	132.3	-62.9	-168.7	-177	-150.7	-1.2	123.5
789	N	35	Very low	28.4	Very low	155 Å²	155	128.8 Å²	128.8	83%	0.829	70%	0.695	S	S	*	*				-67.1	-168.8	128.2	-79.1	-48.8	0	0	0	110.6
790	P	32.6	Very low	28.3	Very low	112 Å²	112	129 Å²	129	73%	0.727	70%	0.696	S	S	*	*			cis	-156.2	177.2	18.1	47.8	-26.3	0	0	0	121.2
791	A	24.1	Very low	28.5	Very low	70 Å²	70	134.5 Å²	134.5	58%	0.579	70%	0.704	S	S	*	*			trans	52	-178.7	141	0	0	0	0	0	121.1
792	F	25	Very low	28.5	Very low	138 Å²	138	132.2 Å²	132.2	61%	0.605	70%	0.698	S	S	*	*			cis	-159.2	146.4	-7.9	-163.7	-116.7	0	0	0	112.1	E794	F792-E794 HydrophobicContact CE1-CG 3.78Å; F792-E794 WeakPolarHBondContact CE1-OE2 3.2Å; F792-E794 HydrophobicContact CZ-CG 3.73Å
793	L	30.2	Very low	28.7	Very low	142 Å²	142	133.9 Å²	133.9	74%	0.743	71%	0.707	S	S	*	*			trans	-175.9	174.7	139.2	-128.4	72.9	0	0	0	112.4
794	E	31.4	Very low	29.3	Very low	148 Å²	148	132.9 Å²	132.9	69%	0.692	71%	0.705	S	S	*	*			trans	-132.1	146.7	-165.9	-58.7	165.5	88.6	0	0	113.9	F792	F792-E794 HydrophobicContact CE1-CG 3.78Å; F792-E794 WeakPolarHBondContact CE1-OE2 3.2Å; F792-E794 HydrophobicContact CZ-CG 3.73Å
795	C	26.3	Very low	29.7	Very low	122 Å²	122	135.2 Å²	135.2	82%	0.824	71%	0.708	S	S	*	*				175.1	122.7	122.8	-91.2	0	0	0	0	117.6
796	D	24.9	Very low	30.2	Very low	111 Å²	111	139.5 Å²	139.5	59%	0.594	71%	0.714	S	S	*	*			trans	71.1	154.4	140	-124.4	-8.1	0	0	0	126.3	K882	D796-K882 PolarHBondContact O-NZ 3.47Å
797	K	26.8	Very low	30.4	Very low	152 Å²	152	139.6 Å²	139.6	66%	0.661	72%	0.715	S	S	*	*			trans	-56.3	131.4	-159.7	-49.4	126.6	-170.9	110.6	0	116.2
798	Y	27.3	Very low	30.6	Very low	94 Å²	94	135.7 Å²	135.7	37%	0.369	72%	0.715	S	S	.	*				-145.9	165.2	97.5	-82.6	-90	0	0	0	107.7	K882 G883 N884	Y798-K882 HydrophobicContact CD2-CB 3.33Å; Y798-K882 HydrophobicContact CD2-CD 3.9Å; Y798-K882 HydrophobicContact CD2-CG 3.5Å; Y798-K882 VanDerWaalsContact CD2-CG 3.5Å; Y798-K882 HydrophobicContact CE2-CB 3.8Å; Y798-K882 HydrophobicContact CE2-CG 4.41Å; Y798-K882 HydrophobicContact CG-CB 4.28Å; Y798-K882 HydrophobicContact CG-CG 4.2Å; Y798-G883 VanDerWaalsContact CZ-CA 3.47Å; Y798-G883 PolarHBondContact OH-O 3.05Å; Y798-N884 HydrophobicContact CE1-CB 3.96Å; Y798-N884 VanDerWaalsContact CE1-CG 3.44Å; Y798-N884 WeakPolarHBondContact CE1-ND2 3.34Å; Y798-N884 WeakPolarHBondContact OH-CB 3.4Å; Y798-N884 PolarHBondContact OH-ND2 3.2Å
799	G	32	Very low	30.7	Very low	56 Å²	56	129.1 Å²	129.1	58%	0.577	70%	0.699	S	S	*	*			cis	-151.7	8.8	-1.8	0	0	0	0	0	115.5
800	T	35.3	Very low	30.4	Very low	124 Å²	124	125.7 Å²	125.7	76%	0.761	69%	0.688	S	S	*	*			trans	69.9	156.3	-177.1	74.7	0	0	0	0	116.1
801	R	35.5	Very low	30.2	Very low	231 Å²	231	126.5 Å²	126.5	87%	0.872	69%	0.69	S	S	*	*	S	Bend	cis	-143.8	143.4	-0.6	-129.7	146	-168.1	168.1	2.7	109
802	A	31	Very low	30.7	Very low	82 Å²	82	129.3 Å²	129.3	68%	0.678	69%	0.691	S	S	*	*			cis	-141.4	137.1	11.3	0	0	0	0	0	112.8
803	I	31.3	Very low	31.2	Very low	157 Å²	157	127.2 Å²	127.2	81%	0.805	69%	0.691	S	S	*	*			trans	-88.5	118.8	149.9	-79	-177.1	0	0	0	107.7	R805	I803-R805 VanDerWaalsContact CG2-N 3.26Å
804	I	36	Very low	31.4	Very low	137 Å²	137	123.7 Å²	123.7	70%	0.703	68%	0.683	S	S	*	*			trans	-114.9	83	141.9	-58.5	-179	0	0	0	106.4
805	R	33.2	Very low	31.3	Very low	201 Å²	201	121.1 Å²	121.1	76%	0.758	67%	0.671	S	S	*	*	S	Bend	trans	66.1	159.4	171.2	-57.7	148.4	-173.6	161.8	-0.8	112.7	I803	I803-R805 VanDerWaalsContact CG2-N 3.26Å
806	R	37	Very low	31.7	Very low	234 Å²	234	120.8 Å²	120.8	88%	0.883	66%	0.655	S	S	*	*			cis	-137.2	147.8	-21.8	-93.8	142.2	172.2	175	-6.3	103.3
807	G	30.6	Very low	32	Very low	77 Å²	77	118.5 Å²	118.5	79%	0.794	64%	0.643	S	S	*	*			cis	93.9	143.7	44.4	0	0	0	0	0	109.7
808	A	30.2	Very low	32.2	Very low	92 Å²	92	117.7 Å²	117.7	76%	0.76	65%	0.646	S	S	*	*			cis	-174	165	-1.7	0	0	0	0	0	106.9
809	T	29.3	Very low	32.5	Very low	76 Å²	76	116.2 Å²	116.2	47%	0.466	66%	0.66	S	S	.	*			cis	-179.8	152.5	-6.7	26.4	0	0	0	0	105.3
810	S	28.1	Very low	32.7	Very low	84 Å²	84	120.4 Å²	120.4	59%	0.587	67%	0.669	S	S	*	*			cis	-145.7	-147.6	-10.8	-132.1	0	0	0	0	106.4
811	V	29.4	Very low	32.6	Very low	129 Å²	129	121.4 Å²	121.4	78%	0.782	67%	0.669	S	S	*	*			cis	-142.8	138.9	8.9	-157.9	0	0	0	0	105.1
812	E	33.5	Very low	32.6	Very low	129 Å²	129	118 Å²	118	60%	0.603	67%	0.669	S	S	*	*			cis	81.1	150.4	41.8	-90.4	-162.8	171.2	0	0	116.6	Y879	E812-Y879 WeakPolarHBondContact CG-OH 3.35Å
813	P	37	Very low	32.6	Very low	93 Å²	93	120.6 Å²	120.6	60%	0.604	67%	0.671	S	S	*	*			cis	-138.4	-170.4	-16.9	36.8	-17.1	0	0	0	115.1
814	A	32.9	Very low	32.6	Very low	68 Å²	68	118.4 Å²	118.4	56%	0.562	66%	0.661	S	S	*	*			trans	92.3	144.2	145.5	0	0	0	0	0	120.4
815	E	30.6	Very low	32.4	Very low	95 Å²	95	118.4 Å²	118.4	44%	0.444	66%	0.663	S	S	.	*			cis	-163.4	160	-41.8	-126.9	-172	-170.8	0	0	110.1	N880 K882	E815-N880 CarbonylContact C-O 3.4Å; E815-N880 VanDerWaalsContact CA-O 3.25Å; E815-N880 WeakPolarHBondContact CA-O 3.4Å; E815-K882 WeakPolarHBondContact OE1-CD 3.48Å
816	K	33.9	Very low	32.5	Very low	114 Å²	114	114.6 Å²	114.6	50%	0.496	66%	0.657	S	S	.	*			trans	84.5	115.6	159.3	-74.2	165.2	171.6	44.1	0	119.8	N880 D881 K882	K816-N880 PolarHBondContact N-O 3.28Å; K816-D881 VanDerWaalsContact CG-O 3.26Å; K816-D881 WeakPolarHBondContact CG-O 3.27Å; K816-D881 PolarHBondContact NZ-O 2.93Å; K816-K882 WeakPolarHBondContact CE-O 2.89Å; K816-K882 PolarHBondContact NZ-O 3.28Å
817	N	30.4	Very low	32.2	Very low	64 Å²	64	107.6 Å²	107.6	34%	0.342	64%	0.637	S	S	.	*				50	149	92.4	-69.6	40.2	0	0	0	118.9	D881 K882 G883	N817-D881 WeakPolarHBondContact OD1-CA 3.39Å; N817-D881 PolarHBondContact OD1-O 3.25Å; N817-K882 PolarHBondContact ND2-N 3.03Å; N817-K882 PolarHBondContact OD1-N 2.87Å; N817-K882 VanDerWaalsContact OD1-N 3.11Å; N817-G883 PolarHBondContact ND2-N 3.15Å
818	D	31.4	Very low	32.4	Very low	134 Å²	134	112.8 Å²	112.8	72%	0.717	63%	0.634	S	S	*	*			cis	-153.6	171.3	5.8	-115	-31.1	0	0	0	110.1
819	G	34.8	Very low	32.6	Very low	64 Å²	64	112.2 Å²	112.2	66%	0.66	62%	0.618	S	S	*	*			trans	95.2	163.9	142.4	0	0	0	0	0	119.4
820	D	34.7	Very low	32.9	Very low	144 Å²	144	114.9 Å²	114.9	77%	0.77	63%	0.634	S	S	*	*	S	Bend	trans	-2.9	123.2	174.3	-63.9	68.3	0	0	0	119.3
821	N	34	Very low	33.2	Very low	144 Å²	144	113.2 Å²	113.2	77%	0.77	62%	0.619	S	S	*	*			cis	-151.9	171.9	-7	-89.4	-53.9	0	0	0	109.8
822	D	34.5	Very low	33.7	Very low	161 Å²	161	112 Å²	112	86%	0.861	61%	0.608	S	S	*	*			trans	-97.4	-18.4	-158.3	-141.4	30.4	0	0	0	116.8
823	D	32.3	Very low	34	Very low	135 Å²	135	111.6 Å²	111.6	72%	0.722	60%	0.601	S	S	*	*	S	Bend	trans	-144.4	152.9	-178.7	-79	-65.6	0	0	0	110.4
824	D	31.1	Very low	34.1	Very low	112 Å²	112	109.5 Å²	109.5	60%	0.599	58%	0.583	S	S	*	*				-141.7	-16.2	-57.4	-166.7	-119.2	0	0	0	111.8	R1455	D824-R1455 IonicContact OD1-NH1 3.89Å; D824-R1455 IonicContact OD2-CZ 2.65Å; D824-R1455 IonicContact OD2-NH1 3.21Å; D824-R1455 PolarHBondContact OD2-NH1 3.37Å
825	D	32.3	Very low	34.5	Very low	137 Å²	137	108.3 Å²	108.3	73%	0.733	57%	0.567	S	S	*	*			cis	-79.4	154.4	-10.4	-74.7	-72.5	0	0	0	114.8	D827	D825-D827 VanDerWaalsContact C-N 3.26Å; D825-D827 HydrophobicContact CB-CB 4.18Å; D825-D827 PolarHBondContact O-N 3.3Å
826	N	34.1	Very low	35.3	Very low	120 Å²	120	105.3 Å²	105.3	64%	0.642	55%	0.553	S	S	*	*			trans	-72.4	83.4	150.1	-59.1	-60.5	0	0	0	108.6
827	D	31.2	Very low	35.7	Very low	87 Å²	87	102.4 Å²	102.4	47%	0.465	54%	0.543	S	S	.	.			trans	-153.5	108.6	167.5	-115.5	2.2	0	0	0	110.2	D825	D825-D827 VanDerWaalsContact C-N 3.26Å; D825-D827 HydrophobicContact CB-CB 4.18Å; D825-D827 PolarHBondContact O-N 3.3Å
828	Y	35.5	Very low	36.3	Very low	186 Å²	186	104.2 Å²	104.2	73%	0.729	55%	0.552	S	S	*	*			cis	-113.2	125.1	3.7	-73.6	-88.8	0	0	0	107.9
829	D	33.3	Very low	36.9	Very low	81 Å²	81	101.9 Å²	101.9	43%	0.433	54%	0.54	S	S	.	.			cis	41.4	50	43.6	-96.6	18.2	0	0	0	110.4
830	V	35.2	Very low	37.2	Very low	132 Å²	132	105.4 Å²	105.4	80%	0.8	54%	0.544	S	S	*	.				-92.9	74.5	124.3	-169.6	0	0	0	0	105
831	D	35.7	Very low	37.1	Very low	49 Å²	49	106.3 Å²	106.3	26%	0.262	54%	0.544	S	S	.	.				67.6	113.4	87.7	-69.7	-59.5	0	0	0	110.4	R833	D831-R833 HydrophobicContact CB-CG 4Å; D831-R833 WeakPolarHBondContact OD1-CG 3.39Å; D831-R833 IonicContact OD1-CZ 3.39Å; D831-R833 IonicContact OD1-NE 3.32Å; D831-R833 PolarHBondContact OD1-NE 3.41Å; D831-R833 IonicContact OD1-NH2 2.69Å; D831-R833 IonicContact OD2-CZ 3.68Å; D831-R833 VanDerWaalsContact OD2-CZ 3.27Å; D831-R833 IonicContact OD2-NE 3.64Å; D831-R833 PolarHBondContact OD2-NE 2.93Å; D831-R833 IonicContact OD2-NH2 2.86Å; D831-R833 PolarHBondContact OD2-NH2 3.15Å
832	D	39.6	Very low	37	Very low	103 Å²	103	105.6 Å²	105.6	55%	0.551	54%	0.538	S	S	*	.				-163.2	128	84.7	-83.6	-37.8	0	0	0	109.7
833	R	39.2	Very low	36.7	Very low	121 Å²	121	109 Å²	109	46%	0.457	54%	0.541	S	S	.	.			cis	159.4	175.1	-8.3	-122.6	-168.7	-150.2	128.5	-1.5	108.6	D831 N853 R855	D831-R833 HydrophobicContact CB-CG 4Å; D831-R833 WeakPolarHBondContact OD1-CG 3.39Å; D831-R833 IonicContact OD1-CZ 3.39Å; D831-R833 IonicContact OD1-NE 3.32Å; D831-R833 PolarHBondContact OD1-NE 3.41Å; D831-R833 IonicContact OD1-NH2 2.69Å; D831-R833 IonicContact OD2-CZ 3.68Å; D831-R833 VanDerWaalsContact OD2-CZ 3.27Å; D831-R833 IonicContact OD2-NE 3.64Å; D831-R833 PolarHBondContact OD2-NE 2.93Å; D831-R833 IonicContact OD2-NH2 2.86Å; D831-R833 PolarHBondContact OD2-NH2 3.15Å; R833-N853 PolarHBondContact O-ND2 2.64Å; R833-R855 PolarHBondContact O-NH2 3.16Å
834	E	39	Very low	36.6	Very low	49 Å²	49	105.8 Å²	105.8	23%	0.229	54%	0.539	C	S	.	.			trans	45.7	157.6	150	-33	122.4	155.4	0	0	120.9	M852 N853 S896	E834-M852 WeakPolarHBondContact CB-O 3.31Å; E834-N853 VanDerWaalsContact CB-ND2 3.29Å; E834-N853 WeakPolarHBondContact CB-ND2 3.48Å; E834-N853 PolarHBondContact O-ND2 3.05Å; E834-N853 PolarHBondContact O-OD1 3.03Å; E834-N853 VanDerWaalsContact OE2-CA 3.31Å; E834-N853 WeakPolarHBondContact OE2-CA 3.42Å; E834-N853 PolarHBondContact OE2-ND2 2.86Å; E834-S896 CarbonylContact C-O 3.01Å
835	D	41.3	Very low	36.6	Very low	43 Å²	43	105.6 Å²	105.6	23%	0.23	55%	0.547	C	S	.	.			cis	-172.1	178.7	-22.3	-96.6	-14	0	0	0	114.9	L894 S896	D835-L894 HydrophobicContact CB-CB 4.05Å; D835-L894 HydrophobicContact CB-CD2 3.51Å; D835-L894 HydrophobicContact CB-CG 4.22Å; D835-L894 WeakPolarHBondContact OD1-CB 3.25Å; D835-L894 WeakPolarHBondContact OD1-CD2 3.37Å; D835-L894 WeakPolarHBondContact OD1-CG 3.2Å; D835-S896 CarbonylContact C-O 3.5Å; D835-S896 VanDerWaalsContact C-O 3.25Å; D835-S896 VanDerWaalsContact CA-O 3.27Å; D835-S896 WeakPolarHBondContact CA-O 3.38Å; D835-S896 PolarHBondContact N-O 3.48Å; D835-S896 CarbonylContact O-C 3.52Å; D835-S896 VanDerWaalsContact O-CA 3.31Å; D835-S896 WeakPolarHBondContact O-CA 3.43Å; D835-S896 WeakPolarHBondContact O-CB 3.21Å; D835-S896 PolarHBondContact O-N 3.37Å
836	H	46.7	Very low	36.8	Very low	31 Å²	31	106 Å²	106	14%	0.144	55%	0.549	C	S	.	.			trans	81.1	149.9	156.4	-87.9	-84	0	0	0	120.6	T851 H893 L894 G895 S896	H836-T851 WeakPolarHBondContact CD2-CB 2.95Å; H836-T851 PolarHBondContact CD2-OG1 3.32Å; H836-T851 PolarHBondContact CE1-OG1 2.73Å; H836-T851 PolarHBondContact ND1-OG1 2.93Å; H836-T851 VanDerWaalsContact NE2-CB 3.33Å; H836-T851 WeakPolarHBondContact NE2-CB 3.3Å; H836-T851 PolarHBondContact NE2-OG1 3.44Å; H836-T851 VanDerWaalsContact NE2-OG1 3.17Å; H836-H893 AromaticContact ND1-ND1 3.72Å; H836-L894 HydrophobicContact CB-CD2 4.31Å; H836-L894 VanDerWaalsContact CD2-CD2 3.4Å; H836-L894 WeakPolarHBondContact CD2-CD2 3.42Å; H836-L894 VanDerWaalsContact N-CB 3.34Å; H836-G895 CarbonylContact O-C 3.54Å; H836-G895 VanDerWaalsContact O-CA 3.26Å; H836-G895 WeakPolarHBondContact O-CA 3.46Å; H836-S896 WeakPolarHBondContact O-CB 3.31Å; H836-S896 PolarHBondContact O-N 2.88Å
837	D	43.4	Very low	37.2	Very low	54 Å²	54	107.6 Å²	107.6	29%	0.289	55%	0.554	S	S	.	*			cis	-122.7	-154.8	4.2	-77	-67.1	0	0	0	111.2	H893	D837-H893 WeakPolarHBondContact CA-ND1 3.19Å; D837-H893 WeakPolarHBondContact O-CA 3.41Å; D837-H893 PolarHBondContact O-N 2.76Å
838	D	42.9	Very low	37.6	Very low	101 Å²	101	110.4 Å²	110.4	54%	0.54	57%	0.569	S	S	.	*			cis	-163.7	-174	4.2	-148.1	-27.7	0	0	0	112.1	S892 H893	D838-S892 WeakPolarHBondContact O-CB 3.12Å; D838-H893 WeakPolarHBondContact CA-CE1 3.46Å; D838-H893 PolarHBondContact N-CE1 2.78Å; D838-H893 VanDerWaalsContact N-CE1 3.29Å; D838-H893 PolarHBondContact N-ND1 2.81Å
839	D	43.5	Very low	37.9	Very low	85 Å²	85	104.2 Å²	104.2	46%	0.455	56%	0.562	S	S	.	*			trans	102.9	72.1	161.1	-101.9	-13.9	0	0	0	123.2
840	N	40.9	Very low	37.8	Very low	138 Å²	138	107.7 Å²	107.7	74%	0.738	57%	0.574	S	S	*	*			trans	78.4	165.5	150.2	-45.6	-77	0	0	0	119.2
841	E	34.3	Very low	37.5	Very low	164 Å²	164	103.7 Å²	103.7	77%	0.766	55%	0.549	S	S	*	.			cis	-159.5	174.2	-6.7	-130.4	-73.3	80.2	0	0	112.2
842	I	30.2	Very low	37.2	Very low	128 Å²	128	107.1 Å²	107.1	66%	0.656	57%	0.565	S	S	*	*	S	Bend	trans	65.6	106.7	170.9	-56.9	-172.6	0	0	0	118.2
843	Y	29	Very low	36.6	Very low	233 Å²	233	104 Å²	104	91%	0.914	55%	0.549	S	S	*	.	S	Bend	trans	56.8	107.3	165.4	-91.8	-74.9	0	0	0	118
844	G	29.3	Very low	36.4	Very low	67 Å²	67	101.7 Å²	101.7	69%	0.691	55%	0.551	S	S	*	*			trans	-178.6	-5.2	169	0	0	0	0	0	119.6
845	S	31.3	Very low	36	Very low	108 Å²	108	102.4 Å²	102.4	76%	0.755	55%	0.552	S	S	*	*			trans	61	108.9	-172.9	61.6	0	0	0	0	116.3
846	N	37.1	Very low	35.4	Very low	146 Å²	146	104 Å²	104	78%	0.781	56%	0.56	S	S	*	*				44.4	130.4	115.6	-61.9	-4.4	0	0	0	119.2
847	M	43.2	Very low	34.5	Very low	153 Å²	153	106.4 Å²	106.4	75%	0.754	58%	0.578	S	S	*	*			cis	-174	171.7	-8.5	-134.5	-178.4	-170.8	0	0	108.9
848	N	39.1	Very low	33.7	Very low	146 Å²	146	113.6 Å²	113.6	78%	0.781	60%	0.601	S	S	*	*			trans	74.3	71.1	160.5	-50.6	-37.5	0	0	0	118.9
849	G	41.7	Very low	33.1	Very low	56 Å²	56	114.5 Å²	114.5	58%	0.577	62%	0.615	S	S	*	*				93	130	106.2	0	0	0	0	0	120
850	F	31.5	Very low	32.2	Very low	154 Å²	154	115.7 Å²	115.7	68%	0.675	63%	0.63	S	S	*	*			trans	55.3	70	174.6	-60.2	-77.8	0	0	0	112.9
851	T	29.8	Very low	31.5	Very low	48 Å²	48	115.1 Å²	115.1	29%	0.294	63%	0.632	S	S	.	*			trans	-85.6	170.8	-164	6.3	0	0	0	0	114.8	H836	H836-T851 WeakPolarHBondContact CD2-CB 2.95Å; H836-T851 PolarHBondContact CD2-OG1 3.32Å; H836-T851 PolarHBondContact CE1-OG1 2.73Å; H836-T851 PolarHBondContact ND1-OG1 2.93Å; H836-T851 VanDerWaalsContact NE2-CB 3.33Å; H836-T851 WeakPolarHBondContact NE2-CB 3.3Å; H836-T851 PolarHBondContact NE2-OG1 3.44Å; H836-T851 VanDerWaalsContact NE2-OG1 3.17Å
852	M	28.8	Very low	31.2	Very low	121 Å²	121	113.7 Å²	113.7	60%	0.596	64%	0.635	S	S	*	*			trans	44.3	79.3	166.2	-47.9	-41.6	175	0	0	119.7	E834	E834-M852 WeakPolarHBondContact CB-O 3.31Å
853	N	27.1	Very low	30.9	Very low	37 Å²	37	112.5 Å²	112.5	20%	0.198	63%	0.628	C	S	.	*			trans	-151.1	125.6	158.4	-83.2	121.8	0	0	0	112.4	R833 E834 R855	R833-N853 PolarHBondContact O-ND2 2.64Å; E834-N853 VanDerWaalsContact CB-ND2 3.29Å; E834-N853 WeakPolarHBondContact CB-ND2 3.48Å; E834-N853 PolarHBondContact O-ND2 3.05Å; E834-N853 PolarHBondContact O-OD1 3.03Å; E834-N853 VanDerWaalsContact OE2-CA 3.31Å; E834-N853 WeakPolarHBondContact OE2-CA 3.42Å; E834-N853 PolarHBondContact OE2-ND2 2.86Å; N853-R855 PolarHBondContact ND2-NH1 2.98Å; N853-R855 PolarHBondContact ND2-NH2 3.21Å
854	S	34.9	Very low	30.7	Very low	73 Å²	73	105 Å²	105	51%	0.51	61%	0.606	S	S	.	*			trans	-163.5	111.5	179.9	48	0	0	0	0	113.9	T903	S854-T903 WeakPolarHBondContact CB-O 3.13Å
855	R	30.1	Very low	30.6	Very low	65 Å²	65	105.7 Å²	105.7	25%	0.245	60%	0.597	C	S	.	*			cis	84.7	164.2	9.8	-48.6	-177.7	177	156.3	10.4	116.3	R833 N853 I899 R900 G902 T903 I904	R833-R855 PolarHBondContact O-NH2 3.16Å; N853-R855 PolarHBondContact ND2-NH1 2.98Å; N853-R855 PolarHBondContact ND2-NH2 3.21Å; R855-I899 PolarHBondContact NH1-O 3.14Å; R855-R900 WeakPolarHBondContact CD-O 3.36Å; R855-G902 CarbonylContact C-O 3.53Å; R855-T903 CarbonylContact O-C 3.14Å; R855-I904 PolarHBondContact O-N 2.65Å
856	L	27.9	Very low	30.3	Very low	75 Å²	75	103.4 Å²	103.4	39%	0.393	58%	0.579	S	S	.	*			trans	57.5	160.3	-159.5	-115.2	82.1	0	0	0	115.3	D901 G902 I904	L856-D901 VanDerWaalsContact CD1-O 3.3Å; L856-D901 WeakPolarHBondContact CD1-O 3.45Å; L856-G902 VanDerWaalsContact CB-O 3.22Å; L856-G902 WeakPolarHBondContact CB-O 3.08Å; L856-G902 VanDerWaalsContact CD1-O 3.23Å; L856-G902 WeakPolarHBondContact CD1-O 3.47Å; L856-G902 PolarHBondContact N-O 2.95Å; L856-I904 HydrophobicContact CB-CB 4.16Å; L856-I904 HydrophobicContact CB-CG1 4.16Å; L856-I904 HydrophobicContact CD2-CB 4.1Å; L856-I904 HydrophobicContact CD2-CD1 3.81Å; L856-I904 HydrophobicContact CD2-CG1 3.9Å
857	P	28.9	Very low	29.9	Very low	82 Å²	82	99 Å²	99	53%	0.532	56%	0.559	S	S	.	*			cis	-123.7	132.6	-20.9	33.4	-17	0	0	0	115	I904	P857-I904 HydrophobicContact CG-CD1 4.37Å; P857-I904 HydrophobicContact CG-CG1 4.1Å
858	R	27	Very low	29.2	Very low	206 Å²	206	94.6 Å²	94.6	78%	0.777	55%	0.553	S	S	*	*			trans	19.1	107.8	131.7	-63.2	174.5	171.8	142.7	3.9	118.5	D901	R858-D901 IonicContact NH2-OD1 3.77Å
859	S	29.2	Very low	28.5	Very low	119 Å²	119	91.8 Å²	91.8	83%	0.832	54%	0.535	S	S	*	.			trans	-162.5	88	141.9	-85.6	0	0	0	0	114.1
860	S	24.7	Very low	27.9	Very low	110 Å²	110	94.1 Å²	94.1	77%	0.769	54%	0.54	S	S	*	.			trans	25.9	115.4	151.4	56.9	0	0	0	0	121.6
861	T	25.9	Very low	27.6	Very low	127 Å²	127	92.1 Å²	92.1	78%	0.779	54%	0.536	S	S	*	.				171.8	162.5	114.2	-69.4	0	0	0	0	111.9
862	T	28.5	Very low	27.4	Very low	133 Å²	133	95.2 Å²	95.2	82%	0.816	55%	0.549	S	S	*	.			trans	80.1	164.6	168	10	0	0	0	0	118.9
863	M	23.4	Very low	27.2	Very low	104 Å²	104	94.2 Å²	94.2	51%	0.512	55%	0.554	S	S	.	*			trans	-150.5	143	-149	-64.3	-158.2	66	0	0	118.6	L738	L738-M863 HydrophobicContact CD2-CE 3.98Å; L738-M863 HydrophobicContact CG-CE 4.12Å
864	T	25.9	Very low	27.1	Very low	75 Å²	75	97.1 Å²	97.1	46%	0.46	58%	0.577	S	S	.	*			trans	70.1	111.2	141.4	50.7	0	0	0	0	125
865	T	25.9	Very low	26.6	Very low	81 Å²	81	100.1 Å²	100.1	50%	0.497	59%	0.587	S	S	.	*			trans	60.5	156.3	130.7	67.6	0	0	0	0	120.4
866	V	25.5	Very low	26.4	Very low	61 Å²	61	103.6 Å²	103.6	37%	0.37	62%	0.616	S	S	.	*			cis	-149.8	152.3	20.6	-166	0	0	0	0	110.6	L641	L641-V866 HydrophobicContact CB-CG1 4.31Å
867	S	28.5	Very low	26.3	Very low	53 Å²	53	105.7 Å²	105.7	37%	0.371	63%	0.627	S	S	.	*			trans	31.6	149.5	158.5	-65.1	0	0	0	0	123.4	L641	L641-S867 WeakPolarHBondContact CD2-OG 3.15Å
868	G	28.3	Very low	26.2	Very low	60 Å²	60	110.8 Å²	110.8	62%	0.619	64%	0.635	S	S	*	*			cis	97.6	86.7	-11	0	0	0	0	0	117.6
869	E	26	Very low	26.1	Very low	88 Å²	88	107.4 Å²	107.4	41%	0.411	62%	0.623	S	S	.	*			trans	-169.1	138.1	145.4	-137.8	178.9	-145.3	0	0	109.9	V744	V744-E869 VanDerWaalsContact CA-OE1 3.27Å; V744-E869 WeakPolarHBondContact CA-OE1 3.44Å; V744-E869 HydrophobicContact CG2-CG 4.34Å
870	P	28.6	Very low	26.1	Very low	104 Å²	104	106.1 Å²	106.1	68%	0.675	61%	0.607	S	S	*	*			trans	-98.1	142	-174.2	36.1	-32.7	0	0	0	113.7
871	L	25.4	Very low	26.6	Very low	113 Å²	113	103.4 Å²	103.4	59%	0.592	58%	0.584	S	S	*	*			trans	-138.1	104.6	169	-75.6	178.2	0	0	0	111.6	Y634 F746	Y634-L871 HydrophobicContact CE2-CD1 3.79Å; F746-L871 HydrophobicContact CZ-CD2 3.88Å
872	I	24.5	Very low	27	Very low	113 Å²	113	99.8 Å²	99.8	58%	0.579	56%	0.558	S	S	*	*			trans	-104.4	117.2	165.4	-63.3	168.4	0	0	0	107.5
873	S	24.2	Very low	27.3	Very low	99 Å²	99	95.1 Å²	95.1	69%	0.692	54%	0.536	S	S	*	.			trans	168.5	139.5	158.1	-82.1	0	0	0	0	108.2
874	S	25.4	Very low	27.8	Very low	99 Å²	99	96.5 Å²	96.5	69%	0.692	55%	0.546	S	S	*	.			cis	51.8	73.8	-4.9	71.2	0	0	0	0	116.7
875	N	25.7	Very low	28.2	Very low	135 Å²	135	98.5 Å²	98.5	72%	0.722	56%	0.558	S	S	*	*			trans	-171.1	136	137.4	-97.4	-24.2	0	0	0	114.5
876	V	25.6	Very low	28.4	Very low	139 Å²	139	103.4 Å²	103.4	84%	0.842	58%	0.577	S	S	*	*			trans	-121.8	97.2	147.8	176	0	0	0	0	103.3
877	L	25.7	Very low	29.1	Very low	118 Å²	118	103.4 Å²	103.4	62%	0.618	59%	0.59	S	S	*	*				71.1	129.2	73.8	-67.9	164.1	0	0	0	112.9
878	R	25.5	Very low	29.9	Very low	189 Å²	189	107.6 Å²	107.6	71%	0.713	61%	0.613	S	S	*	*			cis	-167.8	142.3	0.7	172	-174.4	-73.3	167.8	-2.5	114.4	N880	R878-N880 WeakPolarHBondContact CG-OD1 3.3Å
879	Y	25.8	Very low	30.3	Very low	135 Å²	135	109.4 Å²	109.4	53%	0.529	62%	0.616	S	S	.	*			trans	-167.8	156.1	141.1	-105.4	-83.8	0	0	0	107.4	E812	E812-Y879 WeakPolarHBondContact CG-OH 3.35Å
880	N	29.6	Very low	30.5	Very low	92 Å²	92	108.8 Å²	108.8	49%	0.492	62%	0.619	S	S	.	*			cis	85.4	141.4	9.3	-60.1	110.1	0	0	0	116.1	E815 K816 R878	E815-N880 CarbonylContact C-O 3.4Å; E815-N880 VanDerWaalsContact CA-O 3.25Å; E815-N880 WeakPolarHBondContact CA-O 3.4Å; K816-N880 PolarHBondContact N-O 3.28Å; R878-N880 WeakPolarHBondContact CG-OD1 3.3Å
881	D	35.7	Very low	30.6	Very low	54 Å²	54	109.8 Å²	109.8	29%	0.289	62%	0.622	S	S	.	*			cis	-163.8	-179.6	-4.4	173.5	32.2	0	0	0	110.7	K816 N817	K816-D881 VanDerWaalsContact CG-O 3.26Å; K816-D881 WeakPolarHBondContact CG-O 3.27Å; K816-D881 PolarHBondContact NZ-O 2.93Å; N817-D881 WeakPolarHBondContact OD1-CA 3.39Å; N817-D881 PolarHBondContact OD1-O 3.25Å
882	K	33.6	Very low	30.8	Very low	51 Å²	51	106.8 Å²	106.8	22%	0.222	61%	0.611	C	S	.	*			trans	82.5	116.2	156.7	-45.6	-165.6	-178.3	168.1	0	121.4	D796 Y798 E815 K816 N817	D796-K882 PolarHBondContact O-NZ 3.47Å; Y798-K882 HydrophobicContact CD2-CB 3.33Å; Y798-K882 HydrophobicContact CD2-CD 3.9Å; Y798-K882 HydrophobicContact CD2-CG 3.5Å; Y798-K882 VanDerWaalsContact CD2-CG 3.5Å; Y798-K882 HydrophobicContact CE2-CB 3.8Å; Y798-K882 HydrophobicContact CE2-CG 4.41Å; Y798-K882 HydrophobicContact CG-CB 4.28Å; Y798-K882 HydrophobicContact CG-CG 4.2Å; E815-K882 WeakPolarHBondContact OE1-CD 3.48Å; K816-K882 WeakPolarHBondContact CE-O 2.89Å; K816-K882 PolarHBondContact NZ-O 3.28Å; N817-K882 PolarHBondContact ND2-N 3.03Å; N817-K882 PolarHBondContact OD1-N 2.87Å; N817-K882 VanDerWaalsContact OD1-N 3.11Å
883	G	34.4	Very low	31.3	Very low	35 Å²	35	105.4 Å²	105.4	36%	0.361	60%	0.602	S	S	.	*			cis	156.6	168.7	-10.4	0	0	0	0	0	117.3	Y798 N817	Y798-G883 VanDerWaalsContact CZ-CA 3.47Å; Y798-G883 PolarHBondContact OH-O 3.05Å; N817-G883 PolarHBondContact ND2-N 3.15Å
884	N	33.5	Very low	31.9	Very low	133 Å²	133	105.1 Å²	105.1	71%	0.711	59%	0.592	S	S	*	*			trans	65.9	148.5	179.7	-82.9	-30.3	0	0	0	118.5	Y798	Y798-N884 HydrophobicContact CE1-CB 3.96Å; Y798-N884 VanDerWaalsContact CE1-CG 3.44Å; Y798-N884 WeakPolarHBondContact CE1-ND2 3.34Å; Y798-N884 WeakPolarHBondContact OH-CB 3.4Å; Y798-N884 PolarHBondContact OH-ND2 3.2Å
885	T	35.6	Very low	32.2	Very low	117 Å²	117	103.4 Å²	103.4	72%	0.718	59%	0.59	S	S	*	*			cis	-159.2	170.6	37.2	-35	0	0	0	0	111.8
886	M	28.7	Very low	32.4	Very low	184 Å²	184	99.6 Å²	99.6	91%	0.906	57%	0.574	S	S	*	*			trans	23.6	127.4	160.7	-78.2	173.1	178.3	0	0	120.1
887	G	42.2	Very low	32.6	Very low	61 Å²	61	95.7 Å²	95.7	63%	0.629	55%	0.553	S	S	*	*			cis	113.4	144.2	-0.4	0	0	0	0	0	114.5
888	T	43.2	Very low	32.5	Very low	141 Å²	141	99.8 Å²	99.8	87%	0.865	56%	0.56	S	S	*	*			trans	65.2	171.6	-172	68.1	0	0	0	0	114.9
889	S	37.1	Very low	32.7	Very low	98 Å²	98	96.9 Å²	96.9	69%	0.685	56%	0.557	S	S	*	*			trans	64.8	166.7	-173.7	-68	0	0	0	0	111.5
890	T	29.9	Very low	33	Very low	75 Å²	75	98.4 Å²	98.4	46%	0.46	56%	0.562	S	S	.	*			cis	60	158.4	30.9	81.2	0	0	0	0	110.9
891	V	30.6	Very low	32.8	Very low	124 Å²	124	99.2 Å²	99.2	75%	0.752	57%	0.567	S	S	*	*	S	Bend	cis	-94.8	124.9	-6	172.4	0	0	0	0	107.7
892	S	31	Very low	32.5	Very low	50 Å²	50	97.3 Å²	97.3	35%	0.35	56%	0.56	S	S	.	*			cis	-178	171.9	-3.8	44.1	0	0	0	0	106.3	D838	D838-S892 WeakPolarHBondContact O-CB 3.12Å
893	H	34.8	Very low	32.1	Very low	85 Å²	85	99.8 Å²	99.8	39%	0.394	58%	0.579	S	S	.	*			trans	54.9	107.9	161.1	-61.4	-70.8	0	0	0	114.4	H836 D837 D838	H836-H893 AromaticContact ND1-ND1 3.72Å; D837-H893 WeakPolarHBondContact CA-ND1 3.19Å; D837-H893 WeakPolarHBondContact O-CA 3.41Å; D837-H893 PolarHBondContact O-N 2.76Å; D838-H893 WeakPolarHBondContact CA-CE1 3.46Å; D838-H893 PolarHBondContact N-CE1 2.78Å; D838-H893 VanDerWaalsContact N-CE1 3.29Å; D838-H893 PolarHBondContact N-ND1 2.81Å
894	L	36.1	Very low	31.7	Very low	93 Å²	93	101.5 Å²	101.5	49%	0.487	58%	0.579	S	S	.	*			cis	-165.2	142.9	31.4	-52.9	105.3	0	0	0	106.5	D835 H836	D835-L894 HydrophobicContact CB-CB 4.05Å; D835-L894 HydrophobicContact CB-CD2 3.51Å; D835-L894 HydrophobicContact CB-CG 4.22Å; D835-L894 WeakPolarHBondContact OD1-CB 3.25Å; D835-L894 WeakPolarHBondContact OD1-CD2 3.37Å; D835-L894 WeakPolarHBondContact OD1-CG 3.2Å; H836-L894 HydrophobicContact CB-CD2 4.31Å; H836-L894 VanDerWaalsContact CD2-CD2 3.4Å; H836-L894 WeakPolarHBondContact CD2-CD2 3.42Å; H836-L894 VanDerWaalsContact N-CB 3.34Å
895	G	32.1	Very low	31.7	Very low	63 Å²	63	101 Å²	101	65%	0.649	57%	0.573	S	S	*	*			cis	154.1	-157.2	-1.7	0	0	0	0	0	112.3	H836	H836-G895 CarbonylContact O-C 3.54Å; H836-G895 VanDerWaalsContact O-CA 3.26Å; H836-G895 WeakPolarHBondContact O-CA 3.46Å
896	S	29.3	Very low	31.2	Very low	54 Å²	54	103.9 Å²	103.9	38%	0.378	58%	0.578	S	S	.	*			trans	-48.6	176.8	155.4	-95.1	0	0	0	0	112.9	E834 D835 H836	E834-S896 CarbonylContact C-O 3.01Å; D835-S896 CarbonylContact C-O 3.5Å; D835-S896 VanDerWaalsContact C-O 3.25Å; D835-S896 VanDerWaalsContact CA-O 3.27Å; D835-S896 WeakPolarHBondContact CA-O 3.38Å; D835-S896 PolarHBondContact N-O 3.48Å; D835-S896 CarbonylContact O-C 3.52Å; D835-S896 VanDerWaalsContact O-CA 3.31Å; D835-S896 WeakPolarHBondContact O-CA 3.43Å; D835-S896 WeakPolarHBondContact O-CB 3.21Å; D835-S896 PolarHBondContact O-N 3.37Å; H836-S896 WeakPolarHBondContact O-CB 3.31Å; H836-S896 PolarHBondContact O-N 2.88Å
897	S	31.4	Very low	31.7	Very low	57 Å²	57	100.6 Å²	100.6	40%	0.399	56%	0.56	S	S	.	*			cis	-159	147.9	-10.3	161.2	0	0	0	0	111.2
898	R	23.2	Very low	31.2	Very low	205 Å²	205	107.7 Å²	107.7	77%	0.774	57%	0.57	S	S	*	*			trans	-10.8	149.8	136.5	-46	158.9	165.7	170.9	-3.6	116.5
899	I	29.3	Very low	30.6	Very low	127 Å²	127	105.9 Å²	105.9	65%	0.651	55%	0.551	S	S	*	*			trans	66.9	178.8	141.1	-65.6	159.4	0	0	0	113.7	R855	R855-I899 PolarHBondContact NH1-O 3.14Å
900	R	32.1	Very low	30	Very low	167 Å²	167	109.2 Å²	109.2	63%	0.63	56%	0.56	S	S	*	*			trans	69.9	87.7	165.3	-160.6	168.2	-71.5	167.5	-1.6	111.2	R855 G902	R855-R900 WeakPolarHBondContact CD-O 3.36Å; R900-G902 PolarHBondContact O-N 2.72Å
901	D	26.2	Very low	29.7	Very low	110 Å²	110	111.1 Å²	111.1	59%	0.588	57%	0.568	S	S	*	*				47.8	14.1	63.6	-42.6	-89.4	0	0	0	114	L856 R858	L856-D901 VanDerWaalsContact CD1-O 3.3Å; L856-D901 WeakPolarHBondContact CD1-O 3.45Å; R858-D901 IonicContact NH2-OD1 3.77Å
902	G	28.6	Very low	29.8	Very low	14 Å²	14	112.1 Å²	112.1	14%	0.144	57%	0.569	C	S	.	*			trans	-71.5	164.1	173.4	0	0	0	0	0	113	R855 L856 R900	R855-G902 CarbonylContact C-O 3.53Å; L856-G902 VanDerWaalsContact CB-O 3.22Å; L856-G902 WeakPolarHBondContact CB-O 3.08Å; L856-G902 VanDerWaalsContact CD1-O 3.23Å; L856-G902 WeakPolarHBondContact CD1-O 3.47Å; L856-G902 PolarHBondContact N-O 2.95Å; R900-G902 PolarHBondContact O-N 2.72Å
903	T	25.1	Very low	29.4	Very low	102 Å²	102	117.2 Å²	117.2	63%	0.626	59%	0.587	S	S	*	*			trans	-75.2	122.8	-172.7	42.4	0	0	0	0	113.8	S854 R855	S854-T903 WeakPolarHBondContact CB-O 3.13Å; R855-T903 CarbonylContact O-C 3.14Å
904	I	24.9	Very low	29.1	Very low	71 Å²	71	117.3 Å²	117.3	36%	0.364	61%	0.611	S	S	.	*				61.2	130.3	98.4	-122	176.5	0	0	0	115.5	R855 L856 P857	R855-I904 PolarHBondContact O-N 2.65Å; L856-I904 HydrophobicContact CB-CB 4.16Å; L856-I904 HydrophobicContact CB-CG1 4.16Å; L856-I904 HydrophobicContact CD2-CB 4.1Å; L856-I904 HydrophobicContact CD2-CD1 3.81Å; L856-I904 HydrophobicContact CD2-CG1 3.9Å; P857-I904 HydrophobicContact CG-CD1 4.37Å; P857-I904 HydrophobicContact CG-CG1 4.1Å
905	Q	34.1	Very low	28.7	Very low	124 Å²	124	118.3 Å²	118.3	58%	0.579	62%	0.617	S	S	*	*			trans	27.5	116.2	152.2	-58.8	163.3	-68	0	0	118.7
906	Q	26.4	Very low	28.8	Very low	177 Å²	177	121 Å²	121	83%	0.827	63%	0.626	S	S	*	*				-151.8	136.1	110	-100.5	136.5	92.3	0	0	109.3
907	Q	38.9	Very low	28.8	Very low	114 Å²	114	120.7 Å²	120.7	53%	0.533	62%	0.624	S	S	.	*			cis	73.1	69.6	25.4	-158.8	-179	-33.5	0	0	113.9	H909	Q907-H909 PolarHBondContact O-CD2 2.73Å
908	Y	31.8	Very low	28.9	Very low	211 Å²	211	129.1 Å²	129.1	83%	0.827	65%	0.647	S	S	*	*				-116	140.1	125.2	-89.5	-103	0	0	0	108.3
909	H	30.7	Very low	29.8	Very low	102 Å²	102	123.6 Å²	123.6	47%	0.472	64%	0.638	S	S	.	*			cis	156.8	120.6	-14.6	-116.6	-80.1	0	0	0	101.8	Q907	Q907-H909 PolarHBondContact O-CD2 2.73Å
910	L	23.7	Very low	30.7	Very low	168 Å²	168	125 Å²	125	88%	0.88	64%	0.641	S	S	*	*			trans	158	109.3	157	-88.5	153.5	0	0	0	109.7
911	N	23.8	Very low	31.6	Very low	116 Å²	116	122.8 Å²	122.8	62%	0.62	64%	0.642	S	S	*	*			cis	-163.4	-165.1	-18.9	-115.7	11.5	0	0	0	108.4
912	D	31.6	Very low	32.7	Very low	145 Å²	145	122.9 Å²	122.9	78%	0.775	65%	0.646	S	S	*	*			trans	74.8	64.5	163.1	-63.2	8.1	0	0	0	118.6	G914	D912-G914 PolarHBondContact O-N 2.79Å
913	E	23.3	Very low	33.4	Very low	156 Å²	156	128.6 Å²	128.6	73%	0.729	67%	0.674	S	S	*	*				7.6	98.9	127.3	-54.7	-164.5	131.1	0	0	118.2	N915	E913-N915 PolarHBondContact O-N 2.95Å; E913-N915 PolarHBondContact O-ND2 3.38Å
914	G	29.7	Very low	33.9	Very low	88 Å²	88	130.9 Å²	130.9	91%	0.907	68%	0.682	S	S	*	*			trans	-71.7	35.5	170.8	0	0	0	0	0	116.2	D912	D912-G914 PolarHBondContact O-N 2.79Å
915	N	26.7	Very low	34.5	Very low	113 Å²	113	134.3 Å²	134.3	60%	0.604	70%	0.699	S	S	*	*	S	Bend	trans	47.3	84.6	168.4	-74.8	-71.7	0	0	0	118.5	E913 S917	E913-N915 PolarHBondContact O-N 2.95Å; E913-N915 PolarHBondContact O-ND2 3.38Å; N915-S917 WeakPolarHBondContact CA-OG 3.45Å; N915-S917 PolarHBondContact OD1-O 3.43Å
916	S	34.1	Very low	34.4	Very low	120 Å²	120	133.3 Å²	133.3	84%	0.839	71%	0.705	S	S	*	*			trans	-157.1	51.2	141.7	-178.1	0	0	0	0	110.1	R918	S916-R918 VanDerWaalsContact C-N 3.32Å
917	S	28.8	Very low	34.7	Very low	48 Å²	48	128.9 Å²	128.9	34%	0.336	69%	0.693	S	S	.	*	S	Bend	cis	10.7	64.6	36.4	42.4	0	0	0	0	117.3	N915	N915-S917 WeakPolarHBondContact CA-OG 3.45Å; N915-S917 PolarHBondContact OD1-O 3.43Å
918	R	34.2	Very low	34.4	Very low	234 Å²	234	130.6 Å²	130.6	88%	0.883	70%	0.702	S	S	*	*				-68.1	139.5	119.5	-86.6	176.1	159.5	-176.6	-5.6	106.8	S916	S916-R918 VanDerWaalsContact C-N 3.32Å
919	P	41.2	Very low	34.3	Very low	89 Å²	89	125.7 Å²	125.7	58%	0.578	69%	0.689	S	S	*	*			cis	-136.2	174.9	-28.1	35.8	-18.5	0	0	0	112.8
920	H	48.3	Very low	34.2	Very low	156 Å²	156	128.3 Å²	128.3	72%	0.722	70%	0.699	S	S	*	*			trans	69.7	153.6	165.4	-57.5	-54.2	0	0	0	116
921	N	52.1	Low	34.5	Very low	121 Å²	121	129.6 Å²	129.6	65%	0.647	70%	0.698	S	S	*	*			cis	-171.5	158.2	-14.5	-107.6	8.2	0	0	0	107.6
922	T	49.5	Very low	34.7	Very low	111 Å²	111	127.7 Å²	127.7	68%	0.681	69%	0.694	S	S	*	*			trans	56.2	144.9	148.4	56.9	0	0	0	0	120.1
923	D	42	Very low	34.5	Very low	134 Å²	134	127.1 Å²	127.1	72%	0.717	68%	0.684	S	S	*	*			cis	-165.2	155.7	-10.4	-96.2	-24.7	0	0	0	107.9
924	D	37.2	Very low	34.8	Very low	150 Å²	150	124.3 Å²	124.3	80%	0.802	67%	0.668	S	S	*	*			trans	61	165.6	152.5	-88.6	-22.8	0	0	0	119.4
925	M	35.8	Very low	34.7	Very low	144 Å²	144	126.5 Å²	126.5	71%	0.709	66%	0.658	S	S	*	*			cis	-142.3	129.9	-8.1	-150.4	-170.3	63.1	0	0	111.1
926	S	33.4	Very low	34.5	Very low	102 Å²	102	124.8 Å²	124.8	71%	0.713	66%	0.655	S	S	*	*			trans	61.8	-174.8	155.8	85.9	0	0	0	0	115.2
927	S	31.6	Very low	34.1	Very low	84 Å²	84	121 Å²	121	59%	0.587	63%	0.631	S	S	*	*			cis	-146.1	132.3	-2.9	143.3	0	0	0	0	108.7
928	Q	32.7	Very low	34.1	Very low	151 Å²	151	123 Å²	123	71%	0.706	64%	0.641	S	S	*	*			trans	51.9	124.9	142.4	-54.6	-158.2	65.5	0	0	118.4
929	L	30.2	Very low	33.6	Very low	108 Å²	108	119.3 Å²	119.3	57%	0.565	63%	0.627	S	S	*	*			cis	-170	168	26.1	-150.6	42.1	0	0	0	114.7	K931	L929-K931 PolarHBondContact O-N 3.39Å
930	K	29	Very low	33.1	Very low	157 Å²	157	119.8 Å²	119.8	68%	0.683	63%	0.625	S	S	*	*			trans	-12.9	119.7	146.5	-45.7	147.6	-161.4	151.5	0	110.7
931	K	29.2	Very low	32.2	Very low	195 Å²	195	116.8 Å²	116.8	85%	0.848	61%	0.614	S	S	*	*				-166.4	148.8	86.1	-88.4	141.3	-173.8	172.4	0	110.1	L929	L929-K931 PolarHBondContact O-N 3.39Å
932	S	28.1	Very low	31.3	Very low	76 Å²	76	114.8 Å²	114.8	53%	0.531	60%	0.603	S	S	.	*			cis	-170.8	145.2	-2.4	165.4	0	0	0	0	111.8
933	K	27.6	Very low	30.6	Very low	133 Å²	133	116.6 Å²	116.6	58%	0.578	61%	0.609	S	S	*	*				15	133.6	121.7	-18.7	143.6	92.5	-169.9	0	114.7	L935	K933-L935 HydrophobicContact CB-CD1 4.21Å
934	Y	30	Very low	30.6	Very low	97 Å²	97	113.6 Å²	113.6	38%	0.38	61%	0.609	S	S	.	*			cis	-143	141.3	35.8	-64.9	-84.2	0	0	0	111.3	C1089 S1090	Y934-C1089 HydrophobicContact CD2-CB 4.12Å; Y934-C1089 HydrophobicContact CE2-CB 3.49Å; Y934-C1089 VanDerWaalsContact CE2-CB 3.49Å; Y934-C1089 WeakPolarHBondContact CE2-SG 3.32Å; Y934-S1090 VanDerWaalsContact CD1-CB 3.48Å; Y934-S1090 VanDerWaalsContact CE1-CB 3.48Å; Y934-S1090 WeakPolarHBondContact CE1-OG 3.22Å
935	L	26.8	Very low	30.4	Very low	134 Å²	134	113.2 Å²	113.2	70%	0.702	61%	0.607	S	S	*	*				59.9	128.5	63.2	-74.7	86.9	0	0	0	113.3	K933	K933-L935 HydrophobicContact CB-CD1 4.21Å
936	S	22.9	Very low	30.5	Very low	77 Å²	77	117.8 Å²	117.8	54%	0.538	62%	0.616	S	S	.	*			cis	113.8	120.3	13.9	72.3	0	0	0	0	114.2	F1093	S936-F1093 VanDerWaalsContact CA-CE2 3.42Å
937	A	26.4	Very low	30.4	Very low	41 Å²	41	119.5 Å²	119.5	34%	0.339	62%	0.618	S	S	.	*			trans	-164.3	-127.5	153.6	0	0	0	0	0	112.1	F1093	A937-F1093 HydrophobicContact CB-CB 4Å; A937-F1093 HydrophobicContact CB-CD1 4.09Å; A937-F1093 HydrophobicContact CB-CG 4.16Å; A937-F1093 VanDerWaalsContact CB-O 3.27Å; A937-F1093 WeakPolarHBondContact CB-O 3.36Å; A937-F1093 VanDerWaalsContact N-CD1 3.28Å; A937-F1093 VanDerWaalsContact N-CD2 3.34Å; A937-F1093 WeakPolarHBondContact O-CE1 3.45Å
938	T	27	Very low	30.2	Very low	90 Å²	90	118.6 Å²	118.6	55%	0.552	62%	0.622	S	S	*	*			trans	-176.7	-148.1	-175.6	12	0	0	0	0	111.5	F1093 R1094	T938-F1093 PolarHBondContact N-O 3.43Å; T938-R1094 VanDerWaalsContact C-CZ 3.46Å; T938-R1094 VanDerWaalsContact O-CA 3.31Å; T938-R1094 WeakPolarHBondContact O-CA 3.46Å; T938-R1094 WeakPolarHBondContact O-CD 3.37Å; T938-R1094 WeakPolarHBondContact O-CG 3.49Å; T938-R1094 PolarHBondContact O-NE 3.1Å; T938-R1094 PolarHBondContact OG1-NH2 2.96Å
939	R	25.5	Very low	29.7	Very low	155 Å²	155	118.9 Å²	118.9	59%	0.585	62%	0.617	S	S	*	*			trans	65.2	119.8	-179.4	-79.2	166.1	167.5	116.3	-5.5	116	R1094 C1095	R939-R1094 HydrophobicContact CB-CG 3.82Å; R939-R1094 VanDerWaalsContact CB-NE 3.29Å; R939-C1095 PolarHBondContact O-N 3.4Å
940	N	29.4	Very low	29.5	Very low	100 Å²	100	116.6 Å²	116.6	54%	0.535	61%	0.61	S	S	.	*				78.6	146.4	64.7	-64.9	28.7	0	0	0	111.2	C1095 N1096	N940-C1095 WeakPolarHBondContact O-CA 3.5Å; N940-C1095 WeakPolarHBondContact O-CB 3.45Å; N940-C1095 PolarHBondContact O-SG 2.88Å; N940-N1096 WeakPolarHBondContact O-CB 3.04Å
941	N	30.5	Very low	29.4	Very low	92 Å²	92	111.9 Å²	111.9	49%	0.492	60%	0.597	S	S	.	*			cis	-154.9	137.6	0.8	-135.3	63.8	0	0	0	111.1	N1096 T1097	N941-N1096 VanDerWaalsContact C-ND2 3.33Å; N941-N1096 PolarHBondContact N-ND2 3.42Å; N941-T1097 PolarHBondContact O-OG1 3.11Å
942	D	31.5	Very low	29.5	Very low	80 Å²	80	108.2 Å²	108.2	43%	0.428	58%	0.578	S	S	.	*			trans	137.6	129.6	142.4	-71.2	0.5	0	0	0	117.4	G944 T1097	D942-G944 PolarHBondContact O-N 2.82Å; D942-T1097 HydrophobicContact CB-CG2 4.37Å; D942-T1097 WeakPolarHBondContact O-CG2 3.47Å
943	N	36.3	Very low	29.4	Very low	149 Å²	149	107.7 Å²	107.7	80%	0.797	57%	0.569	S	S	*	*			trans	46.3	65	139	-57.6	-33.4	0	0	0	120
944	G	41.4	Very low	29.3	Very low	70 Å²	70	107.7 Å²	107.7	72%	0.722	57%	0.569	S	S	*	*			trans	-111.2	1.9	175	0	0	0	0	0	117.7	D942 R946	D942-G944 PolarHBondContact O-N 2.82Å; G944-R946 PolarHBondContact O-N 3.43Å
945	N	32.8	Very low	29.2	Very low	142 Å²	142	110.2 Å²	110.2	76%	0.759	58%	0.584	S	S	*	*			trans	35.2	60	169.3	-163.3	21	0	0	0	118.4
946	R	38.8	Very low	29.2	Very low	240 Å²	240	106.4 Å²	106.4	91%	0.906	58%	0.578	S	S	*	*			trans	-134	73.6	162.2	-75.8	-167.2	171.8	170	-1.2	111.8	G944	G944-R946 PolarHBondContact O-N 3.43Å
947	N	30.4	Very low	29.4	Very low	139 Å²	139	111.7 Å²	111.7	74%	0.743	59%	0.586	S	S	*	*			trans	-65.9	157.5	162.5	-60.3	-30.9	0	0	0	110
948	G	27.2	Very low	29.4	Very low	65 Å²	65	119.5 Å²	119.5	67%	0.67	61%	0.606	S	S	*	*			trans	97.8	57.8	-166.8	0	0	0	0	0	109.8
949	Y	22.2	Very low	29.3	Very low	156 Å²	156	118.7 Å²	118.7	61%	0.612	60%	0.602	S	S	*	*				47.3	120.6	66.3	-86.7	-55.1	0	0	0	113.3
950	S	25.5	Very low	29.5	Very low	60 Å²	60	114.2 Å²	114.2	42%	0.42	60%	0.595	S	S	.	*			trans	69.1	140.8	156.5	-120.6	0	0	0	0	115.7	S720	S720-S950 PolarHBondContact O-OG 2.96Å
951	S	27.4	Very low	29.3	Very low	58 Å²	58	111.6 Å²	111.6	41%	0.406	59%	0.585	S	S	.	*			cis	66.4	143.9	30	116	0	0	0	0	111.7
952	R	31.1	Very low	29.1	Very low	119 Å²	119	114.2 Å²	114.2	45%	0.449	59%	0.594	S	S	.	*			cis	-165.4	169.9	3.3	-133.8	162	172.3	161.7	-15.2	108.8	T723 I984	T723-R952 PolarHBondContact O-NH2 3.27Å; T723-R952 VanDerWaalsContact O-NH2 3.1Å; R952-I984 CarbonylContact C-O 3.46Å; R952-I984 VanDerWaalsContact C-O 3.23Å; R952-I984 WeakPolarHBondContact CA-O 3.38Å
953	N	26.2	Very low	28.8	Very low	64 Å²	64	115.5 Å²	115.5	34%	0.342	61%	0.605	S	S	.	*			trans	69.9	151.8	145.9	-64.8	-26	0	0	0	119.8	I984 N985	N953-I984 PolarHBondContact N-O 2.73Å; N953-N985 PolarHBondContact O-ND2 3.25Å
954	K	26.6	Very low	28.3	Very low	133 Å²	133	113.2 Å²	113.2	58%	0.578	59%	0.592	S	S	*	*			trans	68.5	125.9	172.3	-61.6	127	-176	178.2	0	116.9	I984 N985	K954-I984 VanDerWaalsContact C-CG2 3.49Å; K954-I984 WeakPolarHBondContact O-CG2 3.49Å; K954-N985 PolarHBondContact O-ND2 2.92Å
955	H	26.7	Very low	27.5	Very low	151 Å²	151	116.7 Å²	116.7	70%	0.699	59%	0.59	S	S	*	*	S	Bend	trans	85.1	64.1	-158.4	-54	81	0	0	0	114.7	I984	H955-I984 HydrophobicContact CB-CG2 4.43Å; H955-I984 WeakPolarHBondContact O-CG1 3.3Å; H955-I984 WeakPolarHBondContact O-CG2 3.4Å
956	G	27.4	Very low	27.3	Very low	54 Å²	54	112.5 Å²	112.5	56%	0.557	57%	0.566	S	S	*	*			cis	115.5	72.1	25.8	0	0	0	0	0	109
957	R	27	Very low	26.6	Very low	188 Å²	188	102.4 Å²	102.4	71%	0.709	53%	0.53	S	S	*	.			trans	-128.8	125.5	175.9	-63	-174.4	-178.5	-163.8	-2	106.9	I981	R957-I981 VanDerWaalsContact O-CG2 3.3Å; R957-I981 WeakPolarHBondContact O-CG2 3.49Å
958	R	26.2	Very low	26.3	Very low	204 Å²	204	99.5 Å²	99.5	77%	0.77	51%	0.513	S	S	*	.			trans	-125	142	-177	-87.8	-178.3	166.4	-173	-6	109.1
959	P	25.1	Very low	26.3	Very low	73 Å²	73	102.4 Å²	102.4	47%	0.474	51%	0.512	S	S	.	.	S	Bend	cis	-135.8	97.3	-22.6	34.6	-14.9	0	0	0	110.7	A979 T980	P959-A979 CarbonylContact O-C 3.1Å; P959-A979 VanDerWaalsContact O-C 3.31Å; P959-A979 WeakPolarHBondContact O-CB 3.21Å; P959-A979 VanDerWaalsContact O-O 3.11Å; P959-T980 HydrophobicContact CB-CG2 4.19Å; P959-T980 WeakPolarHBondContact O-CA 3.23Å
960	S	29.8	Very low	26.6	Very low	62 Å²	62	98 Å²	98	43%	0.434	50%	0.499	S	S	.	.			trans	-142.2	69.2	-165	44.2	0	0	0	0	120.2	I981	S960-I981 VanDerWaalsContact C-CG1 3.42Å; S960-I981 WeakPolarHBondContact O-CD1 3.34Å; S960-I981 WeakPolarHBondContact OG-CD1 3.5Å
961	S	25	Very low	26.8	Very low	45 Å²	45	101.7 Å²	101.7	32%	0.315	52%	0.521	S	S	.	.			trans	-155	136.7	162	53	0	0	0	0	115.7	T980 I981	S961-T980 VanDerWaalsContact N-C 3.27Å; S961-T980 PolarHBondContact N-O 3.36Å; S961-T980 CarbonylContact O-C 3.59Å; S961-T980 PolarHBondContact O-N 2.86Å; S961-T980 PolarHBondContact OG-O 3.39Å; S961-I981 WeakPolarHBondContact OG-CG1 3.47Å
962	Q	26.8	Very low	26.8	Very low	147 Å²	147	101.7 Å²	101.7	69%	0.687	53%	0.531	S	S	*	.			trans	45.5	173.9	134.3	-64.6	177	-39	0	0	124
963	T	25.2	Very low	26.7	Very low	107 Å²	107	105.1 Å²	105.1	66%	0.656	55%	0.551	S	S	*	*			trans	82	136.3	171.4	72	0	0	0	0	116.1
964	N	25	Very low	26.6	Very low	100 Å²	100	106 Å²	106	54%	0.535	56%	0.56	S	S	.	*			cis	-164.2	124.7	-0.9	-112.5	16.4	0	0	0	112	L1719	N964-L1719 HydrophobicContact CB-CD1 3.63Å; N964-L1719 HydrophobicContact CB-CD2 4.3Å; N964-L1719 WeakPolarHBondContact ND2-CD1 3.32Å; N964-L1719 WeakPolarHBondContact OD1-CD1 3.15Å; N964-L1719 WeakPolarHBondContact OD1-CD2 3.2Å
965	E	25.6	Very low	26.6	Very low	143 Å²	143	106.9 Å²	106.9	67%	0.668	57%	0.571	S	S	*	*				157	101.5	126.5	-80.6	179.2	-167.6	0	0	118.2	L1719	E965-L1719 HydrophobicContact CB-CD1 4.26Å; E965-L1719 HydrophobicContact CG-CD1 3.55Å
966	H	27.6	Very low	26.5	Very low	55 Å²	55	106.9 Å²	106.9	26%	0.255	57%	0.574	S	S	.	*			trans	90.1	156.1	135.7	-50.9	-40.1	0	0	0	124.1	Q1715 C1716 A1717 S1718	H966-Q1715 WeakPolarHBondContact CB-O 3.4Å; H966-C1716 VanDerWaalsContact CD2-CA 3.43Å; H966-C1716 WeakPolarHBondContact CD2-CA 3.28Å; H966-C1716 PolarHBondContact CE1-O 2.87Å; H966-C1716 VanDerWaalsContact CG-C 3.49Å; H966-C1716 PolarHBondContact NE2-O 3.26Å; H966-A1717 PolarHBondContact CE1-N 3.2Å; H966-A1717 VanDerWaalsContact CE1-N 3.33Å; H966-A1717 VanDerWaalsContact ND1-C 3.29Å; H966-A1717 VanDerWaalsContact ND1-CA 3.34Å; H966-A1717 WeakPolarHBondContact ND1-CA 3.19Å; H966-A1717 PolarHBondContact ND1-N 3.49Å; H966-S1718 VanDerWaalsContact C-OG 3.22Å; H966-S1718 VanDerWaalsContact CA-CB 3.49Å; H966-S1718 WeakPolarHBondContact CA-OG 3.42Å; H966-S1718 PolarHBondContact N-OG 2.85Å; H966-S1718 PolarHBondContact ND1-N 3.3Å; H966-S1718 VanDerWaalsContact ND1-N 3.16Å; H966-S1718 PolarHBondContact O-OG 2.88Å
967	D	24.4	Very low	26.4	Very low	27 Å²	27	111.7 Å²	111.7	14%	0.144	58%	0.577	C	S	.	*			trans	-103.6	154.7	-155.5	-62.2	-69.1	0	0	0	115.9	N1714 Q1715 S1718	D967-N1714 VanDerWaalsContact CB-C 3.46Å; D967-N1714 HydrophobicContact CB-CB 3.65Å; D967-N1714 VanDerWaalsContact CB-O 3.23Å; D967-N1714 WeakPolarHBondContact CB-O 3.46Å; D967-N1714 PolarHBondContact N-O 2.83Å; D967-N1714 WeakPolarHBondContact OD2-CB 3.41Å; D967-Q1715 VanDerWaalsContact O-CA 3.24Å; D967-Q1715 WeakPolarHBondContact O-CA 3.42Å; D967-Q1715 WeakPolarHBondContact O-CB 3.45Å; D967-Q1715 WeakPolarHBondContact O-CG 3.5Å; D967-Q1715 PolarHBondContact O-N 3.25Å; D967-Q1715 VanDerWaalsContact O-N 3.13Å; D967-S1718 WeakPolarHBondContact OD1-CA 3.29Å; D967-S1718 WeakPolarHBondContact OD1-CB 3.35Å; D967-S1718 WeakPolarHBondContact OD2-CA 3.33Å; D967-S1718 WeakPolarHBondContact OD2-CB 3.37Å; D967-S1718 PolarHBondContact OD2-N 2.73Å
968	M	24.2	Very low	26.4	Very low	78 Å²	78	109.9 Å²	109.9	38%	0.384	58%	0.581	S	S	.	*				159.7	80.7	96.3	-166	173.2	92.8	0	0	111.1	A1711 N1714	M968-A1711 HydrophobicContact CE-CB 3.71Å; M968-N1714 HydrophobicContact CB-CB 4.27Å; M968-N1714 HydrophobicContact SD-CB 4.15Å; M968-N1714 PolarHBondContact SD-ND2 3.01Å
969	L	27.8	Very low	26.5	Very low	126 Å²	126	101.6 Å²	101.6	66%	0.66	56%	0.556	S	S	*	*			trans	-126.4	164.1	-176.3	-82.3	93.1	0	0	0	114.3
970	I	29	Very low	26.6	Very low	65 Å²	65	102.8 Å²	102.8	33%	0.333	56%	0.563	S	S	.	*			trans	-95.5	152.7	-167.3	-65.3	131.2	0	0	0	109.5	G972 S1450	I970-G972 PolarHBondContact O-N 3.42Å; I970-S1450 WeakPolarHBondContact CG2-OG 3.35Å
971	P	28.1	Very low	26.6	Very low	136 Å²	136	101.9 Å²	101.9	88%	0.883	55%	0.552	S	S	*	*	S	Bend	trans	-82.9	104.5	-156.7	30.7	-34	0	0	0	113.7
972	G	29	Very low	26.7	Very low	59 Å²	59	105 Å²	105	61%	0.608	57%	0.569	S	S	*	*			trans	-153.7	-22.7	179.9	0	0	0	0	0	119.8	I970	I970-G972 PolarHBondContact O-N 3.42Å
973	Q	27.5	Very low	26.9	Very low	190 Å²	190	101.5 Å²	101.5	89%	0.888	56%	0.556	S	S	*	*			trans	-143.5	163.7	-172.9	-80.1	-157.8	17.4	0	0	117
974	P	24.8	Very low	27.2	Very low	82 Å²	82	98 Å²	98	53%	0.532	53%	0.533	S	S	.	.			trans	-115.6	105.2	-165	36.2	-21.1	0	0	0	115.2	K678	K678-P974 VanDerWaalsContact CE-CB 3.45Å
975	L	26.4	Very low	27.5	Very low	153 Å²	153	96 Å²	96	80%	0.801	52%	0.522	S	S	*	.			trans	-97.2	156.3	174.6	-79	171.8	0	0	0	116	K678	K678-L975 PolarHBondContact NZ-O 3.16Å
976	I	24.1	Very low	27.6	Very low	150 Å²	150	98 Å²	98	77%	0.769	52%	0.523	S	S	*	.			trans	-93.5	147.4	-165	-61.5	159.7	0	0	0	110.8
977	Y	27	Very low	27.7	Very low	156 Å²	156	100.4 Å²	100.4	61%	0.612	55%	0.546	S	S	*	.			trans	-134.5	111.6	170.3	-102.4	-79	0	0	0	111.8
978	N	25.8	Very low	27.9	Very low	150 Å²	150	102.7 Å²	102.7	80%	0.802	58%	0.576	S	S	*	*			trans	-116.1	101.1	170	-113.5	0.2	0	0	0	111.1
979	A	28.3	Very low	28	Very low	29 Å²	29	108.1 Å²	108.1	24%	0.24	60%	0.6	C	S	.	*				66.5	91.7	109.6	0	0	0	0	0	121.9	P959	P959-A979 CarbonylContact O-C 3.1Å; P959-A979 VanDerWaalsContact O-C 3.31Å; P959-A979 WeakPolarHBondContact O-CB 3.21Å; P959-A979 VanDerWaalsContact O-O 3.11Å
980	T	26.7	Very low	28.1	Very low	99 Å²	99	107.7 Å²	107.7	61%	0.607	61%	0.608	S	S	*	*				-145.6	137.5	129.3	60.4	0	0	0	0	115.6	P959 S961	P959-T980 HydrophobicContact CB-CG2 4.19Å; P959-T980 WeakPolarHBondContact O-CA 3.23Å; S961-T980 VanDerWaalsContact N-C 3.27Å; S961-T980 PolarHBondContact N-O 3.36Å; S961-T980 CarbonylContact O-C 3.59Å; S961-T980 PolarHBondContact O-N 2.86Å; S961-T980 PolarHBondContact OG-O 3.39Å
981	I	29.6	Very low	28	Very low	42 Å²	42	109.6 Å²	109.6	22%	0.215	63%	0.627	C	S	.	*			trans	-109.1	143	-180	-80	163.2	0	0	0	110.8	R957 S960 S961 N983	R957-I981 VanDerWaalsContact O-CG2 3.3Å; R957-I981 WeakPolarHBondContact O-CG2 3.49Å; S960-I981 VanDerWaalsContact C-CG1 3.42Å; S960-I981 WeakPolarHBondContact O-CD1 3.34Å; S960-I981 WeakPolarHBondContact OG-CD1 3.5Å; S961-I981 WeakPolarHBondContact OG-CG1 3.47Å; I981-N983 HydrophobicContact CG2-CB 3.92Å
982	T	28.2	Very low	28	Very low	110 Å²	110	114.7 Å²	114.7	68%	0.675	63%	0.629	S	S	*	*				179.9	149	124.2	26.2	0	0	0	0	114.3	I984	T982-I984 HydrophobicContact CG2-CD1 4.38Å
983	N	31.9	Very low	27.9	Very low	75 Å²	75	115.1 Å²	115.1	40%	0.401	63%	0.633	S	S	.	*			cis	164.6	175.9	-47.4	171.3	11.5	0	0	0	108.6	I981	I981-N983 HydrophobicContact CG2-CB 3.92Å
984	I	29.6	Very low	28	Very low	34 Å²	34	110.9 Å²	110.9	17%	0.174	62%	0.622	C	S	.	*			trans	95.3	139.7	144.2	-37	147.8	0	0	0	120.4	R952 N953 K954 H955 T982	R952-I984 CarbonylContact C-O 3.46Å; R952-I984 VanDerWaalsContact C-O 3.23Å; R952-I984 WeakPolarHBondContact CA-O 3.38Å; N953-I984 PolarHBondContact N-O 2.73Å; K954-I984 VanDerWaalsContact C-CG2 3.49Å; K954-I984 WeakPolarHBondContact O-CG2 3.49Å; H955-I984 HydrophobicContact CB-CG2 4.43Å; H955-I984 WeakPolarHBondContact O-CG1 3.3Å; H955-I984 WeakPolarHBondContact O-CG2 3.4Å; T982-I984 HydrophobicContact CG2-CD1 4.38Å
985	N	31.2	Very low	28.1	Very low	58 Å²	58	116.4 Å²	116.4	31%	0.31	63%	0.634	S	S	.	*			trans	69.8	146.2	148.5	-83.2	-3.3	0	0	0	123	N953 K954	N953-N985 PolarHBondContact O-ND2 3.25Å; K954-N985 PolarHBondContact O-ND2 2.92Å
986	R	28.9	Very low	28	Very low	184 Å²	184	114.5 Å²	114.5	69%	0.694	63%	0.629	S	S	*	*			cis	-159.8	153.3	-5.9	-137.4	170.3	-157.6	-156.2	1.9	115.2
987	S	28.4	Very low	28.1	Very low	106 Å²	106	110.3 Å²	110.3	74%	0.741	61%	0.613	S	S	*	*			trans	22.2	139.5	146	62.5	0	0	0	0	123.8
988	G	28.9	Very low	28.2	Very low	75 Å²	75	108.1 Å²	108.1	77%	0.773	61%	0.611	S	S	*	*			trans	-158.7	124	157.2	0	0	0	0	0	113
989	H	27.8	Very low	28.2	Very low	191 Å²	191	103.3 Å²	103.3	88%	0.884	60%	0.597	S	S	*	*			trans	-68.6	143.9	-171	-75.3	-96.2	0	0	0	115.8
990	S	28.2	Very low	28.2	Very low	118 Å²	118	108.2 Å²	108.2	83%	0.825	63%	0.626	S	S	*	*				165.4	157.8	110.2	48.6	0	0	0	0	111.7
991	S	26.9	Very low	28.3	Very low	105 Å²	105	106.9 Å²	106.9	73%	0.734	63%	0.632	S	S	*	*			cis	-166.5	151.6	-33.4	-172.1	0	0	0	0	107.8
992	R	29.6	Very low	28.3	Very low	242 Å²	242	113.2 Å²	113.2	91%	0.913	66%	0.66	S	S	*	*			trans	66	126.8	-173.3	-53.6	170.3	172.8	165.6	-4.5	114.3
993	G	25.2	Very low	28.1	Very low	68 Å²	68	115.9 Å²	115.9	70%	0.701	66%	0.663	S	S	*	*			cis	72.6	155.5	-12.8	0	0	0	0	0	117.3
994	P	29.7	Very low	28	Very low	101 Å²	101	123.1 Å²	123.1	66%	0.656	68%	0.684	S	S	*	*			cis	-119.3	-135.4	-13.4	41.8	-26.8	0	0	0	111
995	Y	27.2	Very low	27.9	Very low	199 Å²	199	127 Å²	127	78%	0.78	70%	0.704	S	S	*	*			trans	72.9	93.4	-179	-50.4	-67.7	0	0	0	114.7
996	T	25.8	Very low	27.7	Very low	113 Å²	113	130.6 Å²	130.6	69%	0.693	73%	0.729	S	S	*	*				86.1	124.5	53.5	67.6	0	0	0	0	115.1
997	S	25.1	Very low	27.6	Very low	62 Å²	62	125.6 Å²	125.6	43%	0.434	73%	0.734	S	S	.	*			trans	54.3	85.9	142.8	66.6	0	0	0	0	119.3	S330 G331 P332	S330-S997 WeakPolarHBondContact OG-CB 3.3Å; G331-S997 WeakPolarHBondContact O-CB 3.18Å; G331-S997 PolarHBondContact O-OG 3.37Å; P332-S997 WeakPolarHBondContact CD-O 3.49Å
998	L	28.7	Very low	27.6	Very low	109 Å²	109	130.7 Å²	130.7	57%	0.571	74%	0.737	S	S	*	*				-171.8	142.3	120.6	-163.5	77.5	0	0	0	105.9
999	G	27.1	Very low	28.3	Very low	49 Å²	49	130.6 Å²	130.6	51%	0.505	73%	0.729	S	S	.	*			cis	115.9	56	6.2	0	0	0	0	0	113.9
1000	P	27.3	Very low	28.3	Very low	133 Å²	133	126.2 Å²	126.2	86%	0.864	72%	0.718	S	S	*	*			trans	-62.9	141.1	164.1	-11.9	27.9	0	0	0	109.4
1001	G	30	Very low	28.3	Very low	70 Å²	70	126.1 Å²	126.1	72%	0.722	71%	0.707	S	S	*	*			cis	103.2	123.5	11.4	0	0	0	0	0	110.7
1002	H	27.8	Very low	28.4	Very low	176 Å²	176	122.7 Å²	122.7	82%	0.815	69%	0.685	S	S	*	*			trans	-62.9	143.7	-176.9	-100.1	-105.8	0	0	0	114.4
1003	F	24.4	Very low	28.2	Very low	165 Å²	165	116 Å²	116	72%	0.724	66%	0.661	S	S	*	*			trans	-162.6	141	154.3	-118	-139.4	0	0	0	104.4	I1005	F1003-I1005 HydrophobicContact CD1-CB 4.23Å; F1003-I1005 HydrophobicContact CE1-CB 3.91Å; F1003-I1005 HydrophobicContact CE1-CG2 4.14Å; F1003-I1005 HydrophobicContact CE2-CD1 3.84Å; F1003-I1005 HydrophobicContact CZ-CB 4.1Å; F1003-I1005 HydrophobicContact CZ-CD1 3.82Å; F1003-I1005 HydrophobicContact CZ-CG2 4.35Å
1004	R	29.8	Very low	28.3	Very low	228 Å²	228	116.3 Å²	116.3	86%	0.86	65%	0.646	S	S	*	*			cis	59.4	163.8	5.7	-84	-168.9	170.4	-167	-3.5	115.9
1005	I	27.7	Very low	28.2	Very low	115 Å²	115	113.7 Å²	113.7	59%	0.59	63%	0.633	S	S	*	*			trans	62.1	86.9	-175.4	-61.4	168.5	0	0	0	111.1	F1003	F1003-I1005 HydrophobicContact CD1-CB 4.23Å; F1003-I1005 HydrophobicContact CE1-CB 3.91Å; F1003-I1005 HydrophobicContact CE1-CG2 4.14Å; F1003-I1005 HydrophobicContact CE2-CD1 3.84Å; F1003-I1005 HydrophobicContact CZ-CB 4.1Å; F1003-I1005 HydrophobicContact CZ-CD1 3.82Å; F1003-I1005 HydrophobicContact CZ-CG2 4.35Å
1006	T	27.2	Very low	28.6	Very low	134 Å²	134	109.9 Å²	109.9	82%	0.822	63%	0.631	S	S	*	*				56.1	109.4	81.5	69.8	0	0	0	0	113.8
1007	G	26.9	Very low	28.8	Very low	79 Å²	79	109.2 Å²	109.2	81%	0.814	63%	0.631	S	S	*	*			trans	175.2	123.2	173.7	0	0	0	0	0	113.3
1008	R	27.6	Very low	29.1	Very low	212 Å²	212	115.1 Å²	115.1	80%	0.8	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-48.4	155.2	-179.9	-69.7	171.8	164.7	155.9	-8.8	115.5	G1019	R1008-G1019 PolarHBondContact NH1-O 3.1Å
1009	A	43.8	Very low	29.4	Very low	73 Å²	73	111.7 Å²	111.7	60%	0.603	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-80.5	163	153.2	0	0	0	0	0	111.3
1010	P	28.9	Very low	29.9	Very low	99 Å²	99	114.9 Å²	114.9	64%	0.643	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-79.5	125.4	137.6	32.4	-26.1	0	0	0	108.1
1011	L	28.7	Very low	30.4	Very low	117 Å²	117	112.7 Å²	112.7	61%	0.613	64%	0.639	S	S	*	*			cis	61.9	148.6	38.6	-61.2	172.9	0	0	0	114.5	F1037	L1011-F1037 WeakPolarHBondContact O-CD1 3.43Å; L1011-F1037 WeakPolarHBondContact O-CE1 3.31Å
1012	A	29	Very low	30.7	Very low	32 Å²	32	115.5 Å²	115.5	26%	0.264	64%	0.642	S	S	.	*			trans	75.4	137.9	170.9	0	0	0	0	0	117	D1014 F1037	A1012-D1014 WeakPolarHBondContact CB-OD1 3.26Å; A1012-F1037 HydrophobicContact CB-CD1 4.23Å; A1012-F1037 WeakPolarHBondContact O-CD1 3.17Å; A1012-F1037 WeakPolarHBondContact O-CE1 3.2Å
1013	Y	24.7	Very low	31	Very low	103 Å²	103	112.7 Å²	112.7	40%	0.404	64%	0.639	S	S	.	*	S	Bend	cis	-51.8	141.8	-9.5	-101.7	-104.7	0	0	0	113.1	S1038 F1039 D1040	Y1013-S1038 WeakPolarHBondContact CD2-O 3.24Å; Y1013-S1038 WeakPolarHBondContact CE2-O 3.33Å; Y1013-F1039 VanDerWaalsContact CB-C 3.4Å; Y1013-F1039 WeakPolarHBondContact CB-O 3.45Å; Y1013-F1039 HydrophobicContact CD1-CB 3.71Å; Y1013-F1039 HydrophobicContact CD1-CD2 4.13Å; Y1013-F1039 HydrophobicContact CD1-CG 4.11Å; Y1013-F1039 VanDerWaalsContact CD1-N 3.28Å; Y1013-F1039 WeakPolarHBondContact CD1-O 3.41Å; Y1013-F1039 HydrophobicContact CD2-CB 3.61Å; Y1013-F1039 WeakPolarHBondContact CD2-O 3.28Å; Y1013-F1039 HydrophobicContact CE1-CB 3.02Å; Y1013-F1039 AromaticContact CE1-CD1 3.75Å; Y1013-F1039 HydrophobicContact CE1-CD1 3.75Å; Y1013-F1039 AromaticContact CE1-CD2 3.41Å; Y1013-F1039 HydrophobicContact CE1-CD2 3.41Å; Y1013-F1039 VanDerWaalsContact CE1-CD2 3.41Å; Y1013-F1039 HydrophobicContact CE1-CE2 4.26Å; Y1013-F1039 AromaticContact CE1-CG 3.06Å; Y1013-F1039 HydrophobicContact CE1-CG 3.06Å; Y1013-F1039 HydrophobicContact CE2-CB 2.94Å; Y1013-F1039 HydrophobicContact CE2-CG 4.06Å; Y1013-F1039 WeakPolarHBondContact CE2-O 3.43Å; Y1013-F1039 HydrophobicContact CG-CB 3.95Å; Y1013-F1039 AromaticContact CZ-CD1 3.39Å; Y1013-F1039 AromaticContact CZ-CG 3.06Å; Y1013-F1039 VanDerWaalsContact OH-CB 3.23Å; Y1013-F1039 WeakPolarHBondContact OH-CB 3.43Å; Y1013-F1039 WeakPolarHBondContact OH-CD1 3.43Å; Y1013-F1039 VanDerWaalsContact OH-CG 3.3Å; Y1013-F1039 WeakPolarHBondContact OH-CG 3.39Å; Y1013-D1040 HydrophobicContact CD1-CB 4.17Å; Y1013-D1040 WeakPolarHBondContact CD1-OD2 3.34Å; Y1013-D1040 HydrophobicContact CE1-CB 3.97Å; Y1013-D1040 WeakPolarHBondContact CE1-OD2 3.28Å; Y1013-D1040 PolarHBondContact OH-N 3.28Å
1014	D	26.1	Very low	31.3	Very low	73 Å²	73	112.5 Å²	112.5	39%	0.39	64%	0.644	S	S	.	*	S	Bend	cis	-149.2	154.6	-44.6	-121.4	-16.4	0	0	0	109.1	A1012 S1038 F1039	A1012-D1014 WeakPolarHBondContact CB-OD1 3.26Å; D1014-S1038 WeakPolarHBondContact OD2-CA 3.38Å; D1014-S1038 WeakPolarHBondContact OD2-CB 3.46Å; D1014-S1038 PolarHBondContact OD2-OG 3.27Å; D1014-F1039 PolarHBondContact OD2-N 3.15Å
1015	A	29.4	Very low	31.4	Very low	47 Å²	47	110.1 Å²	110.1	39%	0.388	64%	0.643	S	S	.	*			cis	-131.3	-86.5	-3.8	0	0	0	0	0	111.7
1016	T	33.7	Very low	31.5	Very low	119 Å²	119	109.4 Å²	109.4	73%	0.73	65%	0.648	S	S	*	*			cis	-141.9	160.4	-3.2	-46.4	0	0	0	0	109.8	M1018	T1016-M1018 PolarHBondContact O-N 3.36Å
1017	S	32	Very low	31.9	Very low	98 Å²	98	107.9 Å²	107.9	69%	0.685	64%	0.64	S	S	*	*			trans	-29.7	120.7	-174.2	55.6	0	0	0	0	118.3
1018	M	30.4	Very low	32.1	Very low	187 Å²	187	113.5 Å²	113.5	92%	0.921	64%	0.643	S	S	*	*			trans	60	126	140.2	-52	-64.4	178.2	0	0	118.6	T1016	T1016-M1018 PolarHBondContact O-N 3.36Å
1019	G	34.7	Very low	32.4	Very low	37 Å²	37	108.1 Å²	108.1	38%	0.381	64%	0.635	S	S	.	*			cis	-161.3	-132.1	5	0	0	0	0	0	110	R1008	R1008-G1019 PolarHBondContact NH1-O 3.1Å
1020	T	37.1	Very low	31.8	Very low	115 Å²	115	109.4 Å²	109.4	71%	0.706	63%	0.631	S	S	*	*			cis	168.2	150.1	-14.5	24.3	0	0	0	0	107.7
1021	T	37.5	Very low	32.1	Very low	87 Å²	87	110.3 Å²	110.3	53%	0.534	63%	0.629	S	S	.	*			cis	-178	144.8	-12.7	24.1	0	0	0	0	108	K341	K341-T1021 PolarHBondContact NZ-O 2.94Å
1022	T	37.2	Very low	32.1	Very low	130 Å²	130	110.7 Å²	110.7	80%	0.798	63%	0.632	S	S	*	*			cis	-148.4	-79.9	-20.8	0.8	0	0	0	0	116.4
1023	P	34.7	Very low	32.1	Very low	116 Å²	116	116.1 Å²	116.1	75%	0.753	66%	0.656	S	S	*	*			trans	-135.2	165.9	-138	42.2	-25.4	0	0	0	121.2
1024	I	31.1	Very low	32.3	Very low	161 Å²	161	116.6 Å²	116.6	83%	0.826	67%	0.67	S	S	*	*			trans	-85.4	157.5	164.3	-70.4	170.5	0	0	0	110.9
1025	Q	31.4	Very low	32.4	Very low	178 Å²	178	120.8 Å²	120.8	83%	0.832	69%	0.692	S	S	*	*			trans	-106.6	133	174.8	-156.4	-177.4	44.9	0	0	113.6
1026	S	30.1	Very low	32.5	Very low	101 Å²	101	126.2 Å²	126.2	71%	0.706	71%	0.709	S	S	*	*			trans	81.6	154.9	156.1	85.5	0	0	0	0	119.9
1027	P	34.6	Very low	32.2	Very low	101 Å²	101	127.3 Å²	127.3	66%	0.656	70%	0.704	S	S	*	*				-142.2	140	-50.4	36.8	-20.7	0	0	0	116.8
1028	K	30.4	Very low	31.9	Very low	198 Å²	198	125.7 Å²	125.7	86%	0.861	69%	0.693	S	S	*	*			trans	73.5	156.8	131.8	-74.8	-173.9	175.8	-177.1	0	121
1029	P	34.5	Very low	31.6	Very low	98 Å²	98	123.9 Å²	123.9	64%	0.636	68%	0.68	S	S	*	*			cis	-146.1	179.1	-27.4	35.9	-14.8	0	0	0	117.3
1030	I	30.7	Very low	31.1	Very low	101 Å²	101	127 Å²	127	52%	0.518	69%	0.687	S	S	.	*			trans	77.3	132.4	157.1	-38.1	-168	0	0	0	116.2	E1111	I1030-E1111 WeakPolarHBondContact CG2-OE2 3.39Å; I1030-E1111 WeakPolarHBondContact O-CG 3.31Å
1031	I	35.1	Very low	30.5	Very low	118 Å²	118	126.5 Å²	126.5	61%	0.605	68%	0.68	S	S	*	*			cis	-144.8	147.6	-14.6	-113.4	168.7	0	0	0	113.2
1032	N	29.8	Very low	29.8	Very low	125 Å²	125	127.9 Å²	127.9	67%	0.668	68%	0.681	S	S	*	*			trans	24.6	157	154.1	-49.7	0.3	0	0	0	127.9
1033	D	29	Very low	29.3	Very low	146 Å²	146	127.3 Å²	127.3	78%	0.781	67%	0.669	S	S	*	*			trans	80.6	145.5	153	-60.9	-40.3	0	0	0	122.1
1034	T	29	Very low	29.9	Very low	113 Å²	113	126 Å²	126	69%	0.693	66%	0.658	S	S	*	*			cis	-167.9	166.6	-33.7	-88	0	0	0	0	107.4
1035	L	28.6	Very low	29.9	Very low	161 Å²	161	124.7 Å²	124.7	84%	0.843	65%	0.649	S	S	*	*			trans	79.4	134.6	-177.3	-56.6	176.2	0	0	0	115.8
1036	Q	31.9	Very low	30.6	Very low	160 Å²	160	124.6 Å²	124.6	75%	0.748	64%	0.641	S	S	*	*			cis	71.5	91.3	10.5	-153.4	168.6	-8.2	0	0	114.2
1037	F	26.9	Very low	31.3	Very low	142 Å²	142	126.9 Å²	126.9	62%	0.623	65%	0.645	S	S	*	*			cis	59.2	87.3	47.6	-94.2	-72.4	0	0	0	113.7	L1011 A1012	L1011-F1037 WeakPolarHBondContact O-CD1 3.43Å; L1011-F1037 WeakPolarHBondContact O-CE1 3.31Å; A1012-F1037 HydrophobicContact CB-CD1 4.23Å; A1012-F1037 WeakPolarHBondContact O-CD1 3.17Å; A1012-F1037 WeakPolarHBondContact O-CE1 3.2Å
1038	S	24.9	Very low	31.5	Very low	65 Å²	65	126.8 Å²	126.8	46%	0.455	65%	0.647	S	S	.	*			trans	-170.6	160.9	165.1	-150.3	0	0	0	0	108.2	Y1013 D1014	Y1013-S1038 WeakPolarHBondContact CD2-O 3.24Å; Y1013-S1038 WeakPolarHBondContact CE2-O 3.33Å; D1014-S1038 WeakPolarHBondContact OD2-CA 3.38Å; D1014-S1038 WeakPolarHBondContact OD2-CB 3.46Å; D1014-S1038 PolarHBondContact OD2-OG 3.27Å
1039	F	25.2	Very low	31.8	Very low	149 Å²	149	122.9 Å²	122.9	65%	0.654	64%	0.639	S	S	*	*			trans	89.3	177	150.7	-127.9	-128.4	0	0	0	128.6	Y1013 D1014	Y1013-F1039 VanDerWaalsContact CB-C 3.4Å; Y1013-F1039 WeakPolarHBondContact CB-O 3.45Å; Y1013-F1039 HydrophobicContact CD1-CB 3.71Å; Y1013-F1039 HydrophobicContact CD1-CD2 4.13Å; Y1013-F1039 HydrophobicContact CD1-CG 4.11Å; Y1013-F1039 VanDerWaalsContact CD1-N 3.28Å; Y1013-F1039 WeakPolarHBondContact CD1-O 3.41Å; Y1013-F1039 HydrophobicContact CD2-CB 3.61Å; Y1013-F1039 WeakPolarHBondContact CD2-O 3.28Å; Y1013-F1039 HydrophobicContact CE1-CB 3.02Å; Y1013-F1039 AromaticContact CE1-CD1 3.75Å; Y1013-F1039 HydrophobicContact CE1-CD1 3.75Å; Y1013-F1039 AromaticContact CE1-CD2 3.41Å; Y1013-F1039 HydrophobicContact CE1-CD2 3.41Å; Y1013-F1039 VanDerWaalsContact CE1-CD2 3.41Å; Y1013-F1039 HydrophobicContact CE1-CE2 4.26Å; Y1013-F1039 AromaticContact CE1-CG 3.06Å; Y1013-F1039 HydrophobicContact CE1-CG 3.06Å; Y1013-F1039 HydrophobicContact CE2-CB 2.94Å; Y1013-F1039 HydrophobicContact CE2-CG 4.06Å; Y1013-F1039 WeakPolarHBondContact CE2-O 3.43Å; Y1013-F1039 HydrophobicContact CG-CB 3.95Å; Y1013-F1039 AromaticContact CZ-CD1 3.39Å; Y1013-F1039 AromaticContact CZ-CG 3.06Å; Y1013-F1039 VanDerWaalsContact OH-CB 3.23Å; Y1013-F1039 WeakPolarHBondContact OH-CB 3.43Å; Y1013-F1039 WeakPolarHBondContact OH-CD1 3.43Å; Y1013-F1039 VanDerWaalsContact OH-CG 3.3Å; Y1013-F1039 WeakPolarHBondContact OH-CG 3.39Å; D1014-F1039 PolarHBondContact OD2-N 3.15Å
1040	D	24.1	Very low	31.6	Very low	101 Å²	101	125.7 Å²	125.7	54%	0.54	65%	0.649	S	S	.	*			trans	-139.7	-176.6	-156.9	-58.8	-70	0	0	0	111.6	Y1013 S1340	Y1013-D1040 HydrophobicContact CD1-CB 4.17Å; Y1013-D1040 WeakPolarHBondContact CD1-OD2 3.34Å; Y1013-D1040 HydrophobicContact CE1-CB 3.97Å; Y1013-D1040 WeakPolarHBondContact CE1-OD2 3.28Å; Y1013-D1040 PolarHBondContact OH-N 3.28Å; D1040-S1340 WeakPolarHBondContact O-CB 3.49Å
1041	N	23.7	Very low	31.7	Very low	105 Å²	105	127.2 Å²	127.2	56%	0.561	66%	0.656	S	S	*	*			trans	77.4	143.9	159.4	-57.4	-28.2	0	0	0	119.6	S1340 S1341	N1041-S1340 WeakPolarHBondContact O-CA 3.37Å; N1041-S1340 PolarHBondContact O-N 3.03Å; N1041-S1341 WeakPolarHBondContact CB-OG 3.35Å; N1041-S1341 PolarHBondContact ND2-OG 3.37Å
1042	E	23.4	Very low	31.7	Very low	117 Å²	117	125.9 Å²	125.9	55%	0.547	66%	0.657	S	S	.	*			trans	37.6	-126.7	131.8	-52.7	173.2	106.6	0	0	121.3	P1342	E1042-P1342 WeakPolarHBondContact OE1-CB 3.19Å; E1042-P1342 WeakPolarHBondContact OE1-CG 3.17Å; E1042-P1342 VanDerWaalsContact OE2-CD 3.26Å; E1042-P1342 WeakPolarHBondContact OE2-CD 3.13Å; E1042-P1342 VanDerWaalsContact OE2-CG 3.32Å; E1042-P1342 WeakPolarHBondContact OE2-CG 3.48Å
1043	H	26.8	Very low	31.7	Very low	117 Å²	117	125.1 Å²	125.1	54%	0.542	66%	0.662	S	S	.	*			trans	-128	132.2	-137.1	-99	-77.2	0	0	0	114.5	E1339 S1340 S1341	H1043-E1339 CarbonylContact C-O 3.42Å; H1043-S1340 VanDerWaalsContact N-C 3.31Å; H1043-S1340 CarbonylContact O-C 3.45Å; H1043-S1341 PolarHBondContact O-N 3.37Å
1044	V	46	Very low	32.1	Very low	88 Å²	88	123.1 Å²	123.1	53%	0.533	65%	0.65	S	S	.	*				87.3	126	124.1	162.1	0	0	0	0	121	E1339	V1044-E1339 PolarHBondContact N-O 3.05Å; V1044-E1339 VanDerWaalsContact N-O 3.15Å
1045	Q	31.1	Very low	32.1	Very low	134 Å²	134	123.5 Å²	123.5	63%	0.626	66%	0.655	S	S	*	*			trans	55.8	131	145.3	-75.4	171.2	-2.1	0	0	121.1
1046	R	46.3	Very low	32	Very low	176 Å²	176	120 Å²	120	66%	0.664	64%	0.637	S	S	*	*			trans	74.2	119	137.3	-76.6	-172.5	-150.4	96.6	4	118.1
1047	N	44.8	Very low	31.7	Very low	149 Å²	149	118.5 Å²	118.5	80%	0.797	63%	0.63	S	S	*	*				74.5	158	125.6	-58.4	-6.9	0	0	0	116.2
1048	S	38.4	Very low	31.8	Very low	99 Å²	99	119 Å²	119	69%	0.692	63%	0.631	S	S	*	*			cis	-133	160.8	9.6	66.5	0	0	0	0	112.5
1049	V	37.3	Very low	32	Very low	116 Å²	116	121.1 Å²	121.1	70%	0.703	65%	0.647	S	S	*	*			trans	75.4	133.1	176.4	-158.3	0	0	0	0	109.5
1050	L	31.2	Very low	31.9	Very low	158 Å²	158	119.4 Å²	119.4	83%	0.827	64%	0.644	S	S	*	*				58.9	149.8	58.4	-75.5	160.1	0	0	0	110.1
1051	I	32.1	Very low	32.5	Very low	133 Å²	133	122.4 Å²	122.4	68%	0.682	65%	0.652	S	S	*	*			cis	-151.6	155	5.4	-36.1	154.5	0	0	0	107
1052	S	34.5	Very low	32.5	Very low	89 Å²	89	122.5 Å²	122.5	62%	0.622	66%	0.659	S	S	*	*			trans	58.9	152	150.7	54.2	0	0	0	0	118.7
1053	S	30.3	Very low	32.7	Very low	109 Å²	109	122 Å²	122	76%	0.762	66%	0.664	S	S	*	*			cis	-143.6	135.3	37.2	27.3	0	0	0	0	111.8
1054	I	38.5	Very low	32.5	Very low	104 Å²	104	122.5 Å²	122.5	53%	0.533	67%	0.67	S	S	.	*				72.2	117.7	66	-69.6	175.2	0	0	0	110	N1056	I1054-N1056 HydrophobicContact CG2-CB 3.5Å
1055	P	28.2	Very low	31.5	Very low	122 Å²	122	123.3 Å²	123.3	79%	0.792	67%	0.666	S	S	*	*			cis	-59	133.9	47.7	16.1	-32.8	0	0	0	116.8
1056	N	26.6	Very low	31.1	Very low	88 Å²	88	122.8 Å²	122.8	47%	0.471	66%	0.664	S	S	.	*			cis	34.8	74.3	32.4	-75.8	-14.1	0	0	0	110.7	I1054 K1058	I1054-N1056 HydrophobicContact CG2-CB 3.5Å; N1056-K1058 WeakPolarHBondContact OD1-CE 3.44Å; N1056-K1058 PolarHBondContact OD1-NZ 2.92Å
1057	E	26.4	Very low	30.1	Very low	127 Å²	127	119.8 Å²	119.8	59%	0.593	66%	0.661	S	S	*	*			cis	-137	142.6	42.8	-105.9	69.6	-115.8	0	0	112.7
1058	K	27.8	Very low	29.3	Very low	152 Å²	152	120.6 Å²	120.6	66%	0.661	66%	0.66	S	S	*	*				43	96.9	83.1	-42.3	172	-157	132.7	0	109.5	N1056	N1056-K1058 WeakPolarHBondContact OD1-CE 3.44Å; N1056-K1058 PolarHBondContact OD1-NZ 2.92Å
1059	S	28.9	Very low	28.8	Very low	111 Å²	111	120.3 Å²	120.3	78%	0.776	65%	0.654	S	S	*	*				-140.5	130.2	73.4	-146.6	0	0	0	0	109.7
1060	N	24.3	Very low	28.4	Very low	112 Å²	112	121 Å²	121	60%	0.599	65%	0.652	S	S	*	*				52.2	95	61.9	-139.7	-6.1	0	0	0	111
1061	K	35	Very low	28.4	Very low	164 Å²	164	119 Å²	119	71%	0.713	64%	0.643	S	S	*	*			trans	48.3	117.5	151.6	-56.5	159.2	-170.2	162.1	0	116.9
1062	P	23.8	Very low	28.3	Very low	108 Å²	108	121.3 Å²	121.3	70%	0.701	65%	0.648	S	S	*	*				-122.5	154.7	87.3	-3.4	24.2	0	0	0	112.5	L1064	P1062-L1064 HydrophobicContact CB-CB 4.05Å; P1062-L1064 HydrophobicContact CB-CD1 4.07Å
1063	V	27.7	Very low	28.2	Very low	106 Å²	106	122 Å²	122	64%	0.642	65%	0.65	S	S	*	*			cis	49.6	53.2	2.1	-162.3	0	0	0	0	114.3	F1065	V1063-F1065 HydrophobicContact CG1-CD2 4.07Å; V1063-F1065 HydrophobicContact CG1-CE2 3.92Å
1064	L	24.2	Very low	28.1	Very low	128 Å²	128	121.4 Å²	121.4	67%	0.67	65%	0.646	S	S	*	*			trans	-132.9	132	140.9	-98.5	115.4	0	0	0	106.6	P1062	P1062-L1064 HydrophobicContact CB-CB 4.05Å; P1062-L1064 HydrophobicContact CB-CD1 4.07Å
1065	F	23.3	Very low	28	Very low	104 Å²	104	127.6 Å²	127.6	46%	0.456	66%	0.663	S	S	.	*			cis	61.5	159.2	45.6	-62.1	-81.3	0	0	0	111.3	V1063	V1063-F1065 HydrophobicContact CG1-CD2 4.07Å; V1063-F1065 HydrophobicContact CG1-CE2 3.92Å
1066	E	23.8	Very low	28.2	Very low	123 Å²	123	126.4 Å²	126.4	58%	0.575	66%	0.657	S	S	*	*			cis	-126.8	134.1	-5.8	-136.7	108.7	-161.7	0	0	107
1067	D	24.8	Very low	28.2	Very low	114 Å²	114	127.6 Å²	127.6	61%	0.61	67%	0.671	S	S	*	*				44.8	153.4	119.8	-64.6	13.2	0	0	0	122.2
1068	E	27.4	Very low	28.2	Very low	165 Å²	165	128.1 Å²	128.1	77%	0.771	68%	0.677	S	S	*	*			trans	76.5	158.4	137.4	-85.7	-178.5	173.3	0	0	119.8
1069	T	28	Very low	28.2	Very low	94 Å²	94	128.4 Å²	128.4	58%	0.577	68%	0.683	S	S	*	*			cis	-147.1	-179.7	2.6	-1.8	0	0	0	0	111.4
1070	I	30	Very low	28.6	Very low	129 Å²	129	127.1 Å²	127.1	66%	0.662	67%	0.674	S	S	*	*			trans	50.3	106	139.2	-69.5	163.1	0	0	0	115.5
1071	N	30.7	Very low	28.7	Very low	118 Å²	118	126.5 Å²	126.5	63%	0.631	68%	0.677	S	S	*	*			cis	-160	136.3	36.8	-98.9	-29.2	0	0	0	110
1072	K	29.4	Very low	28.9	Very low	180 Å²	180	127.2 Å²	127.2	78%	0.783	69%	0.687	S	S	*	*				64.5	146.5	82.2	-71.7	-171	-169.3	168.1	0	114.9
1073	P	33.5	Very low	29.6	Very low	104 Å²	104	129.3 Å²	129.3	68%	0.675	69%	0.688	S	S	*	*			cis	-140.7	-170.5	-24.7	37.1	-17.9	0	0	0	113.6
1074	S	28.6	Very low	29.6	Very low	97 Å²	97	136 Å²	136	68%	0.678	70%	0.701	S	S	*	*			trans	65.2	150.8	155.5	46.9	0	0	0	0	118.2
1075	R	34.8	Very low	30	Very low	234 Å²	234	137.5 Å²	137.5	88%	0.883	71%	0.708	S	S	*	*			cis	-159.3	157.8	-7.1	-106.4	161	179.6	175.1	-2.1	104.1
1076	S	32.3	Very low	30.5	Very low	97 Å²	97	138.9 Å²	138.9	68%	0.678	73%	0.726	S	S	*	*			cis	-170.4	169.8	-5.2	39.6	0	0	0	0	108.6
1077	C	27.7	Very low	31	Very low	112 Å²	112	138.8 Å²	138.8	76%	0.757	74%	0.739	S	S	*	*			trans	25.8	145.7	140.2	-60.7	0	0	0	0	121.4
1078	L	26.8	Very low	31.2	Very low	138 Å²	138	142.4 Å²	142.4	72%	0.723	75%	0.749	S	S	*	*			cis	-166.4	159.5	5.4	-122.1	164.8	0	0	0	109.2
1079	M	27.3	Very low	31.4	Very low	158 Å²	158	138.6 Å²	138.6	78%	0.778	74%	0.739	S	S	*	*			trans	63.2	151.8	171.7	-60.9	-51.8	-170	0	0	116.6
1080	S	37.4	Very low	31.8	Very low	85 Å²	85	137.3 Å²	137.3	59%	0.594	73%	0.734	S	S	*	*			cis	-157.5	119.5	-17.8	44.4	0	0	0	0	111.2
1081	C	26.9	Very low	31.9	Very low	99 Å²	99	143 Å²	143	67%	0.669	75%	0.747	S	S	*	*			trans	62.5	152.4	153.8	-58	0	0	0	0	120.3
1082	I	39.5	Very low	32	Very low	179 Å²	179	144.6 Å²	144.6	92%	0.918	76%	0.755	S	S	*	*	S	Bend	trans	62.5	72.2	168.8	-48.7	164.6	0	0	0	113.4
1083	Q	36.9	Very low	32.2	Very low	152 Å²	152	141.4 Å²	141.4	71%	0.71	74%	0.742	S	S	*	*			trans	-149.7	101	-143.2	-167.1	174.4	22.5	0	0	115.1
1084	R	29	Very low	31.9	Very low	246 Å²	246	141.5 Å²	141.5	93%	0.928	73%	0.729	S	S	*	*			trans	172	142.2	166.2	-99	168.9	-159.8	-173.5	7.1	106.2
1085	I	31.1	Very low	31.8	Very low	159 Å²	159	140.9 Å²	140.9	82%	0.815	72%	0.723	S	S	*	*			cis	-137.4	105	19.6	-56.8	171.7	0	0	0	109.6
1086	T	35.6	Very low	31.6	Very low	134 Å²	134	134.4 Å²	134.4	82%	0.822	71%	0.706	S	S	*	*			trans	-149.3	100.2	176.2	37.3	0	0	0	0	111.9
1087	S	32.5	Very low	31.6	Very low	121 Å²	121	133.4 Å²	133.4	85%	0.846	70%	0.696	S	S	*	*			trans	166.7	80.8	155.1	38.4	0	0	0	0	112.4
1088	F	30.1	Very low	31.6	Very low	190 Å²	190	132.6 Å²	132.6	83%	0.833	68%	0.684	S	S	*	*			trans	-128.1	71.2	165.7	-153	-99.2	0	0	0	110.8
1089	C	31.6	Very low	31.8	Very low	84 Å²	84	130.5 Å²	130.5	57%	0.568	68%	0.677	S	S	*	*			trans	-137.9	130.3	178.5	-75.4	0	0	0	0	109.3	Y934	Y934-C1089 HydrophobicContact CD2-CB 4.12Å; Y934-C1089 HydrophobicContact CE2-CB 3.49Å; Y934-C1089 VanDerWaalsContact CE2-CB 3.49Å; Y934-C1089 WeakPolarHBondContact CE2-SG 3.32Å
1090	S	35.7	Very low	31.9	Very low	67 Å²	67	129.3 Å²	129.3	47%	0.469	67%	0.668	S	S	.	*	S	Bend	trans	45	83.5	167.7	51.1	0	0	0	0	117.7	Y934	Y934-S1090 VanDerWaalsContact CD1-CB 3.48Å; Y934-S1090 VanDerWaalsContact CE1-CB 3.48Å; Y934-S1090 WeakPolarHBondContact CE1-OG 3.22Å
1091	R	31.8	Very low	31.5	Very low	248 Å²	248	133.5 Å²	133.5	94%	0.936	68%	0.675	S	S	*	*			trans	-170.2	-12.7	141.7	-109.6	168.4	-160.4	-163.6	6	117.6	F1093	R1091-F1093 PolarHBondContact O-N 2.74Å
1092	L	34.2	Very low	31.7	Very low	153 Å²	153	134.8 Å²	134.8	80%	0.801	68%	0.68	S	S	*	*			trans	-96.6	92	180	-86.3	170.1	0	0	0	113.1
1093	F	32.5	Very low	31.2	Very low	113 Å²	113	132.7 Å²	132.7	50%	0.496	67%	0.671	S	S	.	*			trans	-158.3	55.1	172.3	-164.2	-46.7	0	0	0	107.2	S936 A937 T938 R1091	S936-F1093 VanDerWaalsContact CA-CE2 3.42Å; A937-F1093 HydrophobicContact CB-CB 4Å; A937-F1093 HydrophobicContact CB-CD1 4.09Å; A937-F1093 HydrophobicContact CB-CG 4.16Å; A937-F1093 VanDerWaalsContact CB-O 3.27Å; A937-F1093 WeakPolarHBondContact CB-O 3.36Å; A937-F1093 VanDerWaalsContact N-CD1 3.28Å; A937-F1093 VanDerWaalsContact N-CD2 3.34Å; A937-F1093 WeakPolarHBondContact O-CE1 3.45Å; T938-F1093 PolarHBondContact N-O 3.43Å; R1091-F1093 PolarHBondContact O-N 2.74Å
1094	R	28.1	Very low	30.9	Very low	106 Å²	106	135.3 Å²	135.3	40%	0.4	68%	0.679	S	S	.	*			trans	-166	125	-177.8	-134	101	-145.9	-168	9.4	111.2	T938 R939	T938-R1094 VanDerWaalsContact C-CZ 3.46Å; T938-R1094 VanDerWaalsContact O-CA 3.31Å; T938-R1094 WeakPolarHBondContact O-CA 3.46Å; T938-R1094 WeakPolarHBondContact O-CD 3.37Å; T938-R1094 WeakPolarHBondContact O-CG 3.49Å; T938-R1094 PolarHBondContact O-NE 3.1Å; T938-R1094 PolarHBondContact OG1-NH2 2.96Å; R939-R1094 HydrophobicContact CB-CG 3.82Å; R939-R1094 VanDerWaalsContact CB-NE 3.29Å
1095	C	26.9	Very low	30.9	Very low	83 Å²	83	126.7 Å²	126.7	56%	0.561	67%	0.667	S	S	*	*			trans	59.5	115.6	168.7	-41.5	0	0	0	0	115.9	R939 N940	R939-C1095 PolarHBondContact O-N 3.4Å; N940-C1095 WeakPolarHBondContact O-CA 3.5Å; N940-C1095 WeakPolarHBondContact O-CB 3.45Å; N940-C1095 PolarHBondContact O-SG 2.88Å
1096	N	29.5	Very low	30.7	Very low	98 Å²	98	127.1 Å²	127.1	52%	0.524	67%	0.67	S	S	.	*			cis	66.7	131.3	39.4	-154.9	77.3	0	0	0	114	N940 N941	N940-N1096 WeakPolarHBondContact O-CB 3.04Å; N941-N1096 VanDerWaalsContact C-ND2 3.33Å; N941-N1096 PolarHBondContact N-ND2 3.42Å
1097	T	32.3	Very low	30.3	Very low	76 Å²	76	125.2 Å²	125.2	47%	0.466	66%	0.662	S	S	.	*			trans	61.8	158.5	162.5	37.2	0	0	0	0	117.4	N941 D942	N941-T1097 PolarHBondContact O-OG1 3.11Å; D942-T1097 HydrophobicContact CB-CG2 4.37Å; D942-T1097 WeakPolarHBondContact O-CG2 3.47Å
1098	D	28.6	Very low	30	Very low	96 Å²	96	127 Å²	127	51%	0.513	66%	0.662	S	S	.	*			cis	-134	159	9.7	-161	11.4	0	0	0	114.6	K1100	D1098-K1100 IonicContact OD1-NZ 3.64Å; D1098-K1100 IonicContact OD2-NZ 3.76Å; D1098-K1100 PolarHBondContact OD2-NZ 3.5Å
1099	T	30.4	Very low	29.9	Very low	94 Å²	94	122.4 Å²	122.4	58%	0.577	65%	0.653	S	S	*	*			trans	-45	148.6	162.8	59.8	0	0	0	0	114.9
1100	K	29.1	Very low	29.7	Very low	133 Å²	133	125.5 Å²	125.5	58%	0.578	66%	0.659	S	S	*	*				-173.8	140.1	106.1	-89.7	148	-149.3	70.2	0	109.3	D1098	D1098-K1100 IonicContact OD1-NZ 3.64Å; D1098-K1100 IonicContact OD2-NZ 3.76Å; D1098-K1100 PolarHBondContact OD2-NZ 3.5Å
1101	K	29.7	Very low	29.3	Very low	173 Å²	173	126.7 Å²	126.7	75%	0.752	66%	0.657	S	S	*	*				49.5	134.4	108.1	-48.9	178.5	-177.1	179.4	0	113
1102	V	29.5	Very low	29.1	Very low	125 Å²	125	118.7 Å²	118.7	76%	0.758	64%	0.639	S	S	*	*			cis	-146.6	124.3	46.4	159.4	0	0	0	0	109.2
1103	N	30	Very low	28.8	Very low	136 Å²	136	118.5 Å²	118.5	73%	0.727	65%	0.645	S	S	*	*				59.4	81	75.2	-89.2	17.9	0	0	0	115.8
1104	K	30.7	Very low	28.7	Very low	206 Å²	206	116.5 Å²	116.5	90%	0.896	66%	0.656	S	S	*	*			trans	174.1	130.8	140.4	-92.4	148.6	-173.9	-175.4	0	107.6
1105	G	29.1	Very low	28.9	Very low	65 Å²	65	118.6 Å²	118.6	67%	0.67	67%	0.674	S	S	*	*			cis	108.9	153.7	7	0	0	0	0	0	111.6
1106	L	26.7	Very low	28.9	Very low	169 Å²	169	123.8 Å²	123.8	89%	0.885	69%	0.687	S	S	*	*			trans	69.3	139.6	-160.7	-78.8	58.1	0	0	0	112.8
1107	S	27.3	Very low	29	Very low	93 Å²	93	121.4 Å²	121.4	65%	0.65	69%	0.686	S	S	*	*			cis	-164.4	165.3	-13.6	39.2	0	0	0	0	112.1
1108	L	26.8	Very low	29.1	Very low	159 Å²	159	124.2 Å²	124.2	83%	0.832	71%	0.705	S	S	*	*			trans	7.6	150.5	141.8	-76.9	61.9	0	0	0	118.3
1109	S	27	Very low	29.1	Very low	94 Å²	94	127.5 Å²	127.5	66%	0.657	72%	0.715	S	S	*	*			cis	179	174.4	0.2	49.6	0	0	0	0	106.2
1110	Q	27.5	Very low	29.3	Very low	148 Å²	148	126.8 Å²	126.8	69%	0.692	71%	0.705	S	S	*	*			cis	-158.7	-179.8	7.3	-144.4	162	-99.4	0	0	107.9
1111	E	26.5	Very low	29.8	Very low	92 Å²	92	128 Å²	128	43%	0.43	71%	0.71	S	S	.	*			trans	60.5	-179	169.2	-61.7	127.2	-144.5	0	0	116.7	I1030	I1030-E1111 WeakPolarHBondContact CG2-OE2 3.39Å; I1030-E1111 WeakPolarHBondContact O-CG 3.31Å
1112	S	29.3	Very low	30.1	Very low	80 Å²	80	122.6 Å²	122.6	56%	0.559	70%	0.698	S	S	*	*				-140.7	158.2	-82.6	78.8	0	0	0	0	114.1
1113	T	27.5	Very low	30.6	Very low	149 Å²	149	119.1 Å²	119.1	91%	0.914	68%	0.677	S	S	*	*			trans	67.7	169.8	178.8	79.8	0	0	0	0	116.5
1114	G	31	Very low	31.1	Very low	72 Å²	72	117.1 Å²	117.1	74%	0.742	67%	0.666	S	S	*	*			trans	118.3	94.3	170	0	0	0	0	0	119.3
1115	I	30.7	Very low	31.3	Very low	150 Å²	150	116.4 Å²	116.4	77%	0.769	66%	0.658	S	S	*	*				-5.8	144.5	128.8	-83.3	168.6	0	0	0	116.8
1116	K	28.4	Very low	31.8	Very low	192 Å²	192	116 Å²	116	84%	0.835	65%	0.648	S	S	*	*			cis	-155.1	159.8	2.4	-114.3	166.4	-152.1	163.9	0	109.5
1117	G	31.8	Very low	32.4	Very low	48 Å²	48	113.2 Å²	113.2	50%	0.495	63%	0.632	S	S	.	*			trans	-149.6	145.7	163.7	0	0	0	0	0	110.8	K1119	G1117-K1119 PolarHBondContact O-N 3.48Å
1118	P	33.8	Very low	33.1	Very low	134 Å²	134	111.6 Å²	111.6	87%	0.87	62%	0.624	S	S	*	*			trans	-70.2	121.7	-169.2	26.7	-33.9	0	0	0	112.4
1119	K	28.8	Very low	33.7	Very low	166 Å²	166	106.7 Å²	106.7	72%	0.722	61%	0.606	S	S	*	*			trans	-131.2	42.1	-172.1	-73.7	-176.9	177.3	178.2	0	113.6	G1117	G1117-K1119 PolarHBondContact O-N 3.48Å
1120	E	34.2	Very low	34.3	Very low	79 Å²	79	108 Å²	108	37%	0.369	61%	0.605	S	S	.	*	H	α-helix	trans	-102.6	-2.3	-166.8	-67.7	178.9	-123.4	0	0	115.5	A1122 T1123 K1738	E1120-A1122 VanDerWaalsContact C-N 3.31Å; E1120-T1123 PolarHBondContact O-OG1 2.9Å; E1120-K1738 VanDerWaalsContact CD-NZ 3.26Å; E1120-K1738 IonicContact OE1-NZ 2.88Å; E1120-K1738 PolarHBondContact OE1-NZ 3.26Å; E1120-K1738 WeakPolarHBondContact OE2-CG 3.49Å; E1120-K1738 IonicContact OE2-NZ 3.12Å; E1120-K1738 PolarHBondContact OE2-NZ 3.32Å
1121	F	39.9	Very low	35.1	Very low	157 Å²	157	103.7 Å²	103.7	69%	0.689	60%	0.595	S	S	*	*	H	α-helix	trans	-83.2	-8.6	161.1	-125.7	-88.3	0	0	0	113.5
1122	A	36.4	Very low	35.9	Very low	60 Å²	60	102 Å²	102	50%	0.496	60%	0.597	S	S	.	*	H	α-helix	trans	-85.5	-36.2	172.9	0	0	0	0	0	111.7	E1120 L1124 A1126	E1120-A1122 VanDerWaalsContact C-N 3.31Å; A1122-L1124 PolarHBondContact O-N 3.37Å; A1122-A1126 WeakPolarHBondContact O-CA 3.18Å; A1122-A1126 WeakPolarHBondContact O-CB 3.35Å; A1122-A1126 PolarHBondContact O-N 3.42Å
1123	T	38.5	Very low	36.4	Very low	53 Å²	53	100.3 Å²	100.3	33%	0.325	59%	0.587	S	S	.	*	H	α-helix	trans	-63.7	-42	-175.2	45.1	0	0	0	0	112.9	E1120 A1126 M1127	E1120-T1123 PolarHBondContact O-OG1 2.9Å; T1123-A1126 CarbonylContact O-C 3.41Å; T1123-A1126 PolarHBondContact O-N 3.06Å; T1123-M1127 VanDerWaalsContact O-CB 3.23Å; T1123-M1127 WeakPolarHBondContact O-CB 3.42Å; T1123-M1127 WeakPolarHBondContact O-CG 3.36Å; T1123-M1127 PolarHBondContact O-N 3.15Å
1124	L	41.4	Very low	37.1	Very low	93 Å²	93	97.6 Å²	97.6	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-69.8	-42.5	-178.6	-147.8	159.4	0	0	0	111.9	A1122 A1128 V1737	A1122-L1124 PolarHBondContact O-N 3.37Å; L1124-A1128 WeakPolarHBondContact O-CB 3.46Å; L1124-A1128 PolarHBondContact O-N 3.02Å; L1124-V1737 HydrophobicContact CD1-CG1 4.18Å; L1124-V1737 HydrophobicContact CD1-CG2 4.44Å
1125	R	35.7	Very low	37.5	Very low	192 Å²	192	97.4 Å²	97.4	73%	0.725	56%	0.562	S	S	*	*	H	α-helix	trans	-71.3	-29.9	173.9	-173.1	171.5	-77.4	143	-4.3	112.5	A1129	R1125-A1129 WeakPolarHBondContact O-CB 3.49Å; R1125-A1129 PolarHBondContact O-N 3Å
1126	A	39.1	Very low	37.8	Very low	55 Å²	55	93.5 Å²	93.5	46%	0.455	55%	0.553	S	S	.	*	H	α-helix	trans	-78.9	-31.3	174.6	0	0	0	0	0	112.8	A1122 T1123 L1130	A1122-A1126 WeakPolarHBondContact O-CA 3.18Å; A1122-A1126 WeakPolarHBondContact O-CB 3.35Å; A1122-A1126 PolarHBondContact O-N 3.42Å; T1123-A1126 CarbonylContact O-C 3.41Å; T1123-A1126 PolarHBondContact O-N 3.06Å; A1126-L1130 WeakPolarHBondContact O-CA 3.42Å; A1126-L1130 WeakPolarHBondContact O-CB 3.42Å; A1126-L1130 PolarHBondContact O-N 3.43Å
1127	M	38	Very low	38.5	Very low	112 Å²	112	90.1 Å²	90.1	55%	0.552	55%	0.548	S	S	*	.	H	α-helix	trans	-72	-42.4	171.8	-74	165.5	-180	0	0	110.2	T1123 L1130 A1131	T1123-M1127 VanDerWaalsContact O-CB 3.23Å; T1123-M1127 WeakPolarHBondContact O-CB 3.42Å; T1123-M1127 WeakPolarHBondContact O-CG 3.36Å; T1123-M1127 PolarHBondContact O-N 3.15Å; M1127-L1130 PolarHBondContact O-N 2.87Å; M1127-A1131 WeakPolarHBondContact O-CB 3.46Å; M1127-A1131 PolarHBondContact O-N 3.42Å
1128	A	42.4	Very low	38.8	Very low	58 Å²	58	91.7 Å²	91.7	48%	0.479	56%	0.556	S	S	.	*	H	α-helix	trans	-62.5	-42.9	170.8	0	0	0	0	0	111.8	L1124 A1132	L1124-A1128 WeakPolarHBondContact O-CB 3.46Å; L1124-A1128 PolarHBondContact O-N 3.02Å; A1128-A1132 WeakPolarHBondContact O-CB 3.49Å; A1128-A1132 PolarHBondContact O-N 2.69Å
1129	A	39.5	Very low	38.9	Very low	57 Å²	57	91.1 Å²	91.1	47%	0.471	55%	0.55	S	S	.	*	H	α-helix	trans	-73.9	-26.4	176.7	0	0	0	0	0	113.7	R1125 A1133	R1125-A1129 WeakPolarHBondContact O-CB 3.49Å; R1125-A1129 PolarHBondContact O-N 3Å; A1129-A1133 WeakPolarHBondContact O-CA 3.16Å; A1129-A1133 WeakPolarHBondContact O-CB 3.41Å; A1129-A1133 PolarHBondContact O-N 3.4Å
1130	L	40.8	Very low	39.1	Very low	120 Å²	120	87.6 Å²	87.6	63%	0.628	55%	0.552	S	S	*	*	H	α-helix	trans	-77.3	-44	174	-171.4	104.5	0	0	0	110.2	A1126 M1127 A1133 T1134	A1126-L1130 WeakPolarHBondContact O-CA 3.42Å; A1126-L1130 WeakPolarHBondContact O-CB 3.42Å; A1126-L1130 PolarHBondContact O-N 3.43Å; M1127-L1130 PolarHBondContact O-N 2.87Å; L1130-A1133 CarbonylContact O-C 3.52Å; L1130-A1133 PolarHBondContact O-N 3.2Å; L1130-T1134 WeakPolarHBondContact O-CG2 3.34Å; L1130-T1134 PolarHBondContact O-N 3.17Å; L1130-T1134 PolarHBondContact O-OG1 3.42Å
1131	A	43.5	Very low	38.9	Very low	58 Å²	58	91.3 Å²	91.3	48%	0.479	58%	0.575	S	S	.	*	H	α-helix	trans	-61.3	-45.6	172.7	0	0	0	0	0	111.3	M1127 A1133 T1134 A1135	M1127-A1131 WeakPolarHBondContact O-CB 3.46Å; M1127-A1131 PolarHBondContact O-N 3.42Å; A1131-A1133 VanDerWaalsContact C-N 3.34Å; A1131-A1133 PolarHBondContact O-N 2.76Å; A1131-T1134 WeakPolarHBondContact CA-OG1 3.46Å; A1131-T1134 PolarHBondContact O-N 3.15Å; A1131-T1134 PolarHBondContact O-OG1 3.27Å; A1131-A1135 WeakPolarHBondContact O-CB 3.43Å; A1131-A1135 PolarHBondContact O-N 3.12Å
1132	A	42.6	Very low	38.6	Very low	57 Å²	57	88.6 Å²	88.6	47%	0.471	57%	0.572	S	S	.	*	H	α-helix	trans	-66.8	-32.4	173.5	0	0	0	0	0	112.5	A1128 A1136	A1128-A1132 WeakPolarHBondContact O-CB 3.49Å; A1128-A1132 PolarHBondContact O-N 2.69Å; A1132-A1136 WeakPolarHBondContact O-CB 3.4Å; A1132-A1136 PolarHBondContact O-N 2.86Å
1133	A	39.6	Very low	38.4	Very low	44 Å²	44	91.7 Å²	91.7	36%	0.364	59%	0.585	S	S	.	*	H	α-helix	trans	-71.5	-40.4	172.9	0	0	0	0	0	112.1	A1129 L1130 A1131 A1135 A1136 T1137	A1129-A1133 WeakPolarHBondContact O-CA 3.16Å; A1129-A1133 WeakPolarHBondContact O-CB 3.41Å; A1129-A1133 PolarHBondContact O-N 3.4Å; L1130-A1133 CarbonylContact O-C 3.52Å; L1130-A1133 PolarHBondContact O-N 3.2Å; A1131-A1133 VanDerWaalsContact C-N 3.34Å; A1131-A1133 PolarHBondContact O-N 2.76Å; A1133-A1135 VanDerWaalsContact C-N 3.29Å; A1133-A1135 PolarHBondContact O-N 3.44Å; A1133-A1136 PolarHBondContact O-N 3.43Å; A1133-T1137 WeakPolarHBondContact O-CB 3.22Å; A1133-T1137 WeakPolarHBondContact O-CG2 3.3Å; A1133-T1137 PolarHBondContact O-N 3.05Å; A1133-T1137 PolarHBondContact O-OG1 3.18Å
1134	T	42.2	Very low	38.1	Very low	92 Å²	92	99.5 Å²	99.5	56%	0.564	62%	0.615	S	S	*	*	H	α-helix	trans	-67	-32.1	175.1	47.3	0	0	0	0	111.8	L1130 A1131	L1130-T1134 WeakPolarHBondContact O-CG2 3.34Å; L1130-T1134 PolarHBondContact O-N 3.17Å; L1130-T1134 PolarHBondContact O-OG1 3.42Å; A1131-T1134 WeakPolarHBondContact CA-OG1 3.46Å; A1131-T1134 PolarHBondContact O-N 3.15Å; A1131-T1134 PolarHBondContact O-OG1 3.27Å
1135	A	40.8	Very low	37.6	Very low	68 Å²	68	101.1 Å²	101.1	56%	0.562	63%	0.629	S	S	*	*	H	α-helix	trans	-72.1	-42.4	170.4	0	0	0	0	0	112.3	A1131 A1133 A1138	A1131-A1135 WeakPolarHBondContact O-CB 3.43Å; A1131-A1135 PolarHBondContact O-N 3.12Å; A1133-A1135 VanDerWaalsContact C-N 3.29Å; A1133-A1135 PolarHBondContact O-N 3.44Å; A1135-A1138 PolarHBondContact O-N 3.26Å
1136	A	36.9	Very low	37.3	Very low	69 Å²	69	98.3 Å²	98.3	57%	0.57	63%	0.633	S	S	*	*	H	α-helix	trans	-77	-26.9	-177.5	0	0	0	0	0	114	A1132 A1133 A1138 V1139	A1132-A1136 WeakPolarHBondContact O-CB 3.4Å; A1132-A1136 PolarHBondContact O-N 2.86Å; A1133-A1136 PolarHBondContact O-N 3.43Å; A1136-A1138 PolarHBondContact O-N 2.87Å; A1136-V1139 PolarHBondContact O-N 3.05Å
1137	T	43.8	Very low	36.8	Very low	120 Å²	120	104.4 Å²	104.4	74%	0.736	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-3.8	175.9	49.7	0	0	0	0	113.5	A1133	A1133-T1137 WeakPolarHBondContact O-CB 3.22Å; A1133-T1137 WeakPolarHBondContact O-CG2 3.3Å; A1133-T1137 PolarHBondContact O-N 3.05Å; A1133-T1137 PolarHBondContact O-OG1 3.18Å
1138	A	37.5	Very low	36.4	Very low	81 Å²	81	102.1 Å²	102.1	67%	0.669	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-14.3	170.9	0	0	0	0	0	113.5	A1135 A1136	A1135-A1138 PolarHBondContact O-N 3.26Å; A1136-A1138 PolarHBondContact O-N 2.87Å
1139	V	34.8	Very low	35.8	Very low	122 Å²	122	107.7 Å²	107.7	74%	0.739	68%	0.679	S	S	*	*	S	Bend	trans	-142.2	81	-173.7	-170.6	0	0	0	0	112.2	A1136	A1136-V1139 PolarHBondContact O-N 3.05Å
1140	A	33.1	Very low	35.2	Very low	92 Å²	92	111.5 Å²	111.5	76%	0.76	69%	0.691	S	S	*	*			trans	174.4	114.1	143.7	0	0	0	0	0	112.8
1141	D	30.8	Very low	34.8	Very low	158 Å²	158	113.8 Å²	113.8	85%	0.845	70%	0.702	S	S	*	*				-154.9	108.5	129.3	-156.3	14.6	0	0	0	110.4
1142	P	33.2	Very low	34.2	Very low	99 Å²	99	117.1 Å²	117.1	64%	0.643	71%	0.71	S	S	*	*			trans	-89.3	-176.4	175.6	36	-33.5	0	0	0	112.1
1143	T	32.8	Very low	33.7	Very low	125 Å²	125	119.6 Å²	119.6	77%	0.767	72%	0.721	S	S	*	*			trans	80.4	78.1	171.8	72.1	0	0	0	0	118
1144	K	31.4	Very low	33	Very low	218 Å²	218	122 Å²	122	95%	0.948	74%	0.735	S	S	*	*			trans	-147.4	95.1	132.7	-113.3	170	-174	179.5	0	110.6
1145	T	30.7	Very low	32.7	Very low	126 Å²	126	125.6 Å²	125.6	77%	0.773	75%	0.751	S	S	*	*			trans	-102.4	125.7	-174.2	47.2	0	0	0	0	112.1
1146	T	29.9	Very low	32.2	Very low	133 Å²	133	131.6 Å²	131.6	82%	0.816	77%	0.765	S	S	*	*			trans	173.7	145.4	153.6	33.4	0	0	0	0	108.6
1147	Q	28.9	Very low	31.9	Very low	184 Å²	184	137.2 Å²	137.2	86%	0.86	78%	0.777	S	S	*	*			cis	-169.9	140.5	-18.4	179.8	170.5	-5.8	0	0	107.8
1148	G	28.6	Very low	31.4	Very low	64 Å²	64	137 Å²	137	66%	0.66	77%	0.768	S	S	*	*			trans	85.3	141.2	177.2	0	0	0	0	0	114.4
1149	D	30.4	Very low	31.2	Very low	174 Å²	174	137.5 Å²	137.5	93%	0.93	76%	0.764	S	S	*	*			cis	-143.7	158.8	-12.3	-113.5	-31.3	0	0	0	112.1
1150	L	28	Very low	31.6	Very low	137 Å²	137	136.5 Å²	136.5	72%	0.717	75%	0.754	S	S	*	*			trans	-111.1	117.7	-155.2	-172.6	76.4	0	0	0	113.7	I1152	L1150-I1152 HydrophobicContact CD1-CD1 3.96Å; L1150-I1152 HydrophobicContact CD1-CG1 4.07Å; L1150-I1152 HydrophobicContact CD2-CD1 4.13Å; L1150-I1152 HydrophobicContact CG-CD1 4.15Å; L1150-I1152 HydrophobicContact CG-CG1 4.33Å
1151	I	31.5	Very low	32.3	Very low	168 Å²	168	135 Å²	135	86%	0.862	73%	0.732	S	S	*	*			trans	-132.7	127.5	157.5	-59.2	-177.4	0	0	0	109.1
1152	I	30.8	Very low	33	Very low	129 Å²	129	132.6 Å²	132.6	66%	0.662	72%	0.716	S	S	*	*			trans	-116.3	134.5	179.3	-67.1	161.3	0	0	0	106.9	L1150	L1150-I1152 HydrophobicContact CD1-CD1 3.96Å; L1150-I1152 HydrophobicContact CD1-CG1 4.07Å; L1150-I1152 HydrophobicContact CD2-CD1 4.13Å; L1150-I1152 HydrophobicContact CG-CD1 4.15Å; L1150-I1152 HydrophobicContact CG-CG1 4.33Å
1153	P	31.5	Very low	33.5	Very low	108 Å²	108	131.6 Å²	131.6	70%	0.701	70%	0.702	S	S	*	*				-147.4	142.6	114.2	36.8	-20.2	0	0	0	116.9
1154	S	26.4	Very low	34.4	Very low	94 Å²	94	127.3 Å²	127.3	66%	0.657	68%	0.676	S	S	*	*			trans	42.8	107	144.4	62	0	0	0	0	121.3
1155	N	34.8	Very low	35.5	Very low	168 Å²	168	121 Å²	121	90%	0.898	65%	0.648	S	S	*	*				-168.3	126.2	113.3	-90.1	-24.1	0	0	0	109
1156	F	30.4	Very low	36.6	Very low	195 Å²	195	119.2 Å²	119.2	86%	0.855	64%	0.641	S	S	*	*			trans	-154.9	103.6	-162.6	178.3	-90.3	0	0	0	112.2
1157	F	31.5	Very low	38.1	Very low	186 Å²	186	114.1 Å²	114.1	82%	0.816	61%	0.609	S	S	*	*			trans	-170.7	169.4	155.3	-120	-83.3	0	0	0	111.4
1158	E	32.9	Very low	39.9	Very low	117 Å²	117	110.6 Å²	110.6	55%	0.547	59%	0.592	S	S	.	*			trans	70	89.6	-178.7	-62.7	-158.7	126.5	0	0	118.3	N309	N309-E1158 PolarHBondContact ND2-OE1 3.02Å
1159	P	33.6	Very low	41.9	Very low	90 Å²	90	108.1 Å²	108.1	58%	0.584	56%	0.564	S	S	*	*			trans	-121.7	13.6	176.5	43.2	-32.2	0	0	0	114.7	K688	K688-P1159 PolarHBondContact NZ-O 3.49Å
1160	D	42.1	Very low	44	Very low	101 Å²	101	103.5 Å²	103.5	54%	0.54	54%	0.539	S	S	.	.			trans	-82.4	-27.3	178.6	-65.8	-34.4	0	0	0	111.8	N311 K688 E1162	N311-D1160 PolarHBondContact ND2-O 3.01Å; N311-D1160 VanDerWaalsContact OD1-C 3.28Å; N311-D1160 PolarHBondContact OD1-O 3.3Å; K688-D1160 IonicContact NZ-OD1 2.68Å; K688-D1160 PolarHBondContact NZ-OD1 3.41Å; D1160-E1162 PolarHBondContact O-N 2.93Å
1161	E	47.2	Very low	46.5	Very low	61 Å²	61	97.7 Å²	97.7	29%	0.285	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn		49.6	-60.3	124.9	-36.2	-123.5	-170.9	0	0	118.8	V310 N311 L312	V310-E1161 VanDerWaalsContact CA-CD 3.47Å; V310-E1161 WeakPolarHBondContact CA-OE1 3.42Å; V310-E1161 HydrophobicContact CB-CG 4.39Å; V310-E1161 HydrophobicContact CG2-CG 3.99Å; V310-E1161 PolarHBondContact N-OE1 3.23Å; N311-E1161 CarbonylContact C-O 3.53Å; N311-E1161 WeakPolarHBondContact CA-O 3.43Å; N311-E1161 WeakPolarHBondContact CA-OE2 3.47Å; N311-E1161 WeakPolarHBondContact CB-O 3.2Å; N311-E1161 PolarHBondContact N-OE2 3.46Å; N311-E1161 WeakPolarHBondContact OD1-CA 3.39Å; N311-E1161 PolarHBondContact OD1-N 2.96Å; N311-E1161 PolarHBondContact OD1-O 2.84Å; N311-E1161 VanDerWaalsContact OD1-O 3.07Å; L312-E1161 WeakPolarHBondContact CA-O 3.4Å; L312-E1161 PolarHBondContact N-O 2.94Å; L312-E1161 PolarHBondContact N-OE2 2.89Å
1162	E	46.7	Very low	49.2	Very low	108 Å²	108	90 Å²	90	51%	0.505	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.5	-5.9	-156.6	-60.7	-159.6	135.7	0	0	116	N311 L312 G313 D1160	N311-E1162 PolarHBondContact OD1-N 2.99Å; L312-E1162 HydrophobicContact CB-CG 4.31Å; L312-E1162 HydrophobicContact CD1-CB 3.89Å; L312-E1162 HydrophobicContact CD1-CG 4.26Å; L312-E1162 WeakPolarHBondContact CD1-O 3.36Å; L312-E1162 HydrophobicContact CG-CB 4.23Å; L312-E1162 HydrophobicContact CG-CG 4.04Å; G313-E1162 VanDerWaalsContact CA-OE1 3.3Å; G313-E1162 WeakPolarHBondContact CA-OE1 3.2Å; G313-E1162 PolarHBondContact N-OE1 3.41Å; D1160-E1162 PolarHBondContact O-N 2.93Å
1163	Q	44.1	Very low	51.9	Low	78 Å²	78	84.1 Å²	84.1	36%	0.364	44%	0.439	S	S	.	.	S	Bend	trans	-101.5	-33.7	-157.9	-61.3	-175.3	-31.8	0	0	113.6	N311 P686 K1165 S1166	N311-Q1163 PolarHBondContact ND2-N 2.84Å; P686-Q1163 HydrophobicContact CG-CB 4.47Å; Q1163-K1165 PolarHBondContact O-N 3.13Å; Q1163-S1166 PolarHBondContact O-N 2.8Å; Q1163-S1166 PolarHBondContact O-OG 2.92Å
1164	T	50.9	Low	54.8	Low	34 Å²	34	79.2 Å²	79.2	21%	0.209	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-70.1	-28.2	178.6	65	0	0	0	0	113.9	N311 S1166 I1167	N311-T1164 PolarHBondContact ND2-N 3.49Å; N311-T1164 PolarHBondContact ND2-OG1 3.23Å; T1164-S1166 PolarHBondContact O-N 2.87Å; T1164-S1166 VanDerWaalsContact O-N 3.16Å; T1164-I1167 PolarHBondContact O-N 3.34Å
1165	K	54.6	Low	57.8	Low	85 Å²	85	74.8 Å²	74.8	37%	0.37	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-63.7	-14.9	175.6	-104.2	-176.3	179.6	167.9	0	113.8	N311 L312 T606 Y608 Q1163	N311-K1165 HydrophobicContact CB-CD 4.49Å; N311-K1165 HydrophobicContact CB-CG 4.44Å; N311-K1165 WeakPolarHBondContact O-CD 3.42Å; N311-K1165 WeakPolarHBondContact O-CE 3.5Å; N311-K1165 PolarHBondContact O-NZ 2.91Å; L312-K1165 HydrophobicContact CB-CD 3.7Å; L312-K1165 HydrophobicContact CD1-CB 4.35Å; L312-K1165 HydrophobicContact CD1-CD 4.37Å; L312-K1165 HydrophobicContact CG-CD 4.45Å; T606-K1165 WeakPolarHBondContact CG2-O 3.49Å; Y608-K1165 HydrophobicContact CD1-CG 4.09Å; Y608-K1165 HydrophobicContact CG-CG 4.23Å; Q1163-K1165 PolarHBondContact O-N 3.13Å
1166	S	54.4	Low	60.5	Low	89 Å²	89	66.8 Å²	66.8	62%	0.622	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-94.9	-9	179.5	71.7	0	0	0	0	114.4	Q1163 T1164 Q1168	Q1163-S1166 PolarHBondContact O-N 2.8Å; Q1163-S1166 PolarHBondContact O-OG 2.92Å; T1164-S1166 PolarHBondContact O-N 2.87Å; T1164-S1166 VanDerWaalsContact O-N 3.16Å; S1166-Q1168 PolarHBondContact O-N 3.46Å
1167	I	61.2	Low	63.4	Low	27 Å²	27	57.7 Å²	57.7	14%	0.138	29%	0.293	C	S	.	.			trans	-91.1	103	-172	-46.1	170.4	0	0	0	109.8	T606 I607 K683 T1164	T606-I1167 WeakPolarHBondContact CA-O 3.47Å; I607-I1167 HydrophobicContact CD1-CB 3.88Å; I607-I1167 HydrophobicContact CD1-CD1 4.36Å; I607-I1167 HydrophobicContact CD1-CG2 3.44Å; I607-I1167 VanDerWaalsContact CD1-CG2 3.44Å; I607-I1167 HydrophobicContact CG1-CB 4.17Å; I607-I1167 HydrophobicContact CG1-CG2 4.09Å; I607-I1167 PolarHBondContact N-O 3.04Å; K683-I1167 WeakPolarHBondContact O-CD1 3.45Å; T1164-I1167 PolarHBondContact O-N 3.34Å
1168	Q	66.3	Low	66.2	Low	109 Å²	109	49 Å²	49	51%	0.509	26%	0.255	S	S	.	.	B	Isolated β-bridge	trans	-74.3	148.3	171.2	-66.3	-179.7	-65.1	0	0	111.5	E602 S1166	E602-Q1168 PolarHBondContact O-NE2 3.33Å; S1166-Q1168 PolarHBondContact O-N 3.46Å
1169	L	71.5	Confident	69	Low	12 Å²	12	43.5 Å²	43.5	6%	0.063	23%	0.229	C	C	.	.			trans	-93.1	129.2	175.5	-73.3	159.8	0	0	0	110.2	L605 I607 L610 F680 R1171 E1175	L605-L1169 HydrophobicContact CD2-CD1 3.77Å; L605-L1169 HydrophobicContact CG-CD1 3.95Å; I607-L1169 HydrophobicContact CD1-CD2 4.48Å; I607-L1169 HydrophobicContact CG1-CD2 3.96Å; I607-L1169 HydrophobicContact CG1-CG 4.08Å; L610-L1169 HydrophobicContact CB-CD1 4.41Å; L610-L1169 HydrophobicContact CD2-CD1 3.93Å; F680-L1169 HydrophobicContact CE2-CD2 3.88Å; F680-L1169 HydrophobicContact CZ-CD2 4.4Å; L1169-R1171 PolarHBondContact O-N 3.14Å; L1169-E1175 HydrophobicContact CD1-CG 4.22Å; L1169-E1175 HydrophobicContact CD2-CG 4.39Å
1170	D	73	Confident	71.7	Confident	77 Å²	77	39.2 Å²	39.2	41%	0.412	20%	0.202	S	C	.	.	S	Bend	trans	-61.4	-22	-173.4	-50.4	-44.6	0	0	0	113.8	K683 Y1262	K683-D1170 IonicContact NZ-OD1 2.63Å; K683-D1170 PolarHBondContact NZ-OD1 2.85Å; K683-D1170 IonicContact NZ-OD2 3.27Å; K683-D1170 PolarHBondContact NZ-OD2 3.4Å; D1170-Y1262 HydrophobicContact CB-CE1 4.02Å; D1170-Y1262 VanDerWaalsContact CB-OH 3.31Å; D1170-Y1262 WeakPolarHBondContact CB-OH 3.48Å; D1170-Y1262 PolarHBondContact OD2-OH 3.32Å
1171	R	82	Confident	74.1	Confident	16 Å²	16	34.5 Å²	34.5	6%	0.06	18%	0.176	C	C	.	.			trans	-144.7	101.2	171.6	-61.1	-160.7	-168.8	163.6	5.5	109.7	L1169 E1196 K1197 E1198 Y1262	L1169-R1171 PolarHBondContact O-N 3.14Å; R1171-E1196 WeakPolarHBondContact CD-OE1 3.29Å; R1171-E1196 IonicContact CZ-OE1 3.31Å; R1171-E1196 IonicContact NE-OE1 3.08Å; R1171-E1196 IonicContact NH1-OE1 3.04Å; R1171-E1196 PolarHBondContact NH1-OE1 2.86Å; R1171-K1197 HydrophobicContact CG-CD 4.4Å; R1171-E1198 IonicContact CZ-OE1 3.35Å; R1171-E1198 IonicContact CZ-OE2 2.88Å; R1171-E1198 IonicContact NH1-OE1 3.53Å; R1171-E1198 IonicContact NH1-OE2 2.81Å; R1171-E1198 PolarHBondContact NH1-OE2 3.06Å; R1171-E1198 IonicContact NH2-OE1 2.63Å; R1171-E1198 PolarHBondContact NH2-OE1 3.01Å; R1171-E1198 IonicContact NH2-OE2 3.08Å; R1171-E1198 PolarHBondContact NH2-OE2 2.93Å; R1171-E1198 VanDerWaalsContact NH2-OE2 3.12Å; R1171-Y1262 VanDerWaalsContact CZ-CD2 3.44Å; R1171-Y1262 VanDerWaalsContact NH2-CD2 3.3Å
1172	P	87.4	Confident	76	Confident	6 Å²	6	31.7 Å²	31.7	4%	0.039	16%	0.163	C	C	.	.	H	α-helix	trans	-76	-29.9	-178.7	30.3	-36.4	0	0	0	113.1	L601 E602 L605 E1175 L1176	L601-P1172 HydrophobicContact CB-CB 4.22Å; L601-P1172 HydrophobicContact CB-CG 3.84Å; E602-P1172 HydrophobicContact CG-CG 3.72Å; L605-P1172 HydrophobicContact CB-CB 3.78Å; L605-P1172 HydrophobicContact CD2-CB 3.63Å; L605-P1172 WeakPolarHBondContact CD2-O 3.39Å; L605-P1172 HydrophobicContact CG-CB 4.36Å; P1172-E1175 PolarHBondContact O-N 3.44Å; P1172-L1176 PolarHBondContact O-N 2.88Å
1173	A	88.2	Confident	77.9	Confident	6 Å²	6	26.9 Å²	26.9	5%	0.05	14%	0.141	C	C	.	.	H	α-helix	trans	-60.3	-50.3	-179.3	0	0	0	0	0	112.1	E1175 L1176 L1177 M1195 E1196	A1173-E1175 VanDerWaalsContact C-N 3.34Å; A1173-E1175 PolarHBondContact O-N 2.95Å; A1173-L1176 PolarHBondContact O-N 3.37Å; A1173-L1177 WeakPolarHBondContact O-CB 3.47Å; A1173-L1177 PolarHBondContact O-N 2.98Å; A1173-M1195 HydrophobicContact CB-CB 4.03Å; A1173-E1196 HydrophobicContact CB-CB 4.37Å
1174	R	90.7	Very high	79.8	Confident	4 Å²	4	23.5 Å²	23.5	2%	0.015	13%	0.128	C	C	.	.	H	α-helix	trans	-52.9	-44.7	172.6	-170.2	-165.3	63.1	-113.7	1.9	113.9	L674 L1177 I1178 E1196 Y1263	L674-R1174 VanDerWaalsContact CD2-NH2 3.3Å; R1174-L1177 WeakPolarHBondContact O-CB 3.44Å; R1174-L1177 PolarHBondContact O-N 3.03Å; R1174-I1178 HydrophobicContact CG-CD1 3.88Å; R1174-I1178 HydrophobicContact CG-CG1 4.48Å; R1174-I1178 WeakPolarHBondContact O-CG1 3.34Å; R1174-I1178 PolarHBondContact O-N 3.32Å; R1174-E1196 HydrophobicContact CB-CG 4.45Å; R1174-E1196 WeakPolarHBondContact CB-OE2 3.37Å; R1174-E1196 PolarHBondContact N-OE2 3.46Å; R1174-Y1263 HydrophobicContact CG-CE1 4.47Å
1175	E	89.6	Confident	81.5	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.009	12%	0.121	C	C	.	.	H	α-helix	trans	-72.1	-34.7	-175.8	-47.4	-60.8	-139.9	0	0	111.2	L605 L610 Y675 L1169 P1172 A1173 W1179	L605-E1175 HydrophobicContact CD2-CB 4.15Å; L610-E1175 HydrophobicContact CD1-CB 4.35Å; L610-E1175 HydrophobicContact CD2-CB 3.84Å; L610-E1175 HydrophobicContact CD2-CG 4.35Å; Y675-E1175 WeakPolarHBondContact CE1-OE1 3.31Å; L1169-E1175 HydrophobicContact CD1-CG 4.22Å; L1169-E1175 HydrophobicContact CD2-CG 4.39Å; P1172-E1175 PolarHBondContact O-N 3.44Å; A1173-E1175 VanDerWaalsContact C-N 3.34Å; A1173-E1175 PolarHBondContact O-N 2.95Å; E1175-W1179 VanDerWaalsContact O-CB 3.29Å; E1175-W1179 WeakPolarHBondContact O-CB 3.47Å; E1175-W1179 PolarHBondContact O-N 2.81Å
1176	L	91.2	Very high	83.2	Confident	0 Å²	0	19 Å²	19	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-68.8	-37.6	171.3	-76.5	164.8	0	0	0	112.3	L583 L601 L605 L613 P1172 A1173 W1179 S1180 F1192	L583-L1176 HydrophobicContact CD1-CD2 4.43Å; L601-L1176 HydrophobicContact CD2-CD1 4.07Å; L605-L1176 HydrophobicContact CD1-CD1 4.24Å; L605-L1176 HydrophobicContact CD1-CD2 3.97Å; L605-L1176 HydrophobicContact CD1-CG 4.06Å; L605-L1176 HydrophobicContact CD2-CD1 4.11Å; L605-L1176 HydrophobicContact CD2-CG 3.87Å; L613-L1176 HydrophobicContact CD1-CD2 4.09Å; P1172-L1176 PolarHBondContact O-N 2.88Å; A1173-L1176 PolarHBondContact O-N 3.37Å; L1176-W1179 HydrophobicContact CD2-CE3 4Å; L1176-W1179 HydrophobicContact CD2-CZ3 4.4Å; L1176-W1179 PolarHBondContact O-N 2.68Å; L1176-S1180 WeakPolarHBondContact O-CB 3.35Å; L1176-S1180 PolarHBondContact O-N 2.63Å; L1176-S1180 PolarHBondContact O-OG 2.93Å; L1176-F1192 HydrophobicContact CB-CD1 3.7Å; L1176-F1192 HydrophobicContact CB-CD2 3.84Å; L1176-F1192 HydrophobicContact CB-CE1 3.83Å; L1176-F1192 HydrophobicContact CB-CE2 3.94Å; L1176-F1192 HydrophobicContact CB-CG 3.76Å; L1176-F1192 HydrophobicContact CB-CZ 3.95Å; L1176-F1192 HydrophobicContact CD1-CD1 4.13Å; L1176-F1192 HydrophobicContact CD1-CE1 3.61Å; L1176-F1192 HydrophobicContact CD1-CZ 3.99Å; L1176-F1192 HydrophobicContact CD2-CZ 4.35Å; L1176-F1192 HydrophobicContact CG-CE1 4.24Å; L1176-F1192 HydrophobicContact CG-CZ 4.32Å
1177	L	92.4	Very high	84.8	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	11%	0.11	C	C	.	.	H	α-helix	trans	-58.5	-50	170.7	171.9	68.1	0	0	0	111.2	A1173 R1174 S1180 I1181 A1189 F1192 W1193 A1202	A1173-L1177 WeakPolarHBondContact O-CB 3.47Å; A1173-L1177 PolarHBondContact O-N 2.98Å; R1174-L1177 WeakPolarHBondContact O-CB 3.44Å; R1174-L1177 PolarHBondContact O-N 3.03Å; L1177-S1180 PolarHBondContact O-N 3.02Å; L1177-I1181 HydrophobicContact CD1-CD1 3.83Å; L1177-I1181 HydrophobicContact CD1-CG1 4.47Å; L1177-I1181 HydrophobicContact CG-CD1 3.98Å; L1177-I1181 WeakPolarHBondContact O-CD1 3.27Å; L1177-I1181 VanDerWaalsContact O-CG1 3.29Å; L1177-I1181 WeakPolarHBondContact O-CG1 3.45Å; L1177-I1181 PolarHBondContact O-N 3.16Å; L1177-A1189 HydrophobicContact CD1-CB 3.98Å; L1177-A1189 WeakPolarHBondContact CD1-O 3.46Å; L1177-F1192 HydrophobicContact CB-CB 3.97Å; L1177-W1193 HydrophobicContact CD1-CB 4.27Å; L1177-A1202 HydrophobicContact CD2-CB 3.89Å
1178	I	90.9	Very high	86.2	Confident	4 Å²	4	22.5 Å²	22.5	2%	0.021	10%	0.104	C	C	.	.	H	α-helix	trans	-65.4	-39.4	178.6	-68.3	169.6	0	0	0	111.1	I663 R1174 L1182 L1205	I663-I1178 HydrophobicContact CD1-CG2 3.75Å; I663-I1178 HydrophobicContact CG1-CG2 4.4Å; R1174-I1178 HydrophobicContact CG-CD1 3.88Å; R1174-I1178 HydrophobicContact CG-CG1 4.48Å; R1174-I1178 WeakPolarHBondContact O-CG1 3.34Å; R1174-I1178 PolarHBondContact O-N 3.32Å; I1178-L1182 HydrophobicContact CG2-CD1 3.83Å; I1178-L1182 HydrophobicContact CG2-CG 4.45Å; I1178-L1182 WeakPolarHBondContact O-CB 3.33Å; I1178-L1182 VanDerWaalsContact O-CG 3.29Å; I1178-L1182 WeakPolarHBondContact O-CG 3.48Å; I1178-L1182 PolarHBondContact O-N 2.85Å; I1178-L1205 HydrophobicContact CD1-CD2 4.06Å; I1178-L1205 HydrophobicContact CG1-CD2 4.37Å
1179	W	91.3	Very high	87.4	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.9	-48.8	172.5	168	84.8	0	0	0	111.8	L583 L610 L613 Y614 Q617 E1175 L1176 I1181 L1182 V1183 K1185	L583-W1179 HydrophobicContact CB-CH2 4.04Å; L583-W1179 HydrophobicContact CD2-CH2 4.49Å; L583-W1179 HydrophobicContact CD2-CZ3 4.22Å; L583-W1179 WeakPolarHBondContact O-CH2 3.39Å; L610-W1179 HydrophobicContact CD1-CB 4.45Å; L613-W1179 HydrophobicContact CB-CZ2 4.5Å; L613-W1179 HydrophobicContact CD2-CZ2 4.11Å; L613-W1179 PolarHBondContact O-NE1 2.71Å; Y614-W1179 AromaticContact CD1-CD1 3.72Å; Y614-W1179 HydrophobicContact CE1-CB 4.21Å; Y614-W1179 AromaticContact CE1-CD1 3.71Å; Y614-W1179 HydrophobicContact CE1-CG 4.34Å; Y614-W1179 HydrophobicContact CE2-CB 4.3Å; Y614-W1179 AromaticContact CG-CD1 3.96Å; Y614-W1179 AromaticContact CZ-CD1 3.95Å; Y614-W1179 WeakPolarHBondContact OH-CA 3.31Å; Y614-W1179 PolarHBondContact OH-N 2.82Å; Q617-W1179 HydrophobicContact CG-CZ2 3.8Å; E1175-W1179 VanDerWaalsContact O-CB 3.29Å; E1175-W1179 WeakPolarHBondContact O-CB 3.47Å; E1175-W1179 PolarHBondContact O-N 2.81Å; L1176-W1179 HydrophobicContact CD2-CE3 4Å; L1176-W1179 HydrophobicContact CD2-CZ3 4.4Å; L1176-W1179 PolarHBondContact O-N 2.68Å; W1179-I1181 VanDerWaalsContact C-N 3.34Å; W1179-I1181 PolarHBondContact O-N 3.46Å; W1179-L1182 PolarHBondContact O-N 3.14Å; W1179-V1183 HydrophobicContact CG-CG2 4.47Å; W1179-V1183 WeakPolarHBondContact O-CB 3.43Å; W1179-V1183 VanDerWaalsContact O-CG2 3.25Å; W1179-V1183 WeakPolarHBondContact O-CG2 3.42Å; W1179-V1183 PolarHBondContact O-N 2.9Å; W1179-K1185 HydrophobicContact CH2-CD 4.04Å; W1179-K1185 HydrophobicContact CZ2-CD 4.5Å
1180	S	90.8	Very high	88.3	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.5	-40.4	178.3	-64.7	0	0	0	0	112.6	L1176 L1177 G1184 K1185 M1188	L1176-S1180 WeakPolarHBondContact O-CB 3.35Å; L1176-S1180 PolarHBondContact O-N 2.63Å; L1176-S1180 PolarHBondContact O-OG 2.93Å; L1177-S1180 PolarHBondContact O-N 3.02Å; S1180-G1184 PolarHBondContact O-N 2.99Å; S1180-G1184 VanDerWaalsContact O-N 3.11Å; S1180-K1185 PolarHBondContact O-N 2.84Å; S1180-M1188 WeakPolarHBondContact OG-CB 3.33Å
1181	I	90.6	Very high	89.1	Confident	2 Å²	2	17.5 Å²	17.5	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-65.9	-47.4	176.5	-68.7	163.1	0	0	0	111.3	L1177 W1179 V1183 G1184 A1189 A1206 L1209 L1210 L1213	L1177-I1181 HydrophobicContact CD1-CD1 3.83Å; L1177-I1181 HydrophobicContact CD1-CG1 4.47Å; L1177-I1181 HydrophobicContact CG-CD1 3.98Å; L1177-I1181 WeakPolarHBondContact O-CD1 3.27Å; L1177-I1181 VanDerWaalsContact O-CG1 3.29Å; L1177-I1181 WeakPolarHBondContact O-CG1 3.45Å; L1177-I1181 PolarHBondContact O-N 3.16Å; W1179-I1181 VanDerWaalsContact C-N 3.34Å; W1179-I1181 PolarHBondContact O-N 3.46Å; I1181-V1183 VanDerWaalsContact C-N 3.3Å; I1181-V1183 PolarHBondContact O-N 2.68Å; I1181-G1184 PolarHBondContact O-N 3.06Å; I1181-A1189 HydrophobicContact CG1-CB 3.83Å; I1181-A1206 HydrophobicContact CD1-CB 3.52Å; I1181-L1209 HydrophobicContact CG2-CB 3.89Å; I1181-L1209 HydrophobicContact CG2-CD1 4.4Å; I1181-L1210 HydrophobicContact CG2-CD2 3.97Å; I1181-L1210 HydrophobicContact CG2-CG 4.07Å; I1181-L1213 HydrophobicContact CG2-CD1 4.09Å
1182	L	88.2	Confident	89.5	Confident	3 Å²	3	16.8 Å²	16.8	2%	0.016	8%	0.075	C	C	.	.	H	α-helix	trans	-69.6	-24.7	-178.8	-70	172.6	0	0	0	113.6	Y614 F628 V659 I663 L666 I1178 W1179	Y614-L1182 HydrophobicContact CE1-CD1 4.3Å; F628-L1182 VanDerWaalsContact CB-O 3.25Å; F628-L1182 WeakPolarHBondContact CB-O 3.29Å; F628-L1182 HydrophobicContact CD2-CB 4.03Å; F628-L1182 HydrophobicContact CD2-CD2 4.17Å; F628-L1182 HydrophobicContact CE2-CB 4.1Å; F628-L1182 HydrophobicContact CE2-CD1 4.04Å; F628-L1182 HydrophobicContact CE2-CD2 4.28Å; F628-L1182 HydrophobicContact CE2-CG 4.38Å; V659-L1182 HydrophobicContact CG1-CD1 3.79Å; I663-L1182 HydrophobicContact CD1-CD1 4.32Å; I663-L1182 HydrophobicContact CG1-CD1 4.01Å; L666-L1182 HydrophobicContact CD1-CD2 3.58Å; I1178-L1182 HydrophobicContact CG2-CD1 3.83Å; I1178-L1182 HydrophobicContact CG2-CG 4.45Å; I1178-L1182 WeakPolarHBondContact O-CB 3.33Å; I1178-L1182 VanDerWaalsContact O-CG 3.29Å; I1178-L1182 WeakPolarHBondContact O-CG 3.48Å; I1178-L1182 PolarHBondContact O-N 2.85Å; W1179-L1182 PolarHBondContact O-N 3.14Å
1183	V	85.8	Confident	89.8	Confident	6 Å²	6	16.6 Å²	16.6	4%	0.036	7%	0.074	C	C	.	.	H	α-helix	trans	-90.5	-7.5	176.2	177.4	0	0	0	0	111.7	Q617 V625 W1179 I1181 K1185	Q617-V1183 HydrophobicContact CB-CG1 4.22Å; Q617-V1183 HydrophobicContact CB-CG2 4.31Å; Q617-V1183 HydrophobicContact CG-CG1 4.02Å; Q617-V1183 HydrophobicContact CG-CG2 4.38Å; Q617-V1183 VanDerWaalsContact OE1-CG1 3.3Å; V625-V1183 HydrophobicContact CG2-CG1 3.83Å; W1179-V1183 HydrophobicContact CG-CG2 4.47Å; W1179-V1183 WeakPolarHBondContact O-CB 3.43Å; W1179-V1183 VanDerWaalsContact O-CG2 3.25Å; W1179-V1183 WeakPolarHBondContact O-CG2 3.42Å; W1179-V1183 PolarHBondContact O-N 2.9Å; I1181-V1183 VanDerWaalsContact C-N 3.3Å; I1181-V1183 PolarHBondContact O-N 2.68Å; V1183-K1185 HydrophobicContact CG1-CD 3.92Å; V1183-K1185 HydrophobicContact CG1-CG 3.99Å
1184	G	83.8	Confident	89.8	Confident	8 Å²	8	18.5 Å²	18.5	8%	0.082	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	14.4	-179.2	0	0	0	0	0	115.2	S1180 I1181 L1186	S1180-G1184 PolarHBondContact O-N 2.99Å; S1180-G1184 VanDerWaalsContact O-N 3.11Å; I1181-G1184 PolarHBondContact O-N 3.06Å; G1184-L1186 VanDerWaalsContact C-N 3.28Å; G1184-L1186 PolarHBondContact O-N 2.91Å
1185	K	88.3	Confident	89.7	Confident	14 Å²	14	20.8 Å²	20.8	6%	0.061	10%	0.096	C	C	.	.			trans	-82.7	66.9	178	-68	-179.5	169.2	-136.1	0	111	L583 M584 D586 Q617 W1179 S1180 V1183 R1187 M1188 A1189	L583-K1185 PolarHBondContact O-NZ 2.67Å; M584-K1185 PolarHBondContact O-NZ 2.87Å; D586-K1185 HydrophobicContact CB-CD 4.34Å; D586-K1185 WeakPolarHBondContact OD1-CB 3.35Å; D586-K1185 VanDerWaalsContact OD1-CD 3.25Å; D586-K1185 WeakPolarHBondContact OD1-CD 3.38Å; D586-K1185 WeakPolarHBondContact OD1-CG 3.26Å; D586-K1185 IonicContact OD1-NZ 2.66Å; Q617-K1185 VanDerWaalsContact OE1-CE 3.29Å; W1179-K1185 HydrophobicContact CH2-CD 4.04Å; W1179-K1185 HydrophobicContact CZ2-CD 4.5Å; S1180-K1185 PolarHBondContact O-N 2.84Å; V1183-K1185 HydrophobicContact CG1-CD 3.92Å; V1183-K1185 HydrophobicContact CG1-CG 3.99Å; K1185-R1187 VanDerWaalsContact C-N 3.33Å; K1185-R1187 PolarHBondContact O-N 3.46Å; K1185-M1188 HydrophobicContact CB-CB 4.16Å; K1185-M1188 HydrophobicContact CB-CG 4.36Å; K1185-M1188 WeakPolarHBondContact O-CB 3.48Å; K1185-M1188 PolarHBondContact O-N 3.43Å; K1185-M1188 VanDerWaalsContact O-N 3.12Å; K1185-A1189 PolarHBondContact O-N 2.86Å; K1185-A1189 VanDerWaalsContact O-N 3.1Å
1186	L	89.5	Confident	89.7	Confident	10 Å²	10	20.7 Å²	20.7	5%	0.052	10%	0.096	C	C	.	.	H	α-helix	trans	-62.6	-32.5	-167.2	-57.1	-177.8	0	0	0	114	G1184 A1189 E1190 L1210 D1225 Y1226 F1229	G1184-L1186 VanDerWaalsContact C-N 3.28Å; G1184-L1186 PolarHBondContact O-N 2.91Å; L1186-A1189 WeakPolarHBondContact O-CB 3.45Å; L1186-A1189 PolarHBondContact O-N 2.81Å; L1186-E1190 PolarHBondContact O-N 2.77Å; L1186-L1210 HydrophobicContact CD2-CD2 3.55Å; L1186-D1225 HydrophobicContact CD1-CB 4.17Å; L1186-Y1226 HydrophobicContact CD1-CD1 4.12Å; L1186-Y1226 HydrophobicContact CD1-CE1 4.34Å; L1186-Y1226 HydrophobicContact CD2-CD1 4.15Å; L1186-Y1226 HydrophobicContact CD2-CE1 4.14Å; L1186-F1229 HydrophobicContact CB-CD1 3.89Å; L1186-F1229 HydrophobicContact CB-CD2 4.14Å; L1186-F1229 HydrophobicContact CB-CE1 3.75Å; L1186-F1229 HydrophobicContact CB-CE2 3.99Å; L1186-F1229 HydrophobicContact CB-CG 4.07Å; L1186-F1229 HydrophobicContact CB-CZ 3.79Å; L1186-F1229 HydrophobicContact CD1-CB 4.27Å; L1186-F1229 HydrophobicContact CD1-CD2 3.54Å; L1186-F1229 HydrophobicContact CD1-CE2 3.93Å; L1186-F1229 HydrophobicContact CD1-CG 3.87Å; L1186-F1229 HydrophobicContact CG-CD2 4.42Å; L1186-F1229 HydrophobicContact CG-CG 4.43Å
1187	R	88.2	Confident	89.6	Confident	190 Å²	190	24.2 Å²	24.2	72%	0.717	11%	0.111	S	C	*	.	H	α-helix	trans	-69.2	-38.4	174.4	-68.3	-173.9	179.7	-174.9	1.1	112.8	K1185 A1189 E1190 L1191	K1185-R1187 VanDerWaalsContact C-N 3.33Å; K1185-R1187 PolarHBondContact O-N 3.46Å; R1187-A1189 VanDerWaalsContact C-N 3.35Å; R1187-E1190 PolarHBondContact O-N 2.87Å; R1187-L1191 PolarHBondContact O-N 2.83Å
1188	M	89.5	Confident	89.4	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-65.5	-38.4	173.5	-72.6	-70.3	-169.4	0	0	111.8	D586 H588 V591 S1180 K1185 E1190 L1191 F1192	D586-M1188 WeakPolarHBondContact OD1-CG 3.43Å; H588-M1188 HydrophobicContact CB-CE 4.48Å; V591-M1188 HydrophobicContact CB-CE 4.22Å; V591-M1188 HydrophobicContact CB-SD 4.24Å; V591-M1188 HydrophobicContact CG1-SD 4.41Å; V591-M1188 HydrophobicContact CG2-CE 3.65Å; V591-M1188 HydrophobicContact CG2-SD 4.17Å; S1180-M1188 WeakPolarHBondContact OG-CB 3.33Å; K1185-M1188 HydrophobicContact CB-CB 4.16Å; K1185-M1188 HydrophobicContact CB-CG 4.36Å; K1185-M1188 WeakPolarHBondContact O-CB 3.48Å; K1185-M1188 PolarHBondContact O-N 3.43Å; K1185-M1188 VanDerWaalsContact O-N 3.12Å; M1188-E1190 VanDerWaalsContact C-N 3.27Å; M1188-E1190 PolarHBondContact O-N 2.9Å; M1188-L1191 PolarHBondContact O-N 2.87Å; M1188-F1192 HydrophobicContact CB-CD2 4.33Å; M1188-F1192 HydrophobicContact CB-CE2 4.09Å; M1188-F1192 WeakPolarHBondContact O-CD2 3.45Å; M1188-F1192 PolarHBondContact O-N 3.35Å; M1188-F1192 HydrophobicContact SD-CE2 4.42Å
1189	A	91.9	Very high	89.5	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-58.3	-39.1	176.8	0	0	0	0	0	112.1	L1177 I1181 K1185 L1186 R1187 F1192 W1193 F1233	L1177-A1189 HydrophobicContact CD1-CB 3.98Å; L1177-A1189 WeakPolarHBondContact CD1-O 3.46Å; I1181-A1189 HydrophobicContact CG1-CB 3.83Å; K1185-A1189 PolarHBondContact O-N 2.86Å; K1185-A1189 VanDerWaalsContact O-N 3.1Å; L1186-A1189 WeakPolarHBondContact O-CB 3.45Å; L1186-A1189 PolarHBondContact O-N 2.81Å; R1187-A1189 VanDerWaalsContact C-N 3.35Å; A1189-F1192 PolarHBondContact O-N 2.95Å; A1189-W1193 WeakPolarHBondContact O-CB 3.36Å; A1189-W1193 PolarHBondContact O-N 2.7Å; A1189-F1233 HydrophobicContact CB-CZ 4.29Å
1190	E	90.2	Very high	89.6	Confident	72 Å²	72	24.2 Å²	24.2	34%	0.336	11%	0.111	S	C	.	.	H	α-helix	trans	-63.7	-45.8	174.8	-177.4	160.9	158.8	0	0	112.6	L1186 R1187 M1188 F1192 W1193 T1194 R1236	L1186-E1190 PolarHBondContact O-N 2.77Å; R1187-E1190 PolarHBondContact O-N 2.87Å; M1188-E1190 VanDerWaalsContact C-N 3.27Å; M1188-E1190 PolarHBondContact O-N 2.9Å; E1190-F1192 PolarHBondContact O-N 3.21Å; E1190-W1193 WeakPolarHBondContact O-CB 3.39Å; E1190-W1193 PolarHBondContact O-N 2.65Å; E1190-T1194 PolarHBondContact O-N 2.82Å; E1190-R1236 IonicContact OE1-CZ 2.63Å; E1190-R1236 IonicContact OE1-NH1 3.48Å; E1190-R1236 IonicContact OE1-NH2 2.76Å; E1190-R1236 PolarHBondContact OE1-NH2 3.28Å; E1190-R1236 IonicContact OE2-CZ 3.42Å; E1190-R1236 IonicContact OE2-NH1 3.69Å; E1190-R1236 PolarHBondContact OE2-NH1 2.96Å; E1190-R1236 IonicContact OE2-NH2 2.79Å; E1190-R1236 PolarHBondContact OE2-NH2 3.42Å
1191	L	90	Very high	89.7	Confident	21 Å²	21	24.2 Å²	24.2	11%	0.11	11%	0.111	C	C	.	.	H	α-helix	trans	-58.5	-45.5	175.7	-178	61.3	0	0	0	111.6	V591 K592 L595 R1187 M1188 W1193 T1194 M1195	V591-L1191 HydrophobicContact CB-CD2 4.24Å; V591-L1191 HydrophobicContact CG1-CD2 3.85Å; K592-L1191 HydrophobicContact CB-CD1 4.41Å; K592-L1191 HydrophobicContact CB-CD2 4.15Å; K592-L1191 HydrophobicContact CG-CD1 4.5Å; L595-L1191 HydrophobicContact CD1-CD2 4.16Å; L595-L1191 HydrophobicContact CD1-CG 4.35Å; R1187-L1191 PolarHBondContact O-N 2.83Å; M1188-L1191 PolarHBondContact O-N 2.87Å; L1191-W1193 VanDerWaalsContact C-N 3.34Å; L1191-W1193 PolarHBondContact O-N 3.21Å; L1191-T1194 PolarHBondContact O-N 2.76Å; L1191-T1194 PolarHBondContact O-OG1 2.84Å; L1191-M1195 HydrophobicContact CG-CE 4.38Å
1192	F	91.8	Very high	89.8	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.7	-28.6	177.8	-68.5	-58.4	0	0	0	114	L583 V591 L601 L1176 L1177 M1188 A1189 E1190 T1194 M1195 E1196	L583-F1192 HydrophobicContact CD2-CE2 4.17Å; L583-F1192 HydrophobicContact CD2-CZ 3.71Å; V591-F1192 HydrophobicContact CG1-CZ 4.23Å; L601-F1192 HydrophobicContact CD1-CE1 4.29Å; L1176-F1192 HydrophobicContact CB-CD1 3.7Å; L1176-F1192 HydrophobicContact CB-CD2 3.84Å; L1176-F1192 HydrophobicContact CB-CE1 3.83Å; L1176-F1192 HydrophobicContact CB-CE2 3.94Å; L1176-F1192 HydrophobicContact CB-CG 3.76Å; L1176-F1192 HydrophobicContact CB-CZ 3.95Å; L1176-F1192 HydrophobicContact CD1-CD1 4.13Å; L1176-F1192 HydrophobicContact CD1-CE1 3.61Å; L1176-F1192 HydrophobicContact CD1-CZ 3.99Å; L1176-F1192 HydrophobicContact CD2-CZ 4.35Å; L1176-F1192 HydrophobicContact CG-CE1 4.24Å; L1176-F1192 HydrophobicContact CG-CZ 4.32Å; L1177-F1192 HydrophobicContact CB-CB 3.97Å; M1188-F1192 HydrophobicContact CB-CD2 4.33Å; M1188-F1192 HydrophobicContact CB-CE2 4.09Å; M1188-F1192 WeakPolarHBondContact O-CD2 3.45Å; M1188-F1192 PolarHBondContact O-N 3.35Å; M1188-F1192 HydrophobicContact SD-CE2 4.42Å; A1189-F1192 PolarHBondContact O-N 2.95Å; E1190-F1192 PolarHBondContact O-N 3.21Å; F1192-T1194 VanDerWaalsContact C-N 3.35Å; F1192-M1195 HydrophobicContact CD1-CE 3.53Å; F1192-M1195 HydrophobicContact CE1-CE 3.89Å; F1192-M1195 HydrophobicContact CG-CE 4.48Å; F1192-M1195 PolarHBondContact O-N 3.14Å; F1192-E1196 PolarHBondContact O-N 2.87Å
1193	W	93.4	Very high	90.1	Very high	3 Å²	3	24 Å²	24	1%	0.011	11%	0.11	C	C	.	.	H	α-helix	trans	-62.9	-39.7	173.7	178.8	73.1	0	0	0	112.2	L1177 A1189 E1190 L1191 M1195 E1196 P1199 A1203 F1233 R1236 V1240 Y1754 L1755	L1177-W1193 HydrophobicContact CD1-CB 4.27Å; A1189-W1193 WeakPolarHBondContact O-CB 3.36Å; A1189-W1193 PolarHBondContact O-N 2.7Å; E1190-W1193 WeakPolarHBondContact O-CB 3.39Å; E1190-W1193 PolarHBondContact O-N 2.65Å; L1191-W1193 VanDerWaalsContact C-N 3.34Å; L1191-W1193 PolarHBondContact O-N 3.21Å; W1193-M1195 PolarHBondContact O-N 3.13Å; W1193-M1195 VanDerWaalsContact O-N 3.13Å; W1193-E1196 PolarHBondContact O-N 3.12Å; W1193-P1199 HydrophobicContact CZ2-CB 3.97Å; W1193-P1199 PolarHBondContact NE1-O 3.4Å; W1193-A1203 HydrophobicContact CZ2-CB 4.38Å; W1193-F1233 HydrophobicContact CB-CE1 3.93Å; W1193-F1233 HydrophobicContact CG-CD1 4.44Å; W1193-F1233 AromaticContact CG-CE1 3.97Å; W1193-F1233 HydrophobicContact CG-CE1 3.97Å; W1193-R1236 HydrophobicContact CH2-CB 3.76Å; W1193-R1236 HydrophobicContact CH2-CG 4.13Å; W1193-R1236 HydrophobicContact CZ2-CB 3.95Å; W1193-R1236 HydrophobicContact CZ3-CB 4.27Å; W1193-R1236 HydrophobicContact CZ3-CG 4.19Å; W1193-V1240 HydrophobicContact CH2-CG2 3.93Å; W1193-V1240 HydrophobicContact CZ2-CG2 4.04Å; W1193-Y1754 HydrophobicContact CH2-CE1 4.42Å; W1193-L1755 HydrophobicContact CZ3-CD1 4.25Å; W1193-L1755 HydrophobicContact CZ3-CD2 4.12Å; W1193-L1755 HydrophobicContact CZ3-CG 4.38Å
1194	T	88.6	Confident	90.4	Very high	46 Å²	46	23.7 Å²	23.7	28%	0.282	11%	0.108	S	C	.	.	H	α-helix	trans	-61.3	-22.6	178.2	70.2	0	0	0	0	113.9	E1190 L1191 F1192 M1752 L1755	E1190-T1194 PolarHBondContact O-N 2.82Å; L1191-T1194 PolarHBondContact O-N 2.76Å; L1191-T1194 PolarHBondContact O-OG1 2.84Å; F1192-T1194 VanDerWaalsContact C-N 3.35Å; T1194-M1752 WeakPolarHBondContact O-CE 3.47Å; T1194-L1755 HydrophobicContact CG2-CD1 3.87Å
1195	M	86.6	Confident	90.8	Very high	51 Å²	51	23.5 Å²	23.5	25%	0.251	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-4.5	-178.9	-66.8	-178.6	-76.5	0	0	114.1	L595 L601 A1173 L1191 F1192 W1193	L595-M1195 HydrophobicContact CD1-CE 3.48Å; L595-M1195 VanDerWaalsContact CD1-CE 3.48Å; L595-M1195 HydrophobicContact CD1-SD 3.77Å; L595-M1195 HydrophobicContact CD2-CE 4.38Å; L595-M1195 HydrophobicContact CD2-SD 3.85Å; L595-M1195 HydrophobicContact CG-SD 4.34Å; L601-M1195 HydrophobicContact CD1-CE 3.91Å; L601-M1195 HydrophobicContact CD1-SD 3.8Å; A1173-M1195 HydrophobicContact CB-CB 4.03Å; L1191-M1195 HydrophobicContact CG-CE 4.38Å; F1192-M1195 HydrophobicContact CD1-CE 3.53Å; F1192-M1195 HydrophobicContact CE1-CE 3.89Å; F1192-M1195 HydrophobicContact CG-CE 4.48Å; F1192-M1195 PolarHBondContact O-N 3.14Å; W1193-M1195 PolarHBondContact O-N 3.13Å; W1193-M1195 VanDerWaalsContact O-N 3.13Å
1196	E	90.4	Very high	91	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	10%	0.103	C	C	.	.			trans	-78.3	145.2	-177.8	-176.6	44.5	-137.2	0	0	111.8	R1171 A1173 R1174 F1192 W1193 A1202 Y1263 H1748	R1171-E1196 WeakPolarHBondContact CD-OE1 3.29Å; R1171-E1196 IonicContact CZ-OE1 3.31Å; R1171-E1196 IonicContact NE-OE1 3.08Å; R1171-E1196 IonicContact NH1-OE1 3.04Å; R1171-E1196 PolarHBondContact NH1-OE1 2.86Å; A1173-E1196 HydrophobicContact CB-CB 4.37Å; R1174-E1196 HydrophobicContact CB-CG 4.45Å; R1174-E1196 WeakPolarHBondContact CB-OE2 3.37Å; R1174-E1196 PolarHBondContact N-OE2 3.46Å; F1192-E1196 PolarHBondContact O-N 2.87Å; W1193-E1196 PolarHBondContact O-N 3.12Å; E1196-A1202 HydrophobicContact CB-CB 4.24Å; E1196-A1202 HydrophobicContact CG-CB 3.81Å; E1196-Y1263 WeakPolarHBondContact CG-OH 3.39Å; E1196-H1748 PolarHBondContact O-ND1 3.42Å
1197	K	88.5	Confident	91.2	Very high	74 Å²	74	22.7 Å²	22.7	32%	0.322	10%	0.102	S	C	.	.	S	Bend	trans	-81.2	-21.9	-169.6	-62.6	171.8	-173.2	171	0	112.3	E602 R1171 V1744	E602-K1197 IonicContact OE1-NZ 2.62Å; E602-K1197 PolarHBondContact OE1-NZ 3.17Å; R1171-K1197 HydrophobicContact CG-CD 4.4Å; K1197-V1744 HydrophobicContact CB-CG1 4.15Å; K1197-V1744 VanDerWaalsContact O-CG1 3.27Å; K1197-V1744 WeakPolarHBondContact O-CG1 3.37Å
1198	E	90	Very high	91.4	Very high	3 Å²	3	14.1 Å²	14.1	1%	0.014	7%	0.07	C	C	.	.	S	Bend	trans	-122.7	73.2	173.3	-72.8	163.4	-177	0	0	110.2	R1171 I1200 A1201 A1202 L1260 Y1263 V1744 E1747	R1171-E1198 IonicContact CZ-OE1 3.35Å; R1171-E1198 IonicContact CZ-OE2 2.88Å; R1171-E1198 IonicContact NH1-OE1 3.53Å; R1171-E1198 IonicContact NH1-OE2 2.81Å; R1171-E1198 PolarHBondContact NH1-OE2 3.06Å; R1171-E1198 IonicContact NH2-OE1 2.63Å; R1171-E1198 PolarHBondContact NH2-OE1 3.01Å; R1171-E1198 IonicContact NH2-OE2 3.08Å; R1171-E1198 PolarHBondContact NH2-OE2 2.93Å; R1171-E1198 VanDerWaalsContact NH2-OE2 3.12Å; E1198-I1200 VanDerWaalsContact C-N 3.33Å; E1198-I1200 PolarHBondContact O-N 3.27Å; E1198-A1201 HydrophobicContact CB-CB 4.23Å; E1198-A1201 PolarHBondContact O-N 2.87Å; E1198-A1202 WeakPolarHBondContact O-CB 3.31Å; E1198-A1202 PolarHBondContact O-N 2.86Å; E1198-L1260 HydrophobicContact CG-CD2 4.46Å; E1198-Y1263 HydrophobicContact CB-CE2 4.22Å; E1198-Y1263 WeakPolarHBondContact OE2-CE2 3.05Å; E1198-V1744 HydrophobicContact CG-CG1 4.04Å; E1198-V1744 HydrophobicContact CG-CG2 4.1Å; E1198-E1747 VanDerWaalsContact C-OE1 3.22Å; E1198-E1747 WeakPolarHBondContact CA-OE1 3.23Å
1199	P	92.6	Very high	91.5	Very high	3 Å²	3	14.1 Å²	14.1	2%	0.019	7%	0.07	C	C	.	.	H	α-helix	trans	-61.9	-31.2	-170.9	21.9	-32.8	0	0	0	114.6	W1193 A1202 A1203 V1240 E1747 A1751	W1193-P1199 HydrophobicContact CZ2-CB 3.97Å; W1193-P1199 PolarHBondContact NE1-O 3.4Å; P1199-A1202 PolarHBondContact O-N 3.08Å; P1199-A1203 WeakPolarHBondContact O-CB 3.2Å; P1199-A1203 PolarHBondContact O-N 3.16Å; P1199-V1240 HydrophobicContact CG-CG1 4.43Å; P1199-E1747 VanDerWaalsContact CD-OE1 3.24Å; P1199-E1747 WeakPolarHBondContact CD-OE1 3.28Å; P1199-E1747 HydrophobicContact CG-CG 4.18Å; P1199-E1747 VanDerWaalsContact N-OE1 3.14Å; P1199-A1751 HydrophobicContact CB-CB 4.02Å; P1199-A1751 HydrophobicContact CG-CB 3.44Å; P1199-A1751 VanDerWaalsContact CG-CB 3.44Å
1200	I	93.4	Very high	91.5	Very high	2 Å²	2	14.1 Å²	14.1	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-68.7	-45.8	179.3	-55.3	174.6	0	0	0	109.9	E1198 A1203 L1204 A1237 V1240 L1241 V1268 F1280 E1747	E1198-I1200 VanDerWaalsContact C-N 3.33Å; E1198-I1200 PolarHBondContact O-N 3.27Å; I1200-A1203 PolarHBondContact O-N 2.9Å; I1200-L1204 HydrophobicContact CG2-CD1 4.31Å; I1200-L1204 WeakPolarHBondContact O-CG 3.21Å; I1200-L1204 PolarHBondContact O-N 2.71Å; I1200-L1204 VanDerWaalsContact O-N 3.12Å; I1200-A1237 HydrophobicContact CG2-CB 4.42Å; I1200-V1240 HydrophobicContact CD1-CG1 4.05Å; I1200-V1240 HydrophobicContact CG1-CB 4.11Å; I1200-V1240 HydrophobicContact CG1-CG1 3.63Å; I1200-L1241 HydrophobicContact CD1-CB 4.46Å; I1200-L1241 HydrophobicContact CD1-CD1 4.49Å; I1200-V1268 HydrophobicContact CG2-CG1 3.66Å; I1200-F1280 HydrophobicContact CG2-CE2 3.7Å; I1200-F1280 HydrophobicContact CG2-CZ 3.66Å; I1200-E1747 WeakPolarHBondContact CB-OE1 3.27Å; I1200-E1747 HydrophobicContact CD1-CG 4.03Å; I1200-E1747 HydrophobicContact CG1-CG 4.18Å; I1200-E1747 WeakPolarHBondContact CG1-OE1 3.29Å; I1200-E1747 PolarHBondContact N-OE1 3.49Å
1201	A	92.1	Very high	91.5	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-64.9	-39.6	175.9	0	0	0	0	0	112.2	E1198 L1205 L1260 Y1263	E1198-A1201 HydrophobicContact CB-CB 4.23Å; E1198-A1201 PolarHBondContact O-N 2.87Å; A1201-L1205 WeakPolarHBondContact O-CB 3.08Å; A1201-L1205 PolarHBondContact O-N 2.77Å; A1201-L1260 HydrophobicContact CB-CD1 3.63Å; A1201-L1260 HydrophobicContact CB-CD2 4.11Å; A1201-L1260 HydrophobicContact CB-CG 4.49Å; A1201-Y1263 HydrophobicContact CB-CD1 4.1Å; A1201-Y1263 HydrophobicContact CB-CD2 3.83Å; A1201-Y1263 HydrophobicContact CB-CE1 4.14Å; A1201-Y1263 HydrophobicContact CB-CE2 3.87Å; A1201-Y1263 HydrophobicContact CB-CG 3.97Å
1202	A	92.6	Very high	91.4	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.2	-45.4	176.2	0	0	0	0	0	112.5	L1177 E1196 E1198 P1199 A1206 Y1263	L1177-A1202 HydrophobicContact CD2-CB 3.89Å; E1196-A1202 HydrophobicContact CB-CB 4.24Å; E1196-A1202 HydrophobicContact CG-CB 3.81Å; E1198-A1202 WeakPolarHBondContact O-CB 3.31Å; E1198-A1202 PolarHBondContact O-N 2.86Å; P1199-A1202 PolarHBondContact O-N 3.08Å; A1202-A1206 WeakPolarHBondContact O-CB 3.22Å; A1202-A1206 PolarHBondContact O-N 3.23Å; A1202-Y1263 WeakPolarHBondContact CB-OH 3.22Å
1203	A	94	Very high	91.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-66.5	-44	179.3	0	0	0	0	0	112.6	W1193 P1199 I1200 A1206 S1207 F1233 A1237	W1193-A1203 HydrophobicContact CZ2-CB 4.38Å; P1199-A1203 WeakPolarHBondContact O-CB 3.2Å; P1199-A1203 PolarHBondContact O-N 3.16Å; I1200-A1203 PolarHBondContact O-N 2.9Å; A1203-A1206 PolarHBondContact O-N 3.42Å; A1203-S1207 PolarHBondContact O-N 2.62Å; A1203-F1233 HydrophobicContact CB-CD1 4.45Å; A1203-F1233 WeakPolarHBondContact CB-O 3.18Å; A1203-A1237 HydrophobicContact CB-CB 3.75Å
1204	L	93.4	Very high	91	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-64	-45	176.2	-70.7	169.6	0	0	0	111.8	I1200 A1206 S1207 I1208 A1237 V1268 L1271 A1272 F1280	I1200-L1204 HydrophobicContact CG2-CD1 4.31Å; I1200-L1204 WeakPolarHBondContact O-CG 3.21Å; I1200-L1204 PolarHBondContact O-N 2.71Å; I1200-L1204 VanDerWaalsContact O-N 3.12Å; L1204-A1206 VanDerWaalsContact C-N 3.3Å; L1204-A1206 PolarHBondContact O-N 2.74Å; L1204-S1207 PolarHBondContact O-N 2.83Å; L1204-I1208 VanDerWaalsContact O-CG1 3.27Å; L1204-I1208 WeakPolarHBondContact O-CG1 3.13Å; L1204-I1208 PolarHBondContact O-N 3.19Å; L1204-A1237 HydrophobicContact CD2-CB 4.16Å; L1204-A1237 HydrophobicContact CG-CB 4.06Å; L1204-V1268 HydrophobicContact CD1-CG1 3.62Å; L1204-L1271 HydrophobicContact CB-CD2 3.74Å; L1204-L1271 HydrophobicContact CB-CG 4.07Å; L1204-L1271 HydrophobicContact CD1-CD2 4.45Å; L1204-A1272 HydrophobicContact CD1-CB 3.97Å; L1204-A1272 HydrophobicContact CD2-CB 4.11Å; L1204-F1280 HydrophobicContact CD1-CD1 4.44Å; L1204-F1280 HydrophobicContact CD1-CE1 4.01Å; L1204-F1280 HydrophobicContact CD1-CE2 4.27Å; L1204-F1280 HydrophobicContact CD1-CZ 3.91Å; L1204-F1280 HydrophobicContact CD2-CD1 4.42Å; L1204-F1280 HydrophobicContact CD2-CD2 4.2Å; L1204-F1280 HydrophobicContact CD2-CG 4.14Å
1205	L	91.8	Very high	90.9	Very high	4 Å²	4	16.1 Å²	16.1	2%	0.021	9%	0.086	C	C	.	.	H	α-helix	trans	-60.5	-40.5	175.4	-178.1	67.8	0	0	0	111.6	V667 Y671 I1178 A1201 I1208 L1209 Y1263	V667-L1205 HydrophobicContact CG2-CD1 4Å; Y671-L1205 HydrophobicContact CE1-CD1 4.47Å; Y671-L1205 HydrophobicContact CE2-CD1 3.95Å; Y671-L1205 WeakPolarHBondContact OH-CD2 3.05Å; I1178-L1205 HydrophobicContact CD1-CD2 4.06Å; I1178-L1205 HydrophobicContact CG1-CD2 4.37Å; A1201-L1205 WeakPolarHBondContact O-CB 3.08Å; A1201-L1205 PolarHBondContact O-N 2.77Å; L1205-I1208 PolarHBondContact O-N 3.38Å; L1205-L1209 HydrophobicContact CD1-CD1 4.43Å; L1205-L1209 HydrophobicContact CD1-CG 4.46Å; L1205-L1209 HydrophobicContact CG-CD1 4.06Å; L1205-L1209 HydrophobicContact CG-CG 4.49Å; L1205-L1209 WeakPolarHBondContact O-CB 3.14Å; L1205-L1209 WeakPolarHBondContact O-CG 3.14Å; L1205-L1209 PolarHBondContact O-N 2.97Å; L1205-Y1263 HydrophobicContact CB-CD1 4.08Å; L1205-Y1263 HydrophobicContact CB-CE1 4.12Å; L1205-Y1263 HydrophobicContact CD2-CD1 3.76Å; L1205-Y1263 HydrophobicContact CD2-CE1 3.79Å; L1205-Y1263 HydrophobicContact CG-CD1 4.47Å
1206	A	92.9	Very high	90.8	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.008	9%	0.094	C	C	.	.	H	α-helix	trans	-62	-46.1	175.9	0	0	0	0	0	111.9	I1181 A1202 A1203 L1204 I1208 L1209 L1210 F1233	I1181-A1206 HydrophobicContact CD1-CB 3.52Å; A1202-A1206 WeakPolarHBondContact O-CB 3.22Å; A1202-A1206 PolarHBondContact O-N 3.23Å; A1203-A1206 PolarHBondContact O-N 3.42Å; L1204-A1206 VanDerWaalsContact C-N 3.3Å; L1204-A1206 PolarHBondContact O-N 2.74Å; A1206-I1208 VanDerWaalsContact C-N 3.34Å; A1206-I1208 PolarHBondContact O-N 3.35Å; A1206-L1209 PolarHBondContact O-N 2.83Å; A1206-L1210 WeakPolarHBondContact O-CB 3.4Å; A1206-L1210 WeakPolarHBondContact O-CD1 3.43Å; A1206-L1210 WeakPolarHBondContact O-CG 3.31Å; A1206-L1210 PolarHBondContact O-N 2.88Å; A1206-F1233 HydrophobicContact CB-CB 4.3Å; A1206-F1233 HydrophobicContact CB-CD1 4.08Å; A1206-F1233 HydrophobicContact CB-CD2 3.96Å; A1206-F1233 HydrophobicContact CB-CE1 4.41Å; A1206-F1233 HydrophobicContact CB-CE2 4.3Å; A1206-F1233 HydrophobicContact CB-CG 3.85Å
1207	S	93.3	Very high	90.5	Very high	5 Å²	5	18.5 Å²	18.5	4%	0.035	10%	0.095	C	C	.	.	H	α-helix	trans	-59	-41.8	176.9	-167.2	0	0	0	0	112.5	A1203 L1204 T1211 A1230	A1203-S1207 PolarHBondContact O-N 2.62Å; L1204-S1207 PolarHBondContact O-N 2.83Å; S1207-T1211 VanDerWaalsContact O-CB 3.3Å; S1207-T1211 WeakPolarHBondContact O-CB 3.17Å; S1207-T1211 PolarHBondContact O-N 2.75Å; S1207-T1211 PolarHBondContact O-OG1 3.44Å; S1207-A1230 WeakPolarHBondContact CB-O 3.44Å; S1207-A1230 PolarHBondContact OG-O 2.99Å
1208	I	91.9	Very high	90	Very high	10 Å²	10	20.9 Å²	20.9	5%	0.051	11%	0.112	C	C	.	.	H	α-helix	trans	-65.4	-48.1	176.5	-63.2	165	0	0	0	111.6	V667 L1204 L1205 A1206 T1211 S1212 L1271	V667-I1208 HydrophobicContact CG1-CG2 4.2Å; V667-I1208 HydrophobicContact CG2-CG2 4.38Å; L1204-I1208 VanDerWaalsContact O-CG1 3.27Å; L1204-I1208 WeakPolarHBondContact O-CG1 3.13Å; L1204-I1208 PolarHBondContact O-N 3.19Å; L1205-I1208 PolarHBondContact O-N 3.38Å; A1206-I1208 VanDerWaalsContact C-N 3.34Å; A1206-I1208 PolarHBondContact O-N 3.35Å; I1208-T1211 PolarHBondContact O-N 3.33Å; I1208-S1212 VanDerWaalsContact O-CB 3.3Å; I1208-S1212 WeakPolarHBondContact O-CB 3.23Å; I1208-S1212 PolarHBondContact O-N 3.05Å; I1208-S1212 PolarHBondContact O-OG 2.94Å; I1208-L1271 HydrophobicContact CD1-CD1 3.69Å; I1208-L1271 HydrophobicContact CD1-CG 3.98Å; I1208-L1271 WeakPolarHBondContact CD1-O 3.36Å
1209	L	91	Very high	89.6	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.4	-45.5	179	-74.4	172	0	0	0	111.3	I663 L666 V667 I1181 L1205 A1206 S1212 L1213	I663-L1209 HydrophobicContact CG2-CD2 4.47Å; L666-L1209 HydrophobicContact CB-CD2 3.85Å; L666-L1209 HydrophobicContact CD1-CD2 4.06Å; V667-L1209 HydrophobicContact CG2-CD2 3.61Å; V667-L1209 HydrophobicContact CG2-CG 4.2Å; I1181-L1209 HydrophobicContact CG2-CB 3.89Å; I1181-L1209 HydrophobicContact CG2-CD1 4.4Å; L1205-L1209 HydrophobicContact CD1-CD1 4.43Å; L1205-L1209 HydrophobicContact CD1-CG 4.46Å; L1205-L1209 HydrophobicContact CG-CD1 4.06Å; L1205-L1209 HydrophobicContact CG-CG 4.49Å; L1205-L1209 WeakPolarHBondContact O-CB 3.14Å; L1205-L1209 WeakPolarHBondContact O-CG 3.14Å; L1205-L1209 PolarHBondContact O-N 2.97Å; A1206-L1209 PolarHBondContact O-N 2.83Å; L1209-S1212 PolarHBondContact O-N 3.42Å; L1209-L1213 WeakPolarHBondContact O-CB 3.5Å; L1209-L1213 VanDerWaalsContact O-CG 3.29Å; L1209-L1213 WeakPolarHBondContact O-CG 3.31Å; L1209-L1213 PolarHBondContact O-N 3.42Å
1210	L	92.1	Very high	89.1	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.3	-41.4	179.3	-70.3	165.4	0	0	0	112.1	I1181 L1186 A1206 S1212 L1213 G1214 Y1226 F1229 A1230 F1233	I1181-L1210 HydrophobicContact CG2-CD2 3.97Å; I1181-L1210 HydrophobicContact CG2-CG 4.07Å; L1186-L1210 HydrophobicContact CD2-CD2 3.55Å; A1206-L1210 WeakPolarHBondContact O-CB 3.4Å; A1206-L1210 WeakPolarHBondContact O-CD1 3.43Å; A1206-L1210 WeakPolarHBondContact O-CG 3.31Å; A1206-L1210 PolarHBondContact O-N 2.88Å; L1210-S1212 VanDerWaalsContact C-N 3.28Å; L1210-S1212 PolarHBondContact O-N 3.42Å; L1210-L1213 PolarHBondContact O-N 3.23Å; L1210-G1214 PolarHBondContact O-N 2.69Å; L1210-Y1226 HydrophobicContact CD2-CD1 3.7Å; L1210-Y1226 HydrophobicContact CD2-CE1 4.44Å; L1210-F1229 HydrophobicContact CD1-CB 4.01Å; L1210-A1230 HydrophobicContact CB-CB 3.76Å; L1210-F1233 HydrophobicContact CD1-CD2 3.54Å; L1210-F1233 HydrophobicContact CD1-CE2 3.82Å
1211	T	91.5	Very high	88.7	Confident	58 Å²	58	36 Å²	36	36%	0.356	19%	0.189	S	C	.	.	H	α-helix	trans	-61.5	-39.8	173.6	-58	0	0	0	0	111.2	S1207 I1208 G1214 N1215	S1207-T1211 VanDerWaalsContact O-CB 3.3Å; S1207-T1211 WeakPolarHBondContact O-CB 3.17Å; S1207-T1211 PolarHBondContact O-N 2.75Å; S1207-T1211 PolarHBondContact O-OG1 3.44Å; I1208-T1211 PolarHBondContact O-N 3.33Å; T1211-G1214 PolarHBondContact O-N 3.29Å; T1211-N1215 WeakPolarHBondContact O-CB 3.11Å; T1211-N1215 VanDerWaalsContact O-CG 3.28Å; T1211-N1215 PolarHBondContact O-N 3.14Å; T1211-N1215 PolarHBondContact O-ND2 3.16Å
1212	S	88.4	Confident	88.3	Confident	25 Å²	25	36.4 Å²	36.4	18%	0.175	19%	0.191	C	C	.	.	H	α-helix	trans	-74.2	-26.5	179.4	-57.4	0	0	0	0	113.6	L666 I1208 L1209 L1210 K1216	L666-S1212 WeakPolarHBondContact O-CB 3.43Å; L666-S1212 PolarHBondContact O-OG 3.33Å; I1208-S1212 VanDerWaalsContact O-CB 3.3Å; I1208-S1212 WeakPolarHBondContact O-CB 3.23Å; I1208-S1212 PolarHBondContact O-N 3.05Å; I1208-S1212 PolarHBondContact O-OG 2.94Å; L1209-S1212 PolarHBondContact O-N 3.42Å; L1210-S1212 VanDerWaalsContact C-N 3.28Å; L1210-S1212 PolarHBondContact O-N 3.42Å; S1212-K1216 WeakPolarHBondContact O-CD 3.44Å; S1212-K1216 VanDerWaalsContact O-CG 3.28Å; S1212-K1216 WeakPolarHBondContact O-CG 3.42Å
1213	L	87.4	Confident	88	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-77	-45	169.7	-72.6	165.8	0	0	0	111.1	I627 M631 L666 I1181 L1209 L1210 N1215 K1216 T1217 Y1226	I627-L1213 HydrophobicContact CG2-CD2 4.3Å; M631-L1213 HydrophobicContact SD-CD2 4.45Å; L666-L1213 HydrophobicContact CD1-CD2 4.19Å; L666-L1213 HydrophobicContact CD1-CG 4.43Å; L666-L1213 HydrophobicContact CD2-CD2 4.04Å; L666-L1213 HydrophobicContact CD2-CG 4.16Å; I1181-L1213 HydrophobicContact CG2-CD1 4.09Å; L1209-L1213 WeakPolarHBondContact O-CB 3.5Å; L1209-L1213 VanDerWaalsContact O-CG 3.29Å; L1209-L1213 WeakPolarHBondContact O-CG 3.31Å; L1209-L1213 PolarHBondContact O-N 3.42Å; L1210-L1213 PolarHBondContact O-N 3.23Å; L1213-N1215 VanDerWaalsContact C-N 3.26Å; L1213-N1215 PolarHBondContact O-N 2.78Å; L1213-K1216 CarbonylContact O-C 2.9Å; L1213-K1216 WeakPolarHBondContact O-CA 3.39Å; L1213-K1216 PolarHBondContact O-N 3.05Å; L1213-T1217 PolarHBondContact O-N 3.45Å; L1213-Y1226 HydrophobicContact CB-CD2 4.23Å; L1213-Y1226 HydrophobicContact CB-CE2 4.44Å; L1213-Y1226 HydrophobicContact CB-CG 4.41Å
1214	G	87.6	Confident	87.7	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60	-32.8	174.3	0	0	0	0	0	113.3	L1210 T1211 K1216 K1223	L1210-G1214 PolarHBondContact O-N 2.69Å; T1211-G1214 PolarHBondContact O-N 3.29Å; G1214-K1216 VanDerWaalsContact C-N 3.27Å; G1214-K1216 PolarHBondContact O-N 2.91Å; G1214-K1223 WeakPolarHBondContact O-CE 3.45Å; G1214-K1223 VanDerWaalsContact O-CG 3.3Å; G1214-K1223 WeakPolarHBondContact O-CG 3.34Å; G1214-K1223 PolarHBondContact O-NZ 3.02Å
1215	N	87.3	Confident	87.5	Confident	97 Å²	97	46.1 Å²	46.1	52%	0.519	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.7	173.1	-69.5	-18.8	0	0	0	113.9	T1211 L1213 R1227	T1211-N1215 WeakPolarHBondContact O-CB 3.11Å; T1211-N1215 VanDerWaalsContact O-CG 3.28Å; T1211-N1215 PolarHBondContact O-N 3.14Å; T1211-N1215 PolarHBondContact O-ND2 3.16Å; L1213-N1215 VanDerWaalsContact C-N 3.26Å; L1213-N1215 PolarHBondContact O-N 2.78Å; N1215-R1227 PolarHBondContact OD1-NH2 3.11Å; N1215-R1227 VanDerWaalsContact OD1-NH2 3.13Å
1216	K	84.4	Confident	87.4	Confident	96 Å²	96	46.1 Å²	46.1	42%	0.417	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-2	178.4	-69.8	179.4	-173.4	-176.9	0	114.6	M631 A665 L666 S1212 L1213 G1214	M631-K1216 HydrophobicContact CE-CD 3.89Å; M631-K1216 HydrophobicContact SD-CD 3.82Å; A665-K1216 PolarHBondContact O-NZ 3.48Å; L666-K1216 HydrophobicContact CD2-CD 4.14Å; S1212-K1216 WeakPolarHBondContact O-CD 3.44Å; S1212-K1216 VanDerWaalsContact O-CG 3.28Å; S1212-K1216 WeakPolarHBondContact O-CG 3.42Å; L1213-K1216 CarbonylContact O-C 2.9Å; L1213-K1216 WeakPolarHBondContact O-CA 3.39Å; L1213-K1216 PolarHBondContact O-N 3.05Å; G1214-K1216 VanDerWaalsContact C-N 3.27Å; G1214-K1216 PolarHBondContact O-N 2.91Å
1217	T	83.4	Confident	87.4	Confident	6 Å²	6	51.3 Å²	51.3	4%	0.037	26%	0.257	C	S	.	.			trans	-94.1	139.3	171.1	-170.6	0	0	0	0	111.4	I627 L1213 D1219 D1222 K1223 Y1226	I627-T1217 WeakPolarHBondContact CD1-OG1 3.41Å; L1213-T1217 PolarHBondContact O-N 3.45Å; T1217-D1219 PolarHBondContact OG1-N 2.74Å; T1217-D1222 HydrophobicContact CG2-CB 4.33Å; T1217-K1223 HydrophobicContact CG2-CB 3.79Å; T1217-K1223 HydrophobicContact CG2-CG 4.01Å; T1217-K1223 PolarHBondContact O-NZ 3.19Å; T1217-Y1226 HydrophobicContact CG2-CD2 4.11Å; T1217-Y1226 HydrophobicContact CG2-CE2 4.36Å
1218	D	79.2	Confident	87.3	Confident	125 Å²	125	52.9 Å²	52.9	67%	0.668	27%	0.267	S	S	*	.			trans	-89.2	-27.3	175.1	-62.7	-35.6	0	0	0	111.8	Y749 F1220	Y749-D1218 PolarHBondContact OH-OD2 2.68Å; D1218-F1220 PolarHBondContact O-N 2.81Å
1219	D	80.5	Confident	87.3	Confident	70 Å²	70	54.1 Å²	54.1	37%	0.374	27%	0.272	S	S	.	.			trans	-70.3	118.1	175.5	-175.9	-19.2	0	0	0	110.4	T1217 T1221 D1222 K1223	T1217-D1219 PolarHBondContact OG1-N 2.74Å; D1219-T1221 VanDerWaalsContact C-N 3.26Å; D1219-T1221 PolarHBondContact O-N 3Å; D1219-T1221 WeakPolarHBondContact OD1-CA 3.5Å; D1219-T1221 VanDerWaalsContact OD1-CB 3.25Å; D1219-T1221 WeakPolarHBondContact OD1-CB 3.49Å; D1219-T1221 PolarHBondContact OD1-N 2.72Å; D1219-T1221 PolarHBondContact OD1-OG1 2.7Å; D1219-D1222 HydrophobicContact CB-CB 4.27Å; D1219-D1222 PolarHBondContact O-N 3.05Å; D1219-K1223 VanDerWaalsContact O-CB 3.32Å; D1219-K1223 WeakPolarHBondContact O-CB 3.36Å; D1219-K1223 PolarHBondContact O-N 3Å
1220	F	82.8	Confident	87.4	Confident	159 Å²	159	54.2 Å²	54.2	70%	0.697	27%	0.274	S	S	*	.	H	α-helix	trans	-58.9	-34.4	179	-178.2	-93.3	0	0	0	113.2	D1218 K1223 E1224	D1218-F1220 PolarHBondContact O-N 2.81Å; F1220-K1223 VanDerWaalsContact O-CB 3.3Å; F1220-K1223 WeakPolarHBondContact O-CB 3.38Å; F1220-K1223 PolarHBondContact O-N 3.14Å; F1220-E1224 PolarHBondContact O-N 3.01Å
1221	T	85	Confident	87.4	Confident	95 Å²	95	59.4 Å²	59.4	58%	0.583	30%	0.296	S	S	*	.	H	α-helix	trans	-67.2	-53.5	-179	-26.8	0	0	0	0	110.1	D1219 K1223 E1224 D1225	D1219-T1221 VanDerWaalsContact C-N 3.26Å; D1219-T1221 PolarHBondContact O-N 3Å; D1219-T1221 WeakPolarHBondContact OD1-CA 3.5Å; D1219-T1221 VanDerWaalsContact OD1-CB 3.25Å; D1219-T1221 WeakPolarHBondContact OD1-CB 3.49Å; D1219-T1221 PolarHBondContact OD1-N 2.72Å; D1219-T1221 PolarHBondContact OD1-OG1 2.7Å; T1221-K1223 PolarHBondContact O-N 2.79Å; T1221-E1224 PolarHBondContact O-N 3.49Å; T1221-D1225 PolarHBondContact O-N 2.92Å
1222	D	83	Confident	87.4	Confident	9 Å²	9	59.5 Å²	59.5	5%	0.048	29%	0.294	C	S	.	.	H	α-helix	trans	-62.3	-32.8	174.5	-79.7	2.6	0	0	0	111.2	K624 T1217 D1219 Y1226	K624-D1222 WeakPolarHBondContact CE-OD1 3.44Å; K624-D1222 WeakPolarHBondContact CG-OD2 3.28Å; K624-D1222 IonicContact NZ-OD1 2.7Å; T1217-D1222 HydrophobicContact CG2-CB 4.33Å; D1219-D1222 HydrophobicContact CB-CB 4.27Å; D1219-D1222 PolarHBondContact O-N 3.05Å; D1222-Y1226 HydrophobicContact CB-CD2 4.43Å; D1222-Y1226 HydrophobicContact CB-CE2 3.97Å; D1222-Y1226 WeakPolarHBondContact O-CB 3.48Å; D1222-Y1226 WeakPolarHBondContact O-CD2 3.43Å; D1222-Y1226 VanDerWaalsContact O-CG 3.25Å; D1222-Y1226 PolarHBondContact O-N 2.87Å
1223	K	86.8	Confident	87.6	Confident	52 Å²	52	58.3 Å²	58.3	23%	0.226	29%	0.286	C	S	.	.	H	α-helix	trans	-60.8	-47.2	177.1	-153.5	177.9	-151.6	92.3	0	112.4	G1214 T1217 D1219 F1220 T1221 R1227	G1214-K1223 WeakPolarHBondContact O-CE 3.45Å; G1214-K1223 VanDerWaalsContact O-CG 3.3Å; G1214-K1223 WeakPolarHBondContact O-CG 3.34Å; G1214-K1223 PolarHBondContact O-NZ 3.02Å; T1217-K1223 HydrophobicContact CG2-CB 3.79Å; T1217-K1223 HydrophobicContact CG2-CG 4.01Å; T1217-K1223 PolarHBondContact O-NZ 3.19Å; D1219-K1223 VanDerWaalsContact O-CB 3.32Å; D1219-K1223 WeakPolarHBondContact O-CB 3.36Å; D1219-K1223 PolarHBondContact O-N 3Å; F1220-K1223 VanDerWaalsContact O-CB 3.3Å; F1220-K1223 WeakPolarHBondContact O-CB 3.38Å; F1220-K1223 PolarHBondContact O-N 3.14Å; T1221-K1223 PolarHBondContact O-N 2.79Å; K1223-R1227 WeakPolarHBondContact O-CB 3.5Å; K1223-R1227 VanDerWaalsContact O-CG 3.29Å; K1223-R1227 WeakPolarHBondContact O-CG 3.44Å; K1223-R1227 PolarHBondContact O-N 2.72Å
1224	E	88.9	Confident	87.9	Confident	97 Å²	97	59.4 Å²	59.4	45%	0.453	29%	0.291	S	S	.	.	H	α-helix	trans	-79.3	-31.5	-178.2	-163.3	54.1	-147.4	0	0	111.9	F1220 T1221 R1227 S1228	F1220-E1224 PolarHBondContact O-N 3.01Å; T1221-E1224 PolarHBondContact O-N 3.49Å; E1224-R1227 PolarHBondContact O-N 3.48Å; E1224-S1228 VanDerWaalsContact O-CB 3.23Å; E1224-S1228 WeakPolarHBondContact O-CB 3.02Å; E1224-S1228 PolarHBondContact O-N 3.21Å; E1224-S1228 PolarHBondContact O-OG 3.04Å
1225	D	87.9	Confident	88	Confident	56 Å²	56	62.5 Å²	62.5	30%	0.299	31%	0.305	S	S	.	.	H	α-helix	trans	-54.6	-53.9	164.5	-104.1	12.2	0	0	0	110.9	K624 L1186 T1221 R1227 S1228 F1229	K624-D1225 IonicContact NZ-OD2 3.42Å; K624-D1225 PolarHBondContact NZ-OD2 2.82Å; L1186-D1225 HydrophobicContact CD1-CB 4.17Å; T1221-D1225 PolarHBondContact O-N 2.92Å; D1225-R1227 PolarHBondContact O-N 3.01Å; D1225-S1228 PolarHBondContact O-OG 3.33Å; D1225-F1229 WeakPolarHBondContact O-CB 3.25Å; D1225-F1229 WeakPolarHBondContact O-CD2 3.39Å; D1225-F1229 PolarHBondContact O-N 3.09Å
1226	Y	90.9	Very high	88.2	Confident	3 Å²	3	59.9 Å²	59.9	1%	0.012	29%	0.288	C	S	.	.	H	α-helix	trans	-65.5	-37.5	-179.3	-65	-44	0	0	0	112.5	I627 L1186 L1210 L1213 T1217 D1222 A1230	I627-Y1226 HydrophobicContact CD1-CE2 3.92Å; L1186-Y1226 HydrophobicContact CD1-CD1 4.12Å; L1186-Y1226 HydrophobicContact CD1-CE1 4.34Å; L1186-Y1226 HydrophobicContact CD2-CD1 4.15Å; L1186-Y1226 HydrophobicContact CD2-CE1 4.14Å; L1210-Y1226 HydrophobicContact CD2-CD1 3.7Å; L1210-Y1226 HydrophobicContact CD2-CE1 4.44Å; L1213-Y1226 HydrophobicContact CB-CD2 4.23Å; L1213-Y1226 HydrophobicContact CB-CE2 4.44Å; L1213-Y1226 HydrophobicContact CB-CG 4.41Å; T1217-Y1226 HydrophobicContact CG2-CD2 4.11Å; T1217-Y1226 HydrophobicContact CG2-CE2 4.36Å; D1222-Y1226 HydrophobicContact CB-CD2 4.43Å; D1222-Y1226 HydrophobicContact CB-CE2 3.97Å; D1222-Y1226 WeakPolarHBondContact O-CB 3.48Å; D1222-Y1226 WeakPolarHBondContact O-CD2 3.43Å; D1222-Y1226 VanDerWaalsContact O-CG 3.25Å; D1222-Y1226 PolarHBondContact O-N 2.87Å; Y1226-A1230 WeakPolarHBondContact O-CB 3.31Å; Y1226-A1230 PolarHBondContact O-N 3.09Å
1227	R	91.2	Very high	88.7	Confident	111 Å²	111	55.3 Å²	55.3	42%	0.419	27%	0.268	S	S	.	.	H	α-helix	trans	-70.3	-43.8	178.4	-76.5	174.2	170.7	-164.8	-5.1	113	N1215 K1223 E1224 D1225 A1230 K1231	N1215-R1227 PolarHBondContact OD1-NH2 3.11Å; N1215-R1227 VanDerWaalsContact OD1-NH2 3.13Å; K1223-R1227 WeakPolarHBondContact O-CB 3.5Å; K1223-R1227 VanDerWaalsContact O-CG 3.29Å; K1223-R1227 WeakPolarHBondContact O-CG 3.44Å; K1223-R1227 PolarHBondContact O-N 2.72Å; E1224-R1227 PolarHBondContact O-N 3.48Å; D1225-R1227 PolarHBondContact O-N 3.01Å; R1227-A1230 PolarHBondContact O-N 3.26Å; R1227-K1231 PolarHBondContact O-N 3.49Å
1228	S	91.5	Very high	89.1	Confident	37 Å²	37	57.6 Å²	57.6	26%	0.259	28%	0.279	S	S	.	.	H	α-helix	trans	-64.3	-44.1	176.6	61.5	0	0	0	0	111.5	E1224 D1225 K1231 N1232	E1224-S1228 VanDerWaalsContact O-CB 3.23Å; E1224-S1228 WeakPolarHBondContact O-CB 3.02Å; E1224-S1228 PolarHBondContact O-N 3.21Å; E1224-S1228 PolarHBondContact O-OG 3.04Å; D1225-S1228 PolarHBondContact O-OG 3.33Å; S1228-K1231 PolarHBondContact O-N 3Å; S1228-N1232 PolarHBondContact O-N 3.45Å; S1228-N1232 PolarHBondContact O-ND2 3.47Å; S1228-N1232 PolarHBondContact O-OD1 2.89Å
1229	F	92.1	Very high	89.6	Confident	36 Å²	36	52.2 Å²	52.2	16%	0.158	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-37.8	173.2	-86.1	-95.4	0	0	0	112.8	L1186 L1210 D1225 K1231 N1232 F1233	L1186-F1229 HydrophobicContact CB-CD1 3.89Å; L1186-F1229 HydrophobicContact CB-CD2 4.14Å; L1186-F1229 HydrophobicContact CB-CE1 3.75Å; L1186-F1229 HydrophobicContact CB-CE2 3.99Å; L1186-F1229 HydrophobicContact CB-CG 4.07Å; L1186-F1229 HydrophobicContact CB-CZ 3.79Å; L1186-F1229 HydrophobicContact CD1-CB 4.27Å; L1186-F1229 HydrophobicContact CD1-CD2 3.54Å; L1186-F1229 HydrophobicContact CD1-CE2 3.93Å; L1186-F1229 HydrophobicContact CD1-CG 3.87Å; L1186-F1229 HydrophobicContact CG-CD2 4.42Å; L1186-F1229 HydrophobicContact CG-CG 4.43Å; L1210-F1229 HydrophobicContact CD1-CB 4.01Å; D1225-F1229 WeakPolarHBondContact O-CB 3.25Å; D1225-F1229 WeakPolarHBondContact O-CD2 3.39Å; D1225-F1229 PolarHBondContact O-N 3.09Å; F1229-K1231 VanDerWaalsContact C-N 3.3Å; F1229-K1231 PolarHBondContact O-N 3.44Å; F1229-N1232 PolarHBondContact O-N 3.47Å; F1229-F1233 HydrophobicContact CD1-CE2 4.31Å; F1229-F1233 VanDerWaalsContact O-CD2 3.24Å; F1229-F1233 WeakPolarHBondContact O-CD2 3.35Å; F1229-F1233 PolarHBondContact O-N 3.37Å
1230	A	92.8	Very high	90.2	Very high	3 Å²	3	48.9 Å²	48.9	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-59.2	-42.1	175.1	0	0	0	0	0	112	S1207 L1210 Y1226 R1227 Q1234	S1207-A1230 WeakPolarHBondContact CB-O 3.44Å; S1207-A1230 PolarHBondContact OG-O 2.99Å; L1210-A1230 HydrophobicContact CB-CB 3.76Å; Y1226-A1230 WeakPolarHBondContact O-CB 3.31Å; Y1226-A1230 PolarHBondContact O-N 3.09Å; R1227-A1230 PolarHBondContact O-N 3.26Å; A1230-Q1234 PolarHBondContact O-N 3.47Å
1231	K	92.1	Very high	90.7	Very high	108 Å²	108	41.4 Å²	41.4	47%	0.47	20%	0.202	S	C	.	.	H	α-helix	trans	-64.4	-46.1	173	179.9	-172	167.4	-169	0	111.7	R1227 S1228 F1229 F1233 Q1234 E1235	R1227-K1231 PolarHBondContact O-N 3.49Å; S1228-K1231 PolarHBondContact O-N 3Å; F1229-K1231 VanDerWaalsContact C-N 3.3Å; F1229-K1231 PolarHBondContact O-N 3.44Å; K1231-F1233 VanDerWaalsContact C-N 3.3Å; K1231-F1233 PolarHBondContact O-N 3.02Å; K1231-Q1234 WeakPolarHBondContact O-CB 3.47Å; K1231-Q1234 PolarHBondContact O-N 3.39Å; K1231-Q1234 VanDerWaalsContact O-N 3.07Å; K1231-E1235 WeakPolarHBondContact CE-OE1 3.45Å; K1231-E1235 HydrophobicContact CG-CG 4.48Å; K1231-E1235 PolarHBondContact O-N 3.04Å
1232	N	91.6	Very high	91	Very high	60 Å²	60	40.4 Å²	40.4	32%	0.321	19%	0.193	S	C	.	.	H	α-helix	trans	-59.8	-39.4	178.3	-66.9	-15.6	0	0	0	112	S1228 F1229 R1236	S1228-N1232 PolarHBondContact O-N 3.45Å; S1228-N1232 PolarHBondContact O-ND2 3.47Å; S1228-N1232 PolarHBondContact O-OD1 2.89Å; F1229-N1232 PolarHBondContact O-N 3.47Å; N1232-R1236 WeakPolarHBondContact O-CB 3.22Å; N1232-R1236 WeakPolarHBondContact O-CD 3.35Å; N1232-R1236 VanDerWaalsContact O-CG 3.23Å; N1232-R1236 WeakPolarHBondContact O-CG 3.45Å; N1232-R1236 PolarHBondContact O-N 3.01Å
1233	F	93.3	Very high	91.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-68.5	-39.4	172.5	-78.9	-68	0	0	0	112.5	A1189 W1193 A1203 A1206 L1210 F1229 K1231 E1235 R1236 A1237	A1189-F1233 HydrophobicContact CB-CZ 4.29Å; W1193-F1233 HydrophobicContact CB-CE1 3.93Å; W1193-F1233 HydrophobicContact CG-CD1 4.44Å; W1193-F1233 AromaticContact CG-CE1 3.97Å; W1193-F1233 HydrophobicContact CG-CE1 3.97Å; A1203-F1233 HydrophobicContact CB-CD1 4.45Å; A1203-F1233 WeakPolarHBondContact CB-O 3.18Å; A1206-F1233 HydrophobicContact CB-CB 4.3Å; A1206-F1233 HydrophobicContact CB-CD1 4.08Å; A1206-F1233 HydrophobicContact CB-CD2 3.96Å; A1206-F1233 HydrophobicContact CB-CE1 4.41Å; A1206-F1233 HydrophobicContact CB-CE2 4.3Å; A1206-F1233 HydrophobicContact CB-CG 3.85Å; L1210-F1233 HydrophobicContact CD1-CD2 3.54Å; L1210-F1233 HydrophobicContact CD1-CE2 3.82Å; F1229-F1233 HydrophobicContact CD1-CE2 4.31Å; F1229-F1233 VanDerWaalsContact O-CD2 3.24Å; F1229-F1233 WeakPolarHBondContact O-CD2 3.35Å; F1229-F1233 PolarHBondContact O-N 3.37Å; K1231-F1233 VanDerWaalsContact C-N 3.3Å; K1231-F1233 PolarHBondContact O-N 3.02Å; F1233-E1235 PolarHBondContact O-N 3.29Å; F1233-R1236 PolarHBondContact O-N 3Å; F1233-A1237 PolarHBondContact O-N 2.8Å
1234	Q	92.9	Very high	91.6	Very high	28 Å²	28	38.8 Å²	38.8	13%	0.131	19%	0.187	C	C	.	.	H	α-helix	trans	-60.2	-44.4	174.3	-170.6	-176.9	21.4	0	0	111.9	A1230 K1231 R1236 A1237 E1238 S1277	A1230-Q1234 PolarHBondContact O-N 3.47Å; K1231-Q1234 WeakPolarHBondContact O-CB 3.47Å; K1231-Q1234 PolarHBondContact O-N 3.39Å; K1231-Q1234 VanDerWaalsContact O-N 3.07Å; Q1234-R1236 VanDerWaalsContact C-N 3.33Å; Q1234-R1236 PolarHBondContact O-N 2.89Å; Q1234-A1237 WeakPolarHBondContact O-CB 3.25Å; Q1234-A1237 PolarHBondContact O-N 3.04Å; Q1234-E1238 PolarHBondContact O-N 3.17Å; Q1234-S1277 VanDerWaalsContact NE2-C 3.32Å; Q1234-S1277 VanDerWaalsContact NE2-CA 3.28Å
1235	E	91.3	Very high	91.8	Very high	64 Å²	64	37.3 Å²	37.3	30%	0.299	18%	0.177	S	C	.	.	H	α-helix	trans	-70.5	-28.8	179.6	-69.8	173.8	179.2	0	0	111.7	K1231 F1233 G1239 K1279	K1231-E1235 WeakPolarHBondContact CE-OE1 3.45Å; K1231-E1235 HydrophobicContact CG-CG 4.48Å; K1231-E1235 PolarHBondContact O-N 3.04Å; F1233-E1235 PolarHBondContact O-N 3.29Å; E1235-G1239 PolarHBondContact O-N 3.17Å; E1235-K1279 IonicContact OE1-NZ 2.71Å; E1235-K1279 PolarHBondContact OE1-NZ 3.04Å
1236	R	91.4	Very high	91.9	Very high	42 Å²	42	42.6 Å²	42.6	16%	0.158	19%	0.193	C	C	.	.	H	α-helix	trans	-68.3	-40.4	167.5	-75.1	165	-174.9	156.1	2.1	113.2	E1190 W1193 N1232 F1233 Q1234 E1238 G1239 V1240	E1190-R1236 IonicContact OE1-CZ 2.63Å; E1190-R1236 IonicContact OE1-NH1 3.48Å; E1190-R1236 IonicContact OE1-NH2 2.76Å; E1190-R1236 PolarHBondContact OE1-NH2 3.28Å; E1190-R1236 IonicContact OE2-CZ 3.42Å; E1190-R1236 IonicContact OE2-NH1 3.69Å; E1190-R1236 PolarHBondContact OE2-NH1 2.96Å; E1190-R1236 IonicContact OE2-NH2 2.79Å; E1190-R1236 PolarHBondContact OE2-NH2 3.42Å; W1193-R1236 HydrophobicContact CH2-CB 3.76Å; W1193-R1236 HydrophobicContact CH2-CG 4.13Å; W1193-R1236 HydrophobicContact CZ2-CB 3.95Å; W1193-R1236 HydrophobicContact CZ3-CB 4.27Å; W1193-R1236 HydrophobicContact CZ3-CG 4.19Å; N1232-R1236 WeakPolarHBondContact O-CB 3.22Å; N1232-R1236 WeakPolarHBondContact O-CD 3.35Å; N1232-R1236 VanDerWaalsContact O-CG 3.23Å; N1232-R1236 WeakPolarHBondContact O-CG 3.45Å; N1232-R1236 PolarHBondContact O-N 3.01Å; F1233-R1236 PolarHBondContact O-N 3Å; Q1234-R1236 VanDerWaalsContact C-N 3.33Å; Q1234-R1236 PolarHBondContact O-N 2.89Å; R1236-E1238 VanDerWaalsContact C-N 3.32Å; R1236-G1239 PolarHBondContact O-N 2.99Å; R1236-V1240 WeakPolarHBondContact O-CG2 3.3Å; R1236-V1240 PolarHBondContact O-N 2.9Å
1237	A	93.5	Very high	91.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-42.8	174.1	0	0	0	0	0	111	I1200 A1203 L1204 F1233 Q1234 L1241 F1280	I1200-A1237 HydrophobicContact CG2-CB 4.42Å; A1203-A1237 HydrophobicContact CB-CB 3.75Å; L1204-A1237 HydrophobicContact CD2-CB 4.16Å; L1204-A1237 HydrophobicContact CG-CB 4.06Å; F1233-A1237 PolarHBondContact O-N 2.8Å; Q1234-A1237 WeakPolarHBondContact O-CB 3.25Å; Q1234-A1237 PolarHBondContact O-N 3.04Å; A1237-L1241 VanDerWaalsContact O-CB 3.24Å; A1237-L1241 WeakPolarHBondContact O-CB 3.25Å; A1237-L1241 PolarHBondContact O-N 3.28Å; A1237-F1280 HydrophobicContact CB-CD2 3.91Å; A1237-F1280 HydrophobicContact CB-CE2 3.9Å
1238	E	92.3	Very high	91.8	Very high	55 Å²	55	44.8 Å²	44.8	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-65.7	-40.8	175.8	-166.7	-179.4	147.1	0	0	112.1	Q1234 R1236 L1241 N1242 K1279	Q1234-E1238 PolarHBondContact O-N 3.17Å; R1236-E1238 VanDerWaalsContact C-N 3.32Å; E1238-L1241 PolarHBondContact O-N 3.45Å; E1238-N1242 PolarHBondContact O-N 3.49Å; E1238-N1242 PolarHBondContact O-ND2 3.15Å; E1238-K1279 WeakPolarHBondContact OE2-CB 3.2Å
1239	G	90.8	Very high	91.8	Very high	12 Å²	12	47.4 Å²	47.4	12%	0.124	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-47.3	177.3	0	0	0	0	0	113.8	E1235 R1236 L1241 N1242 E1243 Y1754	E1235-G1239 PolarHBondContact O-N 3.17Å; R1236-G1239 PolarHBondContact O-N 2.99Å; G1239-L1241 VanDerWaalsContact C-N 3.3Å; G1239-L1241 PolarHBondContact O-N 2.65Å; G1239-N1242 PolarHBondContact O-N 3.01Å; G1239-E1243 PolarHBondContact O-N 3.18Å; G1239-E1243 VanDerWaalsContact O-N 3.17Å; G1239-Y1754 VanDerWaalsContact CA-CE2 3.49Å
1240	V	92.2	Very high	91.5	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-37	174.4	176.8	0	0	0	0	111.1	W1193 P1199 I1200 R1236 E1243 C1244 A1751 Y1754	W1193-V1240 HydrophobicContact CH2-CG2 3.93Å; W1193-V1240 HydrophobicContact CZ2-CG2 4.04Å; P1199-V1240 HydrophobicContact CG-CG1 4.43Å; I1200-V1240 HydrophobicContact CD1-CG1 4.05Å; I1200-V1240 HydrophobicContact CG1-CB 4.11Å; I1200-V1240 HydrophobicContact CG1-CG1 3.63Å; R1236-V1240 WeakPolarHBondContact O-CG2 3.3Å; R1236-V1240 PolarHBondContact O-N 2.9Å; V1240-E1243 PolarHBondContact O-N 3.03Å; V1240-C1244 PolarHBondContact O-N 2.96Å; V1240-C1244 PolarHBondContact O-SG 2.91Å; V1240-A1751 HydrophobicContact CG1-CB 3.77Å; V1240-A1751 HydrophobicContact CG2-CB 3.88Å; V1240-Y1754 HydrophobicContact CG2-CD1 3.58Å; V1240-Y1754 HydrophobicContact CG2-CE1 4.12Å; V1240-Y1754 HydrophobicContact CG2-CG 4.08Å
1241	L	93.3	Very high	91.3	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-42.1	176.6	179	63.6	0	0	0	112.5	I1200 A1237 E1238 G1239 E1243 C1244 Y1245 T1252 I1256 F1280 H1283 C1285	I1200-L1241 HydrophobicContact CD1-CB 4.46Å; I1200-L1241 HydrophobicContact CD1-CD1 4.49Å; A1237-L1241 VanDerWaalsContact O-CB 3.24Å; A1237-L1241 WeakPolarHBondContact O-CB 3.25Å; A1237-L1241 PolarHBondContact O-N 3.28Å; E1238-L1241 PolarHBondContact O-N 3.45Å; G1239-L1241 VanDerWaalsContact C-N 3.3Å; G1239-L1241 PolarHBondContact O-N 2.65Å; L1241-E1243 VanDerWaalsContact C-N 3.29Å; L1241-E1243 PolarHBondContact O-N 3.48Å; L1241-C1244 PolarHBondContact O-N 2.94Å; L1241-Y1245 VanDerWaalsContact O-CB 3.24Å; L1241-Y1245 WeakPolarHBondContact O-CB 3.44Å; L1241-Y1245 PolarHBondContact O-N 2.69Å; L1241-T1252 HydrophobicContact CD1-CG2 3.36Å; L1241-I1256 HydrophobicContact CD1-CD1 3.91Å; L1241-I1256 HydrophobicContact CD1-CG1 4.14Å; L1241-F1280 HydrophobicContact CB-CE2 4.08Å; L1241-F1280 HydrophobicContact CD2-CD2 4.22Å; L1241-F1280 HydrophobicContact CD2-CE1 4.21Å; L1241-F1280 HydrophobicContact CD2-CE2 3.66Å; L1241-F1280 HydrophobicContact CD2-CZ 3.66Å; L1241-F1280 HydrophobicContact CG-CE2 4.44Å; L1241-H1283 HydrophobicContact CD2-CB 4.07Å; L1241-H1283 WeakPolarHBondContact CD2-ND1 3.33Å; L1241-C1285 HydrophobicContact CD1-CB 4.45Å
1242	N	92.3	Very high	91.3	Very high	74 Å²	74	50.5 Å²	50.5	40%	0.396	23%	0.231	S	C	.	.	H	α-helix	trans	-56.3	-45	173.6	-89.2	-82.5	0	0	0	110.7	E1238 G1239 Y1245 R1246 H1283	E1238-N1242 PolarHBondContact O-N 3.49Å; E1238-N1242 PolarHBondContact O-ND2 3.15Å; G1239-N1242 PolarHBondContact O-N 3.01Å; N1242-Y1245 PolarHBondContact O-N 3.3Å; N1242-R1246 VanDerWaalsContact O-CB 3.3Å; N1242-R1246 WeakPolarHBondContact O-CB 3.44Å; N1242-R1246 PolarHBondContact O-N 3.48Å; N1242-H1283 VanDerWaalsContact CG-NE2 3.28Å; N1242-H1283 PolarHBondContact ND2-CD2 3.27Å; N1242-H1283 PolarHBondContact ND2-NE2 3.42Å; N1242-H1283 PolarHBondContact OD1-NE2 2.87Å
1243	E	89.8	Confident	91.2	Very high	27 Å²	27	48.5 Å²	48.5	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-69.7	-37.7	-177.7	-171	57.6	-167	0	0	113	G1239 V1240 L1241 R1246 E1247 K1750	G1239-E1243 PolarHBondContact O-N 3.18Å; G1239-E1243 VanDerWaalsContact O-N 3.17Å; V1240-E1243 PolarHBondContact O-N 3.03Å; L1241-E1243 VanDerWaalsContact C-N 3.29Å; L1241-E1243 PolarHBondContact O-N 3.48Å; E1243-R1246 IonicContact OE1-CZ 2.9Å; E1243-R1246 IonicContact OE1-NE 2.69Å; E1243-R1246 IonicContact OE1-NH2 2.74Å; E1243-R1246 PolarHBondContact OE1-NH2 3.05Å; E1243-R1246 IonicContact OE2-CZ 3.26Å; E1243-R1246 IonicContact OE2-NE 3.12Å; E1243-R1246 PolarHBondContact OE2-NE 3.32Å; E1243-R1246 IonicContact OE2-NH2 2.76Å; E1243-R1246 PolarHBondContact OE2-NH2 3.05Å; E1243-E1247 PolarHBondContact O-N 3.25Å; E1243-K1750 HydrophobicContact CG-CB 4.49Å; E1243-K1750 HydrophobicContact CG-CD 4.49Å
1244	C	91.7	Very high	90.9	Very high	1 Å²	1	51 Å²	51	1%	0.007	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-47.7	170.9	-62.1	0	0	0	0	111.2	V1240 L1241 R1246 E1247 D1248 T1252 W1746 K1750	V1240-C1244 PolarHBondContact O-N 2.96Å; V1240-C1244 PolarHBondContact O-SG 2.91Å; L1241-C1244 PolarHBondContact O-N 2.94Å; C1244-R1246 VanDerWaalsContact C-N 3.31Å; C1244-R1246 PolarHBondContact O-N 3.12Å; C1244-E1247 PolarHBondContact O-N 3.07Å; C1244-D1248 PolarHBondContact O-N 3.34Å; C1244-T1252 HydrophobicContact CB-CG2 3.79Å; C1244-T1252 WeakPolarHBondContact CB-OG1 3.34Å; C1244-T1252 PolarHBondContact O-OG1 2.7Å; C1244-W1746 HydrophobicContact CB-CH2 4.02Å; C1244-W1746 HydrophobicContact CB-CZ3 4.03Å; C1244-W1746 WeakPolarHBondContact O-CH2 3.26Å; C1244-K1750 VanDerWaalsContact SG-CB 3.56Å
1245	Y	93.1	Very high	90.7	Very high	66 Å²	66	50.1 Å²	50.1	26%	0.259	23%	0.229	S	C	.	.	H	α-helix	trans	-65	-33	-177.9	178.8	-112	0	0	0	112.9	L1241 N1242 E1247 E1249 T1252 P1284 C1285 D1288	L1241-Y1245 VanDerWaalsContact O-CB 3.24Å; L1241-Y1245 WeakPolarHBondContact O-CB 3.44Å; L1241-Y1245 PolarHBondContact O-N 2.69Å; N1242-Y1245 PolarHBondContact O-N 3.3Å; Y1245-E1247 VanDerWaalsContact C-N 3.3Å; Y1245-E1247 PolarHBondContact O-N 2.8Å; Y1245-E1249 HydrophobicContact CD2-CB 4.41Å; Y1245-E1249 HydrophobicContact CE2-CB 4.18Å; Y1245-E1249 HydrophobicContact CE2-CG 3.99Å; Y1245-T1252 PolarHBondContact N-OG1 3.39Å; Y1245-P1284 HydrophobicContact CE1-CB 3.94Å; Y1245-C1285 HydrophobicContact CD2-CB 3.36Å; Y1245-C1285 VanDerWaalsContact CD2-SG 3.53Å; Y1245-C1285 HydrophobicContact CE2-CB 3.81Å; Y1245-C1285 HydrophobicContact CG-CB 3.81Å; Y1245-D1288 PolarHBondContact OH-OD2 3.25Å
1246	R	90.9	Very high	90.6	Very high	166 Å²	166	47.1 Å²	47.1	63%	0.626	22%	0.215	S	C	*	.	H	α-helix	trans	-65.6	-29.9	175.1	-174.4	170.1	74.4	144.8	3.4	112.9	N1242 E1243 C1244	N1242-R1246 VanDerWaalsContact O-CB 3.3Å; N1242-R1246 WeakPolarHBondContact O-CB 3.44Å; N1242-R1246 PolarHBondContact O-N 3.48Å; E1243-R1246 IonicContact OE1-CZ 2.9Å; E1243-R1246 IonicContact OE1-NE 2.69Å; E1243-R1246 IonicContact OE1-NH2 2.74Å; E1243-R1246 PolarHBondContact OE1-NH2 3.05Å; E1243-R1246 IonicContact OE2-CZ 3.26Å; E1243-R1246 IonicContact OE2-NE 3.12Å; E1243-R1246 PolarHBondContact OE2-NE 3.32Å; E1243-R1246 IonicContact OE2-NH2 2.76Å; E1243-R1246 PolarHBondContact OE2-NH2 3.05Å; C1244-R1246 VanDerWaalsContact C-N 3.31Å; C1244-R1246 PolarHBondContact O-N 3.12Å
1247	E	89.2	Confident	90.4	Very high	101 Å²	101	45.9 Å²	45.9	47%	0.472	21%	0.211	S	C	.	.	H	α-helix	trans	-92.3	-45.8	179.8	-173.8	170.4	117.6	0	0	112.9	E1243 C1244 Y1245 W1746 K1750	E1243-E1247 PolarHBondContact O-N 3.25Å; C1244-E1247 PolarHBondContact O-N 3.07Å; Y1245-E1247 VanDerWaalsContact C-N 3.3Å; Y1245-E1247 PolarHBondContact O-N 2.8Å; E1247-W1746 HydrophobicContact CB-CZ2 4.12Å; E1247-W1746 HydrophobicContact CG-CZ2 4.17Å; E1247-W1746 PolarHBondContact OE1-NE1 2.95Å; E1247-K1750 HydrophobicContact CB-CD 4.3Å; E1247-K1750 IonicContact OE1-NZ 2.63Å; E1247-K1750 WeakPolarHBondContact OE2-CD 3.35Å; E1247-K1750 VanDerWaalsContact OE2-CE 3.22Å; E1247-K1750 WeakPolarHBondContact OE2-CE 3.5Å; E1247-K1750 IonicContact OE2-NZ 3.64Å; E1247-K1750 PolarHBondContact OE2-NZ 3.07Å
1248	D	90.9	Very high	90	Very high	59 Å²	59	46.3 Å²	46.3	32%	0.316	21%	0.214	S	C	.	.			trans	-150.5	103.4	179.4	-175.2	-20.5	0	0	0	111.7	C1244 H1250 R1251 T1252 W1746	C1244-D1248 PolarHBondContact O-N 3.34Å; D1248-H1250 VanDerWaalsContact C-N 3.33Å; D1248-H1250 PolarHBondContact O-N 3.3Å; D1248-H1250 WeakPolarHBondContact OD1-CA 3.35Å; D1248-H1250 PolarHBondContact OD1-N 3.38Å; D1248-R1251 HydrophobicContact CB-CB 3.91Å; D1248-R1251 PolarHBondContact OD1-N 2.89Å; D1248-R1251 WeakPolarHBondContact OD2-CB 3.43Å; D1248-T1252 VanDerWaalsContact O-CB 3.29Å; D1248-T1252 WeakPolarHBondContact O-CB 3.46Å; D1248-T1252 PolarHBondContact O-N 3.18Å; D1248-T1252 PolarHBondContact O-OG1 3.29Å; D1248-W1746 HydrophobicContact CB-CH2 3.96Å; D1248-W1746 HydrophobicContact CB-CZ2 3.91Å
1249	E	89.7	Confident	89.6	Confident	92 Å²	92	44.9 Å²	44.9	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-50	-51.8	172.7	173	-168.5	164.1	0	0	111.5	Y1245 T1252 Q1253	Y1245-E1249 HydrophobicContact CD2-CB 4.41Å; Y1245-E1249 HydrophobicContact CE2-CB 4.18Å; Y1245-E1249 HydrophobicContact CE2-CG 3.99Å; E1249-T1252 PolarHBondContact O-N 3.02Å; E1249-Q1253 HydrophobicContact CG-CG 4.46Å; E1249-Q1253 WeakPolarHBondContact O-CG 3.32Å; E1249-Q1253 PolarHBondContact O-N 3.23Å; E1249-Q1253 PolarHBondContact OE1-NE2 3.01Å
1250	H	87.3	Confident	89.3	Confident	138 Å²	138	44.4 Å²	44.4	64%	0.639	20%	0.201	S	C	*	.	H	α-helix	trans	-71.9	-40.9	-167.6	175.1	-84.1	0	0	0	111.4	D1248 T1252 L1254	D1248-H1250 VanDerWaalsContact C-N 3.33Å; D1248-H1250 PolarHBondContact O-N 3.3Å; D1248-H1250 WeakPolarHBondContact OD1-CA 3.35Å; D1248-H1250 PolarHBondContact OD1-N 3.38Å; H1250-T1252 VanDerWaalsContact C-N 3.34Å; H1250-L1254 WeakPolarHBondContact O-CB 3.39Å; H1250-L1254 PolarHBondContact O-N 3.21Å; H1250-L1254 VanDerWaalsContact O-N 3.16Å
1251	R	88.7	Confident	88.7	Confident	72 Å²	72	47.2 Å²	47.2	27%	0.272	22%	0.216	S	C	.	.	H	α-helix	trans	-68.1	-35	174.1	-171.1	177.9	-170.8	168.8	4.1	111.8	D1248 L1254 I1255 E1742 M1743 W1746	D1248-R1251 HydrophobicContact CB-CB 3.91Å; D1248-R1251 PolarHBondContact OD1-N 2.89Å; D1248-R1251 WeakPolarHBondContact OD2-CB 3.43Å; R1251-L1254 WeakPolarHBondContact O-CB 3.11Å; R1251-L1254 PolarHBondContact O-N 2.99Å; R1251-I1255 PolarHBondContact O-N 3.05Å; R1251-I1255 VanDerWaalsContact O-N 3.09Å; R1251-E1742 PolarHBondContact NH2-O 3.37Å; R1251-M1743 HydrophobicContact CG-CG 4.23Å; R1251-W1746 HydrophobicContact CB-CH2 4.1Å; R1251-W1746 HydrophobicContact CB-CZ3 4.08Å; R1251-W1746 HydrophobicContact CG-CD2 4.38Å; R1251-W1746 HydrophobicContact CG-CE3 3.81Å; R1251-W1746 HydrophobicContact CG-CH2 4.08Å; R1251-W1746 HydrophobicContact CG-CZ3 3.64Å; R1251-W1746 VanDerWaalsContact NH2-CB 3.26Å
1252	T	91	Very high	88	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-68.5	-44.5	175.6	-54.5	0	0	0	0	111.8	L1241 C1244 Y1245 D1248 E1249 H1250 L1254 I1255 I1256	L1241-T1252 HydrophobicContact CD1-CG2 3.36Å; C1244-T1252 HydrophobicContact CB-CG2 3.79Å; C1244-T1252 WeakPolarHBondContact CB-OG1 3.34Å; C1244-T1252 PolarHBondContact O-OG1 2.7Å; Y1245-T1252 PolarHBondContact N-OG1 3.39Å; D1248-T1252 VanDerWaalsContact O-CB 3.29Å; D1248-T1252 WeakPolarHBondContact O-CB 3.46Å; D1248-T1252 PolarHBondContact O-N 3.18Å; D1248-T1252 PolarHBondContact O-OG1 3.29Å; E1249-T1252 PolarHBondContact O-N 3.02Å; H1250-T1252 VanDerWaalsContact C-N 3.34Å; T1252-L1254 PolarHBondContact O-N 3.34Å; T1252-I1255 PolarHBondContact O-N 2.84Å; T1252-I1256 WeakPolarHBondContact O-CG1 3.33Å; T1252-I1256 PolarHBondContact O-N 3.05Å
1253	Q	89.2	Confident	87.6	Confident	18 Å²	18	46 Å²	46	8%	0.084	21%	0.206	C	C	.	.	H	α-helix	trans	-57.7	-30.3	172.1	-72.2	-178.7	23	0	0	112.4	E1249 N1257 F1289 N1292	E1249-Q1253 HydrophobicContact CG-CG 4.46Å; E1249-Q1253 WeakPolarHBondContact O-CG 3.32Å; E1249-Q1253 PolarHBondContact O-N 3.23Å; E1249-Q1253 PolarHBondContact OE1-NE2 3.01Å; Q1253-N1257 PolarHBondContact O-OD1 3.15Å; Q1253-F1289 HydrophobicContact CB-CD2 4.23Å; Q1253-F1289 HydrophobicContact CG-CB 4.1Å; Q1253-N1292 PolarHBondContact OE1-ND2 3.17Å
1254	L	87	Confident	86.8	Confident	53 Å²	53	45.3 Å²	45.3	28%	0.277	21%	0.206	S	C	.	.	H	α-helix	trans	-81.2	-19	177.6	-167.3	59.5	0	0	0	114.3	H1250 R1251 T1252 N1257 F1734 M1743	H1250-L1254 WeakPolarHBondContact O-CB 3.39Å; H1250-L1254 PolarHBondContact O-N 3.21Å; H1250-L1254 VanDerWaalsContact O-N 3.16Å; R1251-L1254 WeakPolarHBondContact O-CB 3.11Å; R1251-L1254 PolarHBondContact O-N 2.99Å; T1252-L1254 PolarHBondContact O-N 3.34Å; L1254-N1257 PolarHBondContact O-OD1 3.31Å; L1254-F1734 HydrophobicContact CD1-CE1 3.88Å; L1254-F1734 HydrophobicContact CD1-CZ 4.4Å; L1254-F1734 HydrophobicContact CD2-CE1 4.14Å; L1254-F1734 HydrophobicContact CG-CE1 3.78Å; L1254-F1734 HydrophobicContact CG-CZ 3.97Å; L1254-M1743 HydrophobicContact CB-SD 4.47Å; L1254-M1743 HydrophobicContact CD2-CE 4.36Å; L1254-M1743 HydrophobicContact CD2-SD 3.7Å; L1254-M1743 HydrophobicContact CG-SD 3.94Å
1255	I	88.6	Confident	86.2	Confident	9 Å²	9	50.4 Å²	50.4	5%	0.046	23%	0.225	C	C	.	.	H	α-helix	trans	-79.8	-43.4	168.2	-70.5	167.8	0	0	0	109.9	R1251 T1252 N1257 H1258 M1743 W1746 E1747	R1251-I1255 PolarHBondContact O-N 3.05Å; R1251-I1255 VanDerWaalsContact O-N 3.09Å; T1252-I1255 PolarHBondContact O-N 2.84Å; I1255-N1257 PolarHBondContact O-N 2.86Å; I1255-N1257 VanDerWaalsContact O-N 3.15Å; I1255-H1258 WeakPolarHBondContact O-CB 3.42Å; I1255-H1258 PolarHBondContact O-N 2.67Å; I1255-H1258 VanDerWaalsContact O-N 3.11Å; I1255-M1743 HydrophobicContact CG1-CB 4.42Å; I1255-W1746 HydrophobicContact CD1-CE3 3.67Å; I1255-W1746 HydrophobicContact CD1-CZ3 3.68Å; I1255-E1747 HydrophobicContact CD1-CB 4.16Å
1256	I	90.4	Very high	85.6	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-54.8	-37	-177.7	-74.1	177.9	0	0	0	112.5	L1241 T1252 V1268 I1269 C1285	L1241-I1256 HydrophobicContact CD1-CD1 3.91Å; L1241-I1256 HydrophobicContact CD1-CG1 4.14Å; T1252-I1256 WeakPolarHBondContact O-CG1 3.33Å; T1252-I1256 PolarHBondContact O-N 3.05Å; I1256-V1268 WeakPolarHBondContact O-CB 3.49Å; I1256-V1268 PolarHBondContact O-N 3.32Å; I1256-I1269 HydrophobicContact CG2-CB 3.64Å; I1256-I1269 HydrophobicContact CG2-CD1 4.3Å; I1256-I1269 HydrophobicContact CG2-CG1 4.37Å; I1256-I1269 HydrophobicContact CG2-CG2 4.24Å; I1256-I1269 PolarHBondContact O-N 2.73Å; I1256-I1269 VanDerWaalsContact O-N 3.08Å; I1256-C1285 HydrophobicContact CD1-CB 4.02Å; I1256-C1285 WeakPolarHBondContact CD1-SG 3.26Å
1257	N	87.5	Confident	85.4	Confident	16 Å²	16	39.6 Å²	39.6	9%	0.086	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	9.6	-178.5	78	-14.2	0	0	0	115.2	Q1253 L1254 I1255 F1289 P1729 C1731 V1732	Q1253-N1257 PolarHBondContact O-OD1 3.15Å; L1254-N1257 PolarHBondContact O-OD1 3.31Å; I1255-N1257 PolarHBondContact O-N 2.86Å; I1255-N1257 VanDerWaalsContact O-N 3.15Å; N1257-F1289 HydrophobicContact CB-CE2 3.77Å; N1257-F1289 HydrophobicContact CB-CZ 3.69Å; N1257-P1729 PolarHBondContact ND2-O 2.93Å; N1257-C1731 CarbonylContact O-C 3.6Å; N1257-C1731 WeakPolarHBondContact O-CA 3.13Å; N1257-V1732 WeakPolarHBondContact ND2-CG2 3.13Å; N1257-V1732 PolarHBondContact O-N 2.95Å
1258	H	84.6	Confident	85.5	Confident	10 Å²	10	34.8 Å²	34.8	5%	0.046	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-67.6	142	179.4	176.6	-134.4	0	0	0	113	I1255 L1260 S1267 F1734	I1255-H1258 WeakPolarHBondContact O-CB 3.42Å; I1255-H1258 PolarHBondContact O-N 2.67Å; I1255-H1258 VanDerWaalsContact O-N 3.11Å; H1258-L1260 PolarHBondContact O-N 3.45Å; H1258-L1260 VanDerWaalsContact O-N 3.15Å; H1258-S1267 VanDerWaalsContact O-CA 3.25Å; H1258-S1267 WeakPolarHBondContact O-CA 3.47Å; H1258-S1267 WeakPolarHBondContact O-CB 3.37Å; H1258-F1734 HydrophobicContact CB-CE2 4.07Å; H1258-F1734 HydrophobicContact CB-CZ 4.2Å; H1258-F1734 AromaticContact CD2-CD2 3.21Å; H1258-F1734 WeakPolarHBondContact CD2-CD2 3.14Å; H1258-F1734 AromaticContact CD2-CE2 3.07Å; H1258-F1734 WeakPolarHBondContact CD2-CE2 3.42Å; H1258-F1734 AromaticContact CD2-CZ 3.81Å; H1258-F1734 AromaticContact CG-CE2 3.47Å; H1258-F1734 VanDerWaalsContact CG-CE2 3.47Å; H1258-F1734 AromaticContact NE2-CD2 3.24Å; H1258-F1734 WeakPolarHBondContact NE2-CD2 3.46Å; H1258-F1734 AromaticContact NE2-CE2 3.46Å; H1258-F1734 WeakPolarHBondContact NE2-CE2 3.24Å
1259	E	84.3	Confident	85.5	Confident	25 Å²	25	32 Å²	32	12%	0.117	15%	0.148	C	C	.	.			trans	-70.8	97.8	168.1	-173	-168.6	158.4	0	0	111.2	I1261 R1265 V1732 R1733	E1259-I1261 PolarHBondContact O-N 3.43Å; E1259-R1265 HydrophobicContact CG-CB 4.06Å; E1259-R1265 HydrophobicContact CG-CG 4.49Å; E1259-R1265 WeakPolarHBondContact OE1-CD 3.49Å; E1259-R1265 WeakPolarHBondContact OE1-CG 3.14Å; E1259-V1732 PolarHBondContact N-O 3.25Å; E1259-R1733 HydrophobicContact CB-CB 4.34Å; E1259-R1733 VanDerWaalsContact OE2-CB 3.25Å; E1259-R1733 WeakPolarHBondContact OE2-CB 3.22Å; E1259-R1733 VanDerWaalsContact OE2-CD 3.23Å; E1259-R1733 WeakPolarHBondContact OE2-CD 3.33Å; E1259-R1733 WeakPolarHBondContact OE2-CG 3.22Å
1260	L	84	Confident	85.4	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.01	14%	0.142	C	C	.	.	B	Isolated β-bridge	trans	-73.7	91.3	178.1	-59.8	163	0	0	0	110.7	E1198 A1201 H1258 Y1262 Y1263 R1265 S1266 V1268	E1198-L1260 HydrophobicContact CG-CD2 4.46Å; A1201-L1260 HydrophobicContact CB-CD1 3.63Å; A1201-L1260 HydrophobicContact CB-CD2 4.11Å; A1201-L1260 HydrophobicContact CB-CG 4.49Å; H1258-L1260 PolarHBondContact O-N 3.45Å; H1258-L1260 VanDerWaalsContact O-N 3.15Å; L1260-Y1262 PolarHBondContact O-N 2.91Å; L1260-Y1263 HydrophobicContact CB-CD2 4.15Å; L1260-Y1263 HydrophobicContact CB-CG 4.41Å; L1260-Y1263 HydrophobicContact CD1-CG 4.48Å; L1260-Y1263 CarbonylContact O-C 3.52Å; L1260-Y1263 PolarHBondContact O-N 3.23Å; L1260-R1265 WeakPolarHBondContact O-CA 3.28Å; L1260-R1265 PolarHBondContact O-N 2.89Å; L1260-S1266 VanDerWaalsContact CB-O 3.28Å; L1260-S1266 WeakPolarHBondContact CB-O 3.45Å; L1260-S1266 PolarHBondContact N-O 2.89Å; L1260-V1268 HydrophobicContact CD1-CG2 3.91Å; L1260-V1268 HydrophobicContact CD2-CG2 4.47Å
1261	I	78.8	Confident	85.5	Confident	58 Å²	58	24.6 Å²	24.6	30%	0.297	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-38.5	-177.8	-59.3	175.6	0	0	0	112.3	E1259	E1259-I1261 PolarHBondContact O-N 3.43Å
1262	Y	78.8	Confident	85.6	Confident	49 Å²	49	21.1 Å²	21.1	19%	0.192	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-24.5	-178.2	-67.8	-72.5	0	0	0	114.5	L674 D1170 R1171 L1260 G1264	L674-Y1262 HydrophobicContact CD2-CD1 4.37Å; D1170-Y1262 HydrophobicContact CB-CE1 4.02Å; D1170-Y1262 VanDerWaalsContact CB-OH 3.31Å; D1170-Y1262 WeakPolarHBondContact CB-OH 3.48Å; D1170-Y1262 PolarHBondContact OD2-OH 3.32Å; R1171-Y1262 VanDerWaalsContact CZ-CD2 3.44Å; R1171-Y1262 VanDerWaalsContact NH2-CD2 3.3Å; L1260-Y1262 PolarHBondContact O-N 2.91Å; Y1262-G1264 VanDerWaalsContact C-N 3.33Å; Y1262-G1264 PolarHBondContact O-N 3.08Å
1263	Y	84.7	Confident	85.5	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	53.4	-179.8	-63.4	-96.1	0	0	0	110.1	R1174 E1196 E1198 A1201 A1202 L1205 L1260 R1265 S1266	R1174-Y1263 HydrophobicContact CG-CE1 4.47Å; E1196-Y1263 WeakPolarHBondContact CG-OH 3.39Å; E1198-Y1263 HydrophobicContact CB-CE2 4.22Å; E1198-Y1263 WeakPolarHBondContact OE2-CE2 3.05Å; A1201-Y1263 HydrophobicContact CB-CD1 4.1Å; A1201-Y1263 HydrophobicContact CB-CD2 3.83Å; A1201-Y1263 HydrophobicContact CB-CE1 4.14Å; A1201-Y1263 HydrophobicContact CB-CE2 3.87Å; A1201-Y1263 HydrophobicContact CB-CG 3.97Å; A1202-Y1263 WeakPolarHBondContact CB-OH 3.22Å; L1205-Y1263 HydrophobicContact CB-CD1 4.08Å; L1205-Y1263 HydrophobicContact CB-CE1 4.12Å; L1205-Y1263 HydrophobicContact CD2-CD1 3.76Å; L1205-Y1263 HydrophobicContact CD2-CE1 3.79Å; L1205-Y1263 HydrophobicContact CG-CD1 4.47Å; L1260-Y1263 HydrophobicContact CB-CD2 4.15Å; L1260-Y1263 HydrophobicContact CB-CG 4.41Å; L1260-Y1263 HydrophobicContact CD1-CG 4.48Å; L1260-Y1263 CarbonylContact O-C 3.52Å; L1260-Y1263 PolarHBondContact O-N 3.23Å; Y1263-R1265 VanDerWaalsContact C-N 3.27Å; Y1263-R1265 PolarHBondContact O-N 2.82Å; Y1263-S1266 PolarHBondContact O-N 3.04Å
1264	G	73.1	Confident	85.1	Confident	13 Å²	13	24.6 Å²	24.6	13%	0.134	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	14.9	174.5	0	0	0	0	0	116.2	H672 Y1262 S1266	H672-G1264 WeakPolarHBondContact O-CA 3.4Å; Y1262-G1264 VanDerWaalsContact C-N 3.33Å; Y1262-G1264 PolarHBondContact O-N 3.08Å; G1264-S1266 PolarHBondContact O-N 3.1Å
1265	R	78.3	Confident	84.9	Confident	108 Å²	108	23 Å²	23	41%	0.408	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	25.2	-170.7	-57.5	179	-176.8	179.1	-1.7	113.6	E679 E1259 L1260 Y1263	E679-R1265 IonicContact OE1-CZ 3.23Å; E679-R1265 IonicContact OE1-NH2 2.72Å; E679-R1265 PolarHBondContact OE1-NH2 3.31Å; E679-R1265 IonicContact OE2-NH2 2.8Å; E679-R1265 PolarHBondContact OE2-NH2 2.87Å; E1259-R1265 HydrophobicContact CG-CB 4.06Å; E1259-R1265 HydrophobicContact CG-CG 4.49Å; E1259-R1265 WeakPolarHBondContact OE1-CD 3.49Å; E1259-R1265 WeakPolarHBondContact OE1-CG 3.14Å; L1260-R1265 WeakPolarHBondContact O-CA 3.28Å; L1260-R1265 PolarHBondContact O-N 2.89Å; Y1263-R1265 VanDerWaalsContact C-N 3.27Å; Y1263-R1265 PolarHBondContact O-N 2.82Å
1266	S	81	Confident	84.8	Confident	5 Å²	5	29.6 Å²	29.6	4%	0.035	14%	0.143	C	C	.	.	B	Isolated β-bridge	trans	-83.1	171.8	166	-161	0	0	0	0	110.5	L1260 Y1263 G1264	L1260-S1266 VanDerWaalsContact CB-O 3.28Å; L1260-S1266 WeakPolarHBondContact CB-O 3.45Å; L1260-S1266 PolarHBondContact N-O 2.89Å; Y1263-S1266 PolarHBondContact O-N 3.04Å; G1264-S1266 PolarHBondContact O-N 3.1Å
1267	S	87.3	Confident	84.7	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.007	14%	0.143	C	C	.	.			trans	-106.5	162.8	168.7	60.4	0	0	0	0	111.3	H1258 I1269 K1270 L1271 F1730	H1258-S1267 VanDerWaalsContact O-CA 3.25Å; H1258-S1267 WeakPolarHBondContact O-CA 3.47Å; H1258-S1267 WeakPolarHBondContact O-CB 3.37Å; S1267-I1269 VanDerWaalsContact C-N 3.3Å; S1267-I1269 PolarHBondContact O-N 2.87Å; S1267-K1270 PolarHBondContact O-N 2.88Å; S1267-K1270 WeakPolarHBondContact OG-CB 3.31Å; S1267-K1270 PolarHBondContact OG-N 3.4Å; S1267-L1271 VanDerWaalsContact O-CB 3.29Å; S1267-L1271 WeakPolarHBondContact O-CB 3.39Å; S1267-L1271 PolarHBondContact O-N 3.18Å; S1267-F1730 WeakPolarHBondContact CB-O 3.24Å; S1267-F1730 PolarHBondContact OG-O 3.28Å
1268	V	91.1	Very high	84.7	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.7	-45.2	178.4	-175	0	0	0	0	110.8	I1200 L1204 I1256 L1260 L1271 A1272 F1280	I1200-V1268 HydrophobicContact CG2-CG1 3.66Å; L1204-V1268 HydrophobicContact CD1-CG1 3.62Å; I1256-V1268 WeakPolarHBondContact O-CB 3.49Å; I1256-V1268 PolarHBondContact O-N 3.32Å; L1260-V1268 HydrophobicContact CD1-CG2 3.91Å; L1260-V1268 HydrophobicContact CD2-CG2 4.47Å; V1268-L1271 PolarHBondContact O-N 2.9Å; V1268-A1272 WeakPolarHBondContact O-CB 3.34Å; V1268-A1272 PolarHBondContact O-N 2.8Å; V1268-F1280 HydrophobicContact CG1-CE1 3.99Å; V1268-F1280 HydrophobicContact CG1-CZ 3.7Å
1269	I	91.1	Very high	84.9	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-64.7	-40.9	178.7	-165.1	168.4	0	0	0	112.7	I1256 S1267 A1272 A1273 M1281 F1289 L1290 Y1683 F1730	I1256-I1269 HydrophobicContact CG2-CB 3.64Å; I1256-I1269 HydrophobicContact CG2-CD1 4.3Å; I1256-I1269 HydrophobicContact CG2-CG1 4.37Å; I1256-I1269 HydrophobicContact CG2-CG2 4.24Å; I1256-I1269 PolarHBondContact O-N 2.73Å; I1256-I1269 VanDerWaalsContact O-N 3.08Å; S1267-I1269 VanDerWaalsContact C-N 3.3Å; S1267-I1269 PolarHBondContact O-N 2.87Å; I1269-A1272 PolarHBondContact O-N 3.01Å; I1269-A1273 WeakPolarHBondContact O-CB 3.47Å; I1269-A1273 PolarHBondContact O-N 3.09Å; I1269-M1281 HydrophobicContact CD1-CE 4.17Å; I1269-M1281 HydrophobicContact CG1-CE 3.8Å; I1269-M1281 HydrophobicContact CG1-SD 3.95Å; I1269-F1289 HydrophobicContact CD1-CD1 3.61Å; I1269-F1289 HydrophobicContact CD1-CE1 3.81Å; I1269-L1290 HydrophobicContact CD1-CG 4.49Å; I1269-Y1683 HydrophobicContact CD1-CD2 3.86Å; I1269-Y1683 HydrophobicContact CD1-CE2 3.93Å; I1269-Y1683 HydrophobicContact CG1-CD2 3.97Å; I1269-Y1683 HydrophobicContact CG1-CE2 3.75Å; I1269-F1730 HydrophobicContact CD1-CD1 4.24Å; I1269-F1730 HydrophobicContact CD1-CE1 4.37Å; I1269-F1730 HydrophobicContact CG2-CB 4.29Å; I1269-F1730 HydrophobicContact CG2-CD1 4.03Å
1270	K	86.8	Confident	85.2	Confident	74 Å²	74	33.3 Å²	33.3	32%	0.322	16%	0.159	S	C	.	.	H	α-helix	trans	-67.7	-41.6	177	-177.3	172.6	-178.4	178.4	0	111	S1267 A1272 A1273 E1274	S1267-K1270 PolarHBondContact O-N 2.88Å; S1267-K1270 WeakPolarHBondContact OG-CB 3.31Å; S1267-K1270 PolarHBondContact OG-N 3.4Å; K1270-A1272 PolarHBondContact O-N 3.44Å; K1270-A1273 PolarHBondContact O-N 2.86Å; K1270-E1274 WeakPolarHBondContact CE-OE1 3.38Å; K1270-E1274 HydrophobicContact CG-CG 3.87Å; K1270-E1274 IonicContact NZ-OE1 3.66Å; K1270-E1274 PolarHBondContact NZ-OE1 2.65Å; K1270-E1274 VanDerWaalsContact NZ-OE1 3.08Å; K1270-E1274 WeakPolarHBondContact O-CB 3.31Å; K1270-E1274 WeakPolarHBondContact O-CG 3.37Å; K1270-E1274 PolarHBondContact O-N 3.01Å
1271	L	88.4	Confident	85.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.1	-44.9	175.5	-173.1	68.6	0	0	0	111.3	F670 L1204 I1208 S1267 V1268 G1275	F670-L1271 HydrophobicContact CE2-CD1 4.17Å; L1204-L1271 HydrophobicContact CB-CD2 3.74Å; L1204-L1271 HydrophobicContact CB-CG 4.07Å; L1204-L1271 HydrophobicContact CD1-CD2 4.45Å; I1208-L1271 HydrophobicContact CD1-CD1 3.69Å; I1208-L1271 HydrophobicContact CD1-CG 3.98Å; I1208-L1271 WeakPolarHBondContact CD1-O 3.36Å; S1267-L1271 VanDerWaalsContact O-CB 3.29Å; S1267-L1271 WeakPolarHBondContact O-CB 3.39Å; S1267-L1271 PolarHBondContact O-N 3.18Å; V1268-L1271 PolarHBondContact O-N 2.9Å; L1271-G1275 WeakPolarHBondContact O-CA 3.2Å; L1271-G1275 PolarHBondContact O-N 2.79Å
1272	A	91.6	Very high	86.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.5	-37.2	176.1	0	0	0	0	0	113.4	L1204 V1268 I1269 K1270 G1275 Q1276 S1277 F1280 M1281	L1204-A1272 HydrophobicContact CD1-CB 3.97Å; L1204-A1272 HydrophobicContact CD2-CB 4.11Å; V1268-A1272 WeakPolarHBondContact O-CB 3.34Å; V1268-A1272 PolarHBondContact O-N 2.8Å; I1269-A1272 PolarHBondContact O-N 3.01Å; K1270-A1272 PolarHBondContact O-N 3.44Å; A1272-G1275 CarbonylContact O-C 3.56Å; A1272-Q1276 PolarHBondContact O-N 3.36Å; A1272-S1277 WeakPolarHBondContact O-CB 3.21Å; A1272-S1277 PolarHBondContact O-N 3.48Å; A1272-F1280 HydrophobicContact CB-CD1 3.43Å; A1272-F1280 VanDerWaalsContact CB-CD1 3.43Å; A1272-F1280 HydrophobicContact CB-CE1 3.81Å; A1272-F1280 HydrophobicContact CB-CG 4.33Å; A1272-M1281 HydrophobicContact CB-CG 4.3Å; A1272-M1281 HydrophobicContact CB-SD 3.82Å
1273	A	87.9	Confident	86.7	Confident	3 Å²	3	29.2 Å²	29.2	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-70.8	-53.4	179.4	0	0	0	0	0	112.3	I1269 K1270 G1275 Q1276 M1281 Y1680 Y1683	I1269-A1273 WeakPolarHBondContact O-CB 3.47Å; I1269-A1273 PolarHBondContact O-N 3.09Å; K1270-A1273 PolarHBondContact O-N 2.86Å; A1273-G1275 PolarHBondContact O-N 3.16Å; A1273-Q1276 PolarHBondContact O-N 2.75Å; A1273-M1281 HydrophobicContact CB-SD 4.37Å; A1273-Y1680 HydrophobicContact CB-CE2 4.5Å; A1273-Y1680 PolarHBondContact O-OH 2.71Å; A1273-Y1683 HydrophobicContact CB-CD1 3.78Å; A1273-Y1683 HydrophobicContact CB-CE1 3.31Å; A1273-Y1683 HydrophobicContact CB-CE2 4.28Å; A1273-Y1683 HydrophobicContact CB-CG 4.45Å
1274	E	82.8	Confident	87.1	Confident	89 Å²	89	32.3 Å²	32.3	42%	0.416	16%	0.164	S	C	.	.	H	α-helix	trans	-61.7	-35.2	176.8	-57.5	-88.8	-155.6	0	0	110.7	F670 K1270 Q1276	F670-E1274 HydrophobicContact CB-CG 4.41Å; F670-E1274 WeakPolarHBondContact CB-OE1 3.45Å; F670-E1274 HydrophobicContact CD1-CB 3.72Å; F670-E1274 HydrophobicContact CD1-CG 3.89Å; F670-E1274 HydrophobicContact CD2-CB 4.12Å; F670-E1274 HydrophobicContact CD2-CG 3.92Å; F670-E1274 HydrophobicContact CE1-CB 3.4Å; F670-E1274 HydrophobicContact CE1-CG 4.09Å; F670-E1274 HydrophobicContact CE2-CB 3.85Å; F670-E1274 HydrophobicContact CE2-CG 4.13Å; F670-E1274 HydrophobicContact CG-CB 4.07Å; F670-E1274 HydrophobicContact CG-CG 3.81Å; F670-E1274 HydrophobicContact CZ-CB 3.47Å; F670-E1274 VanDerWaalsContact CZ-CB 3.47Å; F670-E1274 HydrophobicContact CZ-CG 4.21Å; K1270-E1274 WeakPolarHBondContact CE-OE1 3.38Å; K1270-E1274 HydrophobicContact CG-CG 3.87Å; K1270-E1274 IonicContact NZ-OE1 3.66Å; K1270-E1274 PolarHBondContact NZ-OE1 2.65Å; K1270-E1274 VanDerWaalsContact NZ-OE1 3.08Å; K1270-E1274 WeakPolarHBondContact O-CB 3.31Å; K1270-E1274 WeakPolarHBondContact O-CG 3.37Å; K1270-E1274 PolarHBondContact O-N 3.01Å; E1274-Q1276 PolarHBondContact O-N 3.36Å
1275	G	82.6	Confident	88	Confident	20 Å²	20	31.7 Å²	31.7	21%	0.206	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	14.6	173.4	0	0	0	0	0	116.1	L1271 A1272 A1273 S1277	L1271-G1275 WeakPolarHBondContact O-CA 3.2Å; L1271-G1275 PolarHBondContact O-N 2.79Å; A1272-G1275 CarbonylContact O-C 3.56Å; A1273-G1275 PolarHBondContact O-N 3.16Å; G1275-S1277 PolarHBondContact O-N 2.71Å; G1275-S1277 PolarHBondContact O-OG 3.05Å
1276	Q	85.3	Confident	88.6	Confident	148 Å²	148	26.5 Å²	26.5	69%	0.692	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.6	32.4	177.6	-60.3	-171	-13.7	0	0	114.6	A1272 A1273 E1274 I1278	A1272-Q1276 PolarHBondContact O-N 3.36Å; A1273-Q1276 PolarHBondContact O-N 2.75Å; E1274-Q1276 PolarHBondContact O-N 3.36Å; Q1276-I1278 VanDerWaalsContact O-CG1 3.26Å; Q1276-I1278 WeakPolarHBondContact O-CG1 3.46Å; Q1276-I1278 PolarHBondContact O-N 3.33Å
1277	S	88.2	Confident	89.1	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.014	14%	0.14	C	C	.	.			trans	-81.5	64.2	-173.2	-68.1	0	0	0	0	111.6	Q1234 A1272 G1275 K1279 F1280 M1281	Q1234-S1277 VanDerWaalsContact NE2-C 3.32Å; Q1234-S1277 VanDerWaalsContact NE2-CA 3.28Å; A1272-S1277 WeakPolarHBondContact O-CB 3.21Å; A1272-S1277 PolarHBondContact O-N 3.48Å; G1275-S1277 PolarHBondContact O-N 2.71Å; G1275-S1277 PolarHBondContact O-OG 3.05Å; S1277-K1279 VanDerWaalsContact C-N 3.32Å; S1277-K1279 PolarHBondContact O-N 2.9Å; S1277-F1280 WeakPolarHBondContact O-CB 3.46Å; S1277-F1280 PolarHBondContact O-N 3.28Å; S1277-M1281 PolarHBondContact O-N 3.29Å
1278	I	88.1	Confident	89.2	Confident	47 Å²	47	29.8 Å²	29.8	24%	0.241	15%	0.154	C	C	.	.	H	α-helix	trans	-55.3	-40.8	-166.1	-37.1	-172.9	0	0	0	113.1	Q1276 M1281 A1282 Y1676 Y1677	Q1276-I1278 VanDerWaalsContact O-CG1 3.26Å; Q1276-I1278 WeakPolarHBondContact O-CG1 3.46Å; Q1276-I1278 PolarHBondContact O-N 3.33Å; I1278-M1281 PolarHBondContact O-N 3.04Å; I1278-A1282 PolarHBondContact O-N 3.45Å; I1278-Y1676 WeakPolarHBondContact CG2-O 3.44Å; I1278-Y1677 HydrophobicContact CD1-CD1 4.16Å; I1278-Y1677 HydrophobicContact CD1-CE1 3.8Å
1279	K	88.2	Confident	89.2	Confident	80 Å²	80	30.2 Å²	30.2	35%	0.348	16%	0.156	S	C	.	.	H	α-helix	trans	-57	-53.6	175.1	-66.5	-172.5	172.1	-161.7	0	112.3	E1235 E1238 S1277 M1281 A1282 H1283	E1235-K1279 IonicContact OE1-NZ 2.71Å; E1235-K1279 PolarHBondContact OE1-NZ 3.04Å; E1238-K1279 WeakPolarHBondContact OE2-CB 3.2Å; S1277-K1279 VanDerWaalsContact C-N 3.32Å; S1277-K1279 PolarHBondContact O-N 2.9Å; K1279-M1281 VanDerWaalsContact C-N 3.27Å; K1279-M1281 PolarHBondContact O-N 3.43Å; K1279-A1282 WeakPolarHBondContact O-CA 3.23Å; K1279-A1282 WeakPolarHBondContact O-CB 3.37Å; K1279-A1282 PolarHBondContact O-N 3.14Å; K1279-H1283 PolarHBondContact O-N 3.09Å
1280	F	92	Very high	89.2	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.1	-36.9	178.5	-173.6	-83.6	0	0	0	111.9	I1200 L1204 A1237 L1241 V1268 A1272 S1277 A1282 H1283 C1286	I1200-F1280 HydrophobicContact CG2-CE2 3.7Å; I1200-F1280 HydrophobicContact CG2-CZ 3.66Å; L1204-F1280 HydrophobicContact CD1-CD1 4.44Å; L1204-F1280 HydrophobicContact CD1-CE1 4.01Å; L1204-F1280 HydrophobicContact CD1-CE2 4.27Å; L1204-F1280 HydrophobicContact CD1-CZ 3.91Å; L1204-F1280 HydrophobicContact CD2-CD1 4.42Å; L1204-F1280 HydrophobicContact CD2-CD2 4.2Å; L1204-F1280 HydrophobicContact CD2-CG 4.14Å; A1237-F1280 HydrophobicContact CB-CD2 3.91Å; A1237-F1280 HydrophobicContact CB-CE2 3.9Å; L1241-F1280 HydrophobicContact CB-CE2 4.08Å; L1241-F1280 HydrophobicContact CD2-CD2 4.22Å; L1241-F1280 HydrophobicContact CD2-CE1 4.21Å; L1241-F1280 HydrophobicContact CD2-CE2 3.66Å; L1241-F1280 HydrophobicContact CD2-CZ 3.66Å; L1241-F1280 HydrophobicContact CG-CE2 4.44Å; V1268-F1280 HydrophobicContact CG1-CE1 3.99Å; V1268-F1280 HydrophobicContact CG1-CZ 3.7Å; A1272-F1280 HydrophobicContact CB-CD1 3.43Å; A1272-F1280 VanDerWaalsContact CB-CD1 3.43Å; A1272-F1280 HydrophobicContact CB-CE1 3.81Å; A1272-F1280 HydrophobicContact CB-CG 4.33Å; S1277-F1280 WeakPolarHBondContact O-CB 3.46Å; S1277-F1280 PolarHBondContact O-N 3.28Å; F1280-A1282 VanDerWaalsContact C-N 3.32Å; F1280-A1282 PolarHBondContact O-N 3.46Å; F1280-H1283 VanDerWaalsContact O-CB 3.24Å; F1280-H1283 WeakPolarHBondContact O-CB 3.24Å; F1280-H1283 PolarHBondContact O-N 3.41Å; F1280-C1286 PolarHBondContact O-SG 2.59Å
1281	M	90.4	Very high	89.3	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-70.2	-25.5	174.5	-70.4	-57.1	-57.8	0	0	113.5	I1269 A1272 A1273 S1277 I1278 K1279 Q1287 Y1680 Y1683	I1269-M1281 HydrophobicContact CD1-CE 4.17Å; I1269-M1281 HydrophobicContact CG1-CE 3.8Å; I1269-M1281 HydrophobicContact CG1-SD 3.95Å; A1272-M1281 HydrophobicContact CB-CG 4.3Å; A1272-M1281 HydrophobicContact CB-SD 3.82Å; A1273-M1281 HydrophobicContact CB-SD 4.37Å; S1277-M1281 PolarHBondContact O-N 3.29Å; I1278-M1281 PolarHBondContact O-N 3.04Å; K1279-M1281 VanDerWaalsContact C-N 3.27Å; K1279-M1281 PolarHBondContact O-N 3.43Å; M1281-Q1287 PolarHBondContact O-NE2 2.85Å; M1281-Y1680 HydrophobicContact CB-CD2 4.42Å; M1281-Y1680 HydrophobicContact CG-CD2 4.24Å; M1281-Y1683 HydrophobicContact CE-CD1 4.38Å; M1281-Y1683 HydrophobicContact CE-CD2 3.49Å; M1281-Y1683 VanDerWaalsContact CE-CD2 3.49Å; M1281-Y1683 HydrophobicContact CE-CE2 4.3Å; M1281-Y1683 HydrophobicContact CE-CG 3.55Å
1282	A	90.4	Very high	89.2	Confident	18 Å²	18	30.7 Å²	30.7	15%	0.149	16%	0.164	C	C	.	.	H	α-helix	trans	-82.3	-11.3	174	0	0	0	0	0	114.1	I1278 K1279 F1280 Y1676 N1679	I1278-A1282 PolarHBondContact O-N 3.45Å; K1279-A1282 WeakPolarHBondContact O-CA 3.23Å; K1279-A1282 WeakPolarHBondContact O-CB 3.37Å; K1279-A1282 PolarHBondContact O-N 3.14Å; F1280-A1282 VanDerWaalsContact C-N 3.32Å; F1280-A1282 PolarHBondContact O-N 3.46Å; A1282-Y1676 HydrophobicContact CB-CD1 3.61Å; A1282-Y1676 HydrophobicContact CB-CE1 4.16Å; A1282-N1679 HydrophobicContact CB-CB 4.05Å
1283	H	91.6	Very high	89.1	Confident	6 Å²	6	31.3 Å²	31.3	3%	0.028	17%	0.168	C	C	.	.	S	Bend	trans	-56.1	138.7	177.8	-177.3	-85.3	0	0	0	111.8	L1241 N1242 K1279 F1280 C1285 C1286 Q1287	L1241-H1283 HydrophobicContact CD2-CB 4.07Å; L1241-H1283 WeakPolarHBondContact CD2-ND1 3.33Å; N1242-H1283 VanDerWaalsContact CG-NE2 3.28Å; N1242-H1283 PolarHBondContact ND2-CD2 3.27Å; N1242-H1283 PolarHBondContact ND2-NE2 3.42Å; N1242-H1283 PolarHBondContact OD1-NE2 2.87Å; K1279-H1283 PolarHBondContact O-N 3.09Å; F1280-H1283 VanDerWaalsContact O-CB 3.24Å; F1280-H1283 WeakPolarHBondContact O-CB 3.24Å; F1280-H1283 PolarHBondContact O-N 3.41Å; H1283-C1285 WeakPolarHBondContact ND1-CB 3.31Å; H1283-C1285 PolarHBondContact ND1-N 3.04Å; H1283-C1285 VanDerWaalsContact ND1-N 3.16Å; H1283-C1285 PolarHBondContact O-N 3.04Å; H1283-C1286 WeakPolarHBondContact O-CB 3.39Å; H1283-C1286 PolarHBondContact O-N 3.32Å; H1283-Q1287 PolarHBondContact O-N 2.96Å
1284	P	92	Very high	89.1	Confident	64 Å²	64	32.2 Å²	32.2	42%	0.416	17%	0.17	S	C	.	.	H	α-helix	trans	-49.4	-49.7	-176.2	-31.2	36.6	0	0	0	114	Y1245 C1286 Q1287 D1288	Y1245-P1284 HydrophobicContact CE1-CB 3.94Å; P1284-C1286 PolarHBondContact O-N 3.06Å; P1284-C1286 VanDerWaalsContact O-N 3.08Å; P1284-Q1287 CarbonylContact O-C 3.34Å; P1284-Q1287 WeakPolarHBondContact O-CA 3.45Å; P1284-Q1287 PolarHBondContact O-N 3.03Å; P1284-D1288 PolarHBondContact O-N 3.27Å
1285	C	92	Very high	89.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-54	-34.4	178.3	-164.2	0	0	0	0	114.3	L1241 Y1245 I1256 H1283 F1289	L1241-C1285 HydrophobicContact CD1-CB 4.45Å; Y1245-C1285 HydrophobicContact CD2-CB 3.36Å; Y1245-C1285 VanDerWaalsContact CD2-SG 3.53Å; Y1245-C1285 HydrophobicContact CE2-CB 3.81Å; Y1245-C1285 HydrophobicContact CG-CB 3.81Å; I1256-C1285 HydrophobicContact CD1-CB 4.02Å; I1256-C1285 WeakPolarHBondContact CD1-SG 3.26Å; H1283-C1285 WeakPolarHBondContact ND1-CB 3.31Å; H1283-C1285 PolarHBondContact ND1-N 3.04Å; H1283-C1285 VanDerWaalsContact ND1-N 3.16Å; H1283-C1285 PolarHBondContact O-N 3.04Å; C1285-F1289 WeakPolarHBondContact O-CB 3.23Å; C1285-F1289 PolarHBondContact O-N 3.21Å
1286	C	91.5	Very high	89.2	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-72.4	-40.4	176.3	-63.8	0	0	0	0	110.8	F1280 H1283 P1284 L1290	F1280-C1286 PolarHBondContact O-SG 2.59Å; H1283-C1286 WeakPolarHBondContact O-CB 3.39Å; H1283-C1286 PolarHBondContact O-N 3.32Å; P1284-C1286 PolarHBondContact O-N 3.06Å; P1284-C1286 VanDerWaalsContact O-N 3.08Å; C1286-L1290 WeakPolarHBondContact O-CB 3.35Å; C1286-L1290 VanDerWaalsContact O-CG 3.23Å; C1286-L1290 WeakPolarHBondContact O-CG 3.42Å; C1286-L1290 PolarHBondContact O-N 3.17Å
1287	Q	91.9	Very high	89	Confident	17 Å²	17	25.1 Å²	25.1	8%	0.079	14%	0.142	C	C	.	.	H	α-helix	trans	-73	-30.6	178.6	-64.8	-59.7	-39.4	0	0	113.2	M1281 H1283 P1284 T1291 N1679 R1682	M1281-Q1287 PolarHBondContact O-NE2 2.85Å; H1283-Q1287 PolarHBondContact O-N 2.96Å; P1284-Q1287 CarbonylContact O-C 3.34Å; P1284-Q1287 WeakPolarHBondContact O-CA 3.45Å; P1284-Q1287 PolarHBondContact O-N 3.03Å; Q1287-T1291 WeakPolarHBondContact O-CB 3.27Å; Q1287-T1291 PolarHBondContact O-N 3.39Å; Q1287-T1291 PolarHBondContact O-OG1 3.04Å; Q1287-N1679 PolarHBondContact NE2-O 3.22Å; Q1287-R1682 PolarHBondContact O-NH1 3.35Å; Q1287-R1682 VanDerWaalsContact O-NH1 3.17Å
1288	D	90.4	Very high	88.6	Confident	57 Å²	57	25.5 Å²	25.5	31%	0.305	14%	0.144	S	C	.	.	H	α-helix	trans	-76.9	-41.1	172.6	-70.2	-50	0	0	0	111.7	Y1245 P1284 L1290 T1291 N1292	Y1245-D1288 PolarHBondContact OH-OD2 3.25Å; P1284-D1288 PolarHBondContact O-N 3.27Å; D1288-L1290 VanDerWaalsContact C-N 3.3Å; D1288-L1290 PolarHBondContact O-N 2.9Å; D1288-T1291 CarbonylContact O-C 3.4Å; D1288-T1291 PolarHBondContact O-N 3.47Å; D1288-T1291 VanDerWaalsContact O-N 3.14Å; D1288-N1292 WeakPolarHBondContact O-CB 3.4Å; D1288-N1292 PolarHBondContact O-N 2.87Å
1289	F	90	Very high	88.2	Confident	10 Å²	10	24 Å²	24	4%	0.044	14%	0.138	C	C	.	.	H	α-helix	trans	-56	-44.5	167.9	174.4	-98.2	0	0	0	111.9	Q1253 N1257 I1269 C1285 N1292 T1293 F1730	Q1253-F1289 HydrophobicContact CB-CD2 4.23Å; Q1253-F1289 HydrophobicContact CG-CB 4.1Å; N1257-F1289 HydrophobicContact CB-CE2 3.77Å; N1257-F1289 HydrophobicContact CB-CZ 3.69Å; I1269-F1289 HydrophobicContact CD1-CD1 3.61Å; I1269-F1289 HydrophobicContact CD1-CE1 3.81Å; C1285-F1289 WeakPolarHBondContact O-CB 3.23Å; C1285-F1289 PolarHBondContact O-N 3.21Å; F1289-N1292 PolarHBondContact O-N 3.15Å; F1289-T1293 WeakPolarHBondContact CZ-OG1 3.22Å; F1289-T1293 WeakPolarHBondContact O-CB 3.3Å; F1289-T1293 PolarHBondContact O-N 3.45Å; F1289-T1293 PolarHBondContact O-OG1 3.43Å; F1289-F1730 AromaticContact CE1-CD1 3.82Å; F1289-F1730 HydrophobicContact CE1-CD1 3.82Å; F1289-F1730 HydrophobicContact CE1-CE1 4.05Å; F1289-F1730 HydrophobicContact CZ-CD1 4.46Å
1290	L	90.6	Very high	87.7	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.5	-39.5	175.1	-78.1	168.5	0	0	0	112.1	I1269 C1286 D1288 T1293 W1294 Y1683 I1686 F1730	I1269-L1290 HydrophobicContact CD1-CG 4.49Å; C1286-L1290 WeakPolarHBondContact O-CB 3.35Å; C1286-L1290 VanDerWaalsContact O-CG 3.23Å; C1286-L1290 WeakPolarHBondContact O-CG 3.42Å; C1286-L1290 PolarHBondContact O-N 3.17Å; D1288-L1290 VanDerWaalsContact C-N 3.3Å; D1288-L1290 PolarHBondContact O-N 2.9Å; L1290-T1293 PolarHBondContact O-N 3.3Å; L1290-W1294 WeakPolarHBondContact O-CB 3.26Å; L1290-W1294 PolarHBondContact O-N 3.19Å; L1290-Y1683 HydrophobicContact CD2-CD2 4.05Å; L1290-I1686 HydrophobicContact CB-CD1 3.96Å; L1290-I1686 HydrophobicContact CD2-CB 4.15Å; L1290-I1686 HydrophobicContact CD2-CD1 3.98Å; L1290-I1686 HydrophobicContact CD2-CG2 4.11Å; L1290-I1686 HydrophobicContact CG-CD1 4.48Å; L1290-F1730 HydrophobicContact CD2-CE1 3.85Å; L1290-F1730 HydrophobicContact CD2-CZ 4.28Å
1291	T	89.6	Confident	87.1	Confident	43 Å²	43	31.9 Å²	31.9	26%	0.264	18%	0.178	S	C	.	.	H	α-helix	trans	-65.6	-38.4	174.8	-55.9	0	0	0	0	111.8	Q1287 D1288 S1295 T1300 R1682	Q1287-T1291 WeakPolarHBondContact O-CB 3.27Å; Q1287-T1291 PolarHBondContact O-N 3.39Å; Q1287-T1291 PolarHBondContact O-OG1 3.04Å; D1288-T1291 CarbonylContact O-C 3.4Å; D1288-T1291 PolarHBondContact O-N 3.47Å; D1288-T1291 VanDerWaalsContact O-N 3.14Å; T1291-S1295 WeakPolarHBondContact O-CB 3.34Å; T1291-S1295 PolarHBondContact O-N 2.81Å; T1291-S1295 VanDerWaalsContact O-N 3.1Å; T1291-S1295 PolarHBondContact O-OG 3.13Å; T1291-T1300 HydrophobicContact CG2-CG2 4.04Å; T1291-R1682 PolarHBondContact OG1-NH1 3.29Å; T1291-R1682 PolarHBondContact OG1-NH2 2.84Å
1292	N	87.2	Confident	86.7	Confident	40 Å²	40	33.1 Å²	33.1	21%	0.214	19%	0.185	C	C	.	.	H	α-helix	trans	-69	-35.9	174	-89.5	-37.8	0	0	0	112.6	Q1253 D1288 F1289 S1295 G1296 K1328	Q1253-N1292 PolarHBondContact OE1-ND2 3.17Å; D1288-N1292 WeakPolarHBondContact O-CB 3.4Å; D1288-N1292 PolarHBondContact O-N 2.87Å; F1289-N1292 PolarHBondContact O-N 3.15Å; N1292-S1295 PolarHBondContact O-OG 2.83Å; N1292-G1296 WeakPolarHBondContact O-CA 3.42Å; N1292-G1296 PolarHBondContact O-N 2.86Å; N1292-K1328 PolarHBondContact OD1-NZ 3.15Å
1293	T	87.7	Confident	86.4	Confident	14 Å²	14	35.2 Å²	35.2	9%	0.086	20%	0.198	C	C	.	.	H	α-helix	trans	-72.1	-42.9	175.8	-63.3	0	0	0	0	111.7	F1289 L1290 G1296 P1392 I1686 V1690 P1729 F1730	F1289-T1293 WeakPolarHBondContact CZ-OG1 3.22Å; F1289-T1293 WeakPolarHBondContact O-CB 3.3Å; F1289-T1293 PolarHBondContact O-N 3.45Å; F1289-T1293 PolarHBondContact O-OG1 3.43Å; L1290-T1293 PolarHBondContact O-N 3.3Å; T1293-G1296 PolarHBondContact O-N 3.5Å; T1293-G1296 VanDerWaalsContact O-N 3.16Å; T1293-P1392 WeakPolarHBondContact O-CD 3.3Å; T1293-I1686 HydrophobicContact CG2-CG2 4.13Å; T1293-V1690 HydrophobicContact CG2-CG2 3.89Å; T1293-P1729 HydrophobicContact CG2-CB 3.95Å; T1293-P1729 HydrophobicContact CG2-CG 3.79Å; T1293-F1730 HydrophobicContact CG2-CE2 4.38Å; T1293-F1730 HydrophobicContact CG2-CZ 4.12Å
1294	W	89.3	Confident	86	Confident	21 Å²	21	40.2 Å²	40.2	8%	0.08	23%	0.229	C	C	.	.	H	α-helix	trans	-62.8	-42.3	177.7	-179.7	-117	0	0	0	113.2	L1290 P1392 V1393 F1396 F1532 I1686	L1290-W1294 WeakPolarHBondContact O-CB 3.26Å; L1290-W1294 PolarHBondContact O-N 3.19Å; W1294-P1392 HydrophobicContact CE3-CB 3.65Å; W1294-P1392 HydrophobicContact CZ3-CB 4.03Å; W1294-P1392 WeakPolarHBondContact O-CD 3.43Å; W1294-V1393 HydrophobicContact CD2-CB 3.9Å; W1294-V1393 HydrophobicContact CD2-CG2 4.43Å; W1294-V1393 HydrophobicContact CG-CB 4.14Å; W1294-V1393 HydrophobicContact CZ2-CB 4Å; W1294-V1393 HydrophobicContact CZ2-CG2 3.87Å; W1294-V1393 WeakPolarHBondContact O-CB 3.36Å; W1294-V1393 WeakPolarHBondContact O-CG1 3.26Å; W1294-V1393 PolarHBondContact O-N 2.68Å; W1294-V1393 VanDerWaalsContact O-N 3.09Å; W1294-F1396 HydrophobicContact CH2-CB 3.43Å; W1294-F1396 VanDerWaalsContact CH2-CB 3.43Å; W1294-F1396 AromaticContact CH2-CD1 3.92Å; W1294-F1396 HydrophobicContact CH2-CD1 3.92Å; W1294-F1396 HydrophobicContact CH2-CD2 4.17Å; W1294-F1396 AromaticContact CH2-CG 3.59Å; W1294-F1396 HydrophobicContact CH2-CG 3.59Å; W1294-F1396 HydrophobicContact CZ2-CB 4.09Å; W1294-F1396 AromaticContact CZ2-CD1 3.9Å; W1294-F1396 HydrophobicContact CZ2-CD1 3.9Å; W1294-F1396 HydrophobicContact CZ2-CG 4.07Å; W1294-F1396 HydrophobicContact CZ3-CB 4.21Å; W1294-F1532 HydrophobicContact CD2-CE2 4.13Å; W1294-F1532 HydrophobicContact CD2-CZ 4.07Å; W1294-F1532 AromaticContact CE2-CE1 3.99Å; W1294-F1532 AromaticContact CE2-CE2 3.62Å; W1294-F1532 AromaticContact CE2-CZ 3.25Å; W1294-F1532 HydrophobicContact CE3-CE2 4.44Å; W1294-F1532 HydrophobicContact CH2-CD2 4.11Å; W1294-F1532 AromaticContact CH2-CE2 3.77Å; W1294-F1532 HydrophobicContact CH2-CE2 3.77Å; W1294-F1532 HydrophobicContact CH2-CZ 4.11Å; W1294-F1532 HydrophobicContact CZ2-CD1 4.29Å; W1294-F1532 HydrophobicContact CZ2-CD2 4.04Å; W1294-F1532 AromaticContact CZ2-CE1 3.73Å; W1294-F1532 HydrophobicContact CZ2-CE1 3.73Å; W1294-F1532 AromaticContact CZ2-CE2 3.43Å; W1294-F1532 HydrophobicContact CZ2-CE2 3.43Å; W1294-F1532 VanDerWaalsContact CZ2-CE2 3.43Å; W1294-F1532 HydrophobicContact CZ2-CG 4.45Å; W1294-F1532 AromaticContact CZ2-CZ 3.28Å; W1294-F1532 HydrophobicContact CZ2-CZ 3.28Å; W1294-F1532 HydrophobicContact CZ3-CE2 4.28Å; W1294-F1532 AromaticContact NE1-CE1 3.93Å; W1294-F1532 AromaticContact NE1-CZ 3.29Å; W1294-F1532 VanDerWaalsContact NE1-CZ 3.29Å; W1294-I1686 HydrophobicContact CB-CD1 4.16Å; W1294-I1686 HydrophobicContact CB-CG1 4.48Å; W1294-I1686 HydrophobicContact CB-CG2 4.49Å; W1294-I1686 HydrophobicContact CD2-CG1 4.26Å; W1294-I1686 HydrophobicContact CE3-CB 4.42Å; W1294-I1686 HydrophobicContact CE3-CG1 3.72Å; W1294-I1686 HydrophobicContact CE3-CG2 4.31Å; W1294-I1686 HydrophobicContact CZ3-CG1 4.23Å
1295	S	84.9	Confident	85.7	Confident	13 Å²	13	43.8 Å²	43.8	9%	0.091	24%	0.238	C	C	.	.	H	α-helix	trans	-76.9	-24.3	172.1	55.4	0	0	0	0	113.2	T1291 N1292 N1297 L1298 T1300	T1291-S1295 WeakPolarHBondContact O-CB 3.34Å; T1291-S1295 PolarHBondContact O-N 2.81Å; T1291-S1295 VanDerWaalsContact O-N 3.1Å; T1291-S1295 PolarHBondContact O-OG 3.13Å; N1292-S1295 PolarHBondContact O-OG 2.83Å; S1295-N1297 PolarHBondContact O-N 2.77Å; S1295-L1298 VanDerWaalsContact O-CB 3.25Å; S1295-L1298 WeakPolarHBondContact O-CB 3.4Å; S1295-L1298 WeakPolarHBondContact O-CG 3.41Å; S1295-L1298 PolarHBondContact O-N 3.26Å; S1295-T1300 WeakPolarHBondContact OG-CG2 3Å
1296	G	82.7	Confident	85.3	Confident	23 Å²	23	49.5 Å²	49.5	24%	0.237	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	-123.3	-177.1	0	0	0	0	0	111.9	N1292 T1293 L1298 K1328	N1292-G1296 WeakPolarHBondContact O-CA 3.42Å; N1292-G1296 PolarHBondContact O-N 2.86Å; T1293-G1296 PolarHBondContact O-N 3.5Å; T1293-G1296 VanDerWaalsContact O-N 3.16Å; G1296-L1298 VanDerWaalsContact C-N 3.29Å; G1296-L1298 PolarHBondContact O-N 2.78Å; G1296-K1328 PolarHBondContact O-NZ 3.48Å
1297	N	80.3	Confident	84.9	Confident	73 Å²	73	51.7 Å²	51.7	39%	0.39	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.8	178.8	-69.9	-28.4	0	0	0	113.7	S1295 K1328 D1387	S1295-N1297 PolarHBondContact O-N 2.77Å; N1297-K1328 PolarHBondContact O-N 3Å; N1297-D1387 HydrophobicContact CB-CB 3.95Å
1298	L	80.9	Confident	84.5	Confident	9 Å²	9	55.1 Å²	55.1	5%	0.047	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-77.5	145.9	174	-53	177.1	0	0	0	109.7	S1295 G1296 I1325 K1328 F1388 A1391 V1393 V1394	S1295-L1298 VanDerWaalsContact O-CB 3.25Å; S1295-L1298 WeakPolarHBondContact O-CB 3.4Å; S1295-L1298 WeakPolarHBondContact O-CG 3.41Å; S1295-L1298 PolarHBondContact O-N 3.26Å; G1296-L1298 VanDerWaalsContact C-N 3.29Å; G1296-L1298 PolarHBondContact O-N 2.78Å; L1298-I1325 HydrophobicContact CD2-CG2 4.08Å; L1298-K1328 WeakPolarHBondContact O-CE 2.98Å; L1298-F1388 HydrophobicContact CD1-CD2 3.92Å; L1298-F1388 HydrophobicContact CD1-CE2 4.49Å; L1298-F1388 HydrophobicContact CD2-CB 4.22Å; L1298-F1388 HydrophobicContact CD2-CD2 4.08Å; L1298-A1391 HydrophobicContact CD1-CB 3.81Å; L1298-A1391 HydrophobicContact CG-CB 4.15Å; L1298-V1393 HydrophobicContact CD1-CG1 4.44Å; L1298-V1394 HydrophobicContact CD1-CG2 3.9Å
1299	S	79.7	Confident	84.3	Confident	17 Å²	17	56.1 Å²	56.1	12%	0.119	29%	0.29	C	S	.	.			trans	-71.1	134.1	174	-170.5	0	0	0	0	110.4	K1301 N1302 L1326	S1299-K1301 PolarHBondContact O-N 3.15Å; S1299-K1301 PolarHBondContact OG-N 3.15Å; S1299-N1302 PolarHBondContact O-N 3.26Å; S1299-N1302 PolarHBondContact O-ND2 3.33Å; S1299-L1326 WeakPolarHBondContact CB-O 2.88Å; S1299-L1326 PolarHBondContact N-O 2.79Å
1300	T	77	Confident	84	Confident	74 Å²	74	55.7 Å²	55.7	45%	0.454	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.3	168.1	48.7	0	0	0	0	112.2	T1291 S1295 N1302	T1291-T1300 HydrophobicContact CG2-CG2 4.04Å; S1295-T1300 WeakPolarHBondContact OG-CG2 3Å; T1300-N1302 PolarHBondContact O-N 2.81Å
1301	K	80.1	Confident	83.7	Confident	171 Å²	171	56.2 Å²	56.2	74%	0.743	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	15.4	177.3	-53	-173.4	-179.6	-174.9	0	113.9	S1299	S1299-K1301 PolarHBondContact O-N 3.15Å; S1299-K1301 PolarHBondContact OG-N 3.15Å
1302	N	81.5	Confident	83.5	Confident	25 Å²	25	57.8 Å²	57.8	13%	0.134	30%	0.301	C	S	.	.			trans	-83.3	120.2	171.5	-77	-64.5	0	0	0	110.1	S1299 T1300 L1326	S1299-N1302 PolarHBondContact O-N 3.26Å; S1299-N1302 PolarHBondContact O-ND2 3.33Å; T1300-N1302 PolarHBondContact O-N 2.81Å; N1302-L1326 PolarHBondContact ND2-O 2.87Å; N1302-L1326 WeakPolarHBondContact OD1-CB 3.46Å; N1302-L1326 PolarHBondContact OD1-N 2.81Å
1303	S	84.2	Confident	83.3	Confident	62 Å²	62	56.7 Å²	56.7	43%	0.434	30%	0.296	S	S	.	.			trans	-65.7	154.1	174.4	63.9	0	0	0	0	111.6	F1305 R1306 Y1307	S1303-F1305 PolarHBondContact O-N 3.41Å; S1303-F1305 VanDerWaalsContact O-N 3.11Å; S1303-R1306 WeakPolarHBondContact O-CA 3.19Å; S1303-R1306 PolarHBondContact O-N 2.97Å; S1303-Y1307 PolarHBondContact O-N 3.16Å
1304	V	82.6	Confident	83	Confident	111 Å²	111	56.3 Å²	56.3	67%	0.673	30%	0.295	S	S	*	.	H	α-helix	trans	-52	-37.6	178.6	-177.9	0	0	0	0	111.8	Y1307 I1308	V1304-Y1307 PolarHBondContact O-N 2.7Å; V1304-I1308 HydrophobicContact CG1-CD1 3.87Å; V1304-I1308 HydrophobicContact CG1-CG1 4.38Å; V1304-I1308 WeakPolarHBondContact O-CG1 3.36Å; V1304-I1308 PolarHBondContact O-N 3.05Å
1305	F	85.5	Confident	82.6	Confident	140 Å²	140	60.6 Å²	60.6	61%	0.614	32%	0.319	S	S	*	.	H	α-helix	trans	-64	-44.7	174.4	-177.3	-96.8	0	0	0	113.4	S1303 Y1307 I1308 M1309	S1303-F1305 PolarHBondContact O-N 3.41Å; S1303-F1305 VanDerWaalsContact O-N 3.11Å; F1305-Y1307 VanDerWaalsContact C-N 3.28Å; F1305-Y1307 PolarHBondContact O-N 2.76Å; F1305-I1308 PolarHBondContact O-N 3.33Å; F1305-M1309 HydrophobicContact CD1-CG 4.32Å; F1305-M1309 HydrophobicContact CE1-CG 3.91Å; F1305-M1309 HydrophobicContact CE2-CE 3.83Å; F1305-M1309 HydrophobicContact CE2-CG 4.31Å; F1305-M1309 HydrophobicContact CZ-CE 3.76Å; F1305-M1309 HydrophobicContact CZ-CG 3.91Å; F1305-M1309 WeakPolarHBondContact O-CB 3.47Å; F1305-M1309 WeakPolarHBondContact O-CG 3.25Å; F1305-M1309 PolarHBondContact O-N 2.87Å
1306	R	84.7	Confident	82.5	Confident	119 Å²	119	64 Å²	64	45%	0.449	34%	0.339	S	S	.	.	H	α-helix	trans	-65	-34.5	173.6	-73.6	-173	-173.7	160.2	3.3	111.6	S1303 G1310	S1303-R1306 WeakPolarHBondContact O-CA 3.19Å; S1303-R1306 PolarHBondContact O-N 2.97Å; R1306-G1310 WeakPolarHBondContact O-CA 3.44Å; R1306-G1310 PolarHBondContact O-N 3.08Å
1307	Y	81.9	Confident	82.4	Confident	46 Å²	46	67.3 Å²	67.3	18%	0.18	35%	0.351	C	S	.	.	H	α-helix	trans	-66.4	-49.6	176.2	-174.1	-98.8	0	0	0	111.6	S1303 V1304 F1305 M1309 G1310 V1311 V1393 V1394 V1397	S1303-Y1307 PolarHBondContact O-N 3.16Å; V1304-Y1307 PolarHBondContact O-N 2.7Å; F1305-Y1307 VanDerWaalsContact C-N 3.28Å; F1305-Y1307 PolarHBondContact O-N 2.76Å; Y1307-M1309 PolarHBondContact O-N 3.34Å; Y1307-G1310 CarbonylContact O-C 3.4Å; Y1307-G1310 WeakPolarHBondContact O-CA 3.41Å; Y1307-G1310 PolarHBondContact O-N 3.26Å; Y1307-G1310 VanDerWaalsContact O-N 3.08Å; Y1307-V1311 HydrophobicContact CD1-CG2 4.15Å; Y1307-V1311 HydrophobicContact CE1-CG2 3.58Å; Y1307-V1311 HydrophobicContact CE2-CG2 4.24Å; Y1307-V1311 WeakPolarHBondContact O-CG2 3.18Å; Y1307-V1311 PolarHBondContact O-N 3.18Å; Y1307-V1393 HydrophobicContact CE2-CG1 4.05Å; Y1307-V1393 HydrophobicContact CE2-CG2 4.27Å; Y1307-V1393 PolarHBondContact OH-O 3.28Å; Y1307-V1393 VanDerWaalsContact OH-O 3.12Å; Y1307-V1394 HydrophobicContact CE2-CG2 4.36Å; Y1307-V1397 HydrophobicContact CE1-CG2 4.09Å
1308	I	84.3	Confident	82.2	Confident	89 Å²	89	65.9 Å²	65.9	46%	0.456	35%	0.346	S	S	.	.	H	α-helix	trans	-58.6	-49.5	175.3	-69.4	166.9	0	0	0	110.8	V1304 F1305 G1310 V1311 V1312	V1304-I1308 HydrophobicContact CG1-CD1 3.87Å; V1304-I1308 HydrophobicContact CG1-CG1 4.38Å; V1304-I1308 WeakPolarHBondContact O-CG1 3.36Å; V1304-I1308 PolarHBondContact O-N 3.05Å; F1305-I1308 PolarHBondContact O-N 3.33Å; I1308-G1310 PolarHBondContact O-N 2.82Å; I1308-V1311 PolarHBondContact O-N 3.43Å; I1308-V1312 HydrophobicContact CG2-CG2 4.44Å; I1308-V1312 WeakPolarHBondContact O-CG2 3.14Å; I1308-V1312 PolarHBondContact O-N 3.26Å
1309	M	84.8	Confident	82	Confident	79 Å²	79	72.4 Å²	72.4	39%	0.389	37%	0.374	S	S	.	.	H	α-helix	trans	-60.8	-34.5	175.8	-74.2	-69	160	0	0	111.9	F1305 Y1307 C1313 V1324	F1305-M1309 HydrophobicContact CD1-CG 4.32Å; F1305-M1309 HydrophobicContact CE1-CG 3.91Å; F1305-M1309 HydrophobicContact CE2-CE 3.83Å; F1305-M1309 HydrophobicContact CE2-CG 4.31Å; F1305-M1309 HydrophobicContact CZ-CE 3.76Å; F1305-M1309 HydrophobicContact CZ-CG 3.91Å; F1305-M1309 WeakPolarHBondContact O-CB 3.47Å; F1305-M1309 WeakPolarHBondContact O-CG 3.25Å; F1305-M1309 PolarHBondContact O-N 2.87Å; Y1307-M1309 PolarHBondContact O-N 3.34Å; M1309-C1313 WeakPolarHBondContact O-CB 3.35Å; M1309-C1313 PolarHBondContact O-N 2.69Å; M1309-C1313 PolarHBondContact O-SG 3.14Å; M1309-V1324 HydrophobicContact CB-CG1 3.73Å
1310	G	84.3	Confident	82.1	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-64.7	-45.6	173.3	0	0	0	0	0	113.6	R1306 Y1307 I1308 C1313 G1314 I1325	R1306-G1310 WeakPolarHBondContact O-CA 3.44Å; R1306-G1310 PolarHBondContact O-N 3.08Å; Y1307-G1310 CarbonylContact O-C 3.4Å; Y1307-G1310 WeakPolarHBondContact O-CA 3.41Å; Y1307-G1310 PolarHBondContact O-N 3.26Å; Y1307-G1310 VanDerWaalsContact O-N 3.08Å; I1308-G1310 PolarHBondContact O-N 2.82Å; G1310-C1313 PolarHBondContact O-N 2.91Å; G1310-G1314 PolarHBondContact O-N 2.71Å; G1310-I1325 VanDerWaalsContact CA-CD1 3.5Å
1311	V	84.6	Confident	82.2	Confident	12 Å²	12	71.3 Å²	71.3	7%	0.073	36%	0.364	C	S	.	.	H	α-helix	trans	-65	-44.9	176.5	170.4	0	0	0	0	111.2	Y1307 I1308 G1314 L1315 V1397 Y1398 I1401	Y1307-V1311 HydrophobicContact CD1-CG2 4.15Å; Y1307-V1311 HydrophobicContact CE1-CG2 3.58Å; Y1307-V1311 HydrophobicContact CE2-CG2 4.24Å; Y1307-V1311 WeakPolarHBondContact O-CG2 3.18Å; Y1307-V1311 PolarHBondContact O-N 3.18Å; I1308-V1311 PolarHBondContact O-N 3.43Å; V1311-G1314 PolarHBondContact O-N 2.99Å; V1311-L1315 PolarHBondContact O-N 3.44Å; V1311-V1397 HydrophobicContact CG1-CG1 3.81Å; V1311-V1397 HydrophobicContact CG2-CG1 4.13Å; V1311-Y1398 HydrophobicContact CG1-CD1 4.45Å; V1311-Y1398 HydrophobicContact CG1-CE1 3.75Å; V1311-Y1398 PolarHBondContact O-OH 3.17Å; V1311-I1401 HydrophobicContact CG1-CD1 4.11Å
1312	V	85.4	Confident	81.8	Confident	76 Å²	76	64.5 Å²	64.5	46%	0.461	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-42.7	176.7	173.5	0	0	0	0	111	I1308 G1314 L1315 T1316	I1308-V1312 HydrophobicContact CG2-CG2 4.44Å; I1308-V1312 WeakPolarHBondContact O-CG2 3.14Å; I1308-V1312 PolarHBondContact O-N 3.26Å; V1312-G1314 VanDerWaalsContact C-N 3.35Å; V1312-L1315 PolarHBondContact O-N 3.25Å; V1312-T1316 WeakPolarHBondContact O-CB 3.35Å; V1312-T1316 PolarHBondContact O-N 3.43Å; V1312-T1316 PolarHBondContact O-OG1 2.97Å
1313	C	83.5	Confident	81.6	Confident	16 Å²	16	71.5 Å²	71.5	11%	0.108	37%	0.366	C	S	.	.	H	α-helix	trans	-63.3	-39.2	171.6	-72.8	0	0	0	0	111.7	M1309 G1310 L1315 T1316 L1317 L1320	M1309-C1313 WeakPolarHBondContact O-CB 3.35Å; M1309-C1313 PolarHBondContact O-N 2.69Å; M1309-C1313 PolarHBondContact O-SG 3.14Å; G1310-C1313 PolarHBondContact O-N 2.91Å; C1313-L1315 VanDerWaalsContact C-N 3.26Å; C1313-L1315 PolarHBondContact O-N 2.79Å; C1313-T1316 PolarHBondContact O-N 2.68Å; C1313-L1317 CarbonylContact O-C 3.6Å; C1313-L1317 VanDerWaalsContact O-CA 3.31Å; C1313-L1317 WeakPolarHBondContact O-CA 3.26Å; C1313-L1317 PolarHBondContact O-N 3.42Å; C1313-L1317 VanDerWaalsContact O-O 3.07Å; C1313-L1320 HydrophobicContact CB-CB 4.1Å
1314	G	81.1	Confident	81.3	Confident	6 Å²	6	70.4 Å²	70.4	6%	0.062	36%	0.357	C	S	.	.	H	α-helix	trans	-69.3	-21	177.1	0	0	0	0	0	114.3	G1310 V1311 V1312 Y1389 Y1398	G1310-G1314 PolarHBondContact O-N 2.71Å; V1311-G1314 PolarHBondContact O-N 2.99Å; V1312-G1314 VanDerWaalsContact C-N 3.35Å; G1314-Y1389 PolarHBondContact O-OH 2.83Å; G1314-Y1398 VanDerWaalsContact CA-OH 3.26Å; G1314-Y1398 WeakPolarHBondContact CA-OH 3.44Å
1315	L	80.9	Confident	81.2	Confident	111 Å²	111	65.6 Å²	65.6	58%	0.581	33%	0.327	S	S	*	.	H	α-helix	trans	-87.6	-32	173.9	-168.3	144	0	0	0	112.6	V1311 V1312 C1313 Y1398	V1311-L1315 PolarHBondContact O-N 3.44Å; V1312-L1315 PolarHBondContact O-N 3.25Å; C1313-L1315 VanDerWaalsContact C-N 3.26Å; C1313-L1315 PolarHBondContact O-N 2.79Å; L1315-Y1398 HydrophobicContact CB-CE1 4.18Å; L1315-Y1398 HydrophobicContact CD1-CE1 4.29Å; L1315-Y1398 PolarHBondContact N-OH 2.88Å
1316	T	81.9	Confident	80.8	Confident	84 Å²	84	63 Å²	63	52%	0.515	32%	0.319	S	S	.	.	H	α-helix	trans	-104.4	-41.3	-173.6	56	0	0	0	0	114.6	V1312 C1313	V1312-T1316 WeakPolarHBondContact O-CB 3.35Å; V1312-T1316 PolarHBondContact O-N 3.43Å; V1312-T1316 PolarHBondContact O-OG1 2.97Å; C1313-T1316 PolarHBondContact O-N 2.68Å
1317	L	81.5	Confident	80.2	Confident	94 Å²	94	58.9 Å²	58.9	49%	0.492	31%	0.308	S	S	.	.			trans	-150.1	70.3	-165.2	-74.7	169.5	0	0	0	110.3	C1313 F1319 L1320	C1313-L1317 CarbonylContact O-C 3.6Å; C1313-L1317 VanDerWaalsContact O-CA 3.31Å; C1313-L1317 WeakPolarHBondContact O-CA 3.26Å; C1313-L1317 PolarHBondContact O-N 3.42Å; C1313-L1317 VanDerWaalsContact O-O 3.07Å; L1317-F1319 PolarHBondContact O-N 2.88Å; L1317-L1320 HydrophobicContact CB-CD1 3.94Å; L1317-L1320 HydrophobicContact CB-CG 4.16Å; L1317-L1320 HydrophobicContact CD1-CD1 3.82Å; L1317-L1320 PolarHBondContact O-N 3.11Å
1318	P	75.8	Confident	79.6	Confident	42 Å²	42	59.9 Å²	59.9	27%	0.273	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-54.9	-24.9	-175	18.1	-32.2	0	0	0	114.2	L1320 I1321	P1318-L1320 PolarHBondContact O-N 3.49Å; P1318-L1320 VanDerWaalsContact O-N 3.14Å; P1318-I1321 HydrophobicContact CB-CD1 4.12Å; P1318-I1321 WeakPolarHBondContact O-CD1 3.34Å; P1318-I1321 WeakPolarHBondContact O-CG1 3.43Å; P1318-I1321 PolarHBondContact O-N 3.18Å
1319	F	77.4	Confident	78.4	Confident	146 Å²	146	60.9 Å²	60.9	64%	0.64	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-62.1	-13.8	173.5	-58.3	-71.4	0	0	0	114.7	L1317 Y1381	L1317-F1319 PolarHBondContact O-N 2.88Å; F1319-Y1381 WeakPolarHBondContact O-CE1 3.29Å; F1319-Y1381 PolarHBondContact O-OH 3.19Å
1320	L	80.7	Confident	77	Confident	65 Å²	65	63.8 Å²	63.8	34%	0.34	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-90.4	-16.1	176.4	-66.3	179.5	0	0	0	113.9	C1313 L1317 P1318 K1323 V1324	C1313-L1320 HydrophobicContact CB-CB 4.1Å; L1317-L1320 HydrophobicContact CB-CD1 3.94Å; L1317-L1320 HydrophobicContact CB-CG 4.16Å; L1317-L1320 HydrophobicContact CD1-CD1 3.82Å; L1317-L1320 PolarHBondContact O-N 3.11Å; P1318-L1320 PolarHBondContact O-N 3.49Å; P1318-L1320 VanDerWaalsContact O-N 3.14Å; L1320-K1323 PolarHBondContact O-N 3.47Å; L1320-V1324 PolarHBondContact O-N 3.37Å
1321	I	78.5	Confident	74.9	Confident	4 Å²	4	69.7 Å²	69.7	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-49.2	-50	-176.6	-66.7	160.4	0	0	0	112.2	P1318 K1323 V1324 I1325 I1385 F1388 Y1389	P1318-I1321 HydrophobicContact CB-CD1 4.12Å; P1318-I1321 WeakPolarHBondContact O-CD1 3.34Å; P1318-I1321 WeakPolarHBondContact O-CG1 3.43Å; P1318-I1321 PolarHBondContact O-N 3.18Å; I1321-K1323 PolarHBondContact O-N 3.4Å; I1321-V1324 PolarHBondContact O-N 2.99Å; I1321-V1324 VanDerWaalsContact O-N 3.16Å; I1321-I1325 HydrophobicContact CG2-CD1 3.94Å; I1321-I1325 HydrophobicContact CG2-CG1 4.38Å; I1321-I1325 PolarHBondContact O-N 2.9Å; I1321-I1325 VanDerWaalsContact O-N 3.1Å; I1321-I1385 HydrophobicContact CD1-CG2 4.44Å; I1321-F1388 HydrophobicContact CD1-CD1 3.51Å; I1321-F1388 HydrophobicContact CD1-CE1 3.79Å; I1321-F1388 HydrophobicContact CD1-CG 4.22Å; I1321-F1388 HydrophobicContact CG1-CD1 4.23Å; I1321-F1388 HydrophobicContact CG1-CE1 4.32Å; I1321-F1388 HydrophobicContact CG2-CB 3.9Å; I1321-F1388 HydrophobicContact CG2-CD1 4.28Å; I1321-F1388 HydrophobicContact CG2-CD2 4.23Å; I1321-F1388 HydrophobicContact CG2-CG 3.88Å; I1321-Y1389 HydrophobicContact CD1-CE2 4.1Å
1322	P	73.3	Confident	72.5	Confident	27 Å²	27	75.5 Å²	75.5	18%	0.175	40%	0.403	C	S	.	.	H	α-helix	trans	-61.4	-12.3	178.9	-32.1	43.2	0	0	0	117.3	Y1381 Q1384 I1385	P1322-Y1381 HydrophobicContact CB-CD2 3.94Å; P1322-Y1381 HydrophobicContact CB-CE1 4.35Å; P1322-Y1381 HydrophobicContact CB-CE2 3.58Å; P1322-Y1381 HydrophobicContact CB-CG 4.48Å; P1322-Y1381 HydrophobicContact CG-CD1 3.85Å; P1322-Y1381 HydrophobicContact CG-CD2 3.93Å; P1322-Y1381 HydrophobicContact CG-CE1 3.69Å; P1322-Y1381 HydrophobicContact CG-CE2 3.79Å; P1322-Y1381 HydrophobicContact CG-CG 3.96Å; P1322-Q1384 HydrophobicContact CG-CB 4.22Å; P1322-I1385 HydrophobicContact CG-CG1 4.08Å
1323	K	76.2	Confident	70	Confident	173 Å²	173	77.5 Å²	77.5	75%	0.752	42%	0.418	S	S	*	.	H	α-helix	trans	-101	-23.7	177.4	-68.7	-174	176.8	-177.6	0	113.3	L1320 I1321	L1320-K1323 PolarHBondContact O-N 3.47Å; I1321-K1323 PolarHBondContact O-N 3.4Å
1324	V	79.4	Confident	67.6	Low	39 Å²	39	82.3 Å²	82.3	24%	0.236	45%	0.447	C	S	.	.	H	α-helix	trans	-97.4	-37.3	-172.9	177.8	0	0	0	0	111.4	M1309 L1320 I1321	M1309-V1324 HydrophobicContact CB-CG1 3.73Å; L1320-V1324 PolarHBondContact O-N 3.37Å; I1321-V1324 PolarHBondContact O-N 2.99Å; I1321-V1324 VanDerWaalsContact O-N 3.16Å
1325	I	79.5	Confident	65.3	Low	9 Å²	9	88.9 Å²	88.9	5%	0.046	49%	0.486	C	S	.	.	S	Bend	trans	-109.4	131	-172.4	-42.6	-176.2	0	0	0	110.3	L1298 G1310 I1321 S1327 F1388	L1298-I1325 HydrophobicContact CD2-CG2 4.08Å; G1310-I1325 VanDerWaalsContact CA-CD1 3.5Å; I1321-I1325 HydrophobicContact CG2-CD1 3.94Å; I1321-I1325 HydrophobicContact CG2-CG1 4.38Å; I1321-I1325 PolarHBondContact O-N 2.9Å; I1321-I1325 VanDerWaalsContact O-N 3.1Å; I1325-S1327 PolarHBondContact O-N 3.36Å; I1325-F1388 HydrophobicContact CD1-CD2 3.4Å; I1325-F1388 HydrophobicContact CD1-CE2 3.24Å; I1325-F1388 HydrophobicContact CD1-CG 4.38Å; I1325-F1388 HydrophobicContact CD1-CZ 4.12Å
1326	L	77.6	Confident	63.1	Low	87 Å²	87	93 Å²	93	46%	0.455	50%	0.502	S	S	.	.			trans	-78.4	112.4	174.8	-169.3	69	0	0	0	109.8	S1299 N1302	S1299-L1326 WeakPolarHBondContact CB-O 2.88Å; S1299-L1326 PolarHBondContact N-O 2.79Å; N1302-L1326 PolarHBondContact ND2-O 2.87Å; N1302-L1326 WeakPolarHBondContact OD1-CB 3.46Å; N1302-L1326 PolarHBondContact OD1-N 2.81Å
1327	S	70.7	Confident	60.9	Low	31 Å²	31	92.3 Å²	92.3	22%	0.217	51%	0.512	C	S	.	.	B	Isolated β-bridge	trans	-76.2	154.9	167.6	-50.9	0	0	0	0	111.1	I1325	I1325-S1327 PolarHBondContact O-N 3.36Å
1328	K	70.1	Confident	58.7	Low	68 Å²	68	97.4 Å²	97.4	30%	0.296	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-65.1	130.6	166.8	-70.1	170.9	175.5	167.1	0	109	N1292 G1296 N1297 L1298	N1292-K1328 PolarHBondContact OD1-NZ 3.15Å; G1296-K1328 PolarHBondContact O-NZ 3.48Å; N1297-K1328 PolarHBondContact O-N 3Å; L1298-K1328 WeakPolarHBondContact O-CE 2.98Å
1329	P	59.7	Low	56.8	Low	109 Å²	109	103 Å²	103	71%	0.708	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-67	137.4	176.6	28.2	-33.8	0	0	0	110.1	T1331	P1329-T1331 PolarHBondContact O-N 3.43Å
1330	K	54.9	Low	54.8	Low	141 Å²	141	98.1 Å²	98.1	61%	0.613	54%	0.539	S	S	*	.			trans	-79.1	85.2	179.1	-70	176.3	-179.3	170.7	0	110.1	N1332 S1383 D1387	K1330-N1332 PolarHBondContact O-N 3.06Å; K1330-N1332 VanDerWaalsContact O-N 3.16Å; K1330-S1383 PolarHBondContact NZ-OG 3.34Å; K1330-D1387 IonicContact NZ-OD2 3.13Å
1331	T	40.8	Very low	52.5	Low	124 Å²	124	97.4 Å²	97.4	76%	0.761	54%	0.54	S	S	*	.			trans	-68.6	101.8	172.8	37.4	0	0	0	0	110.4	P1329 P1333	P1329-T1331 PolarHBondContact O-N 3.43Å; T1331-P1333 WeakPolarHBondContact O-CD 3.2Å
1332	N	33	Very low	50.7	Low	134 Å²	134	100.6 Å²	100.6	72%	0.717	56%	0.561	S	S	*	*			trans	-73.6	114.8	167.1	-66.9	-37.2	0	0	0	108.2	K1330 T1334	K1330-N1332 PolarHBondContact O-N 3.06Å; K1330-N1332 VanDerWaalsContact O-N 3.16Å; N1332-T1334 PolarHBondContact O-N 3.3Å; N1332-T1334 PolarHBondContact O-OG1 3.46Å
1333	P	32.9	Very low	48.5	Very low	118 Å²	118	105.1 Å²	105.1	77%	0.766	59%	0.588	S	S	*	*			trans	-67.4	109.1	-177.4	27.1	-33.8	0	0	0	110.1	T1331	T1331-P1333 WeakPolarHBondContact O-CD 3.2Å
1334	T	34.3	Very low	46.2	Very low	117 Å²	117	101.5 Å²	101.5	72%	0.718	59%	0.585	S	S	*	*			trans	-130.7	100.9	-174.4	-44.3	0	0	0	0	109.4	N1332	N1332-T1334 PolarHBondContact O-N 3.3Å; N1332-T1334 PolarHBondContact O-OG1 3.46Å
1335	T	32.6	Very low	43.7	Very low	143 Å²	143	107.3 Å²	107.3	88%	0.877	61%	0.609	S	S	*	*			trans	3.8	100.7	162.7	-47	0	0	0	0	119.3
1336	E	35.2	Very low	41.3	Very low	198 Å²	198	113 Å²	113	93%	0.925	64%	0.636	S	S	*	*			trans	-147.6	162.8	159.8	-67.3	-171.1	166.9	0	0	110
1337	G	35.6	Very low	38.8	Very low	70 Å²	70	117.4 Å²	117.4	72%	0.722	65%	0.654	S	S	*	*			trans	-177.7	169.5	176.7	0	0	0	0	0	114.7
1338	E	34.5	Very low	36.7	Very low	201 Å²	201	119.7 Å²	119.7	94%	0.939	68%	0.682	S	S	*	*			trans	76.1	157.5	171.4	-65.2	173	157.4	0	0	119.8
1339	E	35	Very low	34.6	Very low	159 Å²	159	121.4 Å²	121.4	74%	0.743	70%	0.703	S	S	*	*			trans	91.8	86.8	170.9	-58.4	-170.2	165.7	0	0	122.5	H1043 V1044	H1043-E1339 CarbonylContact C-O 3.42Å; V1044-E1339 PolarHBondContact N-O 3.05Å; V1044-E1339 VanDerWaalsContact N-O 3.15Å
1340	S	36.4	Very low	33.2	Very low	43 Å²	43	121.5 Å²	121.5	30%	0.301	70%	0.701	S	S	.	*				64.5	114.3	103.8	74	0	0	0	0	126.6	D1040 N1041 H1043	D1040-S1340 WeakPolarHBondContact O-CB 3.49Å; N1041-S1340 WeakPolarHBondContact O-CA 3.37Å; N1041-S1340 PolarHBondContact O-N 3.03Å; H1043-S1340 VanDerWaalsContact N-C 3.31Å; H1043-S1340 CarbonylContact O-C 3.45Å
1341	S	33.2	Very low	32.1	Very low	51 Å²	51	123 Å²	123	36%	0.357	71%	0.711	S	S	.	*			trans	79.5	160.9	146.4	-74.7	0	0	0	0	123.6	N1041 H1043	N1041-S1341 WeakPolarHBondContact CB-OG 3.35Å; N1041-S1341 PolarHBondContact ND2-OG 3.37Å; H1043-S1341 PolarHBondContact O-N 3.37Å
1342	P	39.1	Very low	31.5	Very low	70 Å²	70	122.1 Å²	122.1	46%	0.455	71%	0.71	S	S	.	*			trans	-127.8	-150.8	-150.9	47.4	-33.3	0	0	0	115	E1042	E1042-P1342 WeakPolarHBondContact OE1-CB 3.19Å; E1042-P1342 WeakPolarHBondContact OE1-CG 3.17Å; E1042-P1342 VanDerWaalsContact OE2-CD 3.26Å; E1042-P1342 WeakPolarHBondContact OE2-CD 3.13Å; E1042-P1342 VanDerWaalsContact OE2-CG 3.32Å; E1042-P1342 WeakPolarHBondContact OE2-CG 3.48Å
1343	T	26.8	Very low	31.1	Very low	122 Å²	122	123.2 Å²	123.2	75%	0.748	72%	0.716	S	S	*	*			trans	79.3	112.6	169.3	40.8	0	0	0	0	120.7
1344	S	28.9	Very low	30.7	Very low	98 Å²	98	125.8 Å²	125.8	69%	0.685	72%	0.717	S	S	*	*				82.8	121.5	125.6	-59.5	0	0	0	0	122.8
1345	E	26.1	Very low	30.6	Very low	160 Å²	160	125.3 Å²	125.3	75%	0.748	71%	0.714	S	S	*	*				106.6	132.1	124.1	-92.2	-173.3	-124.6	0	0	123.3
1346	Q	28.9	Very low	30.5	Very low	130 Å²	130	126.9 Å²	126.9	61%	0.607	71%	0.714	S	S	*	*			trans	72.4	107	150	-65.6	-170.2	45.5	0	0	123
1347	Q	25.5	Very low	30.3	Very low	179 Å²	179	125.3 Å²	125.3	84%	0.836	70%	0.704	S	S	*	*				69.8	175.2	128.3	-58.3	176.4	28	0	0	118.1
1348	G	26.5	Very low	29.9	Very low	78 Å²	78	133.4 Å²	133.4	80%	0.804	71%	0.714	S	S	*	*			trans	118.4	82.4	173.6	0	0	0	0	0	114.5
1349	S	26.8	Very low	29.7	Very low	105 Å²	105	128 Å²	128	73%	0.734	69%	0.694	S	S	*	*			trans	-68.1	168.5	173.8	54.6	0	0	0	0	114
1350	T	30.8	Very low	29.5	Very low	110 Å²	110	126.8 Å²	126.8	68%	0.675	69%	0.692	S	S	*	*			trans	73.5	125.4	150.6	33.4	0	0	0	0	121.8
1351	Q	31.2	Very low	29	Very low	172 Å²	172	131.8 Å²	131.8	80%	0.804	72%	0.721	S	S	*	*			trans	76.2	157.6	142.5	-63.8	173.9	11.2	0	0	119.5
1352	S	28.4	Very low	29.2	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	74%	0.741	S	S	*	*			trans	48.9	96.9	-175	47.2	0	0	0	0	114.4
1353	N	25.7	Very low	28.9	Very low	156 Å²	156	138.3 Å²	138.3	83%	0.834	76%	0.756	S	S	*	*			cis	41.6	68.1	42.4	-78.5	-8.7	0	0	0	112.6
1354	H	24.3	Very low	29.7	Very low	173 Å²	173	139.5 Å²	139.5	80%	0.801	76%	0.758	S	S	*	*				-162.2	99.5	124	-105.1	-55.5	0	0	0	115.4
1355	T	31.9	Very low	30.2	Very low	107 Å²	107	140 Å²	140	66%	0.656	77%	0.768	S	S	*	*				42.3	126.5	122.8	-40.5	0	0	0	0	120.1
1356	M	29.3	Very low	30.4	Very low	175 Å²	175	135.1 Å²	135.1	86%	0.862	76%	0.76	S	S	*	*			cis	-170.9	59	-18.8	-175.2	178	-177.9	0	0	105.1
1357	K	30.8	Very low	31.1	Very low	165 Å²	165	138.1 Å²	138.1	72%	0.717	77%	0.771	S	S	*	*	S	Bend	trans	-166.7	148.1	-147.3	-107.3	178.4	173.1	-178.8	0	110.4	V1359	K1357-V1359 HydrophobicContact CB-CB 4.31Å; K1357-V1359 HydrophobicContact CB-CG2 3.44Å; K1357-V1359 VanDerWaalsContact CB-CG2 3.44Å; K1357-V1359 HydrophobicContact CD-CB 4.45Å; K1357-V1359 HydrophobicContact CD-CG2 3.91Å; K1357-V1359 HydrophobicContact CG-CG2 4.36Å; K1357-V1359 PolarHBondContact O-N 3.46Å
1358	Y	27.6	Very low	31.8	Very low	241 Å²	241	136.7 Å²	136.7	95%	0.945	76%	0.763	S	S	*	*			trans	-66.8	105.6	130.7	-95.6	-83	0	0	0	106.7
1359	V	32	Very low	32.4	Very low	86 Å²	86	135.5 Å²	135.5	52%	0.521	75%	0.751	S	S	.	*			trans	-84	119.8	-177.6	-179.4	0	0	0	0	107.4	K1357	K1357-V1359 HydrophobicContact CB-CB 4.31Å; K1357-V1359 HydrophobicContact CB-CG2 3.44Å; K1357-V1359 VanDerWaalsContact CB-CG2 3.44Å; K1357-V1359 HydrophobicContact CD-CB 4.45Å; K1357-V1359 HydrophobicContact CD-CG2 3.91Å; K1357-V1359 HydrophobicContact CG-CG2 4.36Å; K1357-V1359 PolarHBondContact O-N 3.46Å
1360	L	29.2	Very low	33.5	Very low	134 Å²	134	134.9 Å²	134.9	70%	0.702	74%	0.742	S	S	*	*			trans	59.6	103.1	173.3	-61.8	164	0	0	0	115.1
1361	T	26.5	Very low	34.5	Very low	148 Å²	148	140 Å²	140	91%	0.908	75%	0.749	S	S	*	*				-170.6	145.6	122.9	19.5	0	0	0	0	108.5
1362	A	37.3	Very low	35.5	Very low	93 Å²	93	140.2 Å²	140.2	77%	0.769	75%	0.748	S	S	*	*			cis	-133.1	158.9	-11	0	0	0	0	0	109.6
1363	E	33.2	Very low	36.7	Very low	166 Å²	166	139 Å²	139	78%	0.776	74%	0.735	S	S	*	*			trans	-77	165.1	178.8	-69.4	149.3	123.4	0	0	112.8	A1365	E1363-A1365 PolarHBondContact O-N 3.1Å
1364	D	42.6	Very low	38.1	Very low	146 Å²	146	136.5 Å²	136.5	78%	0.781	72%	0.722	S	S	*	*			trans	39.2	63.8	154.8	-77	-53.5	0	0	0	121
1365	A	39.1	Very low	39.8	Very low	109 Å²	109	134.9 Å²	134.9	90%	0.901	71%	0.714	S	S	*	*	S	Bend	trans	-150.6	102.8	141.7	0	0	0	0	0	112.5	E1363	E1363-A1365 PolarHBondContact O-N 3.1Å
1366	G	31.4	Very low	41.2	Very low	57 Å²	57	132.7 Å²	132.7	59%	0.588	71%	0.707	S	S	*	*			cis	-177.9	104	-5.8	0	0	0	0	0	111.2	K1368	G1366-K1368 VanDerWaalsContact C-N 3.28Å; G1366-K1368 PolarHBondContact O-N 3.4Å
1367	K	44	Very low	42.9	Very low	193 Å²	193	132.7 Å²	132.7	84%	0.839	70%	0.697	S	S	*	*	S	Bend	trans	54.6	-19	163.8	-65	173.1	-177.5	170.2	0	121.3
1368	K	40.1	Very low	44.9	Very low	149 Å²	149	128.2 Å²	128.2	65%	0.648	68%	0.684	S	S	*	*	S	Bend	trans	-97.1	-21.9	180	-72.2	-163.5	178.6	-168.9	0	116.4	G1366 V1370	G1366-K1368 VanDerWaalsContact C-N 3.28Å; G1366-K1368 PolarHBondContact O-N 3.4Å; K1368-V1370 VanDerWaalsContact C-N 3.31Å; K1368-V1370 PolarHBondContact O-N 3.38Å
1369	G	39.4	Very low	47.1	Very low	54 Å²	54	121.6 Å²	121.6	56%	0.557	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-31.4	179.7	0	0	0	0	0	114.5	R1371 K1372 T1373	G1369-R1371 PolarHBondContact O-N 3.41Å; G1369-K1372 PolarHBondContact O-N 2.88Å; G1369-T1373 PolarHBondContact O-N 3.13Å; G1369-T1373 PolarHBondContact O-OG1 3.39Å
1370	V	48.8	Very low	49.1	Very low	92 Å²	92	122.7 Å²	122.7	56%	0.558	67%	0.668	S	S	*	*	H	α-helix	trans	-53.4	-35	-169.5	-174.5	0	0	0	0	113.7	K1368 T1373 L1374	K1368-V1370 VanDerWaalsContact C-N 3.31Å; K1368-V1370 PolarHBondContact O-N 3.38Å; V1370-T1373 VanDerWaalsContact C-OG1 3.29Å; V1370-T1373 VanDerWaalsContact CA-OG1 3.3Å; V1370-T1373 WeakPolarHBondContact CA-OG1 3.46Å; V1370-T1373 PolarHBondContact O-OG1 3.29Å; V1370-L1374 WeakPolarHBondContact O-CB 3.46Å; V1370-L1374 PolarHBondContact O-N 3.38Å
1371	R	52	Low	51.4	Low	218 Å²	218	120 Å²	120	82%	0.823	65%	0.649	S	S	*	*	H	α-helix	trans	-70.9	-40.9	-177.1	-112.9	-179.5	-177.8	171.3	1.9	113.5	G1369 L1374 Q1375	G1369-R1371 PolarHBondContact O-N 3.41Å; R1371-L1374 PolarHBondContact O-N 2.68Å; R1371-Q1375 PolarHBondContact O-N 2.87Å; R1371-Q1375 VanDerWaalsContact O-N 3.1Å
1372	K	51.5	Low	54	Low	176 Å²	176	118.6 Å²	118.6	77%	0.765	63%	0.634	S	S	*	*	H	α-helix	trans	-68.6	-40.6	176.6	-75.5	-170.7	175.8	-175.8	0	111.1	G1369 L1374 Q1375 A1376	G1369-K1372 PolarHBondContact O-N 2.88Å; K1372-L1374 VanDerWaalsContact C-N 3.32Å; K1372-L1374 PolarHBondContact O-N 2.79Å; K1372-Q1375 PolarHBondContact O-N 2.89Å; K1372-A1376 PolarHBondContact O-N 3.36Å
1373	T	53.6	Low	56	Low	80 Å²	80	115.1 Å²	115.1	49%	0.491	61%	0.605	S	S	.	*	H	α-helix	trans	-64.8	-33.4	174.2	49.1	0	0	0	0	112.7	G1369 V1370 R1377	G1369-T1373 PolarHBondContact O-N 3.13Å; G1369-T1373 PolarHBondContact O-OG1 3.39Å; V1370-T1373 VanDerWaalsContact C-OG1 3.29Å; V1370-T1373 VanDerWaalsContact CA-OG1 3.3Å; V1370-T1373 WeakPolarHBondContact CA-OG1 3.46Å; V1370-T1373 PolarHBondContact O-OG1 3.29Å; T1373-R1377 WeakPolarHBondContact O-CB 3.33Å; T1373-R1377 WeakPolarHBondContact O-CG 3.48Å; T1373-R1377 PolarHBondContact O-N 2.96Å
1374	L	55.9	Low	58.3	Low	105 Å²	105	109.5 Å²	109.5	55%	0.55	58%	0.578	S	S	.	*	H	α-helix	trans	-67.7	-43.3	174.7	-147.4	81.5	0	0	0	111.3	V1370 R1371 K1372 R1377 T1378	V1370-L1374 WeakPolarHBondContact O-CB 3.46Å; V1370-L1374 PolarHBondContact O-N 3.38Å; R1371-L1374 PolarHBondContact O-N 2.68Å; K1372-L1374 VanDerWaalsContact C-N 3.32Å; K1372-L1374 PolarHBondContact O-N 2.79Å; L1374-R1377 PolarHBondContact O-N 3.14Å; L1374-T1378 WeakPolarHBondContact O-CG2 3.35Å; L1374-T1378 PolarHBondContact O-N 3.08Å; L1374-T1378 PolarHBondContact O-OG1 3.44Å
1375	Q	59.9	Low	60.2	Low	139 Å²	139	104 Å²	104	65%	0.65	55%	0.548	S	S	*	.	H	α-helix	trans	-63.5	-46	178.8	-130.1	173.2	-12.9	0	0	111.6	R1371 K1372 T1378 V1379	R1371-Q1375 PolarHBondContact O-N 2.87Å; R1371-Q1375 VanDerWaalsContact O-N 3.1Å; K1372-Q1375 PolarHBondContact O-N 2.89Å; Q1375-T1378 WeakPolarHBondContact CA-OG1 3.43Å; Q1375-T1378 PolarHBondContact O-N 2.83Å; Q1375-T1378 PolarHBondContact O-OG1 2.79Å; Q1375-V1379 PolarHBondContact O-N 2.89Å; Q1375-V1379 VanDerWaalsContact O-N 3.09Å
1376	A	62	Low	62.3	Low	60 Å²	60	105.4 Å²	105.4	50%	0.496	53%	0.53	S	S	.	.	H	α-helix	trans	-56.4	-51.7	173	0	0	0	0	0	111.5	K1372 T1378 V1379 E1380	K1372-A1376 PolarHBondContact O-N 3.36Å; A1376-T1378 VanDerWaalsContact C-N 3.31Å; A1376-T1378 PolarHBondContact O-N 2.77Å; A1376-V1379 PolarHBondContact O-N 3.21Å; A1376-V1379 VanDerWaalsContact O-N 3.14Å; A1376-E1380 WeakPolarHBondContact O-CB 3.12Å; A1376-E1380 PolarHBondContact O-N 3.02Å
1377	R	64.7	Low	64.6	Low	176 Å²	176	103.1 Å²	103.1	66%	0.664	51%	0.505	S	S	*	.	H	α-helix	trans	-57.2	-38.5	176.2	-79.3	-180	174.2	-178.2	-0.9	113.1	T1373 L1374 E1380 Y1381	T1373-R1377 WeakPolarHBondContact O-CB 3.33Å; T1373-R1377 WeakPolarHBondContact O-CG 3.48Å; T1373-R1377 PolarHBondContact O-N 2.96Å; L1374-R1377 PolarHBondContact O-N 3.14Å; R1377-E1380 PolarHBondContact O-N 3.32Å; R1377-Y1381 WeakPolarHBondContact O-CB 3.2Å; R1377-Y1381 PolarHBondContact O-N 3.27Å
1378	T	71.7	Confident	66.6	Low	71 Å²	71	93.9 Å²	93.9	44%	0.436	47%	0.465	S	S	.	.	H	α-helix	trans	-69.3	-35.4	177.3	50.6	0	0	0	0	113.5	L1374 Q1375 A1376 I1382	L1374-T1378 WeakPolarHBondContact O-CG2 3.35Å; L1374-T1378 PolarHBondContact O-N 3.08Å; L1374-T1378 PolarHBondContact O-OG1 3.44Å; Q1375-T1378 WeakPolarHBondContact CA-OG1 3.43Å; Q1375-T1378 PolarHBondContact O-N 2.83Å; Q1375-T1378 PolarHBondContact O-OG1 2.79Å; A1376-T1378 VanDerWaalsContact C-N 3.31Å; A1376-T1378 PolarHBondContact O-N 2.77Å; T1378-I1382 VanDerWaalsContact O-CG1 3.32Å; T1378-I1382 WeakPolarHBondContact O-CG1 2.97Å; T1378-I1382 PolarHBondContact O-N 3.4Å; T1378-I1382 VanDerWaalsContact O-N 3.11Å
1379	V	74.6	Confident	68.8	Low	101 Å²	101	90 Å²	90	61%	0.612	45%	0.446	S	S	*	.	H	α-helix	trans	-70.3	-39.1	174.7	173.9	0	0	0	0	110.5	Q1375 A1376 I1382 S1383	Q1375-V1379 PolarHBondContact O-N 2.89Å; Q1375-V1379 VanDerWaalsContact O-N 3.09Å; A1376-V1379 PolarHBondContact O-N 3.21Å; A1376-V1379 VanDerWaalsContact O-N 3.14Å; V1379-I1382 PolarHBondContact O-N 3.1Å; V1379-S1383 WeakPolarHBondContact O-CB 3.23Å; V1379-S1383 PolarHBondContact O-N 2.98Å
1380	E	73.8	Confident	71	Confident	109 Å²	109	90.6 Å²	90.6	51%	0.509	44%	0.435	S	S	.	.	H	α-helix	trans	-62.4	-43.2	173.2	-174.9	172.1	-147.3	0	0	112.2	A1376 R1377 I1382 S1383 Q1384	A1376-E1380 WeakPolarHBondContact O-CB 3.12Å; A1376-E1380 PolarHBondContact O-N 3.02Å; R1377-E1380 PolarHBondContact O-N 3.32Å; E1380-I1382 PolarHBondContact O-N 3.18Å; E1380-S1383 WeakPolarHBondContact O-CB 3.47Å; E1380-S1383 PolarHBondContact O-N 2.9Å; E1380-Q1384 WeakPolarHBondContact O-CG 3.49Å; E1380-Q1384 PolarHBondContact O-N 2.86Å
1381	Y	77.3	Confident	72.7	Confident	78 Å²	78	86.3 Å²	86.3	31%	0.306	41%	0.41	S	S	.	.	H	α-helix	trans	-59	-46.6	174.8	-142.4	-98.1	0	0	0	112.2	F1319 P1322 R1377 Q1384 I1385	F1319-Y1381 WeakPolarHBondContact O-CE1 3.29Å; F1319-Y1381 PolarHBondContact O-OH 3.19Å; P1322-Y1381 HydrophobicContact CB-CD2 3.94Å; P1322-Y1381 HydrophobicContact CB-CE1 4.35Å; P1322-Y1381 HydrophobicContact CB-CE2 3.58Å; P1322-Y1381 HydrophobicContact CB-CG 4.48Å; P1322-Y1381 HydrophobicContact CG-CD1 3.85Å; P1322-Y1381 HydrophobicContact CG-CD2 3.93Å; P1322-Y1381 HydrophobicContact CG-CE1 3.69Å; P1322-Y1381 HydrophobicContact CG-CE2 3.79Å; P1322-Y1381 HydrophobicContact CG-CG 3.96Å; R1377-Y1381 WeakPolarHBondContact O-CB 3.2Å; R1377-Y1381 PolarHBondContact O-N 3.27Å; Y1381-Q1384 PolarHBondContact O-N 3.37Å; Y1381-I1385 HydrophobicContact CD1-CD1 3.8Å; Y1381-I1385 HydrophobicContact CE1-CD1 4.09Å; Y1381-I1385 WeakPolarHBondContact O-CG1 3.35Å; Y1381-I1385 PolarHBondContact O-N 2.86Å
1382	I	81.4	Confident	74.4	Confident	118 Å²	118	76.2 Å²	76.2	61%	0.605	37%	0.372	S	S	*	.	H	α-helix	trans	-69.6	-35.4	179.1	-67.2	167	0	0	0	110.7	T1378 V1379 E1380 R1386	T1378-I1382 VanDerWaalsContact O-CG1 3.32Å; T1378-I1382 WeakPolarHBondContact O-CG1 2.97Å; T1378-I1382 PolarHBondContact O-N 3.4Å; T1378-I1382 VanDerWaalsContact O-N 3.11Å; V1379-I1382 PolarHBondContact O-N 3.1Å; E1380-I1382 PolarHBondContact O-N 3.18Å; I1382-R1386 WeakPolarHBondContact O-CB 3.38Å; I1382-R1386 PolarHBondContact O-N 3.13Å
1383	S	79.7	Confident	76.2	Confident	21 Å²	21	68.9 Å²	68.9	15%	0.147	34%	0.342	C	S	.	.	H	α-helix	trans	-57.5	-55.3	168.8	-166.2	0	0	0	0	109.8	K1330 V1379 E1380 I1385 R1386 D1387	K1330-S1383 PolarHBondContact NZ-OG 3.34Å; V1379-S1383 WeakPolarHBondContact O-CB 3.23Å; V1379-S1383 PolarHBondContact O-N 2.98Å; E1380-S1383 WeakPolarHBondContact O-CB 3.47Å; E1380-S1383 PolarHBondContact O-N 2.9Å; S1383-I1385 VanDerWaalsContact C-N 3.33Å; S1383-I1385 PolarHBondContact O-N 3.05Å; S1383-R1386 CarbonylContact O-C 3.41Å; S1383-R1386 WeakPolarHBondContact O-CB 3.37Å; S1383-R1386 PolarHBondContact O-N 3.23Å; S1383-R1386 VanDerWaalsContact O-N 3.13Å; S1383-D1387 VanDerWaalsContact C-OD2 3.3Å; S1383-D1387 WeakPolarHBondContact O-CB 3.25Å; S1383-D1387 PolarHBondContact O-N 3.13Å; S1383-D1387 PolarHBondContact OG-OD2 3.47Å
1384	Q	80.4	Confident	77.8	Confident	47 Å²	47	65.1 Å²	65.1	22%	0.22	32%	0.319	C	S	.	.	H	α-helix	trans	-59.4	-38.8	-176.9	-71.7	168.7	-2.3	0	0	113.2	P1322 E1380 Y1381 D1387 F1388	P1322-Q1384 HydrophobicContact CG-CB 4.22Å; E1380-Q1384 WeakPolarHBondContact O-CG 3.49Å; E1380-Q1384 PolarHBondContact O-N 2.86Å; Y1381-Q1384 PolarHBondContact O-N 3.37Å; Q1384-D1387 PolarHBondContact O-N 2.92Å; Q1384-F1388 PolarHBondContact O-N 2.72Å
1385	I	83.4	Confident	79.3	Confident	30 Å²	30	61.9 Å²	61.9	15%	0.154	30%	0.3	C	S	.	.	H	α-helix	trans	-65.8	-46.9	174.7	-67.4	169.8	0	0	0	111.1	I1321 P1322 Y1381 S1383 D1387 F1388 Y1389	I1321-I1385 HydrophobicContact CD1-CG2 4.44Å; P1322-I1385 HydrophobicContact CG-CG1 4.08Å; Y1381-I1385 HydrophobicContact CD1-CD1 3.8Å; Y1381-I1385 HydrophobicContact CE1-CD1 4.09Å; Y1381-I1385 WeakPolarHBondContact O-CG1 3.35Å; Y1381-I1385 PolarHBondContact O-N 2.86Å; S1383-I1385 VanDerWaalsContact C-N 3.33Å; S1383-I1385 PolarHBondContact O-N 3.05Å; I1385-D1387 VanDerWaalsContact C-N 3.34Å; I1385-D1387 PolarHBondContact O-N 3.26Å; I1385-F1388 PolarHBondContact O-N 2.86Å; I1385-Y1389 HydrophobicContact CG2-CD2 4.11Å; I1385-Y1389 HydrophobicContact CG2-CE2 3.79Å; I1385-Y1389 VanDerWaalsContact O-CD2 3.25Å; I1385-Y1389 WeakPolarHBondContact O-CD2 3.34Å; I1385-Y1389 PolarHBondContact O-N 2.75Å
1386	R	83	Confident	80.7	Confident	139 Å²	139	56.4 Å²	56.4	53%	0.525	27%	0.274	S	S	.	.	H	α-helix	trans	-60.5	-45.7	174.5	-179.3	-159	68.5	177.2	0.7	111.2	I1382 S1383 F1388 Y1389 M1390	I1382-R1386 WeakPolarHBondContact O-CB 3.38Å; I1382-R1386 PolarHBondContact O-N 3.13Å; S1383-R1386 CarbonylContact O-C 3.41Å; S1383-R1386 WeakPolarHBondContact O-CB 3.37Å; S1383-R1386 PolarHBondContact O-N 3.23Å; S1383-R1386 VanDerWaalsContact O-N 3.13Å; R1386-F1388 PolarHBondContact O-N 3.23Å; R1386-Y1389 PolarHBondContact O-N 3.34Å; R1386-M1390 HydrophobicContact CG-CG 4.08Å; R1386-M1390 WeakPolarHBondContact O-CB 3.48Å; R1386-M1390 WeakPolarHBondContact O-CG 3.42Å; R1386-M1390 PolarHBondContact O-N 2.87Å
1387	D	80.6	Confident	82	Confident	9 Å²	9	55.1 Å²	55.1	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-67.5	-19.2	-175.5	-62.8	-22.7	0	0	0	111.7	N1297 K1330 S1383 Q1384 I1385	N1297-D1387 HydrophobicContact CB-CB 3.95Å; K1330-D1387 IonicContact NZ-OD2 3.13Å; S1383-D1387 VanDerWaalsContact C-OD2 3.3Å; S1383-D1387 WeakPolarHBondContact O-CB 3.25Å; S1383-D1387 PolarHBondContact O-N 3.13Å; S1383-D1387 PolarHBondContact OG-OD2 3.47Å; Q1384-D1387 PolarHBondContact O-N 2.92Å; I1385-D1387 VanDerWaalsContact C-N 3.34Å; I1385-D1387 PolarHBondContact O-N 3.26Å
1388	F	86	Confident	83.1	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-76.2	-56.9	167	170	-100.8	0	0	0	112.8	L1298 I1321 I1325 Q1384 I1385 R1386 M1390 A1391 V1394 Y1398	L1298-F1388 HydrophobicContact CD1-CD2 3.92Å; L1298-F1388 HydrophobicContact CD1-CE2 4.49Å; L1298-F1388 HydrophobicContact CD2-CB 4.22Å; L1298-F1388 HydrophobicContact CD2-CD2 4.08Å; I1321-F1388 HydrophobicContact CD1-CD1 3.51Å; I1321-F1388 HydrophobicContact CD1-CE1 3.79Å; I1321-F1388 HydrophobicContact CD1-CG 4.22Å; I1321-F1388 HydrophobicContact CG1-CD1 4.23Å; I1321-F1388 HydrophobicContact CG1-CE1 4.32Å; I1321-F1388 HydrophobicContact CG2-CB 3.9Å; I1321-F1388 HydrophobicContact CG2-CD1 4.28Å; I1321-F1388 HydrophobicContact CG2-CD2 4.23Å; I1321-F1388 HydrophobicContact CG2-CG 3.88Å; I1325-F1388 HydrophobicContact CD1-CD2 3.4Å; I1325-F1388 HydrophobicContact CD1-CE2 3.24Å; I1325-F1388 HydrophobicContact CD1-CG 4.38Å; I1325-F1388 HydrophobicContact CD1-CZ 4.12Å; Q1384-F1388 PolarHBondContact O-N 2.72Å; I1385-F1388 PolarHBondContact O-N 2.86Å; R1386-F1388 PolarHBondContact O-N 3.23Å; F1388-M1390 PolarHBondContact O-N 2.96Å; F1388-A1391 WeakPolarHBondContact O-CB 3.45Å; F1388-A1391 PolarHBondContact O-N 3.1Å; F1388-V1394 HydrophobicContact CD1-CG1 4.14Å; F1388-V1394 HydrophobicContact CD2-CG2 3.73Å; F1388-V1394 HydrophobicContact CE1-CG1 3.69Å; F1388-V1394 HydrophobicContact CE2-CB 4.46Å; F1388-V1394 HydrophobicContact CE2-CG1 4.08Å; F1388-V1394 HydrophobicContact CE2-CG2 3.46Å; F1388-V1394 VanDerWaalsContact CE2-CG2 3.46Å; F1388-V1394 HydrophobicContact CG-CG2 4.37Å; F1388-V1394 HydrophobicContact CZ-CB 4.49Å; F1388-V1394 HydrophobicContact CZ-CG1 3.65Å; F1388-V1394 HydrophobicContact CZ-CG2 3.92Å; F1388-V1394 WeakPolarHBondContact O-CG2 3.34Å; F1388-Y1398 HydrophobicContact CE1-CE2 4.09Å; F1388-Y1398 HydrophobicContact CZ-CE2 4.42Å
1389	Y	86	Confident	83.9	Confident	66 Å²	66	45.7 Å²	45.7	26%	0.259	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-20.8	179.9	-66.8	-72.2	0	0	0	113.4	G1314 I1321 I1385 R1386 A1391 V1394 Y1398	G1314-Y1389 PolarHBondContact O-OH 2.83Å; I1321-Y1389 HydrophobicContact CD1-CE2 4.1Å; I1385-Y1389 HydrophobicContact CG2-CD2 4.11Å; I1385-Y1389 HydrophobicContact CG2-CE2 3.79Å; I1385-Y1389 VanDerWaalsContact O-CD2 3.25Å; I1385-Y1389 WeakPolarHBondContact O-CD2 3.34Å; I1385-Y1389 PolarHBondContact O-N 2.75Å; R1386-Y1389 PolarHBondContact O-N 3.34Å; Y1389-A1391 VanDerWaalsContact C-N 3.34Å; Y1389-V1394 HydrophobicContact CD1-CG1 4.49Å; Y1389-Y1398 HydrophobicContact CD1-CD2 4.43Å; Y1389-Y1398 AromaticContact CD1-CE2 3.91Å; Y1389-Y1398 HydrophobicContact CD1-CE2 3.91Å; Y1389-Y1398 AromaticContact CE1-CE2 3.71Å; Y1389-Y1398 HydrophobicContact CE1-CE2 3.71Å
1390	M	84.3	Confident	84.5	Confident	67 Å²	67	42.1 Å²	42.1	33%	0.33	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-13	174	-68.7	-69.1	140.4	0	0	113.7	R1386 F1388 R1395 P1694 W1703	R1386-M1390 HydrophobicContact CG-CG 4.08Å; R1386-M1390 WeakPolarHBondContact O-CB 3.48Å; R1386-M1390 WeakPolarHBondContact O-CG 3.42Å; R1386-M1390 PolarHBondContact O-N 2.87Å; F1388-M1390 PolarHBondContact O-N 2.96Å; M1390-R1395 PolarHBondContact O-NE 2.78Å; M1390-R1395 PolarHBondContact O-NH2 3.07Å; M1390-P1694 HydrophobicContact CE-CB 3.97Å; M1390-P1694 HydrophobicContact CE-CG 3.85Å; M1390-P1694 HydrophobicContact SD-CB 4.49Å; M1390-W1703 HydrophobicContact CE-CH2 3.93Å; M1390-W1703 HydrophobicContact CE-CZ3 4.3Å
1391	A	85.1	Confident	85.3	Confident	2 Å²	2	40.1 Å²	40.1	2%	0.017	19%	0.188	C	C	.	.	S	Bend	trans	-74.5	128.8	-179.1	0	0	0	0	0	111.7	L1298 F1388 Y1389 V1393 V1394 R1395	L1298-A1391 HydrophobicContact CD1-CB 3.81Å; L1298-A1391 HydrophobicContact CG-CB 4.15Å; F1388-A1391 WeakPolarHBondContact O-CB 3.45Å; F1388-A1391 PolarHBondContact O-N 3.1Å; Y1389-A1391 VanDerWaalsContact C-N 3.34Å; A1391-V1393 VanDerWaalsContact C-N 3.31Å; A1391-V1393 HydrophobicContact CB-CG1 4.41Å; A1391-V1393 PolarHBondContact O-N 3.41Å; A1391-V1394 HydrophobicContact CB-CB 4.5Å; A1391-V1394 HydrophobicContact CB-CG2 4.11Å; A1391-V1394 WeakPolarHBondContact O-CB 2.98Å; A1391-V1394 PolarHBondContact O-N 3.08Å; A1391-R1395 PolarHBondContact O-N 3.15Å
1392	P	88.6	Confident	85.8	Confident	6 Å²	6	37 Å²	37	4%	0.039	18%	0.178	C	C	.	.	H	α-helix	trans	-54.3	-40.1	-177	-29.6	36.3	0	0	0	114.5	T1293 W1294 V1394 R1395 F1396 V1690	T1293-P1392 WeakPolarHBondContact O-CD 3.3Å; W1294-P1392 HydrophobicContact CE3-CB 3.65Å; W1294-P1392 HydrophobicContact CZ3-CB 4.03Å; W1294-P1392 WeakPolarHBondContact O-CD 3.43Å; P1392-V1394 PolarHBondContact O-N 3.21Å; P1392-R1395 WeakPolarHBondContact O-CB 3.48Å; P1392-R1395 PolarHBondContact O-N 3.49Å; P1392-R1395 VanDerWaalsContact O-N 3.13Å; P1392-F1396 PolarHBondContact O-N 3.24Å; P1392-V1690 HydrophobicContact CB-CG2 4.3Å; P1392-V1690 HydrophobicContact CG-CG2 3.48Å; P1392-V1690 VanDerWaalsContact CG-CG2 3.48Å
1393	V	87.8	Confident	86.2	Confident	22 Å²	22	32.6 Å²	32.6	13%	0.133	15%	0.154	C	C	.	.	H	α-helix	trans	-58.3	-33.3	176.5	68.7	0	0	0	0	113.3	W1294 L1298 Y1307 A1391 V1397	W1294-V1393 HydrophobicContact CD2-CB 3.9Å; W1294-V1393 HydrophobicContact CD2-CG2 4.43Å; W1294-V1393 HydrophobicContact CG-CB 4.14Å; W1294-V1393 HydrophobicContact CZ2-CB 4Å; W1294-V1393 HydrophobicContact CZ2-CG2 3.87Å; W1294-V1393 WeakPolarHBondContact O-CB 3.36Å; W1294-V1393 WeakPolarHBondContact O-CG1 3.26Å; W1294-V1393 PolarHBondContact O-N 2.68Å; W1294-V1393 VanDerWaalsContact O-N 3.09Å; L1298-V1393 HydrophobicContact CD1-CG1 4.44Å; Y1307-V1393 HydrophobicContact CE2-CG1 4.05Å; Y1307-V1393 HydrophobicContact CE2-CG2 4.27Å; Y1307-V1393 PolarHBondContact OH-O 3.28Å; Y1307-V1393 VanDerWaalsContact OH-O 3.12Å; A1391-V1393 VanDerWaalsContact C-N 3.31Å; A1391-V1393 HydrophobicContact CB-CG1 4.41Å; A1391-V1393 PolarHBondContact O-N 3.41Å; V1393-V1397 WeakPolarHBondContact O-CG2 3.28Å; V1393-V1397 PolarHBondContact O-N 3.42Å; V1393-V1397 VanDerWaalsContact O-N 3.09Å
1394	V	87.5	Confident	86.8	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-77.4	-38.7	178.7	178.5	0	0	0	0	110.4	L1298 Y1307 F1388 Y1389 A1391 P1392 V1397 Y1398	L1298-V1394 HydrophobicContact CD1-CG2 3.9Å; Y1307-V1394 HydrophobicContact CE2-CG2 4.36Å; F1388-V1394 HydrophobicContact CD1-CG1 4.14Å; F1388-V1394 HydrophobicContact CD2-CG2 3.73Å; F1388-V1394 HydrophobicContact CE1-CG1 3.69Å; F1388-V1394 HydrophobicContact CE2-CB 4.46Å; F1388-V1394 HydrophobicContact CE2-CG1 4.08Å; F1388-V1394 HydrophobicContact CE2-CG2 3.46Å; F1388-V1394 VanDerWaalsContact CE2-CG2 3.46Å; F1388-V1394 HydrophobicContact CG-CG2 4.37Å; F1388-V1394 HydrophobicContact CZ-CB 4.49Å; F1388-V1394 HydrophobicContact CZ-CG1 3.65Å; F1388-V1394 HydrophobicContact CZ-CG2 3.92Å; F1388-V1394 WeakPolarHBondContact O-CG2 3.34Å; Y1389-V1394 HydrophobicContact CD1-CG1 4.49Å; A1391-V1394 HydrophobicContact CB-CB 4.5Å; A1391-V1394 HydrophobicContact CB-CG2 4.11Å; A1391-V1394 WeakPolarHBondContact O-CB 2.98Å; A1391-V1394 PolarHBondContact O-N 3.08Å; P1392-V1394 PolarHBondContact O-N 3.21Å; V1394-V1397 PolarHBondContact O-N 3.45Å; V1394-Y1398 HydrophobicContact CG1-CD2 3.58Å; V1394-Y1398 HydrophobicContact CG1-CE2 3.34Å; V1394-Y1398 WeakPolarHBondContact O-CD2 3.31Å; V1394-Y1398 PolarHBondContact O-N 2.73Å
1395	R	88.7	Confident	87.3	Confident	37 Å²	37	35.7 Å²	35.7	14%	0.14	17%	0.172	C	C	.	.	H	α-helix	trans	-61.5	-47.3	172.8	-55.5	-173.6	-163.7	166	16.8	111.3	M1390 A1391 P1392 Y1398 N1399 Y1689 V1690 R1692 P1694	M1390-R1395 PolarHBondContact O-NE 2.78Å; M1390-R1395 PolarHBondContact O-NH2 3.07Å; A1391-R1395 PolarHBondContact O-N 3.15Å; P1392-R1395 WeakPolarHBondContact O-CB 3.48Å; P1392-R1395 PolarHBondContact O-N 3.49Å; P1392-R1395 VanDerWaalsContact O-N 3.13Å; R1395-Y1398 PolarHBondContact O-N 3.32Å; R1395-N1399 VanDerWaalsContact O-CB 3.24Å; R1395-N1399 WeakPolarHBondContact O-CB 3.4Å; R1395-N1399 PolarHBondContact O-N 2.91Å; R1395-Y1689 PolarHBondContact NH1-O 2.72Å; R1395-V1690 PolarHBondContact NH1-O 3.2Å; R1395-R1692 PolarHBondContact NH1-O 3.08Å; R1395-P1694 HydrophobicContact CG-CB 4.5Å
1396	F	89.1	Confident	87.7	Confident	25 Å²	25	34.3 Å²	34.3	11%	0.11	17%	0.165	C	C	.	.	H	α-helix	trans	-56.5	-52.9	175.3	171.1	-104.1	0	0	0	111.6	W1294 P1392 Y1398 N1399 T1400 T1529 F1532 Y1689	W1294-F1396 HydrophobicContact CH2-CB 3.43Å; W1294-F1396 VanDerWaalsContact CH2-CB 3.43Å; W1294-F1396 AromaticContact CH2-CD1 3.92Å; W1294-F1396 HydrophobicContact CH2-CD1 3.92Å; W1294-F1396 HydrophobicContact CH2-CD2 4.17Å; W1294-F1396 AromaticContact CH2-CG 3.59Å; W1294-F1396 HydrophobicContact CH2-CG 3.59Å; W1294-F1396 HydrophobicContact CZ2-CB 4.09Å; W1294-F1396 AromaticContact CZ2-CD1 3.9Å; W1294-F1396 HydrophobicContact CZ2-CD1 3.9Å; W1294-F1396 HydrophobicContact CZ2-CG 4.07Å; W1294-F1396 HydrophobicContact CZ3-CB 4.21Å; P1392-F1396 PolarHBondContact O-N 3.24Å; F1396-Y1398 PolarHBondContact O-N 2.78Å; F1396-N1399 PolarHBondContact O-N 2.87Å; F1396-T1400 WeakPolarHBondContact O-CB 3.23Å; F1396-T1400 PolarHBondContact O-N 2.98Å; F1396-T1400 PolarHBondContact O-OG1 3.25Å; F1396-T1400 VanDerWaalsContact O-OG1 3.09Å; F1396-T1529 HydrophobicContact CE2-CG2 3.98Å; F1396-T1529 HydrophobicContact CZ-CG2 3.76Å; F1396-F1532 HydrophobicContact CE1-CD1 4.36Å; F1396-F1532 HydrophobicContact CZ-CB 4.12Å; F1396-F1532 HydrophobicContact CZ-CG 4.37Å; F1396-Y1689 HydrophobicContact CB-CD1 4.07Å; F1396-Y1689 HydrophobicContact CB-CE1 4.16Å; F1396-Y1689 HydrophobicContact CB-CG 4.33Å; F1396-Y1689 HydrophobicContact CD2-CD2 4.26Å; F1396-Y1689 HydrophobicContact CD2-CE1 4.19Å; F1396-Y1689 AromaticContact CD2-CE2 3.73Å; F1396-Y1689 HydrophobicContact CD2-CE2 3.73Å; F1396-Y1689 AromaticContact CD2-CZ 3.7Å; F1396-Y1689 HydrophobicContact CE2-CE2 4.44Å
1397	V	88.1	Confident	88.2	Confident	32 Å²	32	27.9 Å²	27.9	19%	0.194	14%	0.14	C	C	.	.	H	α-helix	trans	-64.4	-41.2	-177.6	170.3	0	0	0	0	112.4	Y1307 V1311 V1393 V1394 T1400 I1401	Y1307-V1397 HydrophobicContact CE1-CG2 4.09Å; V1311-V1397 HydrophobicContact CG1-CG1 3.81Å; V1311-V1397 HydrophobicContact CG2-CG1 4.13Å; V1393-V1397 WeakPolarHBondContact O-CG2 3.28Å; V1393-V1397 PolarHBondContact O-N 3.42Å; V1393-V1397 VanDerWaalsContact O-N 3.09Å; V1394-V1397 PolarHBondContact O-N 3.45Å; V1397-T1400 PolarHBondContact O-N 3.4Å; V1397-I1401 HydrophobicContact CG1-CD1 3.71Å; V1397-I1401 HydrophobicContact CG1-CG1 4.44Å; V1397-I1401 WeakPolarHBondContact O-CB 3.4Å; V1397-I1401 VanDerWaalsContact O-CG1 3.25Å; V1397-I1401 WeakPolarHBondContact O-CG1 3.4Å; V1397-I1401 PolarHBondContact O-N 2.74Å
1398	Y	88.7	Confident	88.8	Confident	30 Å²	30	32.5 Å²	32.5	12%	0.118	16%	0.164	C	C	.	.	H	α-helix	trans	-70.1	-34	175.2	-70.9	-44.6	0	0	0	113.1	V1311 G1314 L1315 F1388 Y1389 V1394 R1395 F1396 S1402	V1311-Y1398 HydrophobicContact CG1-CD1 4.45Å; V1311-Y1398 HydrophobicContact CG1-CE1 3.75Å; V1311-Y1398 PolarHBondContact O-OH 3.17Å; G1314-Y1398 VanDerWaalsContact CA-OH 3.26Å; G1314-Y1398 WeakPolarHBondContact CA-OH 3.44Å; L1315-Y1398 HydrophobicContact CB-CE1 4.18Å; L1315-Y1398 HydrophobicContact CD1-CE1 4.29Å; L1315-Y1398 PolarHBondContact N-OH 2.88Å; F1388-Y1398 HydrophobicContact CE1-CE2 4.09Å; F1388-Y1398 HydrophobicContact CZ-CE2 4.42Å; Y1389-Y1398 HydrophobicContact CD1-CD2 4.43Å; Y1389-Y1398 AromaticContact CD1-CE2 3.91Å; Y1389-Y1398 HydrophobicContact CD1-CE2 3.91Å; Y1389-Y1398 AromaticContact CE1-CE2 3.71Å; Y1389-Y1398 HydrophobicContact CE1-CE2 3.71Å; V1394-Y1398 HydrophobicContact CG1-CD2 3.58Å; V1394-Y1398 HydrophobicContact CG1-CE2 3.34Å; V1394-Y1398 WeakPolarHBondContact O-CD2 3.31Å; V1394-Y1398 PolarHBondContact O-N 2.73Å; R1395-Y1398 PolarHBondContact O-N 3.32Å; F1396-Y1398 PolarHBondContact O-N 2.78Å; Y1398-S1402 VanDerWaalsContact O-CB 3.31Å; Y1398-S1402 WeakPolarHBondContact O-CB 3.25Å; Y1398-S1402 PolarHBondContact O-N 3Å
1399	N	87.9	Confident	89.1	Confident	20 Å²	20	34.7 Å²	34.7	11%	0.107	18%	0.175	C	C	.	.	H	α-helix	trans	-62.8	-47.1	172.7	-170.3	50.9	0	0	0	111.3	R1395 F1396 S1402 Y1403 Y1689	R1395-N1399 VanDerWaalsContact O-CB 3.24Å; R1395-N1399 WeakPolarHBondContact O-CB 3.4Å; R1395-N1399 PolarHBondContact O-N 2.91Å; F1396-N1399 PolarHBondContact O-N 2.87Å; N1399-S1402 WeakPolarHBondContact O-CB 3.39Å; N1399-S1402 PolarHBondContact O-N 3.03Å; N1399-Y1403 WeakPolarHBondContact O-CB 3.27Å; N1399-Y1403 PolarHBondContact O-N 3.18Å; N1399-Y1689 HydrophobicContact CB-CE1 4.24Å; N1399-Y1689 PolarHBondContact ND2-OH 3.1Å; N1399-Y1689 VanDerWaalsContact ND2-OH 3.15Å
1400	T	88.3	Confident	89.4	Confident	25 Å²	25	31.6 Å²	31.6	15%	0.153	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-43.5	176.8	-63	0	0	0	0	112.4	F1396 V1397 Y1403 I1404 T1529	F1396-T1400 WeakPolarHBondContact O-CB 3.23Å; F1396-T1400 PolarHBondContact O-N 2.98Å; F1396-T1400 PolarHBondContact O-OG1 3.25Å; F1396-T1400 VanDerWaalsContact O-OG1 3.09Å; V1397-T1400 PolarHBondContact O-N 3.4Å; T1400-Y1403 PolarHBondContact O-N 3.47Å; T1400-I1404 HydrophobicContact CG2-CD1 3.84Å; T1400-I1404 WeakPolarHBondContact O-CG1 3.36Å; T1400-I1404 PolarHBondContact O-N 3.13Å; T1400-T1529 HydrophobicContact CG2-CG2 3.77Å; T1400-T1529 WeakPolarHBondContact OG1-CG2 3.45Å
1401	I	88.7	Confident	89.9	Confident	67 Å²	67	29.1 Å²	29.1	34%	0.344	15%	0.153	S	C	.	.	H	α-helix	trans	-64.4	-41.3	175.8	-69.2	166.7	0	0	0	110.8	V1311 V1397 T1405	V1311-I1401 HydrophobicContact CG1-CD1 4.11Å; V1397-I1401 HydrophobicContact CG1-CD1 3.71Å; V1397-I1401 HydrophobicContact CG1-CG1 4.44Å; V1397-I1401 WeakPolarHBondContact O-CB 3.4Å; V1397-I1401 VanDerWaalsContact O-CG1 3.25Å; V1397-I1401 WeakPolarHBondContact O-CG1 3.4Å; V1397-I1401 PolarHBondContact O-N 2.74Å; I1401-T1405 WeakPolarHBondContact O-CB 3.3Å; I1401-T1405 PolarHBondContact O-N 3.45Å; I1401-T1405 PolarHBondContact O-OG1 3.26Å
1402	S	89	Confident	90.3	Very high	12 Å²	12	34 Å²	34	8%	0.084	17%	0.171	C	C	.	.	H	α-helix	trans	-56.5	-50.4	171.3	141.5	0	0	0	0	111.2	Y1398 N1399 I1404 T1405 F1406 W1432 P1697	Y1398-S1402 VanDerWaalsContact O-CB 3.31Å; Y1398-S1402 WeakPolarHBondContact O-CB 3.25Å; Y1398-S1402 PolarHBondContact O-N 3Å; N1399-S1402 WeakPolarHBondContact O-CB 3.39Å; N1399-S1402 PolarHBondContact O-N 3.03Å; S1402-I1404 PolarHBondContact O-N 3.25Å; S1402-T1405 WeakPolarHBondContact O-CB 3.42Å; S1402-T1405 PolarHBondContact O-N 3.18Å; S1402-T1405 VanDerWaalsContact O-N 3.14Å; S1402-F1406 PolarHBondContact O-N 2.93Å; S1402-W1432 WeakPolarHBondContact O-CZ2 3.41Å; S1402-P1697 PolarHBondContact OG-O 2.87Å
1403	Y	90.3	Very high	90.4	Very high	27 Å²	27	34 Å²	34	11%	0.106	17%	0.171	C	C	.	.	H	α-helix	trans	-66	-41.4	-175.1	-165.9	-101.4	0	0	0	112.7	N1399 T1400 T1405 F1406 L1407 F1522	N1399-Y1403 WeakPolarHBondContact O-CB 3.27Å; N1399-Y1403 PolarHBondContact O-N 3.18Å; T1400-Y1403 PolarHBondContact O-N 3.47Å; Y1403-T1405 VanDerWaalsContact C-N 3.32Å; Y1403-T1405 PolarHBondContact O-N 2.94Å; Y1403-F1406 HydrophobicContact CD2-CD1 4.27Å; Y1403-F1406 HydrophobicContact CE2-CD1 4.15Å; Y1403-F1406 HydrophobicContact CE2-CE1 4.35Å; Y1403-F1406 WeakPolarHBondContact O-CB 3.2Å; Y1403-F1406 PolarHBondContact O-N 2.74Å; Y1403-L1407 HydrophobicContact CD1-CD1 3.96Å; Y1403-L1407 HydrophobicContact CD1-CG 4.34Å; Y1403-L1407 HydrophobicContact CE1-CD1 3.7Å; Y1403-L1407 HydrophobicContact CE1-CD2 4.47Å; Y1403-L1407 HydrophobicContact CE1-CG 4.08Å; Y1403-L1407 WeakPolarHBondContact O-CG 3.48Å; Y1403-L1407 PolarHBondContact O-N 2.96Å; Y1403-F1522 WeakPolarHBondContact CE1-O 3.38Å; Y1403-F1522 WeakPolarHBondContact OH-CA 3.29Å; Y1403-F1522 WeakPolarHBondContact OH-CB 3.2Å; Y1403-F1522 PolarHBondContact OH-O 3.21Å
1404	I	91.8	Very high	90.5	Very high	73 Å²	73	33.5 Å²	33.5	37%	0.374	17%	0.168	S	C	.	.	H	α-helix	trans	-63.7	-39	173	-67.9	167.8	0	0	0	110.8	T1400 S1402 L1407 I1408 L1526	T1400-I1404 HydrophobicContact CG2-CD1 3.84Å; T1400-I1404 WeakPolarHBondContact O-CG1 3.36Å; T1400-I1404 PolarHBondContact O-N 3.13Å; S1402-I1404 PolarHBondContact O-N 3.25Å; I1404-L1407 PolarHBondContact O-N 3.06Å; I1404-I1408 HydrophobicContact CG2-CD1 3.87Å; I1404-I1408 VanDerWaalsContact O-CG1 3.27Å; I1404-I1408 WeakPolarHBondContact O-CG1 3.19Å; I1404-I1408 PolarHBondContact O-N 2.78Å; I1404-L1526 HydrophobicContact CG1-CD1 4.24Å
1405	T	91.1	Very high	90.6	Very high	60 Å²	60	40.1 Å²	40.1	37%	0.368	20%	0.202	S	C	.	.	H	α-helix	trans	-64.8	-41.9	175.9	-54.7	0	0	0	0	111.4	I1401 S1402 Y1403 I1408 L1409 W1432	I1401-T1405 WeakPolarHBondContact O-CB 3.3Å; I1401-T1405 PolarHBondContact O-N 3.45Å; I1401-T1405 PolarHBondContact O-OG1 3.26Å; S1402-T1405 WeakPolarHBondContact O-CB 3.42Å; S1402-T1405 PolarHBondContact O-N 3.18Å; S1402-T1405 VanDerWaalsContact O-N 3.14Å; Y1403-T1405 VanDerWaalsContact C-N 3.32Å; Y1403-T1405 PolarHBondContact O-N 2.94Å; T1405-I1408 PolarHBondContact O-N 3.43Å; T1405-L1409 HydrophobicContact CG2-CD1 4.09Å; T1405-L1409 WeakPolarHBondContact O-CB 3.15Å; T1405-L1409 WeakPolarHBondContact O-CG 3.34Å; T1405-L1409 PolarHBondContact O-N 2.91Å; T1405-W1432 HydrophobicContact CG2-CH2 4.23Å
1406	F	92.2	Very high	90.6	Very high	1 Å²	1	42.5 Å²	42.5	0%	0.004	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-49.4	173.1	161.8	-106.9	0	0	0	112.1	S1402 Y1403 I1408 L1409 F1410 V1429 W1432 V1433 L1436 F1522	S1402-F1406 PolarHBondContact O-N 2.93Å; Y1403-F1406 HydrophobicContact CD2-CD1 4.27Å; Y1403-F1406 HydrophobicContact CE2-CD1 4.15Å; Y1403-F1406 HydrophobicContact CE2-CE1 4.35Å; Y1403-F1406 WeakPolarHBondContact O-CB 3.2Å; Y1403-F1406 PolarHBondContact O-N 2.74Å; F1406-I1408 VanDerWaalsContact C-N 3.32Å; F1406-I1408 PolarHBondContact O-N 2.94Å; F1406-L1409 PolarHBondContact O-N 2.8Å; F1406-F1410 HydrophobicContact CE2-CB 4.47Å; F1406-F1410 HydrophobicContact CE2-CD1 4.44Å; F1406-F1410 HydrophobicContact CZ-CD1 4.04Å; F1406-F1410 WeakPolarHBondContact O-CB 3.48Å; F1406-F1410 PolarHBondContact O-N 3.33Å; F1406-V1429 HydrophobicContact CE2-CG1 4.2Å; F1406-W1432 HydrophobicContact CB-CD2 4.21Å; F1406-W1432 HydrophobicContact CB-CG 4.22Å; F1406-W1432 HydrophobicContact CB-CZ2 4.42Å; F1406-W1432 HydrophobicContact CD2-CB 3.87Å; F1406-W1432 AromaticContact CD2-CD1 3.88Å; F1406-W1432 HydrophobicContact CD2-CD2 4.49Å; F1406-W1432 AromaticContact CD2-CG 3.82Å; F1406-W1432 HydrophobicContact CD2-CG 3.82Å; F1406-W1432 HydrophobicContact CE2-CB 4.34Å; F1406-W1432 HydrophobicContact CG-CG 4.32Å; F1406-V1433 HydrophobicContact CE2-CG2 3.7Å; F1406-V1433 HydrophobicContact CZ-CG2 3.93Å; F1406-L1436 HydrophobicContact CD1-CD1 4.43Å; F1406-L1436 HydrophobicContact CE1-CD1 4.12Å; F1406-L1436 HydrophobicContact CZ-CD1 4.2Å; F1406-F1522 HydrophobicContact CE1-CB 4.37Å; F1406-F1522 HydrophobicContact CE1-CD1 4.4Å; F1406-F1522 HydrophobicContact CE1-CD2 4.21Å; F1406-F1522 HydrophobicContact CE1-CG 4.09Å; F1406-F1522 HydrophobicContact CZ-CD2 4.17Å; F1406-F1522 HydrophobicContact CZ-CE2 4.25Å; F1406-F1522 HydrophobicContact CZ-CG 4.5Å
1407	L	92.6	Very high	90.3	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-59.5	-40.8	177.2	-73.2	175.5	0	0	0	112.5	Y1403 I1404 S1411 L1519 F1522 Y1523 L1526	Y1403-L1407 HydrophobicContact CD1-CD1 3.96Å; Y1403-L1407 HydrophobicContact CD1-CG 4.34Å; Y1403-L1407 HydrophobicContact CE1-CD1 3.7Å; Y1403-L1407 HydrophobicContact CE1-CD2 4.47Å; Y1403-L1407 HydrophobicContact CE1-CG 4.08Å; Y1403-L1407 WeakPolarHBondContact O-CG 3.48Å; Y1403-L1407 PolarHBondContact O-N 2.96Å; I1404-L1407 PolarHBondContact O-N 3.06Å; L1407-S1411 VanDerWaalsContact O-CB 3.24Å; L1407-S1411 WeakPolarHBondContact O-CB 3.48Å; L1407-S1411 PolarHBondContact O-N 3.12Å; L1407-S1411 PolarHBondContact O-OG 2.73Å; L1407-L1519 HydrophobicContact CD2-CD1 4.1Å; L1407-F1522 HydrophobicContact CD2-CB 3.74Å; L1407-Y1523 HydrophobicContact CB-CE1 4.4Å; L1407-Y1523 HydrophobicContact CD1-CD1 3.99Å; L1407-Y1523 HydrophobicContact CD1-CE1 4.01Å; L1407-Y1523 HydrophobicContact CD2-CD2 4.22Å; L1407-Y1523 HydrophobicContact CD2-CE2 4.36Å; L1407-Y1523 HydrophobicContact CD2-CG 4.3Å; L1407-L1526 HydrophobicContact CD1-CD1 3.81Å
1408	I	93.2	Very high	90.1	Very high	106 Å²	106	42 Å²	42	54%	0.544	22%	0.217	S	C	.	.	H	α-helix	trans	-65.1	-44.1	176.5	-69.3	166.2	0	0	0	110.8	I1404 T1405 F1406 Y1412	I1404-I1408 HydrophobicContact CG2-CD1 3.87Å; I1404-I1408 VanDerWaalsContact O-CG1 3.27Å; I1404-I1408 WeakPolarHBondContact O-CG1 3.19Å; I1404-I1408 PolarHBondContact O-N 2.78Å; T1405-I1408 PolarHBondContact O-N 3.43Å; F1406-I1408 VanDerWaalsContact C-N 3.32Å; F1406-I1408 PolarHBondContact O-N 2.94Å; I1408-Y1412 WeakPolarHBondContact O-CB 3.41Å; I1408-Y1412 PolarHBondContact O-N 3.18Å
1409	L	92	Very high	89.7	Confident	46 Å²	46	46.8 Å²	46.8	24%	0.241	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-40.2	178.5	-71.8	171.8	0	0	0	112.7	T1405 F1406 Y1412 L1413 V1425 I1428 V1429 W1432	T1405-L1409 HydrophobicContact CG2-CD1 4.09Å; T1405-L1409 WeakPolarHBondContact O-CB 3.15Å; T1405-L1409 WeakPolarHBondContact O-CG 3.34Å; T1405-L1409 PolarHBondContact O-N 2.91Å; F1406-L1409 PolarHBondContact O-N 2.8Å; L1409-Y1412 PolarHBondContact O-N 2.98Å; L1409-L1413 WeakPolarHBondContact O-CB 3.46Å; L1409-L1413 PolarHBondContact O-N 3.46Å; L1409-V1425 HydrophobicContact CD2-CG1 4.28Å; L1409-I1428 HydrophobicContact CD1-CG2 4.22Å; L1409-V1429 HydrophobicContact CB-CG2 4.08Å; L1409-W1432 HydrophobicContact CD1-CZ3 4.14Å
1410	F	93.2	Very high	89.2	Confident	1 Å²	1	46.6 Å²	46.6	0%	0.004	23%	0.234	C	C	.	.	H	α-helix	trans	-71.3	-36.8	177.7	-171.7	-163.3	0	0	0	111.5	F1406 L1413 L1414 V1429 Y1473 L1515 L1519 F1522	F1406-F1410 HydrophobicContact CE2-CB 4.47Å; F1406-F1410 HydrophobicContact CE2-CD1 4.44Å; F1406-F1410 HydrophobicContact CZ-CD1 4.04Å; F1406-F1410 WeakPolarHBondContact O-CB 3.48Å; F1406-F1410 PolarHBondContact O-N 3.33Å; F1410-L1413 HydrophobicContact CD2-CD2 4.28Å; F1410-L1413 WeakPolarHBondContact O-CB 3.4Å; F1410-L1413 PolarHBondContact O-N 3.43Å; F1410-L1414 HydrophobicContact CD2-CD1 3.95Å; F1410-L1414 HydrophobicContact CD2-CG 4.17Å; F1410-L1414 HydrophobicContact CE2-CD1 3.47Å; F1410-L1414 VanDerWaalsContact CE2-CD1 3.47Å; F1410-L1414 HydrophobicContact CE2-CG 3.87Å; F1410-L1414 HydrophobicContact CZ-CD1 3.94Å; F1410-L1414 PolarHBondContact O-N 3.44Å; F1410-V1429 HydrophobicContact CB-CG1 4.16Å; F1410-V1429 HydrophobicContact CB-CG2 4.48Å; F1410-V1429 HydrophobicContact CD2-CG1 4.05Å; F1410-V1429 HydrophobicContact CG-CG1 4.11Å; F1410-Y1473 HydrophobicContact CE1-CD2 4Å; F1410-Y1473 HydrophobicContact CE1-CE2 4.17Å; F1410-Y1473 HydrophobicContact CE2-CD2 4.4Å; F1410-Y1473 AromaticContact CE2-CE2 3.96Å; F1410-Y1473 HydrophobicContact CE2-CE2 3.96Å; F1410-Y1473 AromaticContact CZ-CD2 3.67Å; F1410-Y1473 HydrophobicContact CZ-CD2 3.67Å; F1410-Y1473 AromaticContact CZ-CE2 3.68Å; F1410-Y1473 HydrophobicContact CZ-CE2 3.68Å; F1410-L1515 HydrophobicContact CZ-CB 4.39Å; F1410-L1515 HydrophobicContact CZ-CD2 4.32Å; F1410-L1515 WeakPolarHBondContact CZ-O 2.48Å; F1410-L1519 HydrophobicContact CB-CD1 4.15Å; F1410-L1519 HydrophobicContact CD1-CB 4.09Å; F1410-L1519 HydrophobicContact CD1-CD1 3.63Å; F1410-L1519 HydrophobicContact CD1-CG 4.42Å; F1410-L1519 HydrophobicContact CE1-CB 3.8Å; F1410-L1519 HydrophobicContact CE1-CD1 4.24Å; F1410-L1519 HydrophobicContact CG-CD1 3.99Å; F1410-L1519 HydrophobicContact CZ-CB 4.18Å; F1410-F1522 HydrophobicContact CD1-CD2 4.37Å; F1410-F1522 HydrophobicContact CE1-CD2 4.01Å; F1410-F1522 HydrophobicContact CE1-CE2 4.3Å
1411	S	94.1	Very high	88.7	Confident	16 Å²	16	50.8 Å²	50.8	11%	0.112	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-44.9	170.8	-59	0	0	0	0	112	L1407 L1413 L1414 L1415 Y1523	L1407-S1411 VanDerWaalsContact O-CB 3.24Å; L1407-S1411 WeakPolarHBondContact O-CB 3.48Å; L1407-S1411 PolarHBondContact O-N 3.12Å; L1407-S1411 PolarHBondContact O-OG 2.73Å; S1411-L1413 VanDerWaalsContact C-N 3.34Å; S1411-L1413 PolarHBondContact O-N 2.97Å; S1411-L1414 PolarHBondContact O-N 3.29Å; S1411-L1415 VanDerWaalsContact O-CB 3.31Å; S1411-L1415 WeakPolarHBondContact O-CB 3.11Å; S1411-L1415 VanDerWaalsContact O-CG 3.27Å; S1411-L1415 WeakPolarHBondContact O-CG 3.48Å; S1411-L1415 PolarHBondContact O-N 3.13Å; S1411-Y1523 PolarHBondContact OG-OH 2.79Å
1412	Y	93.2	Very high	88.5	Confident	103 Å²	103	50.1 Å²	50.1	40%	0.404	25%	0.252	S	S	.	.	H	α-helix	trans	-60.8	-42.7	175.5	176.6	-92.8	0	0	0	111.8	I1408 L1409 L1415 V1416 D1417 V1425	I1408-Y1412 WeakPolarHBondContact O-CB 3.41Å; I1408-Y1412 PolarHBondContact O-N 3.18Å; L1409-Y1412 PolarHBondContact O-N 2.98Å; Y1412-L1415 PolarHBondContact O-N 3.2Å; Y1412-V1416 HydrophobicContact CD2-CB 4.12Å; Y1412-V1416 HydrophobicContact CD2-CG2 3.89Å; Y1412-V1416 HydrophobicContact CE2-CB 3.84Å; Y1412-V1416 HydrophobicContact CE2-CG1 3.88Å; Y1412-V1416 HydrophobicContact CE2-CG2 3.87Å; Y1412-V1416 WeakPolarHBondContact O-CB 3.42Å; Y1412-V1416 PolarHBondContact O-N 3.45Å; Y1412-D1417 HydrophobicContact CE1-CB 4.24Å; Y1412-V1425 HydrophobicContact CD1-CG1 4.24Å; Y1412-V1425 HydrophobicContact CE1-CG2 4.27Å
1413	L	91	Very high	88.4	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.031	25%	0.253	C	S	.	.	I	π-helix	trans	-56.7	-51.6	174.8	175.7	63.4	0	0	0	111.5	L1409 F1410 S1411 L1415 D1417 F1418 E1426 V1429	L1409-L1413 WeakPolarHBondContact O-CB 3.46Å; L1409-L1413 PolarHBondContact O-N 3.46Å; F1410-L1413 HydrophobicContact CD2-CD2 4.28Å; F1410-L1413 WeakPolarHBondContact O-CB 3.4Å; F1410-L1413 PolarHBondContact O-N 3.43Å; S1411-L1413 VanDerWaalsContact C-N 3.34Å; S1411-L1413 PolarHBondContact O-N 2.97Å; L1413-L1415 PolarHBondContact O-N 2.74Å; L1413-D1417 CarbonylContact O-C 3.41Å; L1413-D1417 PolarHBondContact O-N 3.33Å; L1413-F1418 WeakPolarHBondContact O-CB 3.25Å; L1413-F1418 PolarHBondContact O-N 3Å; L1413-E1426 HydrophobicContact CD1-CB 3.76Å; L1413-E1426 HydrophobicContact CD1-CG 4.22Å; L1413-E1426 HydrophobicContact CD2-CB 4.14Å; L1413-E1426 HydrophobicContact CD2-CG 4.03Å; L1413-V1429 HydrophobicContact CD2-CB 4.18Å; L1413-V1429 HydrophobicContact CD2-CG1 4.22Å; L1413-V1429 HydrophobicContact CD2-CG2 4.24Å
1414	L	89.8	Confident	88.4	Confident	12 Å²	12	54.6 Å²	54.6	6%	0.063	28%	0.281	C	S	.	.	I	π-helix	trans	-73.7	-23.3	-176.7	-75.8	171.7	0	0	0	114.9	F1410 S1411 F1418 L1515 L1519	F1410-L1414 HydrophobicContact CD2-CD1 3.95Å; F1410-L1414 HydrophobicContact CD2-CG 4.17Å; F1410-L1414 HydrophobicContact CE2-CD1 3.47Å; F1410-L1414 VanDerWaalsContact CE2-CD1 3.47Å; F1410-L1414 HydrophobicContact CE2-CG 3.87Å; F1410-L1414 HydrophobicContact CZ-CD1 3.94Å; F1410-L1414 PolarHBondContact O-N 3.44Å; S1411-L1414 PolarHBondContact O-N 3.29Å; L1414-F1418 HydrophobicContact CD2-CD2 3.84Å; L1414-F1418 HydrophobicContact CD2-CE2 4.06Å; L1414-L1515 HydrophobicContact CD1-CB 4.2Å; L1414-L1515 HydrophobicContact CD2-CB 3.82Å; L1414-L1515 HydrophobicContact CD2-CD1 4.39Å; L1414-L1519 HydrophobicContact CD1-CB 4.03Å; L1414-L1519 HydrophobicContact CD1-CD2 3.87Å
1415	L	89.9	Confident	88.3	Confident	140 Å²	140	52.5 Å²	52.5	73%	0.733	27%	0.272	S	S	*	.	I	π-helix	trans	-94.1	-32.5	-179.4	-68.4	172.6	0	0	0	114.1	S1411 Y1412 L1413	S1411-L1415 VanDerWaalsContact O-CB 3.31Å; S1411-L1415 WeakPolarHBondContact O-CB 3.11Å; S1411-L1415 VanDerWaalsContact O-CG 3.27Å; S1411-L1415 WeakPolarHBondContact O-CG 3.48Å; S1411-L1415 PolarHBondContact O-N 3.13Å; Y1412-L1415 PolarHBondContact O-N 3.2Å; L1413-L1415 PolarHBondContact O-N 2.74Å
1416	V	87.7	Confident	88.3	Confident	87 Å²	87	49.9 Å²	49.9	53%	0.527	26%	0.255	S	S	.	.	I	π-helix	trans	-121.7	-43.8	-168.1	-175.1	0	0	0	0	113.3	Y1412	Y1412-V1416 HydrophobicContact CD2-CB 4.12Å; Y1412-V1416 HydrophobicContact CD2-CG2 3.89Å; Y1412-V1416 HydrophobicContact CE2-CB 3.84Å; Y1412-V1416 HydrophobicContact CE2-CG1 3.88Å; Y1412-V1416 HydrophobicContact CE2-CG2 3.87Å; Y1412-V1416 WeakPolarHBondContact O-CB 3.42Å; Y1412-V1416 PolarHBondContact O-N 3.45Å
1417	D	84.3	Confident	88.2	Confident	22 Å²	22	56.7 Å²	56.7	12%	0.118	28%	0.282	C	S	.	.	I	π-helix	trans	-117.2	18.8	-167.3	-104.8	-25.5	0	0	0	114.6	Y1412 L1413 R1419 T1423	Y1412-D1417 HydrophobicContact CE1-CB 4.24Å; L1413-D1417 CarbonylContact O-C 3.41Å; L1413-D1417 PolarHBondContact O-N 3.33Å; D1417-R1419 VanDerWaalsContact C-N 3.26Å; D1417-R1419 PolarHBondContact O-N 3.07Å; D1417-R1419 IonicContact OD1-CZ 3.21Å; D1417-R1419 IonicContact OD1-NE 2.82Å; D1417-R1419 PolarHBondContact OD1-NE 3.36Å; D1417-R1419 IonicContact OD1-NH2 3.43Å; D1417-R1419 PolarHBondContact OD1-NH2 2.77Å; D1417-T1423 HydrophobicContact CB-CG2 4.27Å; D1417-T1423 VanDerWaalsContact O-CG2 3.31Å; D1417-T1423 WeakPolarHBondContact O-CG2 3.49Å
1418	F	83.5	Confident	88.1	Confident	25 Å²	25	60.2 Å²	60.2	11%	0.11	30%	0.3	C	S	.	.			trans	-74	76.5	173.5	-164.7	-100.6	0	0	0	111.2	L1413 L1414 L1508 R1512 L1515	L1413-F1418 WeakPolarHBondContact O-CB 3.25Å; L1413-F1418 PolarHBondContact O-N 3Å; L1414-F1418 HydrophobicContact CD2-CD2 3.84Å; L1414-F1418 HydrophobicContact CD2-CE2 4.06Å; F1418-L1508 HydrophobicContact CE1-CD1 4.08Å; F1418-L1508 HydrophobicContact CE1-CD2 4.47Å; F1418-L1508 HydrophobicContact CE1-CG 4.27Å; F1418-L1508 HydrophobicContact CZ-CD1 4.37Å; F1418-R1512 HydrophobicContact CD1-CG 4.4Å; F1418-R1512 HydrophobicContact CE1-CB 4.05Å; F1418-R1512 HydrophobicContact CE1-CG 4.1Å; F1418-R1512 HydrophobicContact CZ-CB 4.23Å; F1418-R1512 HydrophobicContact CZ-CG 4.44Å; F1418-L1515 HydrophobicContact CE2-CD1 3.7Å; F1418-L1515 HydrophobicContact CZ-CD1 4.23Å
1419	R	79.6	Confident	88.1	Confident	131 Å²	131	55.2 Å²	55.2	49%	0.494	27%	0.274	S	S	.	.			trans	-95.3	173.9	178.7	-56.7	178.6	-163.8	-123.4	1.7	110.8	D1417 R1480	D1417-R1419 VanDerWaalsContact C-N 3.26Å; D1417-R1419 PolarHBondContact O-N 3.07Å; D1417-R1419 IonicContact OD1-CZ 3.21Å; D1417-R1419 IonicContact OD1-NE 2.82Å; D1417-R1419 PolarHBondContact OD1-NE 3.36Å; D1417-R1419 IonicContact OD1-NH2 3.43Å; D1417-R1419 PolarHBondContact OD1-NH2 2.77Å; R1419-R1480 PolarHBondContact O-NH1 3.47Å; R1419-R1480 PolarHBondContact O-NH2 2.86Å
1420	I	76.7	Confident	88	Confident	16 Å²	16	54.2 Å²	54.2	8%	0.082	27%	0.269	C	S	.	.	S	Bend	trans	-66.1	-41	170.8	-68.2	179.2	0	0	0	110.6	L1484 L1487 F1493 E1498 I1502	I1420-L1484 VanDerWaalsContact O-CD2 3.24Å; I1420-L1484 WeakPolarHBondContact O-CD2 3.43Å; I1420-L1487 HydrophobicContact CD1-CD1 4.04Å; I1420-L1487 HydrophobicContact CG1-CD1 4.41Å; I1420-L1487 HydrophobicContact CG2-CD1 3.57Å; I1420-F1493 HydrophobicContact CD1-CE1 3.68Å; I1420-F1493 HydrophobicContact CD1-CZ 3.55Å; I1420-E1498 HydrophobicContact CD1-CG 3.92Å; I1420-E1498 HydrophobicContact CG1-CG 4.27Å; I1420-I1502 HydrophobicContact CD1-CG1 4.29Å; I1420-I1502 HydrophobicContact CG1-CD1 4.23Å; I1420-I1502 HydrophobicContact CG1-CG1 4.05Å
1421	N	79.3	Confident	87.8	Confident	113 Å²	113	56.3 Å²	56.3	60%	0.604	29%	0.287	S	S	*	.	S	Bend	trans	-79.1	141.6	176.7	-66.1	-70	0	0	0	112.3	T1423	N1421-T1423 PolarHBondContact O-N 2.69Å
1422	I	84.3	Confident	87.7	Confident	52 Å²	52	56.8 Å²	56.8	27%	0.267	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-65	123.1	175.5	-56.8	178.7	0	0	0	110	E1426 Y1427 L1484	I1422-E1426 WeakPolarHBondContact CA-OE2 3.35Å; I1422-E1426 HydrophobicContact CG2-CB 4.08Å; I1422-E1426 HydrophobicContact CG2-CG 3.98Å; I1422-Y1427 HydrophobicContact CB-CE2 4.09Å; I1422-Y1427 HydrophobicContact CG2-CD1 4.29Å; I1422-Y1427 HydrophobicContact CG2-CD2 3.76Å; I1422-Y1427 HydrophobicContact CG2-CE1 4.05Å; I1422-Y1427 HydrophobicContact CG2-CE2 3.49Å; I1422-Y1427 VanDerWaalsContact CG2-CE2 3.49Å; I1422-Y1427 HydrophobicContact CG2-CG 4.15Å; I1422-L1484 HydrophobicContact CD1-CD1 3.9Å; I1422-L1484 HydrophobicContact CG1-CD1 3.79Å
1423	T	87.1	Confident	87.6	Confident	18 Å²	18	52.2 Å²	52.2	11%	0.11	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-89.4	163.9	-177.9	71.2	0	0	0	0	113.1	D1417 N1421 V1425 E1426 Y1427	D1417-T1423 HydrophobicContact CB-CG2 4.27Å; D1417-T1423 VanDerWaalsContact O-CG2 3.31Å; D1417-T1423 WeakPolarHBondContact O-CG2 3.49Å; N1421-T1423 PolarHBondContact O-N 2.69Å; T1423-V1425 VanDerWaalsContact C-N 3.27Å; T1423-V1425 PolarHBondContact O-N 2.85Å; T1423-E1426 PolarHBondContact N-OE2 2.86Å; T1423-E1426 WeakPolarHBondContact O-CB 3.37Å; T1423-E1426 PolarHBondContact O-N 3.27Å; T1423-E1426 VanDerWaalsContact O-N 3.13Å; T1423-E1426 WeakPolarHBondContact OG1-CB 3.26Å; T1423-E1426 PolarHBondContact OG1-N 3.09Å; T1423-E1426 VanDerWaalsContact OG1-N 3.09Å; T1423-Y1427 VanDerWaalsContact O-CD2 3.24Å; T1423-Y1427 WeakPolarHBondContact O-CD2 3.47Å; T1423-Y1427 PolarHBondContact O-N 2.75Å
1424	V	89.3	Confident	87.5	Confident	115 Å²	115	56 Å²	56	70%	0.697	29%	0.288	S	S	*	.	H	α-helix	trans	-63.2	-34.8	175	-178.6	0	0	0	0	111.6	E1426 Y1427 I1428	V1424-E1426 VanDerWaalsContact C-N 3.34Å; V1424-Y1427 PolarHBondContact O-N 3Å; V1424-I1428 HydrophobicContact CG1-CD1 4.47Å; V1424-I1428 WeakPolarHBondContact O-CG1 3.14Å; V1424-I1428 PolarHBondContact O-N 3.38Å
1425	V	91	Very high	87.5	Confident	30 Å²	30	55.6 Å²	55.6	18%	0.182	29%	0.286	C	S	.	.	H	α-helix	trans	-66.7	-39.6	173.5	-179.1	0	0	0	0	110.5	L1409 Y1412 T1423 I1428 V1429	L1409-V1425 HydrophobicContact CD2-CG1 4.28Å; Y1412-V1425 HydrophobicContact CD1-CG1 4.24Å; Y1412-V1425 HydrophobicContact CE1-CG2 4.27Å; T1423-V1425 VanDerWaalsContact C-N 3.27Å; T1423-V1425 PolarHBondContact O-N 2.85Å; V1425-I1428 WeakPolarHBondContact O-CB 3.47Å; V1425-I1428 PolarHBondContact O-N 2.99Å; V1425-I1428 VanDerWaalsContact O-N 3.14Å; V1425-V1429 HydrophobicContact CG1-CG2 4.43Å; V1425-V1429 WeakPolarHBondContact O-CG2 3.46Å; V1425-V1429 PolarHBondContact O-N 3.38Å
1426	E	90.5	Very high	87.4	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.019	26%	0.255	C	S	.	.	H	α-helix	trans	-62.3	-44.3	175.1	-170	176.4	166.8	0	0	112.5	L1413 I1422 T1423 V1424 I1428 V1429 I1430 R1480	L1413-E1426 HydrophobicContact CD1-CB 3.76Å; L1413-E1426 HydrophobicContact CD1-CG 4.22Å; L1413-E1426 HydrophobicContact CD2-CB 4.14Å; L1413-E1426 HydrophobicContact CD2-CG 4.03Å; I1422-E1426 WeakPolarHBondContact CA-OE2 3.35Å; I1422-E1426 HydrophobicContact CG2-CB 4.08Å; I1422-E1426 HydrophobicContact CG2-CG 3.98Å; T1423-E1426 PolarHBondContact N-OE2 2.86Å; T1423-E1426 WeakPolarHBondContact O-CB 3.37Å; T1423-E1426 PolarHBondContact O-N 3.27Å; T1423-E1426 VanDerWaalsContact O-N 3.13Å; T1423-E1426 WeakPolarHBondContact OG1-CB 3.26Å; T1423-E1426 PolarHBondContact OG1-N 3.09Å; T1423-E1426 VanDerWaalsContact OG1-N 3.09Å; V1424-E1426 VanDerWaalsContact C-N 3.34Å; E1426-I1428 PolarHBondContact O-N 2.92Å; E1426-V1429 PolarHBondContact O-N 3.43Å; E1426-V1429 VanDerWaalsContact O-N 3.14Å; E1426-I1430 HydrophobicContact CG-CD1 3.82Å; E1426-I1430 HydrophobicContact CG-CG1 4.34Å; E1426-I1430 WeakPolarHBondContact O-CB 3.15Å; E1426-I1430 VanDerWaalsContact O-CG1 3.26Å; E1426-I1430 WeakPolarHBondContact O-CG1 3.11Å; E1426-I1430 PolarHBondContact O-N 3.1Å; E1426-R1480 VanDerWaalsContact CD-NH2 3.33Å; E1426-R1480 IonicContact OE1-CZ 3.21Å; E1426-R1480 IonicContact OE1-NE 3.88Å; E1426-R1480 PolarHBondContact OE1-NE 3.12Å; E1426-R1480 IonicContact OE1-NH2 2.73Å; E1426-R1480 PolarHBondContact OE1-NH2 3.24Å; E1426-R1480 IonicContact OE2-CZ 2.74Å; E1426-R1480 IonicContact OE2-NE 3.38Å; E1426-R1480 IonicContact OE2-NH2 3.74Å; E1426-R1480 PolarHBondContact OE2-NH2 3.05Å
1427	Y	90	Very high	87.4	Confident	145 Å²	145	49.9 Å²	49.9	57%	0.569	25%	0.249	S	C	*	.	H	α-helix	trans	-57.6	-36.2	171.9	-79	-68.4	0	0	0	112.8	I1422 T1423 V1424 A1431	I1422-Y1427 HydrophobicContact CB-CE2 4.09Å; I1422-Y1427 HydrophobicContact CG2-CD1 4.29Å; I1422-Y1427 HydrophobicContact CG2-CD2 3.76Å; I1422-Y1427 HydrophobicContact CG2-CE1 4.05Å; I1422-Y1427 HydrophobicContact CG2-CE2 3.49Å; I1422-Y1427 VanDerWaalsContact CG2-CE2 3.49Å; I1422-Y1427 HydrophobicContact CG2-CG 4.15Å; T1423-Y1427 VanDerWaalsContact O-CD2 3.24Å; T1423-Y1427 WeakPolarHBondContact O-CD2 3.47Å; T1423-Y1427 PolarHBondContact O-N 2.75Å; V1424-Y1427 PolarHBondContact O-N 3Å; Y1427-A1431 VanDerWaalsContact O-CB 3.28Å; Y1427-A1431 WeakPolarHBondContact O-CB 3.46Å; Y1427-A1431 PolarHBondContact O-N 3.12Å
1428	I	91.3	Very high	87.5	Confident	76 Å²	76	51.7 Å²	51.7	39%	0.39	26%	0.258	S	S	.	.	H	α-helix	trans	-69.1	-43.8	175.3	-67.2	164.4	0	0	0	110.9	L1409 V1424 V1425 E1426 A1431 W1432	L1409-I1428 HydrophobicContact CD1-CG2 4.22Å; V1424-I1428 HydrophobicContact CG1-CD1 4.47Å; V1424-I1428 WeakPolarHBondContact O-CG1 3.14Å; V1424-I1428 PolarHBondContact O-N 3.38Å; V1425-I1428 WeakPolarHBondContact O-CB 3.47Å; V1425-I1428 PolarHBondContact O-N 2.99Å; V1425-I1428 VanDerWaalsContact O-N 3.14Å; E1426-I1428 PolarHBondContact O-N 2.92Å; I1428-A1431 PolarHBondContact O-N 3.35Å; I1428-W1432 HydrophobicContact CG2-CE3 4.02Å; I1428-W1432 HydrophobicContact CG2-CZ3 4.28Å; I1428-W1432 WeakPolarHBondContact O-CB 3.34Å; I1428-W1432 PolarHBondContact O-N 3.18Å
1429	V	91.6	Very high	87.6	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	25%	0.253	C	S	.	.	H	α-helix	trans	-65.6	-45.1	177.8	173.3	0	0	0	0	111.1	F1406 L1409 F1410 L1413 V1425 E1426 A1431 W1432 V1433 Y1473	F1406-V1429 HydrophobicContact CE2-CG1 4.2Å; L1409-V1429 HydrophobicContact CB-CG2 4.08Å; F1410-V1429 HydrophobicContact CB-CG1 4.16Å; F1410-V1429 HydrophobicContact CB-CG2 4.48Å; F1410-V1429 HydrophobicContact CD2-CG1 4.05Å; F1410-V1429 HydrophobicContact CG-CG1 4.11Å; L1413-V1429 HydrophobicContact CD2-CB 4.18Å; L1413-V1429 HydrophobicContact CD2-CG1 4.22Å; L1413-V1429 HydrophobicContact CD2-CG2 4.24Å; V1425-V1429 HydrophobicContact CG1-CG2 4.43Å; V1425-V1429 WeakPolarHBondContact O-CG2 3.46Å; V1425-V1429 PolarHBondContact O-N 3.38Å; E1426-V1429 PolarHBondContact O-N 3.43Å; E1426-V1429 VanDerWaalsContact O-N 3.14Å; V1429-A1431 PolarHBondContact O-N 2.59Å; V1429-W1432 WeakPolarHBondContact O-CA 3.43Å; V1429-W1432 WeakPolarHBondContact O-CB 3.15Å; V1429-W1432 PolarHBondContact O-N 3.11Å; V1429-W1432 VanDerWaalsContact O-N 3.09Å; V1429-V1433 WeakPolarHBondContact O-CG2 3.47Å; V1429-V1433 PolarHBondContact O-N 2.86Å; V1429-Y1473 HydrophobicContact CG1-CE2 4.41Å
1430	I	90.1	Very high	87.9	Confident	25 Å²	25	44.8 Å²	44.8	13%	0.128	23%	0.232	C	C	.	.	H	α-helix	trans	-57.8	-48.3	174.8	-69.1	164.6	0	0	0	110.2	E1426 W1432 V1433 I1434 Y1473 F1477	E1426-I1430 HydrophobicContact CG-CD1 3.82Å; E1426-I1430 HydrophobicContact CG-CG1 4.34Å; E1426-I1430 WeakPolarHBondContact O-CB 3.15Å; E1426-I1430 VanDerWaalsContact O-CG1 3.26Å; E1426-I1430 WeakPolarHBondContact O-CG1 3.11Å; E1426-I1430 PolarHBondContact O-N 3.1Å; I1430-W1432 VanDerWaalsContact C-N 3.26Å; I1430-W1432 PolarHBondContact O-N 2.88Å; I1430-V1433 PolarHBondContact O-N 3.33Å; I1430-I1434 HydrophobicContact CG2-CD1 3.75Å; I1430-I1434 HydrophobicContact CG2-CG1 4.45Å; I1430-I1434 WeakPolarHBondContact O-CB 3.19Å; I1430-I1434 VanDerWaalsContact O-CG1 3.29Å; I1430-I1434 WeakPolarHBondContact O-CG1 3.34Å; I1430-I1434 PolarHBondContact O-N 3.38Å; I1430-Y1473 WeakPolarHBondContact CG1-OH 3.16Å; I1430-F1477 HydrophobicContact CD1-CD2 4.39Å; I1430-F1477 HydrophobicContact CD1-CE2 3.56Å; I1430-F1477 HydrophobicContact CD1-CZ 4.12Å; I1430-F1477 HydrophobicContact CG1-CE2 4.08Å
1431	A	89.8	Confident	88.2	Confident	45 Å²	45	48 Å²	48	37%	0.372	25%	0.248	S	C	.	.	H	α-helix	trans	-60.2	-36.9	176.2	0	0	0	0	0	112.1	Y1427 I1428 V1429 T1435	Y1427-A1431 VanDerWaalsContact O-CB 3.28Å; Y1427-A1431 WeakPolarHBondContact O-CB 3.46Å; Y1427-A1431 PolarHBondContact O-N 3.12Å; I1428-A1431 PolarHBondContact O-N 3.35Å; V1429-A1431 PolarHBondContact O-N 2.59Å; A1431-T1435 WeakPolarHBondContact O-CG2 3.2Å; A1431-T1435 PolarHBondContact O-N 3.21Å
1432	W	91.8	Very high	88.2	Confident	26 Å²	26	45.3 Å²	45.3	10%	0.098	23%	0.231	C	C	.	.	H	α-helix	trans	-66	-47.2	175.5	-138.1	-65.4	0	0	0	112.1	S1402 T1405 F1406 L1409 I1428 V1429 I1430 I1434 T1435 L1436 P1698	S1402-W1432 WeakPolarHBondContact O-CZ2 3.41Å; T1405-W1432 HydrophobicContact CG2-CH2 4.23Å; F1406-W1432 HydrophobicContact CB-CD2 4.21Å; F1406-W1432 HydrophobicContact CB-CG 4.22Å; F1406-W1432 HydrophobicContact CB-CZ2 4.42Å; F1406-W1432 HydrophobicContact CD2-CB 3.87Å; F1406-W1432 AromaticContact CD2-CD1 3.88Å; F1406-W1432 HydrophobicContact CD2-CD2 4.49Å; F1406-W1432 AromaticContact CD2-CG 3.82Å; F1406-W1432 HydrophobicContact CD2-CG 3.82Å; F1406-W1432 HydrophobicContact CE2-CB 4.34Å; F1406-W1432 HydrophobicContact CG-CG 4.32Å; L1409-W1432 HydrophobicContact CD1-CZ3 4.14Å; I1428-W1432 HydrophobicContact CG2-CE3 4.02Å; I1428-W1432 HydrophobicContact CG2-CZ3 4.28Å; I1428-W1432 WeakPolarHBondContact O-CB 3.34Å; I1428-W1432 PolarHBondContact O-N 3.18Å; V1429-W1432 WeakPolarHBondContact O-CA 3.43Å; V1429-W1432 WeakPolarHBondContact O-CB 3.15Å; V1429-W1432 PolarHBondContact O-N 3.11Å; V1429-W1432 VanDerWaalsContact O-N 3.09Å; I1430-W1432 VanDerWaalsContact C-N 3.26Å; I1430-W1432 PolarHBondContact O-N 2.88Å; W1432-I1434 VanDerWaalsContact C-N 3.33Å; W1432-I1434 PolarHBondContact O-N 3.23Å; W1432-T1435 PolarHBondContact O-N 2.68Å; W1432-T1435 PolarHBondContact O-OG1 3.34Å; W1432-L1436 PolarHBondContact O-N 3.13Å; W1432-P1698 HydrophobicContact CD2-CB 4.44Å; W1432-P1698 HydrophobicContact CD2-CG 4.41Å; W1432-P1698 HydrophobicContact CE3-CG 4.17Å; W1432-P1698 HydrophobicContact CZ3-CG 4.26Å
1433	V	91	Very high	88	Confident	8 Å²	8	45.6 Å²	45.6	5%	0.048	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-39.4	177.4	178	0	0	0	0	111.1	F1406 V1429 I1430 T1435 L1436 F1437 L1470 Y1473	F1406-V1433 HydrophobicContact CE2-CG2 3.7Å; F1406-V1433 HydrophobicContact CZ-CG2 3.93Å; V1429-V1433 WeakPolarHBondContact O-CG2 3.47Å; V1429-V1433 PolarHBondContact O-N 2.86Å; I1430-V1433 PolarHBondContact O-N 3.33Å; V1433-T1435 VanDerWaalsContact C-N 3.29Å; V1433-T1435 PolarHBondContact O-N 2.83Å; V1433-L1436 PolarHBondContact O-N 2.95Å; V1433-F1437 WeakPolarHBondContact O-CB 3.37Å; V1433-F1437 PolarHBondContact O-N 3.03Å; V1433-L1470 HydrophobicContact CG1-CD2 3.8Å; V1433-Y1473 HydrophobicContact CB-CD1 4.32Å; V1433-Y1473 HydrophobicContact CB-CE1 4.06Å; V1433-Y1473 HydrophobicContact CG1-CD1 3.7Å; V1433-Y1473 HydrophobicContact CG1-CE1 3.92Å; V1433-Y1473 HydrophobicContact CG1-CG 4.09Å; V1433-Y1473 HydrophobicContact CG2-CD1 4.35Å; V1433-Y1473 HydrophobicContact CG2-CD2 4.14Å; V1433-Y1473 HydrophobicContact CG2-CE1 4.07Å; V1433-Y1473 HydrophobicContact CG2-CE2 3.86Å; V1433-Y1473 HydrophobicContact CG2-CG 4.38Å
1434	I	89.3	Confident	87.6	Confident	85 Å²	85	46.9 Å²	46.9	44%	0.436	24%	0.237	S	C	.	.	H	α-helix	trans	-59.3	-40.5	171.4	-69.4	167.4	0	0	0	110.9	I1430 W1432 L1436 F1437 I1438	I1430-I1434 HydrophobicContact CG2-CD1 3.75Å; I1430-I1434 HydrophobicContact CG2-CG1 4.45Å; I1430-I1434 WeakPolarHBondContact O-CB 3.19Å; I1430-I1434 VanDerWaalsContact O-CG1 3.29Å; I1430-I1434 WeakPolarHBondContact O-CG1 3.34Å; I1430-I1434 PolarHBondContact O-N 3.38Å; W1432-I1434 VanDerWaalsContact C-N 3.33Å; W1432-I1434 PolarHBondContact O-N 3.23Å; I1434-L1436 PolarHBondContact O-N 3.29Å; I1434-F1437 PolarHBondContact O-N 2.98Å; I1434-I1438 HydrophobicContact CG2-CD1 3.79Å; I1434-I1438 HydrophobicContact CG2-CG1 4.5Å; I1434-I1438 WeakPolarHBondContact O-CB 3.27Å; I1434-I1438 WeakPolarHBondContact O-CD1 2.97Å; I1434-I1438 VanDerWaalsContact O-CG1 3.25Å; I1434-I1438 WeakPolarHBondContact O-CG1 3.12Å; I1434-I1438 PolarHBondContact O-N 3.11Å
1435	T	88.9	Confident	86.9	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-69.3	-30.9	177.2	68.3	0	0	0	0	113.6	A1431 W1432 V1433 E1439 P1698 I1701	A1431-T1435 WeakPolarHBondContact O-CG2 3.2Å; A1431-T1435 PolarHBondContact O-N 3.21Å; W1432-T1435 PolarHBondContact O-N 2.68Å; W1432-T1435 PolarHBondContact O-OG1 3.34Å; V1433-T1435 VanDerWaalsContact C-N 3.29Å; V1433-T1435 PolarHBondContact O-N 2.83Å; T1435-E1439 PolarHBondContact O-N 3.45Å; T1435-P1698 HydrophobicContact CG2-CB 3.81Å; T1435-P1698 WeakPolarHBondContact CG2-O 3.35Å; T1435-I1701 HydrophobicContact CG2-CD1 3.43Å; T1435-I1701 VanDerWaalsContact CG2-CD1 3.43Å; T1435-I1701 HydrophobicContact CG2-CG1 3.86Å
1436	L	87.6	Confident	86	Confident	16 Å²	16	47.8 Å²	47.8	8%	0.084	23%	0.234	C	C	.	.	H	α-helix	trans	-71	-47.6	172.6	-67.1	171.8	0	0	0	110.6	F1406 W1432 V1433 I1434 I1438 E1439 E1440 P1697	F1406-L1436 HydrophobicContact CD1-CD1 4.43Å; F1406-L1436 HydrophobicContact CE1-CD1 4.12Å; F1406-L1436 HydrophobicContact CZ-CD1 4.2Å; W1432-L1436 PolarHBondContact O-N 3.13Å; V1433-L1436 PolarHBondContact O-N 2.95Å; I1434-L1436 PolarHBondContact O-N 3.29Å; L1436-I1438 VanDerWaalsContact C-N 3.29Å; L1436-I1438 PolarHBondContact O-N 3.46Å; L1436-E1439 WeakPolarHBondContact O-CA 3.17Å; L1436-E1439 WeakPolarHBondContact O-CB 3.23Å; L1436-E1439 PolarHBondContact O-N 3.36Å; L1436-E1440 PolarHBondContact O-N 2.94Å; L1436-P1697 HydrophobicContact CD2-CB 4.43Å; L1436-P1697 HydrophobicContact CD2-CG 3.95Å
1437	F	88.3	Confident	84.9	Confident	92 Å²	92	48.1 Å²	48.1	40%	0.404	24%	0.238	S	C	.	.	H	α-helix	trans	-57.3	-40	176.7	-174.3	-120.7	0	0	0	112.4	V1433 I1434 E1440 I1441 L1470 I1474	V1433-F1437 WeakPolarHBondContact O-CB 3.37Å; V1433-F1437 PolarHBondContact O-N 3.03Å; I1434-F1437 PolarHBondContact O-N 2.98Å; F1437-E1440 PolarHBondContact O-N 3.27Å; F1437-I1441 HydrophobicContact CD1-CD1 3.75Å; F1437-I1441 HydrophobicContact CD2-CD1 4.38Å; F1437-I1441 HydrophobicContact CE1-CD1 3.49Å; F1437-I1441 VanDerWaalsContact CE1-CD1 3.49Å; F1437-I1441 HydrophobicContact CE2-CD1 4.15Å; F1437-I1441 HydrophobicContact CG-CD1 4.2Å; F1437-I1441 HydrophobicContact CZ-CD1 3.71Å; F1437-I1441 WeakPolarHBondContact O-CB 3.37Å; F1437-I1441 VanDerWaalsContact O-CG1 3.28Å; F1437-I1441 WeakPolarHBondContact O-CG1 3.43Å; F1437-I1441 PolarHBondContact O-N 3.24Å; F1437-L1470 HydrophobicContact CB-CD2 4.44Å; F1437-L1470 HydrophobicContact CD2-CD1 4.47Å; F1437-I1474 HydrophobicContact CE2-CD1 4.36Å
1438	I	87.1	Confident	84	Confident	60 Å²	60	45.1 Å²	45.1	31%	0.308	23%	0.234	S	C	.	.	H	α-helix	trans	-66.2	-37	173.6	-70	166.2	0	0	0	112.1	I1434 L1436 K1442 I1701	I1434-I1438 HydrophobicContact CG2-CD1 3.79Å; I1434-I1438 HydrophobicContact CG2-CG1 4.5Å; I1434-I1438 WeakPolarHBondContact O-CB 3.27Å; I1434-I1438 WeakPolarHBondContact O-CD1 2.97Å; I1434-I1438 VanDerWaalsContact O-CG1 3.25Å; I1434-I1438 WeakPolarHBondContact O-CG1 3.12Å; I1434-I1438 PolarHBondContact O-N 3.11Å; L1436-I1438 VanDerWaalsContact C-N 3.29Å; L1436-I1438 PolarHBondContact O-N 3.46Å; I1438-K1442 VanDerWaalsContact O-CB 3.28Å; I1438-K1442 WeakPolarHBondContact O-CB 3.37Å; I1438-K1442 PolarHBondContact O-N 2.85Å; I1438-I1701 HydrophobicContact CD1-CD1 4.1Å; I1438-I1701 HydrophobicContact CD1-CG1 4.39Å
1439	E	84.6	Confident	82.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-71.5	-34.5	178.1	176.8	68.1	168.4	0	0	112.2	T1435 L1436 K1442 Q1443 R1692 I1700 H1704	T1435-E1439 PolarHBondContact O-N 3.45Å; L1436-E1439 WeakPolarHBondContact O-CA 3.17Å; L1436-E1439 WeakPolarHBondContact O-CB 3.23Å; L1436-E1439 PolarHBondContact O-N 3.36Å; E1439-K1442 PolarHBondContact O-N 2.98Å; E1439-K1442 IonicContact OE1-NZ 2.7Å; E1439-K1442 PolarHBondContact OE1-NZ 3.3Å; E1439-K1442 VanDerWaalsContact OE1-NZ 3.08Å; E1439-K1442 VanDerWaalsContact OE2-CE 3.27Å; E1439-K1442 WeakPolarHBondContact OE2-CE 3.44Å; E1439-K1442 IonicContact OE2-NZ 3.3Å; E1439-K1442 PolarHBondContact OE2-NZ 3.25Å; E1439-Q1443 WeakPolarHBondContact O-CG 3.42Å; E1439-Q1443 PolarHBondContact O-N 2.85Å; E1439-Q1443 PolarHBondContact O-NE2 3.07Å; E1439-Q1443 VanDerWaalsContact O-NE2 3.12Å; E1439-R1692 VanDerWaalsContact CG-NH2 3.29Å; E1439-R1692 VanDerWaalsContact OE1-CG 3.25Å; E1439-R1692 WeakPolarHBondContact OE1-CG 3.16Å; E1439-R1692 IonicContact OE1-CZ 2.76Å; E1439-R1692 IonicContact OE1-NE 3.45Å; E1439-R1692 PolarHBondContact OE1-NE 3.04Å; E1439-R1692 IonicContact OE1-NH2 3.01Å; E1439-I1700 HydrophobicContact CB-CD1 4.31Å; E1439-I1700 VanDerWaalsContact CD-CD1 3.47Å; E1439-I1700 HydrophobicContact CG-CD1 4.06Å; E1439-I1700 WeakPolarHBondContact OE2-CD1 2.96Å; E1439-H1704 IonicContact OE2-CE1 3.89Å; E1439-H1704 PolarHBondContact OE2-CE1 3.25Å; E1439-H1704 IonicContact OE2-NE2 2.62Å
1440	E	85.3	Confident	81	Confident	10 Å²	10	47.8 Å²	47.8	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-73	-42.8	171.9	-57.6	-41.1	125.7	0	0	111.6	L1436 F1437 K1442 Q1443 I1444 L1470 R1692	L1436-E1440 PolarHBondContact O-N 2.94Å; F1437-E1440 PolarHBondContact O-N 3.27Å; E1440-K1442 PolarHBondContact O-N 2.95Å; E1440-Q1443 WeakPolarHBondContact O-CB 3.47Å; E1440-Q1443 PolarHBondContact O-N 3.3Å; E1440-Q1443 PolarHBondContact OE1-NE2 3.15Å; E1440-Q1443 PolarHBondContact OE2-NE2 3.49Å; E1440-I1444 WeakPolarHBondContact O-CG1 3.49Å; E1440-I1444 PolarHBondContact O-N 2.87Å; E1440-L1470 HydrophobicContact CG-CD1 4.11Å; E1440-R1692 IonicContact OE1-NH2 2.74Å
1441	I	83.2	Confident	79.4	Confident	83 Å²	83	49.7 Å²	49.7	43%	0.426	28%	0.277	S	S	.	.	H	α-helix	trans	-56.4	-40.4	169.7	-74.7	169.2	0	0	0	110.9	F1437 I1444 A1445	F1437-I1441 HydrophobicContact CD1-CD1 3.75Å; F1437-I1441 HydrophobicContact CD2-CD1 4.38Å; F1437-I1441 HydrophobicContact CE1-CD1 3.49Å; F1437-I1441 VanDerWaalsContact CE1-CD1 3.49Å; F1437-I1441 HydrophobicContact CE2-CD1 4.15Å; F1437-I1441 HydrophobicContact CG-CD1 4.2Å; F1437-I1441 HydrophobicContact CZ-CD1 3.71Å; F1437-I1441 WeakPolarHBondContact O-CB 3.37Å; F1437-I1441 VanDerWaalsContact O-CG1 3.28Å; F1437-I1441 WeakPolarHBondContact O-CG1 3.43Å; F1437-I1441 PolarHBondContact O-N 3.24Å; I1441-I1444 PolarHBondContact O-N 3.14Å; I1441-A1445 WeakPolarHBondContact O-CB 3.4Å; I1441-A1445 PolarHBondContact O-N 3.2Å
1442	K	80.9	Confident	78	Confident	58 Å²	58	51.1 Å²	51.1	25%	0.252	28%	0.278	S	S	.	.	H	α-helix	trans	-65.8	-37	175.8	-172.8	-143.4	71.7	-169.6	0	111.9	I1438 E1439 E1440 W1446	I1438-K1442 VanDerWaalsContact O-CB 3.28Å; I1438-K1442 WeakPolarHBondContact O-CB 3.37Å; I1438-K1442 PolarHBondContact O-N 2.85Å; E1439-K1442 PolarHBondContact O-N 2.98Å; E1439-K1442 IonicContact OE1-NZ 2.7Å; E1439-K1442 PolarHBondContact OE1-NZ 3.3Å; E1439-K1442 VanDerWaalsContact OE1-NZ 3.08Å; E1439-K1442 VanDerWaalsContact OE2-CE 3.27Å; E1439-K1442 WeakPolarHBondContact OE2-CE 3.44Å; E1439-K1442 IonicContact OE2-NZ 3.3Å; E1439-K1442 PolarHBondContact OE2-NZ 3.25Å; E1440-K1442 PolarHBondContact O-N 2.95Å; K1442-W1446 WeakPolarHBondContact O-CB 3.45Å; K1442-W1446 PolarHBondContact O-N 3Å
1443	Q	78.6	Confident	76.6	Confident	57 Å²	57	53.2 Å²	53.2	27%	0.266	30%	0.297	S	S	.	.	H	α-helix	trans	-67.2	-46.7	175	-76.9	169.7	95.6	0	0	111.7	E1439 E1440 W1446 A1447 Y1457	E1439-Q1443 WeakPolarHBondContact O-CG 3.42Å; E1439-Q1443 PolarHBondContact O-N 2.85Å; E1439-Q1443 PolarHBondContact O-NE2 3.07Å; E1439-Q1443 VanDerWaalsContact O-NE2 3.12Å; E1440-Q1443 WeakPolarHBondContact O-CB 3.47Å; E1440-Q1443 PolarHBondContact O-N 3.3Å; E1440-Q1443 PolarHBondContact OE1-NE2 3.15Å; E1440-Q1443 PolarHBondContact OE2-NE2 3.49Å; Q1443-W1446 PolarHBondContact O-N 2.52Å; Q1443-A1447 PolarHBondContact O-N 3.21Å; Q1443-Y1457 HydrophobicContact CB-CE2 4.28Å
1444	I	79.3	Confident	75.6	Confident	46 Å²	46	57.8 Å²	57.8	24%	0.236	32%	0.316	C	S	.	.	H	α-helix	trans	-59.1	-50.7	174.6	-65.6	164.4	0	0	0	110.3	E1440 I1441 W1446 A1447 V1448 F1454 Y1457	E1440-I1444 WeakPolarHBondContact O-CG1 3.49Å; E1440-I1444 PolarHBondContact O-N 2.87Å; I1441-I1444 PolarHBondContact O-N 3.14Å; I1444-W1446 VanDerWaalsContact C-N 3.29Å; I1444-W1446 PolarHBondContact O-N 2.88Å; I1444-A1447 PolarHBondContact O-N 3.41Å; I1444-V1448 HydrophobicContact CG2-CG2 4.42Å; I1444-V1448 WeakPolarHBondContact O-CG2 3.24Å; I1444-V1448 PolarHBondContact O-N 3.42Å; I1444-F1454 HydrophobicContact CD1-CE2 4.5Å; I1444-F1454 HydrophobicContact CG2-CD2 4.12Å; I1444-F1454 HydrophobicContact CG2-CE2 4.04Å; I1444-Y1457 HydrophobicContact CD1-CD1 4.42Å; I1444-Y1457 HydrophobicContact CD1-CE1 3.76Å; I1444-Y1457 HydrophobicContact CG1-CD1 3.82Å; I1444-Y1457 HydrophobicContact CG1-CD2 4.27Å; I1444-Y1457 HydrophobicContact CG1-CE1 3.49Å; I1444-Y1457 VanDerWaalsContact CG1-CE1 3.49Å; I1444-Y1457 HydrophobicContact CG1-CE2 3.96Å; I1444-Y1457 HydrophobicContact CG1-CG 4.21Å
1445	A	75.4	Confident	74.8	Confident	44 Å²	44	59.7 Å²	59.7	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-61.4	-36	178.1	0	0	0	0	0	112.3	I1441 L1449	I1441-A1445 WeakPolarHBondContact O-CB 3.4Å; I1441-A1445 PolarHBondContact O-N 3.2Å; A1445-L1449 VanDerWaalsContact O-CB 3.31Å; A1445-L1449 WeakPolarHBondContact O-CB 3.4Å; A1445-L1449 WeakPolarHBondContact O-CD1 3.4Å; A1445-L1449 PolarHBondContact O-N 3.4Å
1446	W	71	Confident	74	Confident	120 Å²	120	63.4 Å²	63.4	46%	0.455	34%	0.34	S	S	.	.	H	α-helix	trans	-69.9	-39.2	175.9	-172.2	73.1	0	0	0	112.4	K1442 Q1443 I1444 S1450	K1442-W1446 WeakPolarHBondContact O-CB 3.45Å; K1442-W1446 PolarHBondContact O-N 3Å; Q1443-W1446 PolarHBondContact O-N 2.52Å; I1444-W1446 VanDerWaalsContact C-N 3.29Å; I1444-W1446 PolarHBondContact O-N 2.88Å; W1446-S1450 VanDerWaalsContact O-CB 3.26Å; W1446-S1450 WeakPolarHBondContact O-CB 3.39Å; W1446-S1450 PolarHBondContact O-N 3.07Å; W1446-S1450 PolarHBondContact O-OG 2.86Å
1447	A	68.6	Low	73.4	Confident	11 Å²	11	63.6 Å²	63.6	9%	0.091	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-50.2	173.2	0	0	0	0	0	111.2	Q1443 I1444 S1450 G1451 I1452	Q1443-A1447 PolarHBondContact O-N 3.21Å; I1444-A1447 PolarHBondContact O-N 3.41Å; A1447-S1450 CarbonylContact O-C 3.56Å; A1447-S1450 WeakPolarHBondContact O-CA 3.47Å; A1447-S1450 WeakPolarHBondContact O-CB 3.2Å; A1447-S1450 PolarHBondContact O-N 3.34Å; A1447-S1450 VanDerWaalsContact O-N 3.08Å; A1447-G1451 PolarHBondContact O-N 3.32Å; A1447-I1452 HydrophobicContact CB-CB 4.39Å; A1447-I1452 PolarHBondContact O-N 2.96Å
1448	V	70.8	Confident	72.9	Confident	81 Å²	81	62.5 Å²	62.5	49%	0.491	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-45.9	179.5	173.6	0	0	0	0	111.7	I1444 S1450 G1451	I1444-V1448 HydrophobicContact CG2-CG2 4.42Å; I1444-V1448 WeakPolarHBondContact O-CG2 3.24Å; I1444-V1448 PolarHBondContact O-N 3.42Å; V1448-S1450 PolarHBondContact O-N 2.79Å; V1448-G1451 PolarHBondContact O-N 3.19Å
1449	L	62.4	Low	72.5	Confident	101 Å²	101	63.8 Å²	63.8	53%	0.529	35%	0.352	S	S	.	.	H	α-helix	trans	-65.8	-21.3	174.4	-96.4	70.7	0	0	0	113.5	A1445 G1451	A1445-L1449 VanDerWaalsContact O-CB 3.31Å; A1445-L1449 WeakPolarHBondContact O-CB 3.4Å; A1445-L1449 WeakPolarHBondContact O-CD1 3.4Å; A1445-L1449 PolarHBondContact O-N 3.4Å; L1449-G1451 VanDerWaalsContact C-N 3.28Å
1450	S	56.2	Low	72.1	Confident	32 Å²	32	67 Å²	67	22%	0.224	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-3.5	174	-58.2	0	0	0	0	112.9	I970 W1446 A1447 V1448 I1452	I970-S1450 WeakPolarHBondContact CG2-OG 3.35Å; W1446-S1450 VanDerWaalsContact O-CB 3.26Å; W1446-S1450 WeakPolarHBondContact O-CB 3.39Å; W1446-S1450 PolarHBondContact O-N 3.07Å; W1446-S1450 PolarHBondContact O-OG 2.86Å; A1447-S1450 CarbonylContact O-C 3.56Å; A1447-S1450 WeakPolarHBondContact O-CA 3.47Å; A1447-S1450 WeakPolarHBondContact O-CB 3.2Å; A1447-S1450 PolarHBondContact O-N 3.34Å; A1447-S1450 VanDerWaalsContact O-N 3.08Å; V1448-S1450 PolarHBondContact O-N 2.79Å; S1450-I1452 VanDerWaalsContact C-N 3.27Å
1451	G	56.4	Low	71.9	Confident	65 Å²	65	68.8 Å²	68.8	67%	0.67	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	14.2	-175.6	0	0	0	0	0	114	A1447 V1448 L1449	A1447-G1451 PolarHBondContact O-N 3.32Å; V1448-G1451 PolarHBondContact O-N 3.19Å; L1449-G1451 VanDerWaalsContact C-N 3.28Å
1452	I	61	Low	72	Confident	75 Å²	75	67.4 Å²	67.4	39%	0.385	38%	0.38	S	S	.	.			trans	-82	132.4	173.2	-57.7	172.8	0	0	0	107.3	A1447 S1450 T1456	A1447-I1452 HydrophobicContact CB-CB 4.39Å; A1447-I1452 PolarHBondContact O-N 2.96Å; S1450-I1452 VanDerWaalsContact C-N 3.27Å; I1452-T1456 HydrophobicContact CG2-CG2 3.96Å
1453	S	62.8	Low	72.2	Confident	71 Å²	71	65.6 Å²	65.6	50%	0.497	37%	0.373	S	S	.	.			trans	-62.3	141.5	179.2	-179.6	0	0	0	0	111.5	R1455 T1456	S1453-R1455 PolarHBondContact O-N 2.91Å; S1453-R1455 WeakPolarHBondContact OG-CB 3.34Å; S1453-R1455 PolarHBondContact OG-N 2.82Å; S1453-T1456 WeakPolarHBondContact O-CB 3.42Å; S1453-T1456 PolarHBondContact O-N 2.95Å
1454	F	69.4	Low	72.6	Confident	104 Å²	104	68.7 Å²	68.7	46%	0.456	39%	0.386	S	S	.	.	H	α-helix	trans	-53.2	-33.7	171.3	-177.7	-126.9	0	0	0	112	I1444 T1456 Y1457 I1458	I1444-F1454 HydrophobicContact CD1-CE2 4.5Å; I1444-F1454 HydrophobicContact CG2-CD2 4.12Å; I1444-F1454 HydrophobicContact CG2-CE2 4.04Å; F1454-T1456 PolarHBondContact O-N 2.65Å; F1454-Y1457 HydrophobicContact CD2-CD1 4.49Å; F1454-Y1457 HydrophobicContact CE2-CD1 4.31Å; F1454-Y1457 WeakPolarHBondContact O-CB 3.33Å; F1454-Y1457 PolarHBondContact O-N 2.74Å; F1454-I1458 HydrophobicContact CD1-CD1 3.9Å; F1454-I1458 HydrophobicContact CE1-CD1 3.38Å; F1454-I1458 HydrophobicContact CE1-CG1 4.34Å; F1454-I1458 HydrophobicContact CE2-CD1 4.16Å; F1454-I1458 HydrophobicContact CE2-CG1 4.34Å; F1454-I1458 HydrophobicContact CG-CD1 4.49Å; F1454-I1458 HydrophobicContact CZ-CD1 3.54Å; F1454-I1458 HydrophobicContact CZ-CG1 4.19Å; F1454-I1458 PolarHBondContact O-N 3.26Å
1455	R	73.5	Confident	73.1	Confident	125 Å²	125	68.4 Å²	68.4	47%	0.472	38%	0.384	S	S	.	.	H	α-helix	trans	-54.7	-33.7	171.9	-172.2	172.1	178	147.8	-1.4	113.3	D824 S1453 S1459	D824-R1455 IonicContact OD1-NH1 3.89Å; D824-R1455 IonicContact OD2-CZ 2.65Å; D824-R1455 IonicContact OD2-NH1 3.21Å; D824-R1455 PolarHBondContact OD2-NH1 3.37Å; S1453-R1455 PolarHBondContact O-N 2.91Å; S1453-R1455 WeakPolarHBondContact OG-CB 3.34Å; S1453-R1455 PolarHBondContact OG-N 2.82Å; R1455-S1459 WeakPolarHBondContact O-CB 3.34Å; R1455-S1459 PolarHBondContact O-N 3.14Å
1456	T	72.6	Confident	73.6	Confident	80 Å²	80	67 Å²	67	49%	0.491	37%	0.371	S	S	.	.	H	α-helix	trans	-71.9	-41.3	176	-51.7	0	0	0	0	111.5	I1452 S1453 F1454 S1459	I1452-T1456 HydrophobicContact CG2-CG2 3.96Å; S1453-T1456 WeakPolarHBondContact O-CB 3.42Å; S1453-T1456 PolarHBondContact O-N 2.95Å; F1454-T1456 PolarHBondContact O-N 2.65Å; T1456-S1459 PolarHBondContact O-N 2.84Å; T1456-S1459 PolarHBondContact O-OG 3.38Å
1457	Y	73.4	Confident	74.4	Confident	21 Å²	21	63.8 Å²	63.8	8%	0.082	37%	0.366	C	S	.	.	H	α-helix	trans	-63.4	-43.8	174.4	171.7	-92.6	0	0	0	111.6	Q1443 I1444 F1454 S1459 N1463	Q1443-Y1457 HydrophobicContact CB-CE2 4.28Å; I1444-Y1457 HydrophobicContact CD1-CD1 4.42Å; I1444-Y1457 HydrophobicContact CD1-CE1 3.76Å; I1444-Y1457 HydrophobicContact CG1-CD1 3.82Å; I1444-Y1457 HydrophobicContact CG1-CD2 4.27Å; I1444-Y1457 HydrophobicContact CG1-CE1 3.49Å; I1444-Y1457 VanDerWaalsContact CG1-CE1 3.49Å; I1444-Y1457 HydrophobicContact CG1-CE2 3.96Å; I1444-Y1457 HydrophobicContact CG1-CG 4.21Å; F1454-Y1457 HydrophobicContact CD2-CD1 4.49Å; F1454-Y1457 HydrophobicContact CE2-CD1 4.31Å; F1454-Y1457 WeakPolarHBondContact O-CB 3.33Å; F1454-Y1457 PolarHBondContact O-N 2.74Å; Y1457-S1459 VanDerWaalsContact C-N 3.28Å; Y1457-S1459 PolarHBondContact O-N 3.32Å; Y1457-N1463 WeakPolarHBondContact CD2-ND2 3.42Å; Y1457-N1463 HydrophobicContact CE1-CB 4.14Å; Y1457-N1463 HydrophobicContact CE2-CB 4.16Å; Y1457-N1463 WeakPolarHBondContact CE2-ND2 3.43Å; Y1457-N1463 PolarHBondContact O-ND2 3.49Å
1458	I	78.6	Confident	75.4	Confident	68 Å²	68	65.4 Å²	65.4	35%	0.349	38%	0.379	S	S	.	.	H	α-helix	trans	-68	-23.4	175.3	-75.6	-175.2	0	0	0	112.6	F1454 D1460 K1464	F1454-I1458 HydrophobicContact CD1-CD1 3.9Å; F1454-I1458 HydrophobicContact CE1-CD1 3.38Å; F1454-I1458 HydrophobicContact CE1-CG1 4.34Å; F1454-I1458 HydrophobicContact CE2-CD1 4.16Å; F1454-I1458 HydrophobicContact CE2-CG1 4.34Å; F1454-I1458 HydrophobicContact CG-CD1 4.49Å; F1454-I1458 HydrophobicContact CZ-CD1 3.54Å; F1454-I1458 HydrophobicContact CZ-CG1 4.19Å; F1454-I1458 PolarHBondContact O-N 3.26Å; I1458-D1460 PolarHBondContact O-N 2.86Å; I1458-K1464 WeakPolarHBondContact O-CE 3.13Å; I1458-K1464 VanDerWaalsContact O-CG 3.3Å; I1458-K1464 WeakPolarHBondContact O-CG 3.08Å
1459	S	77.6	Confident	76.4	Confident	88 Å²	88	61.6 Å²	61.6	62%	0.615	36%	0.356	S	S	*	.	H	α-helix	trans	-67.4	-20.6	-179.4	73	0	0	0	0	114.3	R1455 T1456 Y1457 G1461	R1455-S1459 WeakPolarHBondContact O-CB 3.34Å; R1455-S1459 PolarHBondContact O-N 3.14Å; T1456-S1459 PolarHBondContact O-N 2.84Å; T1456-S1459 PolarHBondContact O-OG 3.38Å; Y1457-S1459 VanDerWaalsContact C-N 3.28Å; Y1457-S1459 PolarHBondContact O-N 3.32Å; S1459-G1461 PolarHBondContact O-N 2.99Å
1460	D	76.9	Confident	77.8	Confident	66 Å²	66	57.3 Å²	57.3	35%	0.353	33%	0.334	S	S	.	.	S	Bend	trans	-78.4	120	172.6	-172.3	-10.1	0	0	0	111.1	I1458 W1462 N1463 K1464	I1458-D1460 PolarHBondContact O-N 2.86Å; D1460-W1462 PolarHBondContact O-N 3.47Å; D1460-W1462 VanDerWaalsContact OD1-CD1 3.29Å; D1460-W1462 PolarHBondContact OD1-N 2.81Å; D1460-N1463 HydrophobicContact CB-CB 4.32Å; D1460-N1463 PolarHBondContact O-N 2.89Å; D1460-N1463 VanDerWaalsContact O-N 3.07Å; D1460-K1464 PolarHBondContact O-N 2.85Å; D1460-K1464 VanDerWaalsContact O-N 3.11Å
1461	G	81.4	Confident	79.5	Confident	48 Å²	48	58 Å²	58	50%	0.495	34%	0.341	S	S	.	.	H	α-helix	trans	-58.5	-26.3	176.3	0	0	0	0	0	114.2	S1459 L1465	S1459-G1461 PolarHBondContact O-N 2.99Å; G1461-L1465 WeakPolarHBondContact O-CB 3.14Å; G1461-L1465 PolarHBondContact O-N 2.9Å
1462	W	85.6	Confident	81.2	Confident	54 Å²	54	57 Å²	57	21%	0.205	32%	0.321	C	S	.	.	H	α-helix	trans	-72.6	-36.5	174.6	-64.1	103.8	0	0	0	112.6	D1460 L1465 D1466 M1527 Y1528 L1540	D1460-W1462 PolarHBondContact O-N 3.47Å; D1460-W1462 VanDerWaalsContact OD1-CD1 3.29Å; D1460-W1462 PolarHBondContact OD1-N 2.81Å; W1462-L1465 HydrophobicContact CE3-CD2 4Å; W1462-L1465 HydrophobicContact CZ3-CD2 4.06Å; W1462-L1465 WeakPolarHBondContact O-CB 3.49Å; W1462-L1465 PolarHBondContact O-N 3.47Å; W1462-D1466 PolarHBondContact O-N 3.07Å; W1462-M1527 HydrophobicContact CH2-CB 4.07Å; W1462-Y1528 AromaticContact CD1-CD2 3.79Å; W1462-Y1528 AromaticContact CD2-CD2 3.86Å; W1462-Y1528 HydrophobicContact CD2-CD2 3.86Å; W1462-Y1528 HydrophobicContact CD2-CG 4.4Å; W1462-Y1528 AromaticContact CE2-CD2 3.92Å; W1462-Y1528 AromaticContact CG-CD2 3.8Å; W1462-Y1528 HydrophobicContact CG-CD2 3.8Å; W1462-Y1528 HydrophobicContact CG-CE2 4.42Å; W1462-Y1528 AromaticContact NE1-CD2 3.85Å; W1462-L1540 HydrophobicContact CZ2-CD2 4.21Å
1463	N	85.3	Confident	82.7	Confident	20 Å²	20	54.1 Å²	54.1	11%	0.107	31%	0.305	C	S	.	.	H	α-helix	trans	-71.4	-37.4	176.5	-62.1	-14.4	0	0	0	110.3	Y1457 D1460 L1465 D1466 C1467	Y1457-N1463 WeakPolarHBondContact CD2-ND2 3.42Å; Y1457-N1463 HydrophobicContact CE1-CB 4.14Å; Y1457-N1463 HydrophobicContact CE2-CB 4.16Å; Y1457-N1463 WeakPolarHBondContact CE2-ND2 3.43Å; Y1457-N1463 PolarHBondContact O-ND2 3.49Å; D1460-N1463 HydrophobicContact CB-CB 4.32Å; D1460-N1463 PolarHBondContact O-N 2.89Å; D1460-N1463 VanDerWaalsContact O-N 3.07Å; N1463-L1465 VanDerWaalsContact C-N 3.32Å; N1463-L1465 PolarHBondContact O-N 3.18Å; N1463-D1466 PolarHBondContact O-N 2.89Å; N1463-C1467 WeakPolarHBondContact O-CB 3.33Å; N1463-C1467 PolarHBondContact O-N 2.96Å; N1463-C1467 PolarHBondContact O-SG 3.2Å
1464	K	86.7	Confident	84.1	Confident	123 Å²	123	54 Å²	54	54%	0.535	30%	0.298	S	S	.	.	H	α-helix	trans	-57.2	-45.1	169.1	-64.6	-167.6	-179.2	-166.1	0	111.9	I1458 D1460 A1468	I1458-K1464 WeakPolarHBondContact O-CE 3.13Å; I1458-K1464 VanDerWaalsContact O-CG 3.3Å; I1458-K1464 WeakPolarHBondContact O-CG 3.08Å; D1460-K1464 PolarHBondContact O-N 2.85Å; D1460-K1464 VanDerWaalsContact O-N 3.11Å; K1464-A1468 WeakPolarHBondContact O-CB 3.5Å; K1464-A1468 PolarHBondContact O-N 2.69Å
1465	L	88.9	Confident	85.2	Confident	40 Å²	40	53 Å²	53	21%	0.209	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-45.7	179.2	-170.7	75.7	0	0	0	112.1	G1461 W1462 N1463 A1468 G1469 T1521 I1524 R1525	G1461-L1465 WeakPolarHBondContact O-CB 3.14Å; G1461-L1465 PolarHBondContact O-N 2.9Å; W1462-L1465 HydrophobicContact CE3-CD2 4Å; W1462-L1465 HydrophobicContact CZ3-CD2 4.06Å; W1462-L1465 WeakPolarHBondContact O-CB 3.49Å; W1462-L1465 PolarHBondContact O-N 3.47Å; N1463-L1465 VanDerWaalsContact C-N 3.32Å; N1463-L1465 PolarHBondContact O-N 3.18Å; L1465-A1468 PolarHBondContact O-N 3.4Å; L1465-G1469 PolarHBondContact O-N 2.77Å; L1465-T1521 HydrophobicContact CD1-CG2 3.76Å; L1465-T1521 HydrophobicContact CG-CG2 3.8Å; L1465-T1521 WeakPolarHBondContact O-CG2 3.33Å; L1465-I1524 HydrophobicContact CD2-CB 4.09Å; L1465-I1524 HydrophobicContact CD2-CG2 3.67Å; L1465-R1525 HydrophobicContact CD2-CB 4.39Å
1466	D	87.2	Confident	86.1	Confident	14 Å²	14	47.1 Å²	47.1	8%	0.075	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-43.4	178	-78.1	-0.4	0	0	0	111.8	W1462 N1463 A1468 G1469 L1470 R1525	W1462-D1466 PolarHBondContact O-N 3.07Å; N1463-D1466 PolarHBondContact O-N 2.89Å; D1466-A1468 VanDerWaalsContact C-N 3.34Å; D1466-A1468 PolarHBondContact O-N 2.63Å; D1466-G1469 PolarHBondContact O-N 3.35Å; D1466-L1470 WeakPolarHBondContact O-CB 3.31Å; D1466-L1470 WeakPolarHBondContact O-CG 3.14Å; D1466-L1470 PolarHBondContact O-N 2.77Å; D1466-R1525 WeakPolarHBondContact OD1-CD 3.22Å; D1466-R1525 WeakPolarHBondContact OD1-CG 3.47Å; D1466-R1525 IonicContact OD1-CZ 2.72Å; D1466-R1525 IonicContact OD1-NE 3.05Å; D1466-R1525 PolarHBondContact OD1-NE 3.47Å; D1466-R1525 IonicContact OD2-CZ 2.7Å; D1466-R1525 IonicContact OD2-NE 3.84Å; D1466-R1525 PolarHBondContact OD2-NE 3.03Å; D1466-R1525 IonicContact OD2-NH2 2.67Å; D1466-R1525 PolarHBondContact OD2-NH2 3.03Å
1467	C	87.5	Confident	86.9	Confident	53 Å²	53	46 Å²	46	36%	0.358	26%	0.263	S	S	.	.	H	α-helix	trans	-59.4	-42.4	173.5	-73.2	0	0	0	0	111.8	N1463 L1470 A1471	N1463-C1467 WeakPolarHBondContact O-CB 3.33Å; N1463-C1467 PolarHBondContact O-N 2.96Å; N1463-C1467 PolarHBondContact O-SG 3.2Å; C1467-L1470 PolarHBondContact O-N 3.09Å; C1467-A1471 VanDerWaalsContact O-CB 3.29Å; C1467-A1471 WeakPolarHBondContact O-CB 3.12Å; C1467-A1471 PolarHBondContact O-N 3Å
1468	A	89.4	Confident	87.8	Confident	45 Å²	45	49 Å²	49	37%	0.372	28%	0.28	S	S	.	.	H	α-helix	trans	-65.4	-40.5	175.4	0	0	0	0	0	112.4	K1464 L1465 D1466 A1471 L1472	K1464-A1468 WeakPolarHBondContact O-CB 3.5Å; K1464-A1468 PolarHBondContact O-N 2.69Å; L1465-A1468 PolarHBondContact O-N 3.4Å; D1466-A1468 VanDerWaalsContact C-N 3.34Å; D1466-A1468 PolarHBondContact O-N 2.63Å; A1468-A1471 PolarHBondContact O-N 2.93Å; A1468-L1472 WeakPolarHBondContact O-CB 3.29Å; A1468-L1472 VanDerWaalsContact O-CG 3.31Å; A1468-L1472 WeakPolarHBondContact O-CG 3.41Å; A1468-L1472 PolarHBondContact O-N 3.07Å
1469	G	91.6	Very high	88.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.2	-41.1	175.9	0	0	0	0	0	112.9	L1465 D1466 Y1473 S1518	L1465-G1469 PolarHBondContact O-N 2.77Å; D1466-G1469 PolarHBondContact O-N 3.35Å; G1469-Y1473 PolarHBondContact O-N 2.97Å; G1469-S1518 PolarHBondContact O-OG 3.49Å
1470	L	91.4	Very high	88.9	Confident	11 Å²	11	43.8 Å²	43.8	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-68.5	-44	174.1	-72.7	165.8	0	0	0	112.1	V1433 F1437 E1440 D1466 C1467 Y1473 I1474 F1522	V1433-L1470 HydrophobicContact CG1-CD2 3.8Å; F1437-L1470 HydrophobicContact CB-CD2 4.44Å; F1437-L1470 HydrophobicContact CD2-CD1 4.47Å; E1440-L1470 HydrophobicContact CG-CD1 4.11Å; D1466-L1470 WeakPolarHBondContact O-CB 3.31Å; D1466-L1470 WeakPolarHBondContact O-CG 3.14Å; D1466-L1470 PolarHBondContact O-N 2.77Å; C1467-L1470 PolarHBondContact O-N 3.09Å; L1470-Y1473 WeakPolarHBondContact O-CB 3.24Å; L1470-Y1473 PolarHBondContact O-N 3.07Å; L1470-I1474 VanDerWaalsContact O-CG1 3.3Å; L1470-I1474 WeakPolarHBondContact O-CG1 3.23Å; L1470-I1474 PolarHBondContact O-N 2.86Å; L1470-F1522 HydrophobicContact CD2-CZ 4.11Å; L1470-F1522 HydrophobicContact CG-CE1 4.5Å; L1470-F1522 HydrophobicContact CG-CZ 4.26Å
1471	A	91.4	Very high	89.3	Confident	46 Å²	46	44.1 Å²	44.1	38%	0.38	25%	0.246	S	C	.	.	H	α-helix	trans	-61.7	-45.7	177	0	0	0	0	0	111.7	C1467 A1468 Y1473 I1474 I1475	C1467-A1471 VanDerWaalsContact O-CB 3.29Å; C1467-A1471 WeakPolarHBondContact O-CB 3.12Å; C1467-A1471 PolarHBondContact O-N 3Å; A1468-A1471 PolarHBondContact O-N 2.93Å; A1471-Y1473 VanDerWaalsContact C-N 3.3Å; A1471-Y1473 PolarHBondContact O-N 2.85Å; A1471-I1474 PolarHBondContact O-N 2.95Å; A1471-I1475 VanDerWaalsContact O-CG1 3.31Å; A1471-I1475 WeakPolarHBondContact O-CG1 3.48Å; A1471-I1475 PolarHBondContact O-N 2.92Å
1472	L	92.5	Very high	89.6	Confident	46 Å²	46	45.4 Å²	45.4	24%	0.241	24%	0.241	C	C	.	.	H	α-helix	trans	-64	-33.8	174.6	-71.6	169.7	0	0	0	112.7	A1468 G1476 I1517	A1468-L1472 WeakPolarHBondContact O-CB 3.29Å; A1468-L1472 VanDerWaalsContact O-CG 3.31Å; A1468-L1472 WeakPolarHBondContact O-CG 3.41Å; A1468-L1472 PolarHBondContact O-N 3.07Å; L1472-G1476 PolarHBondContact O-N 3.15Å; L1472-I1517 HydrophobicContact CD1-CB 4.38Å; L1472-I1517 HydrophobicContact CD1-CG2 3.71Å
1473	Y	93.5	Very high	89.4	Confident	14 Å²	14	43.1 Å²	43.1	6%	0.055	23%	0.233	C	C	.	.	H	α-helix	trans	-64.1	-47.3	171.4	-170.2	-88.1	0	0	0	111.1	F1410 V1429 I1430 V1433 G1469 L1470 A1471 G1476 F1477 L1515 S1518	F1410-Y1473 HydrophobicContact CE1-CD2 4Å; F1410-Y1473 HydrophobicContact CE1-CE2 4.17Å; F1410-Y1473 HydrophobicContact CE2-CD2 4.4Å; F1410-Y1473 AromaticContact CE2-CE2 3.96Å; F1410-Y1473 HydrophobicContact CE2-CE2 3.96Å; F1410-Y1473 AromaticContact CZ-CD2 3.67Å; F1410-Y1473 HydrophobicContact CZ-CD2 3.67Å; F1410-Y1473 AromaticContact CZ-CE2 3.68Å; F1410-Y1473 HydrophobicContact CZ-CE2 3.68Å; V1429-Y1473 HydrophobicContact CG1-CE2 4.41Å; I1430-Y1473 WeakPolarHBondContact CG1-OH 3.16Å; V1433-Y1473 HydrophobicContact CB-CD1 4.32Å; V1433-Y1473 HydrophobicContact CB-CE1 4.06Å; V1433-Y1473 HydrophobicContact CG1-CD1 3.7Å; V1433-Y1473 HydrophobicContact CG1-CE1 3.92Å; V1433-Y1473 HydrophobicContact CG1-CG 4.09Å; V1433-Y1473 HydrophobicContact CG2-CD1 4.35Å; V1433-Y1473 HydrophobicContact CG2-CD2 4.14Å; V1433-Y1473 HydrophobicContact CG2-CE1 4.07Å; V1433-Y1473 HydrophobicContact CG2-CE2 3.86Å; V1433-Y1473 HydrophobicContact CG2-CG 4.38Å; G1469-Y1473 PolarHBondContact O-N 2.97Å; L1470-Y1473 WeakPolarHBondContact O-CB 3.24Å; L1470-Y1473 PolarHBondContact O-N 3.07Å; A1471-Y1473 VanDerWaalsContact C-N 3.3Å; A1471-Y1473 PolarHBondContact O-N 2.85Å; Y1473-G1476 PolarHBondContact O-N 2.8Å; Y1473-F1477 HydrophobicContact CD1-CB 4.39Å; Y1473-F1477 HydrophobicContact CE1-CB 4.26Å; Y1473-F1477 WeakPolarHBondContact O-CB 3.29Å; Y1473-F1477 PolarHBondContact O-N 2.81Å; Y1473-L1515 HydrophobicContact CD2-CD2 3.77Å; Y1473-L1515 HydrophobicContact CE2-CD2 3.94Å; Y1473-L1515 HydrophobicContact CG-CD2 4.28Å; Y1473-S1518 WeakPolarHBondContact CB-OG 2.92Å; Y1473-S1518 PolarHBondContact N-OG 2.63Å
1474	I	92.1	Very high	89.2	Confident	69 Å²	69	44.2 Å²	44.2	35%	0.354	24%	0.238	S	C	.	.	H	α-helix	trans	-63	-45.1	-179.6	-70	163.7	0	0	0	110.6	F1437 L1470 A1471 F1477 I1478	F1437-I1474 HydrophobicContact CE2-CD1 4.36Å; L1470-I1474 VanDerWaalsContact O-CG1 3.3Å; L1470-I1474 WeakPolarHBondContact O-CG1 3.23Å; L1470-I1474 PolarHBondContact O-N 2.86Å; A1471-I1474 PolarHBondContact O-N 2.95Å; I1474-F1477 PolarHBondContact O-N 3.41Å; I1474-I1478 HydrophobicContact CG2-CD1 3.67Å; I1474-I1478 HydrophobicContact CG2-CG1 4.38Å; I1474-I1478 WeakPolarHBondContact O-CB 3.25Å; I1474-I1478 VanDerWaalsContact O-CG1 3.24Å; I1474-I1478 WeakPolarHBondContact O-CG1 3.35Å; I1474-I1478 PolarHBondContact O-N 2.84Å
1475	I	92.8	Very high	89	Confident	83 Å²	83	43.8 Å²	43.8	43%	0.426	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-50	175.3	-67.4	163	0	0	0	110.6	A1471 F1477 I1478 L1479	A1471-I1475 VanDerWaalsContact O-CG1 3.31Å; A1471-I1475 WeakPolarHBondContact O-CG1 3.48Å; A1471-I1475 PolarHBondContact O-N 2.92Å; I1475-F1477 VanDerWaalsContact C-N 3.3Å; I1475-F1477 PolarHBondContact O-N 3.44Å; I1475-I1478 PolarHBondContact O-N 3.49Å; I1475-L1479 HydrophobicContact CG2-CD1 4.08Å; I1475-L1479 WeakPolarHBondContact O-CG 3.38Å; I1475-L1479 PolarHBondContact O-N 2.84Å
1476	G	91.5	Very high	88.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.2	-37.1	177.6	0	0	0	0	0	113.3	L1472 Y1473 R1480	L1472-G1476 PolarHBondContact O-N 3.15Å; Y1473-G1476 PolarHBondContact O-N 2.8Å; G1476-R1480 VanDerWaalsContact O-CB 3.28Å; G1476-R1480 WeakPolarHBondContact O-CB 3.5Å; G1476-R1480 PolarHBondContact O-N 2.75Å
1477	F	90.6	Very high	87.8	Confident	58 Å²	58	48.5 Å²	48.5	25%	0.254	26%	0.257	S	S	.	.	H	α-helix	trans	-71.8	-38.3	175.8	-176.1	-105.9	0	0	0	112.6	I1430 Y1473 I1474 I1475 R1480 L1481	I1430-F1477 HydrophobicContact CD1-CD2 4.39Å; I1430-F1477 HydrophobicContact CD1-CE2 3.56Å; I1430-F1477 HydrophobicContact CD1-CZ 4.12Å; I1430-F1477 HydrophobicContact CG1-CE2 4.08Å; Y1473-F1477 HydrophobicContact CD1-CB 4.39Å; Y1473-F1477 HydrophobicContact CE1-CB 4.26Å; Y1473-F1477 WeakPolarHBondContact O-CB 3.29Å; Y1473-F1477 PolarHBondContact O-N 2.81Å; I1474-F1477 PolarHBondContact O-N 3.41Å; I1475-F1477 VanDerWaalsContact C-N 3.3Å; I1475-F1477 PolarHBondContact O-N 3.44Å; F1477-R1480 PolarHBondContact O-N 2.74Å; F1477-L1481 VanDerWaalsContact O-CB 3.29Å; F1477-L1481 WeakPolarHBondContact O-CB 3.45Å; F1477-L1481 PolarHBondContact O-N 3.44Å
1478	I	91.8	Very high	87	Confident	84 Å²	84	48.7 Å²	48.7	43%	0.431	27%	0.268	S	S	.	.	H	α-helix	trans	-65.3	-44.9	173.8	-72.3	167.2	0	0	0	110.4	I1474 I1475 R1480 L1481 I1482	I1474-I1478 HydrophobicContact CG2-CD1 3.67Å; I1474-I1478 HydrophobicContact CG2-CG1 4.38Å; I1474-I1478 WeakPolarHBondContact O-CB 3.25Å; I1474-I1478 VanDerWaalsContact O-CG1 3.24Å; I1474-I1478 WeakPolarHBondContact O-CG1 3.35Å; I1474-I1478 PolarHBondContact O-N 2.84Å; I1475-I1478 PolarHBondContact O-N 3.49Å; I1478-R1480 VanDerWaalsContact C-N 3.33Å; I1478-R1480 PolarHBondContact O-N 3.35Å; I1478-L1481 CarbonylContact O-C 3.49Å; I1478-L1481 WeakPolarHBondContact O-CB 3.15Å; I1478-L1481 PolarHBondContact O-N 3.33Å; I1478-L1481 VanDerWaalsContact O-N 3.16Å; I1478-I1482 HydrophobicContact CG2-CD1 3.87Å; I1478-I1482 HydrophobicContact CG2-CG1 4.47Å; I1478-I1482 VanDerWaalsContact O-CG1 3.31Å; I1478-I1482 WeakPolarHBondContact O-CG1 3.47Å; I1478-I1482 PolarHBondContact O-N 3.37Å
1479	L	90.4	Very high	85.8	Confident	41 Å²	41	54.2 Å²	54.2	22%	0.215	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-43.2	174.6	-68.8	170.8	0	0	0	111.5	I1475 L1481 I1482 V1483 I1507 P1510	I1475-L1479 HydrophobicContact CG2-CD1 4.08Å; I1475-L1479 WeakPolarHBondContact O-CG 3.38Å; I1475-L1479 PolarHBondContact O-N 2.84Å; L1479-L1481 VanDerWaalsContact C-N 3.34Å; L1479-L1481 PolarHBondContact O-N 2.96Å; L1479-I1482 PolarHBondContact O-N 3.09Å; L1479-V1483 WeakPolarHBondContact O-CG2 3.45Å; L1479-V1483 PolarHBondContact O-N 3.42Å; L1479-I1507 HydrophobicContact CB-CG2 4.41Å; L1479-I1507 HydrophobicContact CD2-CG2 4.07Å; L1479-P1510 HydrophobicContact CD1-CB 4.5Å
1480	R	88.1	Confident	84.4	Confident	5 Å²	5	59.4 Å²	59.4	2%	0.019	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-36.9	174.1	-178.3	169.1	173.3	70.8	3.7	112.6	R1419 E1426 G1476 F1477 I1478 V1483 L1484	R1419-R1480 PolarHBondContact O-NH1 3.47Å; R1419-R1480 PolarHBondContact O-NH2 2.86Å; E1426-R1480 VanDerWaalsContact CD-NH2 3.33Å; E1426-R1480 IonicContact OE1-CZ 3.21Å; E1426-R1480 IonicContact OE1-NE 3.88Å; E1426-R1480 PolarHBondContact OE1-NE 3.12Å; E1426-R1480 IonicContact OE1-NH2 2.73Å; E1426-R1480 PolarHBondContact OE1-NH2 3.24Å; E1426-R1480 IonicContact OE2-CZ 2.74Å; E1426-R1480 IonicContact OE2-NE 3.38Å; E1426-R1480 IonicContact OE2-NH2 3.74Å; E1426-R1480 PolarHBondContact OE2-NH2 3.05Å; G1476-R1480 VanDerWaalsContact O-CB 3.28Å; G1476-R1480 WeakPolarHBondContact O-CB 3.5Å; G1476-R1480 PolarHBondContact O-N 2.75Å; F1477-R1480 PolarHBondContact O-N 2.74Å; I1478-R1480 VanDerWaalsContact C-N 3.33Å; I1478-R1480 PolarHBondContact O-N 3.35Å; R1480-V1483 PolarHBondContact O-N 3.14Å; R1480-L1484 HydrophobicContact CG-CD1 4.49Å; R1480-L1484 WeakPolarHBondContact O-CG 3.41Å; R1480-L1484 PolarHBondContact O-N 3.44Å
1481	L	86.8	Confident	82.7	Confident	73 Å²	73	66.2 Å²	66.2	38%	0.382	35%	0.347	S	S	.	.	H	α-helix	trans	-69.6	-37.7	174.8	-175.7	62.8	0	0	0	112	F1477 I1478 L1479 L1484 L1485	F1477-L1481 VanDerWaalsContact O-CB 3.29Å; F1477-L1481 WeakPolarHBondContact O-CB 3.45Å; F1477-L1481 PolarHBondContact O-N 3.44Å; I1478-L1481 CarbonylContact O-C 3.49Å; I1478-L1481 WeakPolarHBondContact O-CB 3.15Å; I1478-L1481 PolarHBondContact O-N 3.33Å; I1478-L1481 VanDerWaalsContact O-N 3.16Å; L1479-L1481 VanDerWaalsContact C-N 3.34Å; L1479-L1481 PolarHBondContact O-N 2.96Å; L1481-L1484 WeakPolarHBondContact O-CB 3.3Å; L1481-L1484 PolarHBondContact O-N 3.01Å; L1481-L1485 HydrophobicContact CG-CD1 4.15Å; L1481-L1485 WeakPolarHBondContact O-CB 3.25Å; L1481-L1485 VanDerWaalsContact O-CG 3.27Å; L1481-L1485 WeakPolarHBondContact O-CG 3.43Å; L1481-L1485 PolarHBondContact O-N 2.96Å
1482	I	86.9	Confident	81.1	Confident	75 Å²	75	71.1 Å²	71.1	39%	0.385	37%	0.367	S	S	.	.	H	α-helix	trans	-62.4	-44.2	173.3	-71.3	163.8	0	0	0	110.4	I1478 L1479 L1485 R1486 I1507	I1478-I1482 HydrophobicContact CG2-CD1 3.87Å; I1478-I1482 HydrophobicContact CG2-CG1 4.47Å; I1478-I1482 VanDerWaalsContact O-CG1 3.31Å; I1478-I1482 WeakPolarHBondContact O-CG1 3.47Å; I1478-I1482 PolarHBondContact O-N 3.37Å; L1479-I1482 PolarHBondContact O-N 3.09Å; I1482-L1485 PolarHBondContact O-N 3.07Å; I1482-R1486 VanDerWaalsContact O-CB 3.29Å; I1482-R1486 WeakPolarHBondContact O-CB 3.13Å; I1482-R1486 PolarHBondContact O-N 2.97Å; I1482-I1507 HydrophobicContact CG2-CD1 4.28Å; I1482-I1507 HydrophobicContact CG2-CG2 4.48Å
1483	V	82.1	Confident	79.4	Confident	5 Å²	5	71.9 Å²	71.9	3%	0.03	37%	0.368	C	S	.	.	H	α-helix	trans	-61.1	-46.7	173.6	174.7	0	0	0	0	111	L1479 R1480 L1485 R1486 L1487 I1507 L1508	L1479-V1483 WeakPolarHBondContact O-CG2 3.45Å; L1479-V1483 PolarHBondContact O-N 3.42Å; R1480-V1483 PolarHBondContact O-N 3.14Å; V1483-L1485 PolarHBondContact O-N 2.92Å; V1483-R1486 PolarHBondContact O-N 3.38Å; V1483-L1487 HydrophobicContact CG1-CD1 3.63Å; V1483-L1487 HydrophobicContact CG1-CG 4.16Å; V1483-L1487 WeakPolarHBondContact O-CB 3.44Å; V1483-L1487 VanDerWaalsContact O-CG 3.26Å; V1483-L1487 WeakPolarHBondContact O-CG 3.4Å; V1483-L1487 PolarHBondContact O-N 3Å; V1483-I1507 HydrophobicContact CG2-CB 3.71Å; V1483-I1507 HydrophobicContact CG2-CG2 3.65Å; V1483-L1508 HydrophobicContact CG1-CD1 4.16Å; V1483-L1508 HydrophobicContact CG2-CB 4.41Å; V1483-L1508 HydrophobicContact CG2-CD1 4.43Å
1484	L	80.1	Confident	77.8	Confident	43 Å²	43	76.3 Å²	76.3	23%	0.225	39%	0.393	C	S	.	.	H	α-helix	trans	-56.6	-44.2	175.3	-85.2	162.1	0	0	0	113	I1420 I1422 R1480 L1481 G1488	I1420-L1484 VanDerWaalsContact O-CD2 3.24Å; I1420-L1484 WeakPolarHBondContact O-CD2 3.43Å; I1422-L1484 HydrophobicContact CD1-CD1 3.9Å; I1422-L1484 HydrophobicContact CG1-CD1 3.79Å; R1480-L1484 HydrophobicContact CG-CD1 4.49Å; R1480-L1484 WeakPolarHBondContact O-CG 3.41Å; R1480-L1484 PolarHBondContact O-N 3.44Å; L1481-L1484 WeakPolarHBondContact O-CB 3.3Å; L1481-L1484 PolarHBondContact O-N 3.01Å; L1484-G1488 PolarHBondContact O-N 3.14Å
1485	L	82	Confident	76.4	Confident	115 Å²	115	79.6 Å²	79.6	60%	0.602	41%	0.409	S	S	*	.	H	α-helix	trans	-68.2	-41	178.4	-71.9	168.4	0	0	0	112.1	L1481 I1482 V1483 G1488 Q1489	L1481-L1485 HydrophobicContact CG-CD1 4.15Å; L1481-L1485 WeakPolarHBondContact O-CB 3.25Å; L1481-L1485 VanDerWaalsContact O-CG 3.27Å; L1481-L1485 WeakPolarHBondContact O-CG 3.43Å; L1481-L1485 PolarHBondContact O-N 2.96Å; I1482-L1485 PolarHBondContact O-N 3.07Å; V1483-L1485 PolarHBondContact O-N 2.92Å; L1485-G1488 PolarHBondContact O-N 2.98Å; L1485-Q1489 PolarHBondContact O-N 3.33Å
1486	R	78.8	Confident	75	Confident	132 Å²	132	84.3 Å²	84.3	50%	0.498	43%	0.427	S	S	.	.	H	α-helix	trans	-63.4	-48.5	177.6	-166.2	-175.4	-147.5	-179.4	9.3	111.5	I1482 V1483 G1488 Q1489 D1505	I1482-R1486 VanDerWaalsContact O-CB 3.29Å; I1482-R1486 WeakPolarHBondContact O-CB 3.13Å; I1482-R1486 PolarHBondContact O-N 2.97Å; V1483-R1486 PolarHBondContact O-N 3.38Å; R1486-G1488 VanDerWaalsContact C-N 3.27Å; R1486-G1488 PolarHBondContact O-N 3.48Å; R1486-Q1489 PolarHBondContact O-N 3.31Å; R1486-D1505 IonicContact NH1-OD1 2.72Å
1487	L	72.7	Confident	73.7	Confident	21 Å²	21	90.4 Å²	90.4	11%	0.11	45%	0.451	C	S	.	.	H	α-helix	trans	-67.5	-29.5	176.7	-64.7	177.3	0	0	0	111.9	I1420 V1483 Q1489 E1490 F1493 Y1501	I1420-L1487 HydrophobicContact CD1-CD1 4.04Å; I1420-L1487 HydrophobicContact CG1-CD1 4.41Å; I1420-L1487 HydrophobicContact CG2-CD1 3.57Å; V1483-L1487 HydrophobicContact CG1-CD1 3.63Å; V1483-L1487 HydrophobicContact CG1-CG 4.16Å; V1483-L1487 WeakPolarHBondContact O-CB 3.44Å; V1483-L1487 VanDerWaalsContact O-CG 3.26Å; V1483-L1487 WeakPolarHBondContact O-CG 3.4Å; V1483-L1487 PolarHBondContact O-N 3Å; L1487-Q1489 PolarHBondContact O-N 3.15Å; L1487-E1490 PolarHBondContact O-N 2.85Å; L1487-E1490 VanDerWaalsContact O-N 3.1Å; L1487-F1493 HydrophobicContact CD2-CD2 4.07Å; L1487-F1493 HydrophobicContact CD2-CE2 3.61Å; L1487-F1493 HydrophobicContact CD2-CZ 4.37Å; L1487-Y1501 HydrophobicContact CD2-CD1 4.41Å; L1487-Y1501 HydrophobicContact CD2-CE1 4.48Å
1488	G	69.8	Low	72.5	Confident	57 Å²	57	89.8 Å²	89.8	59%	0.588	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.7	173	0	0	0	0	0	115.2	L1484 L1485 R1486	L1484-G1488 PolarHBondContact O-N 3.14Å; L1485-G1488 PolarHBondContact O-N 2.98Å; R1486-G1488 VanDerWaalsContact C-N 3.27Å; R1486-G1488 PolarHBondContact O-N 3.48Å
1489	Q	66	Low	71.3	Confident	161 Å²	161	96.2 Å²	96.2	75%	0.752	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-22.8	171.1	-70.2	-171.9	-77.9	0	0	113.3	L1485 R1486 L1487 N1491	L1485-Q1489 PolarHBondContact O-N 3.33Å; R1486-Q1489 PolarHBondContact O-N 3.31Å; L1487-Q1489 PolarHBondContact O-N 3.15Å; Q1489-N1491 PolarHBondContact O-N 3.33Å
1490	E	62.2	Low	70.2	Confident	108 Å²	108	101.7 Å²	101.7	51%	0.505	49%	0.486	S	S	.	.			trans	-89.2	82.1	-179.5	-68	-158.6	161.7	0	0	112.1	L1487 N1492 F1493	L1487-E1490 PolarHBondContact O-N 2.85Å; L1487-E1490 VanDerWaalsContact O-N 3.1Å; E1490-N1492 PolarHBondContact O-N 2.85Å; E1490-F1493 PolarHBondContact O-N 2.97Å
1491	N	55.1	Low	69.2	Low	155 Å²	155	105.1 Å²	105.1	83%	0.829	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-0.5	179.5	-73.6	-58	0	0	0	116.7	Q1489	Q1489-N1491 PolarHBondContact O-N 3.33Å
1492	N	57	Low	68.3	Low	149 Å²	149	103.6 Å²	103.6	80%	0.797	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	27.4	-178.5	-76.6	-47.2	0	0	0	113.2	E1490 N1494	E1490-N1492 PolarHBondContact O-N 2.85Å; N1492-N1494 PolarHBondContact O-N 3.48Å
1493	F	57.2	Low	67.3	Low	62 Å²	62	104.9 Å²	104.9	27%	0.272	50%	0.503	S	S	.	.			trans	-64.4	97.7	-174.9	-156.5	-98.8	0	0	0	113.3	I1420 L1487 E1490 I1495 Y1501	I1420-F1493 HydrophobicContact CD1-CE1 3.68Å; I1420-F1493 HydrophobicContact CD1-CZ 3.55Å; L1487-F1493 HydrophobicContact CD2-CD2 4.07Å; L1487-F1493 HydrophobicContact CD2-CE2 3.61Å; L1487-F1493 HydrophobicContact CD2-CZ 4.37Å; E1490-F1493 PolarHBondContact O-N 2.97Å; F1493-I1495 PolarHBondContact O-N 2.8Å; F1493-Y1501 HydrophobicContact CE2-CD1 4.15Å; F1493-Y1501 AromaticContact CE2-CD2 3.64Å; F1493-Y1501 HydrophobicContact CE2-CD2 3.64Å; F1493-Y1501 HydrophobicContact CE2-CE1 4.16Å; F1493-Y1501 AromaticContact CE2-CE2 3.67Å; F1493-Y1501 HydrophobicContact CE2-CE2 3.67Å; F1493-Y1501 AromaticContact CE2-CG 3.89Å; F1493-Y1501 HydrophobicContact CE2-CG 3.89Å; F1493-Y1501 AromaticContact CE2-CZ 3.92Å; F1493-Y1501 AromaticContact CZ-CD2 3.65Å; F1493-Y1501 HydrophobicContact CZ-CD2 3.65Å; F1493-Y1501 HydrophobicContact CZ-CE2 4.13Å; F1493-Y1501 AromaticContact CZ-CG 3.88Å; F1493-Y1501 HydrophobicContact CZ-CG 3.88Å
1494	N	59.3	Low	66.6	Low	107 Å²	107	107.7 Å²	107.7	57%	0.572	52%	0.52	S	S	*	.			trans	-76.9	113.3	-178.2	-114.2	-69.3	0	0	0	110.7	N1492 K1496 Y1497	N1492-N1494 PolarHBondContact O-N 3.48Å; N1494-K1496 PolarHBondContact O-N 3.32Å; N1494-Y1497 HydrophobicContact CB-CD2 3.75Å; N1494-Y1497 HydrophobicContact CB-CE2 4.18Å; N1494-Y1497 PolarHBondContact O-N 3.37Å
1495	I	62.9	Low	66.3	Low	137 Å²	137	106.4 Å²	106.4	70%	0.703	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-46.8	-32.4	179.6	-59.7	168.6	0	0	0	112.8	F1493 Y1497 E1498	F1493-I1495 PolarHBondContact O-N 2.8Å; I1495-Y1497 PolarHBondContact O-N 3.23Å; I1495-Y1497 VanDerWaalsContact O-N 3.16Å; I1495-E1498 WeakPolarHBondContact O-CB 3.37Å; I1495-E1498 PolarHBondContact O-N 3.39Å; I1495-E1498 VanDerWaalsContact O-N 3.12Å
1496	K	63.5	Low	66.3	Low	183 Å²	183	105.7 Å²	105.7	80%	0.796	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-59.4	-24.2	178.2	-162.1	175.8	-177.7	-176.8	0	114.1	N1494	N1494-K1496 PolarHBondContact O-N 3.32Å
1497	Y	64.6	Low	66.5	Low	127 Å²	127	101.2 Å²	101.2	50%	0.498	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-100.4	0.2	178.9	-60.3	-78.1	0	0	0	113.9	N1494 I1495 R1499 Y1500 Y1501	N1494-Y1497 HydrophobicContact CB-CD2 3.75Å; N1494-Y1497 HydrophobicContact CB-CE2 4.18Å; N1494-Y1497 PolarHBondContact O-N 3.37Å; I1495-Y1497 PolarHBondContact O-N 3.23Å; I1495-Y1497 VanDerWaalsContact O-N 3.16Å; Y1497-R1499 VanDerWaalsContact C-N 3.26Å; Y1497-R1499 PolarHBondContact O-N 3.3Å; Y1497-Y1500 WeakPolarHBondContact O-CA 3.4Å; Y1497-Y1500 WeakPolarHBondContact O-CB 3.44Å; Y1497-Y1500 PolarHBondContact O-N 3.01Å; Y1497-Y1501 WeakPolarHBondContact O-CD2 3.44Å; Y1497-Y1501 PolarHBondContact O-N 2.99Å
1498	E	66.1	Low	67	Low	46 Å²	46	100.6 Å²	100.6	22%	0.215	50%	0.498	C	S	.	.	H	α-helix	trans	-50.7	-45.7	178.8	175.5	170.8	-153.8	0	0	111.7	I1420 I1495 Y1500 I1502	I1420-E1498 HydrophobicContact CD1-CG 3.92Å; I1420-E1498 HydrophobicContact CG1-CG 4.27Å; I1495-E1498 WeakPolarHBondContact O-CB 3.37Å; I1495-E1498 PolarHBondContact O-N 3.39Å; I1495-E1498 VanDerWaalsContact O-N 3.12Å; E1498-Y1500 VanDerWaalsContact C-N 3.27Å; E1498-Y1500 PolarHBondContact O-N 3.35Å; E1498-I1502 HydrophobicContact CG-CD1 3.69Å; E1498-I1502 WeakPolarHBondContact O-CB 3.39Å; E1498-I1502 WeakPolarHBondContact O-CD1 3.5Å; E1498-I1502 WeakPolarHBondContact O-CG1 3.38Å; E1498-I1502 PolarHBondContact O-N 2.78Å
1499	R	66.2	Low	67.6	Low	219 Å²	219	101.1 Å²	101.1	83%	0.826	49%	0.487	S	S	*	.	H	α-helix	trans	-66.4	-23	176.3	-64.9	-173	-174.5	179.6	1.5	114.9	Y1497 V1503	Y1497-R1499 VanDerWaalsContact C-N 3.26Å; Y1497-R1499 PolarHBondContact O-N 3.3Å; R1499-V1503 WeakPolarHBondContact O-CG2 3.31Å
1500	Y	66.9	Low	68.7	Low	155 Å²	155	95.8 Å²	95.8	61%	0.608	47%	0.467	S	S	*	.	H	α-helix	trans	-82.8	-48.4	178.2	-173.2	-100.7	0	0	0	110.1	Y1497 E1498 I1502 V1503 T1504	Y1497-Y1500 WeakPolarHBondContact O-CA 3.4Å; Y1497-Y1500 WeakPolarHBondContact O-CB 3.44Å; Y1497-Y1500 PolarHBondContact O-N 3.01Å; E1498-Y1500 VanDerWaalsContact C-N 3.27Å; E1498-Y1500 PolarHBondContact O-N 3.35Å; Y1500-I1502 VanDerWaalsContact C-N 3.27Å; Y1500-I1502 PolarHBondContact O-N 3.3Å; Y1500-V1503 CarbonylContact O-C 3.49Å; Y1500-V1503 PolarHBondContact O-N 2.71Å; Y1500-T1504 HydrophobicContact CD1-CG2 4.38Å; Y1500-T1504 HydrophobicContact CD2-CG2 4.38Å; Y1500-T1504 HydrophobicContact CE1-CG2 3.99Å; Y1500-T1504 HydrophobicContact CE2-CG2 3.97Å; Y1500-T1504 PolarHBondContact O-N 3.25Å; Y1500-T1504 PolarHBondContact O-OG1 2.78Å
1501	Y	67.6	Low	70	Confident	78 Å²	78	90.7 Å²	90.7	31%	0.306	44%	0.443	S	S	.	.	H	α-helix	trans	-56.9	-39.7	173	-81.9	-87.5	0	0	0	112	L1487 F1493 Y1497 V1503 T1504 D1505	L1487-Y1501 HydrophobicContact CD2-CD1 4.41Å; L1487-Y1501 HydrophobicContact CD2-CE1 4.48Å; F1493-Y1501 HydrophobicContact CE2-CD1 4.15Å; F1493-Y1501 AromaticContact CE2-CD2 3.64Å; F1493-Y1501 HydrophobicContact CE2-CD2 3.64Å; F1493-Y1501 HydrophobicContact CE2-CE1 4.16Å; F1493-Y1501 AromaticContact CE2-CE2 3.67Å; F1493-Y1501 HydrophobicContact CE2-CE2 3.67Å; F1493-Y1501 AromaticContact CE2-CG 3.89Å; F1493-Y1501 HydrophobicContact CE2-CG 3.89Å; F1493-Y1501 AromaticContact CE2-CZ 3.92Å; F1493-Y1501 AromaticContact CZ-CD2 3.65Å; F1493-Y1501 HydrophobicContact CZ-CD2 3.65Å; F1493-Y1501 HydrophobicContact CZ-CE2 4.13Å; F1493-Y1501 AromaticContact CZ-CG 3.88Å; F1493-Y1501 HydrophobicContact CZ-CG 3.88Å; Y1497-Y1501 WeakPolarHBondContact O-CD2 3.44Å; Y1497-Y1501 PolarHBondContact O-N 2.99Å; Y1501-V1503 PolarHBondContact O-N 3.18Å; Y1501-T1504 PolarHBondContact O-N 3.21Å; Y1501-D1505 WeakPolarHBondContact O-CB 3.32Å; Y1501-D1505 PolarHBondContact O-N 3.32Å
1502	I	66.6	Low	71.6	Confident	40 Å²	40	88.9 Å²	88.9	21%	0.205	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.6	176.3	-72.6	168.1	0	0	0	113.8	I1420 E1498 Y1500 L1508	I1420-I1502 HydrophobicContact CD1-CG1 4.29Å; I1420-I1502 HydrophobicContact CG1-CD1 4.23Å; I1420-I1502 HydrophobicContact CG1-CG1 4.05Å; E1498-I1502 HydrophobicContact CG-CD1 3.69Å; E1498-I1502 WeakPolarHBondContact O-CB 3.39Å; E1498-I1502 WeakPolarHBondContact O-CD1 3.5Å; E1498-I1502 WeakPolarHBondContact O-CG1 3.38Å; E1498-I1502 PolarHBondContact O-N 2.78Å; Y1500-I1502 VanDerWaalsContact C-N 3.27Å; Y1500-I1502 PolarHBondContact O-N 3.3Å; I1502-L1508 HydrophobicContact CB-CD2 4.07Å; I1502-L1508 HydrophobicContact CG1-CD2 3.85Å; I1502-L1508 HydrophobicContact CG2-CD2 4.19Å
1503	V	67.1	Low	73.2	Confident	102 Å²	102	86.5 Å²	86.5	62%	0.618	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	3.6	-177.3	-177	0	0	0	0	111.9	R1499 Y1500 Y1501	R1499-V1503 WeakPolarHBondContact O-CG2 3.31Å; Y1500-V1503 CarbonylContact O-C 3.49Å; Y1500-V1503 PolarHBondContact O-N 2.71Å; Y1501-V1503 PolarHBondContact O-N 3.18Å
1504	T	67.8	Low	74.9	Confident	65 Å²	65	84.6 Å²	84.6	40%	0.399	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	-9.1	-177.2	55	0	0	0	0	115.5	Y1500 Y1501 P1506	Y1500-T1504 HydrophobicContact CD1-CG2 4.38Å; Y1500-T1504 HydrophobicContact CD2-CG2 4.38Å; Y1500-T1504 HydrophobicContact CE1-CG2 3.99Å; Y1500-T1504 HydrophobicContact CE2-CG2 3.97Å; Y1500-T1504 PolarHBondContact O-N 3.25Å; Y1500-T1504 PolarHBondContact O-OG1 2.78Å; Y1501-T1504 PolarHBondContact O-N 3.21Å; T1504-P1506 VanDerWaalsContact O-CD 3.28Å; T1504-P1506 WeakPolarHBondContact O-CD 3.25Å
1505	D	73.6	Confident	76.5	Confident	15 Å²	15	79.9 Å²	79.9	8%	0.08	38%	0.38	C	S	.	.			trans	-75.9	113.7	169.5	-169.9	-30.6	0	0	0	109.7	R1486 Y1501 I1507 L1508	R1486-D1505 IonicContact NH1-OD1 2.72Å; Y1501-D1505 WeakPolarHBondContact O-CB 3.32Å; Y1501-D1505 PolarHBondContact O-N 3.32Å; D1505-I1507 PolarHBondContact O-N 3.39Å; D1505-I1507 WeakPolarHBondContact OD1-CB 3.32Å; D1505-I1507 PolarHBondContact OD1-N 3.42Å; D1505-L1508 HydrophobicContact CB-CB 4.18Å; D1505-L1508 PolarHBondContact O-N 3Å
1506	P	80.9	Confident	77.9	Confident	100 Å²	100	75.7 Å²	75.7	65%	0.649	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-5.5	-177	29.5	-37.2	0	0	0	114	T1504 P1510	T1504-P1506 VanDerWaalsContact O-CD 3.28Å; T1504-P1506 WeakPolarHBondContact O-CD 3.25Å; P1506-P1510 WeakPolarHBondContact O-CD 3.49Å; P1506-P1510 WeakPolarHBondContact O-CG 3.31Å
1507	I	83.8	Confident	79.3	Confident	39 Å²	39	70.8 Å²	70.8	20%	0.2	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-27.6	174.9	-49.8	-178.2	0	0	0	111.5	L1479 I1482 V1483 D1505 P1510 S1511	L1479-I1507 HydrophobicContact CB-CG2 4.41Å; L1479-I1507 HydrophobicContact CD2-CG2 4.07Å; I1482-I1507 HydrophobicContact CG2-CD1 4.28Å; I1482-I1507 HydrophobicContact CG2-CG2 4.48Å; V1483-I1507 HydrophobicContact CG2-CB 3.71Å; V1483-I1507 HydrophobicContact CG2-CG2 3.65Å; D1505-I1507 PolarHBondContact O-N 3.39Å; D1505-I1507 WeakPolarHBondContact OD1-CB 3.32Å; D1505-I1507 PolarHBondContact OD1-N 3.42Å; I1507-P1510 WeakPolarHBondContact O-CD 3.27Å; I1507-P1510 WeakPolarHBondContact O-CG 3.41Å; I1507-S1511 WeakPolarHBondContact O-CB 3.17Å; I1507-S1511 PolarHBondContact O-N 3.47Å
1508	L	83.5	Confident	80.7	Confident	8 Å²	8	64.7 Å²	64.7	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-74.4	-42.6	-178.1	-167.2	76.7	0	0	0	112	F1418 V1483 I1502 D1505 S1511 R1512	F1418-L1508 HydrophobicContact CE1-CD1 4.08Å; F1418-L1508 HydrophobicContact CE1-CD2 4.47Å; F1418-L1508 HydrophobicContact CE1-CG 4.27Å; F1418-L1508 HydrophobicContact CZ-CD1 4.37Å; V1483-L1508 HydrophobicContact CG1-CD1 4.16Å; V1483-L1508 HydrophobicContact CG2-CB 4.41Å; V1483-L1508 HydrophobicContact CG2-CD1 4.43Å; I1502-L1508 HydrophobicContact CB-CD2 4.07Å; I1502-L1508 HydrophobicContact CG1-CD2 3.85Å; I1502-L1508 HydrophobicContact CG2-CD2 4.19Å; D1505-L1508 HydrophobicContact CB-CB 4.18Å; D1505-L1508 PolarHBondContact O-N 3Å; L1508-S1511 WeakPolarHBondContact O-CB 2.86Å; L1508-S1511 PolarHBondContact O-N 2.93Å; L1508-S1511 VanDerWaalsContact O-N 3.14Å; L1508-S1511 PolarHBondContact O-OG 3.05Å; L1508-R1512 PolarHBondContact O-N 3.08Å
1509	D	82.6	Confident	81.9	Confident	68 Å²	68	63.6 Å²	63.6	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-55.6	-52.6	176.6	-81.2	-36.9	0	0	0	113	S1511 R1512 I1513	D1509-S1511 VanDerWaalsContact C-N 3.31Å; D1509-S1511 PolarHBondContact O-N 3.24Å; D1509-R1512 PolarHBondContact O-N 3.26Å; D1509-R1512 VanDerWaalsContact O-N 3.15Å; D1509-I1513 WeakPolarHBondContact O-CG1 3.29Å; D1509-I1513 PolarHBondContact O-N 3.03Å
1510	P	87.6	Confident	83.2	Confident	49 Å²	49	59.3 Å²	59.3	32%	0.318	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-32.4	174.7	22.8	-31.6	0	0	0	113	L1479 P1506 I1507 R1512 I1513 C1514	L1479-P1510 HydrophobicContact CD1-CB 4.5Å; P1506-P1510 WeakPolarHBondContact O-CD 3.49Å; P1506-P1510 WeakPolarHBondContact O-CG 3.31Å; I1507-P1510 WeakPolarHBondContact O-CD 3.27Å; I1507-P1510 WeakPolarHBondContact O-CG 3.41Å; P1510-R1512 VanDerWaalsContact C-N 3.31Å; P1510-R1512 PolarHBondContact O-N 3.23Å; P1510-I1513 PolarHBondContact O-N 3.3Å; P1510-C1514 WeakPolarHBondContact O-CB 3.38Å; P1510-C1514 PolarHBondContact O-N 2.91Å; P1510-C1514 PolarHBondContact O-SG 2.89Å
1511	S	89.2	Confident	84.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-41.4	173.3	84.5	0	0	0	0	111.9	I1507 L1508 D1509 L1515	I1507-S1511 WeakPolarHBondContact O-CB 3.17Å; I1507-S1511 PolarHBondContact O-N 3.47Å; L1508-S1511 WeakPolarHBondContact O-CB 2.86Å; L1508-S1511 PolarHBondContact O-N 2.93Å; L1508-S1511 VanDerWaalsContact O-N 3.14Å; L1508-S1511 PolarHBondContact O-OG 3.05Å; D1509-S1511 VanDerWaalsContact C-N 3.31Å; D1509-S1511 PolarHBondContact O-N 3.24Å; S1511-L1515 WeakPolarHBondContact O-CG 3.35Å; S1511-L1515 PolarHBondContact O-N 3.21Å; S1511-L1515 VanDerWaalsContact O-N 3.1Å
1512	R	90	Very high	85.5	Confident	117 Å²	117	49.1 Å²	49.1	44%	0.442	27%	0.267	S	S	.	.	H	α-helix	trans	-70.9	-39	178.9	-169.4	-178.1	-176.3	-158.1	0.2	111.5	F1418 L1508 D1509 P1510 L1515 A1516	F1418-R1512 HydrophobicContact CD1-CG 4.4Å; F1418-R1512 HydrophobicContact CE1-CB 4.05Å; F1418-R1512 HydrophobicContact CE1-CG 4.1Å; F1418-R1512 HydrophobicContact CZ-CB 4.23Å; F1418-R1512 HydrophobicContact CZ-CG 4.44Å; L1508-R1512 PolarHBondContact O-N 3.08Å; D1509-R1512 PolarHBondContact O-N 3.26Å; D1509-R1512 VanDerWaalsContact O-N 3.15Å; P1510-R1512 VanDerWaalsContact C-N 3.31Å; P1510-R1512 PolarHBondContact O-N 3.23Å; R1512-L1515 PolarHBondContact O-N 2.62Å; R1512-A1516 VanDerWaalsContact O-CB 3.32Å; R1512-A1516 WeakPolarHBondContact O-CB 3.35Å; R1512-A1516 PolarHBondContact O-N 3.29Å
1513	I	90.7	Very high	86.7	Confident	100 Å²	100	52.1 Å²	52.1	51%	0.513	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-47.9	174.6	-67.7	164.2	0	0	0	110.3	D1509 P1510 L1515 A1516 I1517	D1509-I1513 WeakPolarHBondContact O-CG1 3.29Å; D1509-I1513 PolarHBondContact O-N 3.03Å; P1510-I1513 PolarHBondContact O-N 3.3Å; I1513-L1515 VanDerWaalsContact C-N 3.35Å; I1513-L1515 PolarHBondContact O-N 3.02Å; I1513-A1516 PolarHBondContact O-N 3.49Å; I1513-A1516 VanDerWaalsContact O-N 3.14Å; I1513-I1517 HydrophobicContact CG2-CD1 3.74Å; I1513-I1517 HydrophobicContact CG2-CG1 4.37Å; I1513-I1517 WeakPolarHBondContact O-CG1 3.23Å; I1513-I1517 PolarHBondContact O-N 3.3Å
1514	C	92.5	Very high	87.8	Confident	22 Å²	22	50 Å²	50	15%	0.149	26%	0.262	C	S	.	.	H	α-helix	trans	-58.4	-44.5	177.2	-67.7	0	0	0	0	112.2	P1510 I1517 S1518	P1510-C1514 WeakPolarHBondContact O-CB 3.38Å; P1510-C1514 PolarHBondContact O-N 2.91Å; P1510-C1514 PolarHBondContact O-SG 2.89Å; C1514-I1517 PolarHBondContact O-N 3.01Å; C1514-S1518 WeakPolarHBondContact O-CB 3.48Å; C1514-S1518 PolarHBondContact O-N 3.29Å
1515	L	92.1	Very high	88.8	Confident	8 Å²	8	48.4 Å²	48.4	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-33.5	176.7	-67.8	170.9	0	0	0	112.7	F1410 L1414 F1418 Y1473 S1511 R1512 I1513 L1519	F1410-L1515 HydrophobicContact CZ-CB 4.39Å; F1410-L1515 HydrophobicContact CZ-CD2 4.32Å; F1410-L1515 WeakPolarHBondContact CZ-O 2.48Å; L1414-L1515 HydrophobicContact CD1-CB 4.2Å; L1414-L1515 HydrophobicContact CD2-CB 3.82Å; L1414-L1515 HydrophobicContact CD2-CD1 4.39Å; F1418-L1515 HydrophobicContact CE2-CD1 3.7Å; F1418-L1515 HydrophobicContact CZ-CD1 4.23Å; Y1473-L1515 HydrophobicContact CD2-CD2 3.77Å; Y1473-L1515 HydrophobicContact CE2-CD2 3.94Å; Y1473-L1515 HydrophobicContact CG-CD2 4.28Å; S1511-L1515 WeakPolarHBondContact O-CG 3.35Å; S1511-L1515 PolarHBondContact O-N 3.21Å; S1511-L1515 VanDerWaalsContact O-N 3.1Å; R1512-L1515 PolarHBondContact O-N 2.62Å; I1513-L1515 VanDerWaalsContact C-N 3.35Å; I1513-L1515 PolarHBondContact O-N 3.02Å; L1515-L1519 WeakPolarHBondContact O-CB 3.13Å; L1515-L1519 PolarHBondContact O-N 3.38Å
1516	A	93.2	Very high	89.5	Confident	48 Å²	48	49.5 Å²	49.5	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-69.6	-40.3	174.8	0	0	0	0	0	112.5	R1512 I1513 L1519 F1520	R1512-A1516 VanDerWaalsContact O-CB 3.32Å; R1512-A1516 WeakPolarHBondContact O-CB 3.35Å; R1512-A1516 PolarHBondContact O-N 3.29Å; I1513-A1516 PolarHBondContact O-N 3.49Å; I1513-A1516 VanDerWaalsContact O-N 3.14Å; A1516-L1519 PolarHBondContact O-N 2.84Å; A1516-F1520 PolarHBondContact O-N 3.17Å
1517	I	92.6	Very high	89.8	Confident	80 Å²	80	48.7 Å²	48.7	41%	0.41	24%	0.243	S	C	.	.	H	α-helix	trans	-67.9	-40.1	173.8	-58.4	166.1	0	0	0	109.8	L1472 I1513 C1514 L1519 F1520 T1521	L1472-I1517 HydrophobicContact CD1-CB 4.38Å; L1472-I1517 HydrophobicContact CD1-CG2 3.71Å; I1513-I1517 HydrophobicContact CG2-CD1 3.74Å; I1513-I1517 HydrophobicContact CG2-CG1 4.37Å; I1513-I1517 WeakPolarHBondContact O-CG1 3.23Å; I1513-I1517 PolarHBondContact O-N 3.3Å; C1514-I1517 PolarHBondContact O-N 3.01Å; I1517-L1519 PolarHBondContact O-N 3.22Å; I1517-F1520 WeakPolarHBondContact O-CB 3.12Å; I1517-F1520 PolarHBondContact O-N 2.79Å; I1517-F1520 VanDerWaalsContact O-N 3.16Å; I1517-T1521 PolarHBondContact O-N 2.86Å; I1517-T1521 PolarHBondContact O-OG1 2.89Å
1518	S	93.3	Very high	89.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57.1	-47.1	171.9	176.9	0	0	0	0	112.2	G1469 Y1473 C1514 F1520 T1521 F1522	G1469-S1518 PolarHBondContact O-OG 3.49Å; Y1473-S1518 WeakPolarHBondContact CB-OG 2.92Å; Y1473-S1518 PolarHBondContact N-OG 2.63Å; C1514-S1518 WeakPolarHBondContact O-CB 3.48Å; C1514-S1518 PolarHBondContact O-N 3.29Å; S1518-F1520 VanDerWaalsContact C-N 3.33Å; S1518-F1520 PolarHBondContact O-N 3.44Å; S1518-T1521 WeakPolarHBondContact O-CB 3.36Å; S1518-T1521 PolarHBondContact O-N 3.36Å; S1518-F1522 WeakPolarHBondContact O-CD2 2.94Å; S1518-F1522 PolarHBondContact O-N 3.06Å; S1518-F1522 VanDerWaalsContact OG-CE2 3.29Å; S1518-F1522 WeakPolarHBondContact OG-CE2 2.89Å
1519	L	93.2	Very high	89.9	Confident	22 Å²	22	49.7 Å²	49.7	12%	0.115	25%	0.247	C	C	.	.	H	α-helix	trans	-59	-42.1	173.8	176.1	62.6	0	0	0	112	L1407 F1410 L1414 L1515 A1516 I1517 F1522 Y1523	L1407-L1519 HydrophobicContact CD2-CD1 4.1Å; F1410-L1519 HydrophobicContact CB-CD1 4.15Å; F1410-L1519 HydrophobicContact CD1-CB 4.09Å; F1410-L1519 HydrophobicContact CD1-CD1 3.63Å; F1410-L1519 HydrophobicContact CD1-CG 4.42Å; F1410-L1519 HydrophobicContact CE1-CB 3.8Å; F1410-L1519 HydrophobicContact CE1-CD1 4.24Å; F1410-L1519 HydrophobicContact CG-CD1 3.99Å; F1410-L1519 HydrophobicContact CZ-CB 4.18Å; L1414-L1519 HydrophobicContact CD1-CB 4.03Å; L1414-L1519 HydrophobicContact CD1-CD2 3.87Å; L1515-L1519 WeakPolarHBondContact O-CB 3.13Å; L1515-L1519 PolarHBondContact O-N 3.38Å; A1516-L1519 PolarHBondContact O-N 2.84Å; I1517-L1519 PolarHBondContact O-N 3.22Å; L1519-F1522 PolarHBondContact O-N 2.95Å; L1519-Y1523 HydrophobicContact CD1-CD2 3.89Å; L1519-Y1523 HydrophobicContact CD1-CE2 3.71Å; L1519-Y1523 HydrophobicContact CD2-CE2 4.38Å; L1519-Y1523 HydrophobicContact CG-CD2 3.96Å; L1519-Y1523 HydrophobicContact CG-CE2 3.96Å; L1519-Y1523 WeakPolarHBondContact O-CD2 3.41Å; L1519-Y1523 PolarHBondContact O-N 3.19Å
1520	F	92.6	Very high	90.1	Very high	130 Å²	130	51.3 Å²	51.3	57%	0.57	25%	0.251	S	S	*	.	H	α-helix	trans	-61.8	-43.9	175.9	176	-108.5	0	0	0	112.2	A1516 I1517 S1518 F1522 Y1523 I1524	A1516-F1520 PolarHBondContact O-N 3.17Å; I1517-F1520 WeakPolarHBondContact O-CB 3.12Å; I1517-F1520 PolarHBondContact O-N 2.79Å; I1517-F1520 VanDerWaalsContact O-N 3.16Å; S1518-F1520 VanDerWaalsContact C-N 3.33Å; S1518-F1520 PolarHBondContact O-N 3.44Å; F1520-F1522 PolarHBondContact O-N 2.92Å; F1520-Y1523 WeakPolarHBondContact O-CA 3.49Å; F1520-Y1523 WeakPolarHBondContact O-CB 3.36Å; F1520-Y1523 PolarHBondContact O-N 2.98Å; F1520-I1524 HydrophobicContact CD1-CD1 4.12Å; F1520-I1524 HydrophobicContact CE1-CD1 3.61Å; F1520-I1524 HydrophobicContact CE1-CG1 4.39Å; F1520-I1524 HydrophobicContact CZ-CD1 3.88Å; F1520-I1524 HydrophobicContact CZ-CG1 4.32Å; F1520-I1524 PolarHBondContact O-N 3.09Å
1521	T	90.8	Very high	89.9	Confident	13 Å²	13	49 Å²	49	8%	0.08	24%	0.236	C	C	.	.	H	α-helix	trans	-58.9	-45.6	174	-55.7	0	0	0	0	111.8	L1465 I1517 S1518 Y1523 I1524 R1525	L1465-T1521 HydrophobicContact CD1-CG2 3.76Å; L1465-T1521 HydrophobicContact CG-CG2 3.8Å; L1465-T1521 WeakPolarHBondContact O-CG2 3.33Å; I1517-T1521 PolarHBondContact O-N 2.86Å; I1517-T1521 PolarHBondContact O-OG1 2.89Å; S1518-T1521 WeakPolarHBondContact O-CB 3.36Å; S1518-T1521 PolarHBondContact O-N 3.36Å; T1521-Y1523 VanDerWaalsContact C-N 3.27Å; T1521-Y1523 PolarHBondContact O-N 3.03Å; T1521-I1524 PolarHBondContact O-N 3.35Å; T1521-R1525 PolarHBondContact O-N 3.31Å; T1521-R1525 VanDerWaalsContact O-N 3.14Å
1522	F	91.5	Very high	89.7	Confident	5 Å²	5	51.1 Å²	51.1	2%	0.022	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-27.6	174.1	-69.9	-55.1	0	0	0	113.1	Y1403 F1406 L1407 F1410 L1470 S1518 L1519 F1520	Y1403-F1522 WeakPolarHBondContact CE1-O 3.38Å; Y1403-F1522 WeakPolarHBondContact OH-CA 3.29Å; Y1403-F1522 WeakPolarHBondContact OH-CB 3.2Å; Y1403-F1522 PolarHBondContact OH-O 3.21Å; F1406-F1522 HydrophobicContact CE1-CB 4.37Å; F1406-F1522 HydrophobicContact CE1-CD1 4.4Å; F1406-F1522 HydrophobicContact CE1-CD2 4.21Å; F1406-F1522 HydrophobicContact CE1-CG 4.09Å; F1406-F1522 HydrophobicContact CZ-CD2 4.17Å; F1406-F1522 HydrophobicContact CZ-CE2 4.25Å; F1406-F1522 HydrophobicContact CZ-CG 4.5Å; L1407-F1522 HydrophobicContact CD2-CB 3.74Å; F1410-F1522 HydrophobicContact CD1-CD2 4.37Å; F1410-F1522 HydrophobicContact CE1-CD2 4.01Å; F1410-F1522 HydrophobicContact CE1-CE2 4.3Å; L1470-F1522 HydrophobicContact CD2-CZ 4.11Å; L1470-F1522 HydrophobicContact CG-CE1 4.5Å; L1470-F1522 HydrophobicContact CG-CZ 4.26Å; S1518-F1522 WeakPolarHBondContact O-CD2 2.94Å; S1518-F1522 PolarHBondContact O-N 3.06Å; S1518-F1522 VanDerWaalsContact OG-CE2 3.29Å; S1518-F1522 WeakPolarHBondContact OG-CE2 2.89Å; L1519-F1522 PolarHBondContact O-N 2.95Å; F1520-F1522 PolarHBondContact O-N 2.92Å
1523	Y	92.1	Very high	89.5	Confident	103 Å²	103	50.2 Å²	50.2	40%	0.404	25%	0.246	S	C	.	.	H	α-helix	trans	-70.7	-40.5	170.3	-94.3	-69.4	0	0	0	112.8	L1407 S1411 L1519 F1520 T1521 R1525 L1526	L1407-Y1523 HydrophobicContact CB-CE1 4.4Å; L1407-Y1523 HydrophobicContact CD1-CD1 3.99Å; L1407-Y1523 HydrophobicContact CD1-CE1 4.01Å; L1407-Y1523 HydrophobicContact CD2-CD2 4.22Å; L1407-Y1523 HydrophobicContact CD2-CE2 4.36Å; L1407-Y1523 HydrophobicContact CD2-CG 4.3Å; S1411-Y1523 PolarHBondContact OG-OH 2.79Å; L1519-Y1523 HydrophobicContact CD1-CD2 3.89Å; L1519-Y1523 HydrophobicContact CD1-CE2 3.71Å; L1519-Y1523 HydrophobicContact CD2-CE2 4.38Å; L1519-Y1523 HydrophobicContact CG-CD2 3.96Å; L1519-Y1523 HydrophobicContact CG-CE2 3.96Å; L1519-Y1523 WeakPolarHBondContact O-CD2 3.41Å; L1519-Y1523 PolarHBondContact O-N 3.19Å; F1520-Y1523 WeakPolarHBondContact O-CA 3.49Å; F1520-Y1523 WeakPolarHBondContact O-CB 3.36Å; F1520-Y1523 PolarHBondContact O-N 2.98Å; T1521-Y1523 VanDerWaalsContact C-N 3.27Å; T1521-Y1523 PolarHBondContact O-N 3.03Å; Y1523-R1525 VanDerWaalsContact C-N 3.29Å; Y1523-R1525 PolarHBondContact O-N 2.99Å; Y1523-L1526 WeakPolarHBondContact O-CB 3.42Å; Y1523-L1526 PolarHBondContact O-N 3.46Å; Y1523-L1526 VanDerWaalsContact O-N 3.09Å
1524	I	90.7	Very high	89.1	Confident	59 Å²	59	50.9 Å²	50.9	30%	0.303	25%	0.249	S	C	.	.	H	α-helix	trans	-59.8	-41.2	174.8	-64.6	173	0	0	0	110.5	L1465 F1520 T1521 L1526 M1527	L1465-I1524 HydrophobicContact CD2-CB 4.09Å; L1465-I1524 HydrophobicContact CD2-CG2 3.67Å; F1520-I1524 HydrophobicContact CD1-CD1 4.12Å; F1520-I1524 HydrophobicContact CE1-CD1 3.61Å; F1520-I1524 HydrophobicContact CE1-CG1 4.39Å; F1520-I1524 HydrophobicContact CZ-CD1 3.88Å; F1520-I1524 HydrophobicContact CZ-CG1 4.32Å; F1520-I1524 PolarHBondContact O-N 3.09Å; T1521-I1524 PolarHBondContact O-N 3.35Å; I1524-L1526 PolarHBondContact O-N 3.11Å; I1524-M1527 VanDerWaalsContact O-CB 3.3Å; I1524-M1527 WeakPolarHBondContact O-CB 3.49Å; I1524-M1527 WeakPolarHBondContact O-CG 3.33Å; I1524-M1527 PolarHBondContact O-N 3.22Å
1525	R	88.8	Confident	88.8	Confident	30 Å²	30	52.4 Å²	52.4	11%	0.113	26%	0.264	C	S	.	.	H	α-helix	trans	-55.7	-23.5	176.4	-179.3	56.2	151.5	154.9	-14	113.8	L1465 D1466 T1521 Y1523 M1527 Y1528	L1465-R1525 HydrophobicContact CD2-CB 4.39Å; D1466-R1525 WeakPolarHBondContact OD1-CD 3.22Å; D1466-R1525 WeakPolarHBondContact OD1-CG 3.47Å; D1466-R1525 IonicContact OD1-CZ 2.72Å; D1466-R1525 IonicContact OD1-NE 3.05Å; D1466-R1525 PolarHBondContact OD1-NE 3.47Å; D1466-R1525 IonicContact OD2-CZ 2.7Å; D1466-R1525 IonicContact OD2-NE 3.84Å; D1466-R1525 PolarHBondContact OD2-NE 3.03Å; D1466-R1525 IonicContact OD2-NH2 2.67Å; D1466-R1525 PolarHBondContact OD2-NH2 3.03Å; T1521-R1525 PolarHBondContact O-N 3.31Å; T1521-R1525 VanDerWaalsContact O-N 3.14Å; Y1523-R1525 VanDerWaalsContact C-N 3.29Å; Y1523-R1525 PolarHBondContact O-N 2.99Å; R1525-M1527 PolarHBondContact O-N 3.48Å; R1525-Y1528 WeakPolarHBondContact O-CB 3.2Å; R1525-Y1528 PolarHBondContact O-N 3.36Å
1526	L	87.2	Confident	88.5	Confident	38 Å²	38	55.8 Å²	55.8	20%	0.199	28%	0.281	C	S	.	.	H	α-helix	trans	-60.3	-29.8	173.6	-167	146.5	0	0	0	112.2	I1404 L1407 Y1523 I1524 Y1528 T1529 F1530	I1404-L1526 HydrophobicContact CG1-CD1 4.24Å; L1407-L1526 HydrophobicContact CD1-CD1 3.81Å; Y1523-L1526 WeakPolarHBondContact O-CB 3.42Å; Y1523-L1526 PolarHBondContact O-N 3.46Å; Y1523-L1526 VanDerWaalsContact O-N 3.09Å; I1524-L1526 PolarHBondContact O-N 3.11Å; L1526-Y1528 VanDerWaalsContact C-N 3.27Å; L1526-Y1528 PolarHBondContact O-N 3.27Å; L1526-T1529 WeakPolarHBondContact O-CB 3.13Å; L1526-T1529 PolarHBondContact O-N 2.91Å; L1526-T1529 PolarHBondContact O-OG1 3.07Å; L1526-F1530 HydrophobicContact CD2-CD2 4.43Å; L1526-F1530 HydrophobicContact CD2-CE1 3.93Å; L1526-F1530 HydrophobicContact CD2-CE2 3.61Å; L1526-F1530 HydrophobicContact CD2-CZ 3.31Å
1527	M	87.3	Confident	88.1	Confident	84 Å²	84	53.5 Å²	53.5	41%	0.414	26%	0.262	S	S	.	.	H	α-helix	trans	-58.5	-34.7	176.8	-67.4	-171.6	68.9	0	0	113.2	W1462 I1524 R1525 T1529 F1530 L1540	W1462-M1527 HydrophobicContact CH2-CB 4.07Å; I1524-M1527 VanDerWaalsContact O-CB 3.3Å; I1524-M1527 WeakPolarHBondContact O-CB 3.49Å; I1524-M1527 WeakPolarHBondContact O-CG 3.33Å; I1524-M1527 PolarHBondContact O-N 3.22Å; R1525-M1527 PolarHBondContact O-N 3.48Å; M1527-T1529 PolarHBondContact O-N 2.83Å; M1527-F1530 WeakPolarHBondContact O-CB 3.45Å; M1527-F1530 PolarHBondContact O-N 2.68Å; M1527-L1540 HydrophobicContact CB-CD1 4.1Å; M1527-L1540 HydrophobicContact CE-CD1 4.35Å; M1527-L1540 VanDerWaalsContact O-CD1 3.23Å; M1527-L1540 WeakPolarHBondContact O-CD1 3.21Å
1528	Y	86.1	Confident	87.7	Confident	38 Å²	38	50.6 Å²	50.6	15%	0.149	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-35.7	174.3	177.1	-89.1	0	0	0	111.6	W1462 R1525 L1526 F1530 S1531	W1462-Y1528 AromaticContact CD1-CD2 3.79Å; W1462-Y1528 AromaticContact CD2-CD2 3.86Å; W1462-Y1528 HydrophobicContact CD2-CD2 3.86Å; W1462-Y1528 HydrophobicContact CD2-CG 4.4Å; W1462-Y1528 AromaticContact CE2-CD2 3.92Å; W1462-Y1528 AromaticContact CG-CD2 3.8Å; W1462-Y1528 HydrophobicContact CG-CD2 3.8Å; W1462-Y1528 HydrophobicContact CG-CE2 4.42Å; W1462-Y1528 AromaticContact NE1-CD2 3.85Å; R1525-Y1528 WeakPolarHBondContact O-CB 3.2Å; R1525-Y1528 PolarHBondContact O-N 3.36Å; L1526-Y1528 VanDerWaalsContact C-N 3.27Å; L1526-Y1528 PolarHBondContact O-N 3.27Å; Y1528-F1530 PolarHBondContact O-N 3.46Å; Y1528-S1531 WeakPolarHBondContact O-CB 3.45Å; Y1528-S1531 PolarHBondContact O-N 3.06Å; Y1528-S1531 VanDerWaalsContact O-N 3.09Å; Y1528-S1531 PolarHBondContact O-OG 2.7Å
1529	T	84.3	Confident	87.4	Confident	29 Å²	29	56.3 Å²	56.3	18%	0.178	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-29.8	177.1	-49.1	0	0	0	0	112.4	F1396 T1400 L1526 M1527 S1531	F1396-T1529 HydrophobicContact CE2-CG2 3.98Å; F1396-T1529 HydrophobicContact CZ-CG2 3.76Å; T1400-T1529 HydrophobicContact CG2-CG2 3.77Å; T1400-T1529 WeakPolarHBondContact OG1-CG2 3.45Å; L1526-T1529 WeakPolarHBondContact O-CB 3.13Å; L1526-T1529 PolarHBondContact O-N 2.91Å; L1526-T1529 PolarHBondContact O-OG1 3.07Å; M1527-T1529 PolarHBondContact O-N 2.83Å; T1529-S1531 VanDerWaalsContact C-N 3.32Å
1530	F	86	Confident	87	Confident	102 Å²	102	56.6 Å²	56.6	45%	0.447	28%	0.275	S	S	.	.	H	α-helix	trans	-76.1	-16.1	176.9	-59.8	-36.9	0	0	0	113.6	L1526 M1527 Y1528 F1532 H1533 L1536	L1526-F1530 HydrophobicContact CD2-CD2 4.43Å; L1526-F1530 HydrophobicContact CD2-CE1 3.93Å; L1526-F1530 HydrophobicContact CD2-CE2 3.61Å; L1526-F1530 HydrophobicContact CD2-CZ 3.31Å; M1527-F1530 WeakPolarHBondContact O-CB 3.45Å; M1527-F1530 PolarHBondContact O-N 2.68Å; Y1528-F1530 PolarHBondContact O-N 3.46Å; F1530-F1532 PolarHBondContact O-N 2.67Å; F1530-H1533 WeakPolarHBondContact O-CB 3.38Å; F1530-H1533 PolarHBondContact O-N 2.73Å; F1530-L1536 HydrophobicContact CB-CB 4.44Å; F1530-L1536 HydrophobicContact CB-CD1 4.26Å; F1530-L1536 HydrophobicContact CG-CD1 4.45Å
1531	S	84.6	Confident	86.5	Confident	1 Å²	1	52 Å²	52	1%	0.007	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-28.1	178.2	68.5	0	0	0	0	113.2	Y1528 T1529 H1533 G1537 W1678 M1685	Y1528-S1531 WeakPolarHBondContact O-CB 3.45Å; Y1528-S1531 PolarHBondContact O-N 3.06Å; Y1528-S1531 VanDerWaalsContact O-N 3.09Å; Y1528-S1531 PolarHBondContact O-OG 2.7Å; T1529-S1531 VanDerWaalsContact C-N 3.32Å; S1531-H1533 PolarHBondContact O-N 3.14Å; S1531-G1537 WeakPolarHBondContact O-CA 3.47Å; S1531-W1678 PolarHBondContact O-NE1 3.36Å; S1531-M1685 PolarHBondContact OG-SD 3.31Å
1532	F	83.5	Confident	86.2	Confident	44 Å²	44	52.1 Å²	52.1	19%	0.193	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-21.3	172.8	-171	-94	0	0	0	113.6	W1294 F1396 F1530 M1685	W1294-F1532 HydrophobicContact CD2-CE2 4.13Å; W1294-F1532 HydrophobicContact CD2-CZ 4.07Å; W1294-F1532 AromaticContact CE2-CE1 3.99Å; W1294-F1532 AromaticContact CE2-CE2 3.62Å; W1294-F1532 AromaticContact CE2-CZ 3.25Å; W1294-F1532 HydrophobicContact CE3-CE2 4.44Å; W1294-F1532 HydrophobicContact CH2-CD2 4.11Å; W1294-F1532 AromaticContact CH2-CE2 3.77Å; W1294-F1532 HydrophobicContact CH2-CE2 3.77Å; W1294-F1532 HydrophobicContact CH2-CZ 4.11Å; W1294-F1532 HydrophobicContact CZ2-CD1 4.29Å; W1294-F1532 HydrophobicContact CZ2-CD2 4.04Å; W1294-F1532 AromaticContact CZ2-CE1 3.73Å; W1294-F1532 HydrophobicContact CZ2-CE1 3.73Å; W1294-F1532 AromaticContact CZ2-CE2 3.43Å; W1294-F1532 HydrophobicContact CZ2-CE2 3.43Å; W1294-F1532 VanDerWaalsContact CZ2-CE2 3.43Å; W1294-F1532 HydrophobicContact CZ2-CG 4.45Å; W1294-F1532 AromaticContact CZ2-CZ 3.28Å; W1294-F1532 HydrophobicContact CZ2-CZ 3.28Å; W1294-F1532 HydrophobicContact CZ3-CE2 4.28Å; W1294-F1532 AromaticContact NE1-CE1 3.93Å; W1294-F1532 AromaticContact NE1-CZ 3.29Å; W1294-F1532 VanDerWaalsContact NE1-CZ 3.29Å; F1396-F1532 HydrophobicContact CE1-CD1 4.36Å; F1396-F1532 HydrophobicContact CZ-CB 4.12Å; F1396-F1532 HydrophobicContact CZ-CG 4.37Å; F1530-F1532 PolarHBondContact O-N 2.67Å; F1532-M1685 HydrophobicContact CB-CE 4.33Å; F1532-M1685 HydrophobicContact CB-SD 4.04Å; F1532-M1685 HydrophobicContact CD2-CE 4.27Å; F1532-M1685 HydrophobicContact CD2-SD 4.37Å
1533	H	85.5	Confident	86	Confident	98 Å²	98	56.3 Å²	56.3	45%	0.454	28%	0.277	S	S	.	.	S	Bend	trans	-82.3	122.8	-178.2	-176.8	-93.8	0	0	0	111.6	F1530 S1531 A1535 L1536 G1537	F1530-H1533 WeakPolarHBondContact O-CB 3.38Å; F1530-H1533 PolarHBondContact O-N 2.73Å; S1531-H1533 PolarHBondContact O-N 3.14Å; H1533-A1535 PolarHBondContact ND1-N 3.17Å; H1533-A1535 PolarHBondContact O-N 3.31Å; H1533-L1536 HydrophobicContact CB-CB 4.2Å; H1533-L1536 HydrophobicContact CB-CD1 4.29Å; H1533-L1536 HydrophobicContact CB-CG 4.48Å; H1533-L1536 PolarHBondContact O-N 2.94Å; H1533-G1537 PolarHBondContact O-N 3.47Å
1534	I	83.9	Confident	85.6	Confident	114 Å²	114	53 Å²	53	59%	0.585	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-33	-171.1	-168.9	164.5	0	0	0	115.4	P1538 W1678	I1534-P1538 VanDerWaalsContact O-CD 3.22Å; I1534-P1538 WeakPolarHBondContact O-CD 3.36Å; I1534-P1538 WeakPolarHBondContact O-CG 3.47Å; I1534-W1678 HydrophobicContact CB-CH2 3.77Å; I1534-W1678 HydrophobicContact CB-CZ2 3.83Å; I1534-W1678 HydrophobicContact CB-CZ3 4.36Å; I1534-W1678 HydrophobicContact CD1-CH2 3.93Å; I1534-W1678 HydrophobicContact CD1-CZ3 3.91Å; I1534-W1678 HydrophobicContact CG1-CE3 4.23Å; I1534-W1678 HydrophobicContact CG1-CH2 3.67Å; I1534-W1678 HydrophobicContact CG1-CZ2 4.11Å; I1534-W1678 HydrophobicContact CG1-CZ3 3.74Å
1535	A	85.3	Confident	85.3	Confident	55 Å²	55	53.5 Å²	53.5	46%	0.455	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-0.4	179.1	0	0	0	0	0	114.8	H1533	H1533-A1535 PolarHBondContact ND1-N 3.17Å; H1533-A1535 PolarHBondContact O-N 3.31Å
1536	L	86.8	Confident	85.3	Confident	78 Å²	78	53.2 Å²	53.2	41%	0.408	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-35.3	179.4	-65.2	174.9	0	0	0	112.8	F1530 H1533 K1539 L1540	F1530-L1536 HydrophobicContact CB-CB 4.44Å; F1530-L1536 HydrophobicContact CB-CD1 4.26Å; F1530-L1536 HydrophobicContact CG-CD1 4.45Å; H1533-L1536 HydrophobicContact CB-CB 4.2Å; H1533-L1536 HydrophobicContact CB-CD1 4.29Å; H1533-L1536 HydrophobicContact CB-CG 4.48Å; H1533-L1536 PolarHBondContact O-N 2.94Å; L1536-K1539 CarbonylContact O-C 2.96Å; L1536-K1539 PolarHBondContact O-N 3.45Å; L1536-L1540 WeakPolarHBondContact O-CB 3.25Å; L1536-L1540 PolarHBondContact O-N 3.25Å
1537	G	84.1	Confident	85.3	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-55.4	-49.5	174.4	0	0	0	0	0	114.4	S1531 H1533 K1539 L1540 I1541	S1531-G1537 WeakPolarHBondContact O-CA 3.47Å; H1533-G1537 PolarHBondContact O-N 3.47Å; G1537-K1539 VanDerWaalsContact C-N 3.27Å; G1537-K1539 PolarHBondContact O-N 2.89Å; G1537-L1540 PolarHBondContact O-N 3.09Å; G1537-I1541 PolarHBondContact O-N 3.25Å; G1537-I1541 VanDerWaalsContact O-N 3.09Å
1538	P	83.9	Confident	85.3	Confident	20 Å²	20	54.2 Å²	54.2	13%	0.13	29%	0.288	C	S	.	.	H	α-helix	trans	-56	-42	174.3	-24.9	33.8	0	0	0	112.5	I1534 I1541 M1542 W1678	I1534-P1538 VanDerWaalsContact O-CD 3.22Å; I1534-P1538 WeakPolarHBondContact O-CD 3.36Å; I1534-P1538 WeakPolarHBondContact O-CG 3.47Å; P1538-I1541 PolarHBondContact O-N 3.41Å; P1538-M1542 WeakPolarHBondContact O-CB 3.37Å; P1538-M1542 PolarHBondContact O-N 2.91Å; P1538-W1678 HydrophobicContact CG-CB 3.89Å; P1538-W1678 HydrophobicContact CG-CG 4.01Å
1539	K	86.2	Confident	85.3	Confident	120 Å²	120	56.9 Å²	56.9	52%	0.522	30%	0.304	S	S	.	.	H	α-helix	trans	-69.8	-34	179.8	-59	-165.5	178.3	-157.7	0	112.7	L1536 G1537 M1542 I1543	L1536-K1539 CarbonylContact O-C 2.96Å; L1536-K1539 PolarHBondContact O-N 3.45Å; G1537-K1539 VanDerWaalsContact C-N 3.27Å; G1537-K1539 PolarHBondContact O-N 2.89Å; K1539-M1542 PolarHBondContact O-N 2.88Å; K1539-I1543 WeakPolarHBondContact O-CB 3.46Å; K1539-I1543 WeakPolarHBondContact O-CD1 3.24Å; K1539-I1543 WeakPolarHBondContact O-CG1 3.07Å; K1539-I1543 PolarHBondContact O-N 2.84Å
1540	L	85.8	Confident	85.7	Confident	27 Å²	27	56.3 Å²	56.3	14%	0.141	30%	0.3	C	S	.	.	H	α-helix	trans	-68.7	-41.5	176.5	-172	154.3	0	0	0	111.2	W1462 M1527 L1536 G1537 G1544	W1462-L1540 HydrophobicContact CZ2-CD2 4.21Å; M1527-L1540 HydrophobicContact CB-CD1 4.1Å; M1527-L1540 HydrophobicContact CE-CD1 4.35Å; M1527-L1540 VanDerWaalsContact O-CD1 3.23Å; M1527-L1540 WeakPolarHBondContact O-CD1 3.21Å; L1536-L1540 WeakPolarHBondContact O-CB 3.25Å; L1536-L1540 PolarHBondContact O-N 3.25Å; G1537-L1540 PolarHBondContact O-N 3.09Å; L1540-G1544 PolarHBondContact O-N 3.18Å
1541	I	81.8	Confident	85.9	Confident	35 Å²	35	53.6 Å²	53.6	18%	0.179	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-44.1	173.1	-63.4	171.3	0	0	0	110.6	G1537 P1538 G1544 K1545	G1537-I1541 PolarHBondContact O-N 3.25Å; G1537-I1541 VanDerWaalsContact O-N 3.09Å; P1538-I1541 PolarHBondContact O-N 3.41Å; I1541-G1544 PolarHBondContact O-N 3.35Å; I1541-K1545 PolarHBondContact O-N 3.49Å
1542	M	83.7	Confident	86.1	Confident	14 Å²	14	58 Å²	58	7%	0.069	31%	0.313	C	S	.	.	H	α-helix	trans	-61.2	-50.9	177.7	177.3	-174.1	-87.8	0	0	112.2	P1538 K1539 G1544 K1545 M1546 Y1667 I1670 E1671	P1538-M1542 WeakPolarHBondContact O-CB 3.37Å; P1538-M1542 PolarHBondContact O-N 2.91Å; K1539-M1542 PolarHBondContact O-N 2.88Å; M1542-G1544 VanDerWaalsContact C-N 3.3Å; M1542-G1544 PolarHBondContact O-N 2.99Å; M1542-K1545 PolarHBondContact O-N 3.05Å; M1542-M1546 HydrophobicContact CG-CE 3.81Å; M1542-M1546 HydrophobicContact CG-SD 3.96Å; M1542-M1546 WeakPolarHBondContact O-CG 3.42Å; M1542-M1546 PolarHBondContact O-N 3.43Å; M1542-M1546 HydrophobicContact SD-CE 4.26Å; M1542-Y1667 HydrophobicContact CE-CD1 4.45Å; M1542-Y1667 HydrophobicContact CE-CD2 3.68Å; M1542-Y1667 HydrophobicContact CE-CE1 4.41Å; M1542-Y1667 HydrophobicContact CE-CE2 3.67Å; M1542-Y1667 HydrophobicContact CE-CG 4.07Å; M1542-Y1667 HydrophobicContact SD-CD2 3.37Å; M1542-Y1667 WeakPolarHBondContact SD-CD2 3.19Å; M1542-Y1667 HydrophobicContact SD-CE2 3.4Å; M1542-Y1667 WeakPolarHBondContact SD-CE2 3.47Å; M1542-Y1667 HydrophobicContact SD-CG 4.27Å; M1542-I1670 HydrophobicContact CB-CG2 4Å; M1542-I1670 HydrophobicContact CE-CB 4.45Å; M1542-I1670 HydrophobicContact CE-CG2 4.37Å; M1542-I1670 HydrophobicContact CG-CG2 4.28Å; M1542-E1671 HydrophobicContact CE-CB 3.81Å
1543	I	87.4	Confident	86.3	Confident	93 Å²	93	58.7 Å²	58.7	48%	0.477	32%	0.322	S	S	.	.	H	α-helix	trans	-57.7	-43.7	174.5	-69.9	163.1	0	0	0	110.5	K1539 K1545 M1546 V1547	K1539-I1543 WeakPolarHBondContact O-CB 3.46Å; K1539-I1543 WeakPolarHBondContact O-CD1 3.24Å; K1539-I1543 WeakPolarHBondContact O-CG1 3.07Å; K1539-I1543 PolarHBondContact O-N 2.84Å; I1543-K1545 PolarHBondContact O-N 3.17Å; I1543-M1546 PolarHBondContact O-N 3Å; I1543-V1547 HydrophobicContact CG2-CG2 4.32Å; I1543-V1547 WeakPolarHBondContact O-CB 3.46Å; I1543-V1547 VanDerWaalsContact O-CG2 3.25Å; I1543-V1547 WeakPolarHBondContact O-CG2 3.47Å; I1543-V1547 PolarHBondContact O-N 3.35Å
1544	G	84.2	Confident	86.5	Confident	35 Å²	35	54.5 Å²	54.5	36%	0.361	30%	0.302	S	S	.	.	H	α-helix	trans	-56.7	-48.7	176.9	0	0	0	0	0	112.7	L1540 I1541 M1542 V1547 T1548	L1540-G1544 PolarHBondContact O-N 3.18Å; I1541-G1544 PolarHBondContact O-N 3.35Å; M1542-G1544 VanDerWaalsContact C-N 3.3Å; M1542-G1544 PolarHBondContact O-N 2.99Å; G1544-V1547 PolarHBondContact O-N 2.65Å; G1544-T1548 PolarHBondContact O-N 3.48Å; G1544-T1548 PolarHBondContact O-OG1 3.44Å
1545	K	85.1	Confident	86.7	Confident	68 Å²	68	53.5 Å²	53.5	30%	0.296	30%	0.296	S	S	.	.	H	α-helix	trans	-67.9	-39.7	177.9	-77.7	-172.4	171.9	-170.8	0	113.6	I1541 M1542 I1543 V1547 T1548 N1549 I1670	I1541-K1545 PolarHBondContact O-N 3.49Å; M1542-K1545 PolarHBondContact O-N 3.05Å; I1543-K1545 PolarHBondContact O-N 3.17Å; K1545-V1547 VanDerWaalsContact C-N 3.29Å; K1545-V1547 PolarHBondContact O-N 3.37Å; K1545-T1548 WeakPolarHBondContact CA-OG1 3.24Å; K1545-T1548 PolarHBondContact O-N 3.48Å; K1545-T1548 PolarHBondContact O-OG1 3.1Å; K1545-N1549 WeakPolarHBondContact O-CB 3.25Å; K1545-N1549 VanDerWaalsContact O-CG 3.25Å; K1545-N1549 PolarHBondContact O-N 2.95Å; K1545-N1549 PolarHBondContact O-OD1 2.78Å; K1545-I1670 HydrophobicContact CB-CD1 3.52Å; K1545-I1670 HydrophobicContact CD-CD1 3.69Å; K1545-I1670 HydrophobicContact CD-CG1 4.08Å; K1545-I1670 HydrophobicContact CG-CD1 4.25Å
1546	M	88.5	Confident	86.9	Confident	25 Å²	25	56 Å²	56	12%	0.123	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-40.3	173.6	-73	169.7	163.6	0	0	111.6	M1542 I1543 D1550 L1551 F1663 Y1667	M1542-M1546 HydrophobicContact CG-CE 3.81Å; M1542-M1546 HydrophobicContact CG-SD 3.96Å; M1542-M1546 WeakPolarHBondContact O-CG 3.42Å; M1542-M1546 PolarHBondContact O-N 3.43Å; M1542-M1546 HydrophobicContact SD-CE 4.26Å; I1543-M1546 PolarHBondContact O-N 3Å; M1546-D1550 WeakPolarHBondContact O-CB 3.5Å; M1546-D1550 PolarHBondContact O-N 3.35Å; M1546-L1551 PolarHBondContact O-N 3.11Å; M1546-F1663 HydrophobicContact CB-CD1 4.11Å; M1546-F1663 HydrophobicContact CB-CE1 4.01Å; M1546-F1663 WeakPolarHBondContact CE-O 3.22Å; M1546-F1663 HydrophobicContact CG-CD1 4.28Å; M1546-Y1667 HydrophobicContact CE-CD2 3.92Å; M1546-Y1667 HydrophobicContact CE-CG 4.24Å
1547	V	87.3	Confident	87	Confident	62 Å²	62	55.9 Å²	55.9	38%	0.376	30%	0.3	S	S	.	.	I	π-helix	trans	-65.4	-45.8	176.4	168.7	0	0	0	0	111	I1543 G1544 K1545 L1551 I1552	I1543-V1547 HydrophobicContact CG2-CG2 4.32Å; I1543-V1547 WeakPolarHBondContact O-CB 3.46Å; I1543-V1547 VanDerWaalsContact O-CG2 3.25Å; I1543-V1547 WeakPolarHBondContact O-CG2 3.47Å; I1543-V1547 PolarHBondContact O-N 3.35Å; G1544-V1547 PolarHBondContact O-N 2.65Å; K1545-V1547 VanDerWaalsContact C-N 3.29Å; K1545-V1547 PolarHBondContact O-N 3.37Å; V1547-L1551 HydrophobicContact CG1-CD2 4.5Å; V1547-L1551 HydrophobicContact CG2-CD2 4.08Å; V1547-I1552 WeakPolarHBondContact O-CG1 3.34Å; V1547-I1552 PolarHBondContact O-N 2.88Å
1548	T	86.2	Confident	87.2	Confident	80 Å²	80	56.3 Å²	56.3	49%	0.491	30%	0.302	S	S	.	.	I	π-helix	trans	-72.1	-38.7	-179.1	54.6	0	0	0	0	113.7	G1544 K1545	G1544-T1548 PolarHBondContact O-N 3.48Å; G1544-T1548 PolarHBondContact O-OG1 3.44Å; K1545-T1548 WeakPolarHBondContact CA-OG1 3.24Å; K1545-T1548 PolarHBondContact O-N 3.48Å; K1545-T1548 PolarHBondContact O-OG1 3.1Å
1549	N	87.9	Confident	87.4	Confident	94 Å²	94	57.8 Å²	57.8	50%	0.503	31%	0.311	S	S	.	.	I	π-helix	trans	-93.7	-37.9	-167.9	-62.7	15	0	0	0	112.9	K1545 P1553	K1545-N1549 WeakPolarHBondContact O-CB 3.25Å; K1545-N1549 VanDerWaalsContact O-CG 3.25Å; K1545-N1549 PolarHBondContact O-N 2.95Å; K1545-N1549 PolarHBondContact O-OD1 2.78Å; N1549-P1553 WeakPolarHBondContact O-CD 3.34Å; N1549-P1553 WeakPolarHBondContact O-CG 3.41Å
1550	D	92.2	Very high	87.6	Confident	17 Å²	17	57 Å²	57	9%	0.091	32%	0.316	C	S	.	.	I	π-helix	trans	-110.8	-45.5	-171.4	-48.1	-46.1	0	0	0	111.8	M1546 F1554 M1662 F1663 T1666	M1546-D1550 WeakPolarHBondContact O-CB 3.5Å; M1546-D1550 PolarHBondContact O-N 3.35Å; D1550-F1554 VanDerWaalsContact O-CB 3.27Å; D1550-F1554 WeakPolarHBondContact O-CB 3.49Å; D1550-F1554 PolarHBondContact O-N 3.38Å; D1550-M1662 HydrophobicContact CB-CB 4.19Å; D1550-M1662 HydrophobicContact CB-CE 4.44Å; D1550-F1663 HydrophobicContact CB-CD1 3.83Å; D1550-F1663 HydrophobicContact CB-CE1 3.82Å; D1550-T1666 VanDerWaalsContact OD1-CG2 3.31Å; D1550-T1666 WeakPolarHBondContact OD1-CG2 3.45Å; D1550-T1666 WeakPolarHBondContact OD2-CB 3.45Å; D1550-T1666 WeakPolarHBondContact OD2-CG2 3.42Å; D1550-T1666 PolarHBondContact OD2-OG1 3.04Å
1551	L	89.8	Confident	87.8	Confident	45 Å²	45	57.6 Å²	57.6	24%	0.236	32%	0.319	C	S	.	.	I	π-helix	trans	-72.1	-38.3	-173.3	-172.3	62.3	0	0	0	113	M1546 V1547 F1554 M1555 L1659 F1663	M1546-L1551 PolarHBondContact O-N 3.11Å; V1547-L1551 HydrophobicContact CG1-CD2 4.5Å; V1547-L1551 HydrophobicContact CG2-CD2 4.08Å; L1551-F1554 HydrophobicContact CD1-CD1 4.37Å; L1551-F1554 PolarHBondContact O-N 3.09Å; L1551-M1555 HydrophobicContact CD1-CE 3.98Å; L1551-M1555 HydrophobicContact CD1-CG 4.27Å; L1551-M1555 HydrophobicContact CG-CG 4.3Å; L1551-M1555 WeakPolarHBondContact O-CB 3.28Å; L1551-M1555 VanDerWaalsContact O-CG 3.26Å; L1551-M1555 WeakPolarHBondContact O-CG 3.42Å; L1551-M1555 PolarHBondContact O-N 3.13Å; L1551-L1659 HydrophobicContact CD1-CD1 4.47Å; L1551-F1663 HydrophobicContact CB-CE1 4.4Å; L1551-F1663 HydrophobicContact CB-CZ 4.35Å; L1551-F1663 HydrophobicContact CD1-CZ 4.27Å
1552	I	88.5	Confident	88.1	Confident	93 Å²	93	56.1 Å²	56.1	48%	0.477	31%	0.311	S	S	.	.	H	α-helix	trans	-63.5	-52.1	177.8	-72.5	172.2	0	0	0	111.1	V1547 F1554 M1555 I1556	V1547-I1552 WeakPolarHBondContact O-CG1 3.34Å; V1547-I1552 PolarHBondContact O-N 2.88Å; I1552-F1554 VanDerWaalsContact C-N 3.31Å; I1552-F1554 PolarHBondContact O-N 3.03Å; I1552-M1555 PolarHBondContact O-N 2.74Å; I1552-I1556 WeakPolarHBondContact O-CG1 3.36Å; I1552-I1556 PolarHBondContact O-N 3.26Å
1553	P	88.4	Confident	88.4	Confident	59 Å²	59	58.1 Å²	58.1	38%	0.383	32%	0.324	S	S	.	.	H	α-helix	trans	-58	-39.7	172.7	-28.3	37.7	0	0	0	113.6	N1549 M1555 I1556 I1557	N1549-P1553 WeakPolarHBondContact O-CD 3.34Å; N1549-P1553 WeakPolarHBondContact O-CG 3.41Å; P1553-M1555 PolarHBondContact O-N 3.11Å; P1553-I1556 PolarHBondContact O-N 2.92Å; P1553-I1557 WeakPolarHBondContact O-CG1 3.21Å; P1553-I1557 PolarHBondContact O-N 2.63Å
1554	F	90	Very high	88.6	Confident	11 Å²	11	55.8 Å²	55.8	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-61.1	-43.9	176.2	-178.2	-101.1	0	0	0	112.8	D1550 L1551 I1552 I1556 I1557 L1558 M1655 L1658 L1659 M1662	D1550-F1554 VanDerWaalsContact O-CB 3.27Å; D1550-F1554 WeakPolarHBondContact O-CB 3.49Å; D1550-F1554 PolarHBondContact O-N 3.38Å; L1551-F1554 HydrophobicContact CD1-CD1 4.37Å; L1551-F1554 PolarHBondContact O-N 3.09Å; I1552-F1554 VanDerWaalsContact C-N 3.31Å; I1552-F1554 PolarHBondContact O-N 3.03Å; F1554-I1556 VanDerWaalsContact C-N 3.29Å; F1554-I1556 PolarHBondContact O-N 3.38Å; F1554-I1557 PolarHBondContact O-N 2.78Å; F1554-L1558 HydrophobicContact CE1-CD2 4.22Å; F1554-L1558 WeakPolarHBondContact O-CB 3.46Å; F1554-L1558 PolarHBondContact O-N 3.29Å; F1554-M1655 HydrophobicContact CE2-CB 3.96Å; F1554-M1655 VanDerWaalsContact CE2-O 3.32Å; F1554-M1655 WeakPolarHBondContact CE2-O 3.06Å; F1554-M1655 HydrophobicContact CE2-SD 4.07Å; F1554-M1655 HydrophobicContact CZ-CB 3.97Å; F1554-L1658 HydrophobicContact CD2-CD2 4.44Å; F1554-L1659 HydrophobicContact CB-CD1 4.18Å; F1554-L1659 HydrophobicContact CD1-CD1 3.94Å; F1554-L1659 HydrophobicContact CD1-CD2 4.26Å; F1554-L1659 HydrophobicContact CD2-CB 4.19Å; F1554-L1659 HydrophobicContact CD2-CD1 4.09Å; F1554-L1659 HydrophobicContact CE1-CB 4.5Å; F1554-L1659 HydrophobicContact CE1-CD1 4.34Å; F1554-L1659 HydrophobicContact CE1-CD2 3.91Å; F1554-L1659 HydrophobicContact CE1-CG 4.49Å; F1554-L1659 HydrophobicContact CE2-CB 3.86Å; F1554-L1659 HydrophobicContact CE2-CD1 4.48Å; F1554-L1659 HydrophobicContact CG-CD1 3.8Å; F1554-L1659 HydrophobicContact CZ-CB 4.02Å; F1554-L1659 HydrophobicContact CZ-CD2 4.15Å; F1554-L1659 HydrophobicContact CZ-CG 4.49Å; F1554-M1662 HydrophobicContact CB-CE 3.98Å; F1554-M1662 HydrophobicContact CD2-CE 4.11Å; F1554-M1662 HydrophobicContact CG-CE 4.44Å
1555	M	87.4	Confident	88.9	Confident	92 Å²	92	54.7 Å²	54.7	45%	0.453	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-31.2	179	-76.4	-70.1	-178.9	0	0	112.7	L1551 I1552 P1553 L1558 T1559	L1551-M1555 HydrophobicContact CD1-CE 3.98Å; L1551-M1555 HydrophobicContact CD1-CG 4.27Å; L1551-M1555 HydrophobicContact CG-CG 4.3Å; L1551-M1555 WeakPolarHBondContact O-CB 3.28Å; L1551-M1555 VanDerWaalsContact O-CG 3.26Å; L1551-M1555 WeakPolarHBondContact O-CG 3.42Å; L1551-M1555 PolarHBondContact O-N 3.13Å; I1552-M1555 PolarHBondContact O-N 2.74Å; P1553-M1555 PolarHBondContact O-N 3.11Å; M1555-L1558 HydrophobicContact SD-CD2 4.13Å; M1555-T1559 VanDerWaalsContact O-CB 3.31Å; M1555-T1559 WeakPolarHBondContact O-CB 3.33Å; M1555-T1559 PolarHBondContact O-N 3.15Å; M1555-T1559 PolarHBondContact O-OG1 3.05Å
1556	I	89.4	Confident	89.1	Confident	107 Å²	107	51.6 Å²	51.6	55%	0.549	30%	0.295	S	S	.	.	H	α-helix	trans	-65.1	-51.2	172.7	-64.5	167.5	0	0	0	110	I1552 P1553 F1554 L1558 T1559 V1560	I1552-I1556 WeakPolarHBondContact O-CG1 3.36Å; I1552-I1556 PolarHBondContact O-N 3.26Å; P1553-I1556 PolarHBondContact O-N 2.92Å; F1554-I1556 VanDerWaalsContact C-N 3.29Å; F1554-I1556 PolarHBondContact O-N 3.38Å; I1556-L1558 VanDerWaalsContact C-N 3.33Å; I1556-L1558 PolarHBondContact O-N 2.76Å; I1556-T1559 PolarHBondContact O-N 2.68Å; I1556-V1560 PolarHBondContact O-N 3.44Å; I1556-V1560 VanDerWaalsContact O-N 3.09Å
1557	I	90	Very high	89.1	Confident	77 Å²	77	54.2 Å²	54.2	40%	0.395	31%	0.312	S	S	.	.	H	α-helix	trans	-58.8	-45.6	178.4	-63.2	167.1	0	0	0	110.7	P1553 F1554 T1559 V1560 I1561 M1655	P1553-I1557 WeakPolarHBondContact O-CG1 3.21Å; P1553-I1557 PolarHBondContact O-N 2.63Å; F1554-I1557 PolarHBondContact O-N 2.78Å; I1557-T1559 VanDerWaalsContact C-N 3.35Å; I1557-T1559 PolarHBondContact O-N 3.25Å; I1557-V1560 PolarHBondContact O-N 2.83Å; I1557-I1561 HydrophobicContact CG2-CD1 3.95Å; I1557-I1561 WeakPolarHBondContact O-CG1 3.29Å; I1557-I1561 PolarHBondContact O-N 3.14Å; I1557-M1655 HydrophobicContact CG2-CE 3.79Å; I1557-M1655 HydrophobicContact CG2-SD 3.79Å
1558	L	88.4	Confident	89.2	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-41.3	177.5	-179.1	62.1	0	0	0	112.2	F1554 M1555 I1556 I1561 M1562 M1610 T1651	F1554-L1558 HydrophobicContact CE1-CD2 4.22Å; F1554-L1558 WeakPolarHBondContact O-CB 3.46Å; F1554-L1558 PolarHBondContact O-N 3.29Å; M1555-L1558 HydrophobicContact SD-CD2 4.13Å; I1556-L1558 VanDerWaalsContact C-N 3.33Å; I1556-L1558 PolarHBondContact O-N 2.76Å; L1558-I1561 PolarHBondContact O-N 3.47Å; L1558-M1562 HydrophobicContact CG-CE 4.38Å; L1558-M1562 VanDerWaalsContact O-CB 3.29Å; L1558-M1562 WeakPolarHBondContact O-CB 3.46Å; L1558-M1562 PolarHBondContact O-N 3.41Å; L1558-M1610 HydrophobicContact CD1-CE 3.67Å; L1558-M1610 HydrophobicContact CD1-SD 3.8Å; L1558-M1610 HydrophobicContact CD2-CE 3.77Å; L1558-M1610 HydrophobicContact CD2-SD 3.88Å; L1558-M1610 HydrophobicContact CG-CE 4.36Å; L1558-M1610 HydrophobicContact CG-SD 4.31Å; L1558-T1651 HydrophobicContact CD1-CG2 4.46Å
1559	T	86.6	Confident	89.2	Confident	52 Å²	52	49.3 Å²	49.3	32%	0.319	29%	0.286	S	S	.	.	H	α-helix	trans	-64.5	-40.4	178.8	-60.9	0	0	0	0	111.6	M1555 I1556 I1557 I1561 M1562 V1563	M1555-T1559 VanDerWaalsContact O-CB 3.31Å; M1555-T1559 WeakPolarHBondContact O-CB 3.33Å; M1555-T1559 PolarHBondContact O-N 3.15Å; M1555-T1559 PolarHBondContact O-OG1 3.05Å; I1556-T1559 PolarHBondContact O-N 2.68Å; I1557-T1559 VanDerWaalsContact C-N 3.35Å; I1557-T1559 PolarHBondContact O-N 3.25Å; T1559-I1561 PolarHBondContact O-N 3.08Å; T1559-M1562 PolarHBondContact O-N 3.48Å; T1559-V1563 HydrophobicContact CG2-CG2 4.24Å; T1559-V1563 WeakPolarHBondContact O-CB 3.47Å; T1559-V1563 VanDerWaalsContact O-CG2 3.3Å; T1559-V1563 WeakPolarHBondContact O-CG2 3.18Å; T1559-V1563 PolarHBondContact O-N 3.12Å
1560	V	90.7	Very high	89	Confident	102 Å²	102	46.4 Å²	46.4	62%	0.618	27%	0.27	S	S	*	.	H	α-helix	trans	-61.4	-44.6	175.4	173.6	0	0	0	0	111.3	I1556 I1557 G1564	I1556-V1560 PolarHBondContact O-N 3.44Å; I1556-V1560 VanDerWaalsContact O-N 3.09Å; I1557-V1560 PolarHBondContact O-N 2.83Å; V1560-G1564 PolarHBondContact O-N 3.46Å
1561	I	89.6	Confident	88.6	Confident	40 Å²	40	49 Å²	49	21%	0.205	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-46.6	177.4	-67.3	161.4	0	0	0	111	I1557 L1558 T1559 G1564 Y1565 Y1647 L1650 T1651 M1655	I1557-I1561 HydrophobicContact CG2-CD1 3.95Å; I1557-I1561 WeakPolarHBondContact O-CG1 3.29Å; I1557-I1561 PolarHBondContact O-N 3.14Å; L1558-I1561 PolarHBondContact O-N 3.47Å; T1559-I1561 PolarHBondContact O-N 3.08Å; I1561-G1564 PolarHBondContact O-N 2.92Å; I1561-Y1565 PolarHBondContact O-N 2.82Å; I1561-Y1647 HydrophobicContact CG2-CD2 4.31Å; I1561-Y1647 HydrophobicContact CG2-CE2 4.16Å; I1561-L1650 HydrophobicContact CD1-CD2 3.85Å; I1561-L1650 HydrophobicContact CG1-CD2 4.25Å; I1561-L1650 HydrophobicContact CG2-CD2 3.66Å; I1561-T1651 HydrophobicContact CG2-CG2 4.32Å; I1561-M1655 HydrophobicContact CD1-CE 3.55Å; I1561-M1655 HydrophobicContact CD1-CG 4.01Å; I1561-M1655 HydrophobicContact CD1-SD 3.65Å
1562	M	89.3	Confident	88.3	Confident	4 Å²	4	49 Å²	49	2%	0.02	29%	0.289	C	S	.	.	H	α-helix	trans	-60.9	-49.6	179.5	-171.9	-167.3	-51.1	0	0	111.2	L1558 T1559 G1564 Y1565 A1566 Y1603 A1606 Y1607	L1558-M1562 HydrophobicContact CG-CE 4.38Å; L1558-M1562 VanDerWaalsContact O-CB 3.29Å; L1558-M1562 WeakPolarHBondContact O-CB 3.46Å; L1558-M1562 PolarHBondContact O-N 3.41Å; T1559-M1562 PolarHBondContact O-N 3.48Å; M1562-G1564 PolarHBondContact O-N 3.32Å; M1562-Y1565 PolarHBondContact O-N 3.36Å; M1562-A1566 WeakPolarHBondContact O-CB 3.36Å; M1562-A1566 PolarHBondContact O-N 3.36Å; M1562-Y1603 HydrophobicContact SD-CD2 4.04Å; M1562-Y1603 HydrophobicContact SD-CE1 4.21Å; M1562-Y1603 HydrophobicContact SD-CE2 3.52Å; M1562-Y1603 VanDerWaalsContact SD-CE2 3.52Å; M1562-A1606 HydrophobicContact CG-CB 3.89Å; M1562-Y1607 HydrophobicContact CE-CD2 4.04Å; M1562-Y1607 HydrophobicContact SD-CD2 4.35Å
1563	V	89.7	Confident	87.8	Confident	56 Å²	56	45 Å²	45	34%	0.339	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-42.4	177.7	170.9	0	0	0	0	111.2	T1559 Y1565 A1566 V1567 M1602	T1559-V1563 HydrophobicContact CG2-CG2 4.24Å; T1559-V1563 WeakPolarHBondContact O-CB 3.47Å; T1559-V1563 VanDerWaalsContact O-CG2 3.3Å; T1559-V1563 WeakPolarHBondContact O-CG2 3.18Å; T1559-V1563 PolarHBondContact O-N 3.12Å; V1563-Y1565 PolarHBondContact O-N 2.83Å; V1563-A1566 PolarHBondContact O-N 2.92Å; V1563-V1567 HydrophobicContact CG1-CG2 4.22Å; V1563-V1567 WeakPolarHBondContact O-CG2 3.49Å; V1563-V1567 PolarHBondContact O-N 3.22Å; V1563-M1602 HydrophobicContact CG1-CE 4.44Å
1564	G	90.6	Very high	87.2	Confident	44 Å²	44	44.9 Å²	44.9	45%	0.454	26%	0.262	S	S	.	.	H	α-helix	trans	-59.1	-45.8	177	0	0	0	0	0	112.9	V1560 I1561 M1562 A1568	V1560-G1564 PolarHBondContact O-N 3.46Å; I1561-G1564 PolarHBondContact O-N 2.92Å; M1562-G1564 PolarHBondContact O-N 3.32Å; G1564-A1568 PolarHBondContact O-N 2.76Å
1565	Y	91.5	Very high	86.4	Confident	13 Å²	13	47.3 Å²	47.3	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-65.3	-44.4	173.4	171.1	-115.8	0	0	0	112.1	I1561 M1562 V1563 V1567 A1568 A1569 A1606 Q1609 M1643 L1644 Y1647	I1561-Y1565 PolarHBondContact O-N 2.82Å; M1562-Y1565 PolarHBondContact O-N 3.36Å; V1563-Y1565 PolarHBondContact O-N 2.83Å; Y1565-V1567 PolarHBondContact O-N 3.35Å; Y1565-A1568 PolarHBondContact O-N 2.92Å; Y1565-A1569 HydrophobicContact CE2-CB 4.21Å; Y1565-A1569 WeakPolarHBondContact O-CB 3.22Å; Y1565-A1569 PolarHBondContact O-N 2.74Å; Y1565-A1606 HydrophobicContact CD1-CB 4.03Å; Y1565-A1606 HydrophobicContact CE1-CB 4.38Å; Y1565-Q1609 PolarHBondContact OH-OE1 3.07Å; Y1565-M1643 HydrophobicContact CE2-CB 4.16Å; Y1565-L1644 HydrophobicContact CE1-CD1 4.5Å; Y1565-L1644 WeakPolarHBondContact OH-CB 3.49Å; Y1565-L1644 WeakPolarHBondContact OH-CD1 3.44Å; Y1565-Y1647 AromaticContact CD1-CD1 3.48Å; Y1565-Y1647 HydrophobicContact CD1-CD1 3.48Å; Y1565-Y1647 VanDerWaalsContact CD1-CD1 3.48Å; Y1565-Y1647 AromaticContact CD1-CD2 3.65Å; Y1565-Y1647 HydrophobicContact CD1-CD2 3.65Å; Y1565-Y1647 AromaticContact CD1-CE1 3.55Å; Y1565-Y1647 HydrophobicContact CD1-CE1 3.55Å; Y1565-Y1647 AromaticContact CD1-CE2 3.73Å; Y1565-Y1647 HydrophobicContact CD1-CE2 3.73Å; Y1565-Y1647 AromaticContact CD1-CG 3.5Å; Y1565-Y1647 HydrophobicContact CD1-CG 3.5Å; Y1565-Y1647 AromaticContact CD1-CZ 3.66Å; Y1565-Y1647 HydrophobicContact CD2-CD2 4.32Å; Y1565-Y1647 HydrophobicContact CD2-CG 4.01Å; Y1565-Y1647 AromaticContact CE1-CD1 3.48Å; Y1565-Y1647 HydrophobicContact CE1-CD1 3.48Å; Y1565-Y1647 VanDerWaalsContact CE1-CD1 3.48Å; Y1565-Y1647 HydrophobicContact CE1-CD2 4.46Å; Y1565-Y1647 AromaticContact CE1-CE1 3.7Å; Y1565-Y1647 HydrophobicContact CE1-CE1 3.7Å; Y1565-Y1647 AromaticContact CE1-CG 3.88Å; Y1565-Y1647 HydrophobicContact CE1-CG 3.88Å; Y1565-Y1647 HydrophobicContact CE2-CG 4.36Å; Y1565-Y1647 HydrophobicContact CG-CD1 4.06Å; Y1565-Y1647 AromaticContact CG-CD2 3.56Å; Y1565-Y1647 HydrophobicContact CG-CD2 3.56Å; Y1565-Y1647 HydrophobicContact CG-CE1 4.43Å; Y1565-Y1647 AromaticContact CG-CE2 4Å; Y1565-Y1647 HydrophobicContact CG-CE2 4Å; Y1565-Y1647 AromaticContact CG-CG 3.58Å; Y1565-Y1647 HydrophobicContact CG-CG 3.58Å
1566	A	88.7	Confident	85.3	Confident	3 Å²	3	50.2 Å²	50.2	3%	0.025	30%	0.296	C	S	.	.	H	α-helix	trans	-63	-41.4	-177.9	0	0	0	0	0	112.7	M1562 V1563 Q1570 M1602 A1606	M1562-A1566 WeakPolarHBondContact O-CB 3.36Å; M1562-A1566 PolarHBondContact O-N 3.36Å; V1563-A1566 PolarHBondContact O-N 2.92Å; A1566-Q1570 WeakPolarHBondContact O-CB 3.29Å; A1566-Q1570 PolarHBondContact O-N 3.27Å; A1566-M1602 HydrophobicContact CB-CE 3.76Å; A1566-M1602 HydrophobicContact CB-CG 3.69Å; A1566-M1602 HydrophobicContact CB-SD 3.49Å; A1566-M1602 WeakPolarHBondContact CB-SD 2.92Å; A1566-A1606 HydrophobicContact CB-CB 3.57Å
1567	V	88.8	Confident	84.2	Confident	79 Å²	79	45.8 Å²	45.8	48%	0.479	28%	0.277	S	S	.	.	H	α-helix	trans	-63.4	-46.1	174.3	173	0	0	0	0	110.2	V1563 Y1565 S1571 M1602	V1563-V1567 HydrophobicContact CG1-CG2 4.22Å; V1563-V1567 WeakPolarHBondContact O-CG2 3.49Å; V1563-V1567 PolarHBondContact O-N 3.22Å; Y1565-V1567 PolarHBondContact O-N 3.35Å; V1567-S1571 VanDerWaalsContact O-CB 3.28Å; V1567-S1571 WeakPolarHBondContact O-CB 3.31Å; V1567-S1571 PolarHBondContact O-N 2.75Å; V1567-S1571 PolarHBondContact O-OG 2.86Å; V1567-M1602 HydrophobicContact CB-CE 4.28Å; V1567-M1602 HydrophobicContact CG2-CE 3.35Å
1568	A	89.1	Confident	82.7	Confident	26 Å²	26	45.4 Å²	45.4	22%	0.215	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-48.1	179.7	0	0	0	0	0	111.8	G1564 Y1565 S1571 I1572 M1643	G1564-A1568 PolarHBondContact O-N 2.76Å; Y1565-A1568 PolarHBondContact O-N 2.92Å; A1568-S1571 PolarHBondContact O-OG 3.36Å; A1568-I1572 WeakPolarHBondContact O-CB 3.48Å; A1568-I1572 VanDerWaalsContact O-CD1 3.29Å; A1568-I1572 WeakPolarHBondContact O-CD1 3.37Å; A1568-I1572 WeakPolarHBondContact O-CG1 3.37Å; A1568-I1572 PolarHBondContact O-N 2.79Å; A1568-I1572 VanDerWaalsContact O-N 3.17Å; A1568-M1643 HydrophobicContact CB-CE 4.25Å
1569	A	86.2	Confident	81.4	Confident	13 Å²	13	49 Å²	49	11%	0.107	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-49.9	178.3	0	0	0	0	0	111.8	Y1565 S1571 I1572 A1573 V1640	Y1565-A1569 HydrophobicContact CE2-CB 4.21Å; Y1565-A1569 WeakPolarHBondContact O-CB 3.22Å; Y1565-A1569 PolarHBondContact O-N 2.74Å; A1569-S1571 PolarHBondContact O-N 3.08Å; A1569-I1572 PolarHBondContact O-N 2.95Å; A1569-A1573 VanDerWaalsContact O-CB 3.28Å; A1569-A1573 WeakPolarHBondContact O-CB 3.48Å; A1569-A1573 PolarHBondContact O-N 2.93Å; A1569-V1640 HydrophobicContact CB-CG1 4.19Å
1570	Q	84.9	Confident	79.7	Confident	33 Å²	33	52 Å²	52	15%	0.154	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-40.9	-176.6	-170.8	67.8	-0.7	0	0	112.5	A1566 A1573 Y1574 M1602	A1566-Q1570 WeakPolarHBondContact O-CB 3.29Å; A1566-Q1570 PolarHBondContact O-N 3.27Å; Q1570-A1573 PolarHBondContact O-N 3.02Å; Q1570-Y1574 PolarHBondContact O-N 3.24Å; Q1570-M1602 HydrophobicContact CB-CB 4.35Å; Q1570-M1602 HydrophobicContact CB-CG 4.02Å; Q1570-M1602 HydrophobicContact CG-CB 4.19Å; Q1570-M1602 HydrophobicContact CG-CG 4.32Å
1571	S	83.4	Confident	77.6	Confident	73 Å²	73	51.5 Å²	51.5	51%	0.51	30%	0.299	S	S	.	.	H	α-helix	trans	-70.5	-31.6	179.1	58.1	0	0	0	0	113.7	V1567 A1568 A1569	V1567-S1571 VanDerWaalsContact O-CB 3.28Å; V1567-S1571 WeakPolarHBondContact O-CB 3.31Å; V1567-S1571 PolarHBondContact O-N 2.75Å; V1567-S1571 PolarHBondContact O-OG 2.86Å; A1568-S1571 PolarHBondContact O-OG 3.36Å; A1569-S1571 PolarHBondContact O-N 3.08Å
1572	I	83.8	Confident	75.9	Confident	43 Å²	43	58.9 Å²	58.9	22%	0.221	33%	0.333	C	S	.	.	H	α-helix	trans	-75.6	-38.1	174.6	-67.3	167.1	0	0	0	111.2	A1568 A1569 T1633 L1639 V1640	A1568-I1572 WeakPolarHBondContact O-CB 3.48Å; A1568-I1572 VanDerWaalsContact O-CD1 3.29Å; A1568-I1572 WeakPolarHBondContact O-CD1 3.37Å; A1568-I1572 WeakPolarHBondContact O-CG1 3.37Å; A1568-I1572 PolarHBondContact O-N 2.79Å; A1568-I1572 VanDerWaalsContact O-N 3.17Å; A1569-I1572 PolarHBondContact O-N 2.95Å; I1572-T1633 PolarHBondContact O-OG1 3.41Å; I1572-L1639 HydrophobicContact CD1-CD2 3.89Å; I1572-L1639 HydrophobicContact CD1-CG 4.26Å; I1572-L1639 HydrophobicContact CG1-CD2 4.46Å; I1572-L1639 HydrophobicContact CG2-CD2 4.1Å; I1572-V1640 HydrophobicContact CB-CG2 4.05Å; I1572-V1640 HydrophobicContact CG2-CG2 3.57Å
1573	A	77.3	Confident	73.9	Confident	9 Å²	9	64.6 Å²	64.6	7%	0.074	36%	0.363	C	S	.	.	H	α-helix	trans	-74.4	-46.2	-179.4	0	0	0	0	0	113.2	A1569 Q1570 P1632 T1633	A1569-A1573 VanDerWaalsContact O-CB 3.28Å; A1569-A1573 WeakPolarHBondContact O-CB 3.48Å; A1569-A1573 PolarHBondContact O-N 2.93Å; Q1570-A1573 PolarHBondContact O-N 3.02Å; A1573-P1632 HydrophobicContact CB-CB 4.33Å; A1573-T1633 PolarHBondContact O-N 2.75Å
1574	Y	76.7	Confident	71.6	Confident	57 Å²	57	71 Å²	71	22%	0.224	39%	0.392	C	S	.	.	S	Bend	trans	-130.8	74.7	-169.4	-55.7	-72.2	0	0	0	112.3	Q1570 N1576 G1577 F1579	Q1570-Y1574 PolarHBondContact O-N 3.24Å; Y1574-N1576 PolarHBondContact O-N 2.91Å; Y1574-G1577 PolarHBondContact O-N 2.9Å; Y1574-G1577 VanDerWaalsContact O-N 3.08Å; Y1574-F1579 HydrophobicContact CD1-CE1 4.25Å; Y1574-F1579 HydrophobicContact CE1-CE1 4.16Å
1575	P	71.6	Confident	69.4	Low	62 Å²	62	73 Å²	73	40%	0.403	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-56.4	132.4	178.9	24.1	-34.7	0	0	0	111.5	G1577 L1578 T1633	P1575-G1577 PolarHBondContact O-N 3.32Å; P1575-L1578 PolarHBondContact O-N 3.32Å; P1575-T1633 HydrophobicContact CG-CG2 3.7Å
1576	N	66	Low	67.3	Low	153 Å²	153	80.5 Å²	80.5	82%	0.818	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	56.9	12.2	-176.6	-55.9	-22.6	0	0	0	115.7	Y1574 L1578	Y1574-N1576 PolarHBondContact O-N 2.91Å; N1576-L1578 HydrophobicContact CB-CD1 3.97Å; N1576-L1578 HydrophobicContact CB-CG 4.14Å; N1576-L1578 PolarHBondContact O-N 2.89Å
1577	G	65.6	Low	65.5	Low	15 Å²	15	87.9 Å²	87.9	16%	0.155	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	64	20.6	-174.4	0	0	0	0	0	114	Y1574 P1575	Y1574-G1577 PolarHBondContact O-N 2.9Å; Y1574-G1577 VanDerWaalsContact O-N 3.08Å; P1575-G1577 PolarHBondContact O-N 3.32Å
1578	L	58.2	Low	63.5	Low	69 Å²	69	86.7 Å²	86.7	36%	0.361	47%	0.47	S	S	.	.			trans	-100.2	122.3	-176.5	-71.2	172.2	0	0	0	111.4	P1575 N1576 T1580 I1590	P1575-L1578 PolarHBondContact O-N 3.32Å; N1576-L1578 HydrophobicContact CB-CD1 3.97Å; N1576-L1578 HydrophobicContact CB-CG 4.14Å; N1576-L1578 PolarHBondContact O-N 2.89Å; L1578-T1580 PolarHBondContact O-N 3.4Å; L1578-I1590 HydrophobicContact CD2-CG2 3.56Å
1579	F	61.1	Low	61.5	Low	83 Å²	83	94.5 Å²	94.5	36%	0.364	50%	0.502	S	S	.	.			trans	-79.5	116.5	171.7	-60.1	-79.9	0	0	0	110.5	Y1574 M1593 M1630	Y1574-F1579 HydrophobicContact CD1-CE1 4.25Å; Y1574-F1579 HydrophobicContact CE1-CE1 4.16Å; F1579-M1593 HydrophobicContact CE2-CB 4.49Å; F1579-M1593 HydrophobicContact CZ-SD 4.26Å; F1579-M1630 HydrophobicContact CD1-CG 4.43Å; F1579-M1630 HydrophobicContact CE1-CE 3.94Å; F1579-M1630 HydrophobicContact CZ-CE 4.43Å
1580	T	51.3	Low	59.8	Low	114 Å²	114	99.3 Å²	99.3	70%	0.699	53%	0.525	S	S	*	.			trans	-84	115.1	-179.1	51.9	0	0	0	0	112.1	L1578	L1578-T1580 PolarHBondContact O-N 3.4Å
1581	K	46.8	Very low	58.5	Low	92 Å²	92	106.6 Å²	106.6	40%	0.4	56%	0.556	S	S	.	*			trans	-85.1	114.9	176.9	-168.2	-173.5	-167.4	-173.7	0	110.7	N1583 S1588	K1581-N1583 PolarHBondContact O-N 3.02Å; K1581-N1583 VanDerWaalsContact O-N 3.16Å; K1581-S1588 PolarHBondContact NZ-OG 2.8Å
1582	E	52.5	Low	57.4	Low	195 Å²	195	109.4 Å²	109.4	91%	0.911	56%	0.561	S	S	*	*	S	Bend	trans	-61	-24.7	-178.5	-76.7	-170.1	131.3	0	0	114.3	M1584	E1582-M1584 PolarHBondContact O-N 3.34Å
1583	N	47.3	Very low	56.6	Low	125 Å²	125	109.7 Å²	109.7	67%	0.668	56%	0.561	S	S	*	*	S	Bend	trans	-94.9	85.1	175.5	-75.4	-32.5	0	0	0	111.8	K1581 T1585	K1581-N1583 PolarHBondContact O-N 3.02Å; K1581-N1583 VanDerWaalsContact O-N 3.16Å; N1583-T1585 PolarHBondContact O-N 2.9Å; N1583-T1585 PolarHBondContact O-OG1 3.25Å; N1583-T1585 VanDerWaalsContact O-OG1 3.05Å
1584	M	41.5	Very low	56.4	Low	189 Å²	189	112.9 Å²	112.9	93%	0.931	58%	0.58	S	S	*	*			trans	-60.2	104.1	174.1	-171	176.9	-172.3	0	0	110.7	E1582	E1582-M1584 PolarHBondContact O-N 3.34Å
1585	T	44.4	Very low	56.5	Low	86 Å²	86	118 Å²	118	53%	0.528	60%	0.604	S	S	.	*			trans	-131.1	131.4	-179.1	34.9	0	0	0	0	108.4	N1583 N1587	N1583-T1585 PolarHBondContact O-N 2.9Å; N1583-T1585 PolarHBondContact O-OG1 3.25Å; N1583-T1585 VanDerWaalsContact O-OG1 3.05Å; T1585-N1587 PolarHBondContact O-N 2.66Å
1586	L	48.5	Very low	56.8	Low	172 Å²	172	118.2 Å²	118.2	90%	0.901	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-17.9	-155.3	-155.5	71.7	0	0	0	115.8
1587	N	49.8	Very low	57.3	Low	157 Å²	157	114.7 Å²	114.7	84%	0.84	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	39.1	-168.1	-58.4	-14.5	0	0	0	112.7	T1585	T1585-N1587 PolarHBondContact O-N 2.66Å
1588	S	46.9	Very low	58	Low	55 Å²	55	116.3 Å²	116.3	39%	0.385	60%	0.597	S	S	.	*			trans	-104.5	124.3	178.3	-169.8	0	0	0	0	111.1	K1581	K1581-S1588 PolarHBondContact NZ-OG 2.8Å
1589	E	47.6	Very low	59.2	Low	190 Å²	190	117 Å²	117	89%	0.888	60%	0.6	S	S	*	*			trans	-62.4	142.9	175.8	-64.9	-178.5	134.4	0	0	112.2
1590	I	51.3	Low	60.2	Low	114 Å²	114	120 Å²	120	59%	0.585	61%	0.613	S	S	*	*			trans	-90.6	106.3	172.7	-60.5	173.7	0	0	0	107.2	L1578 H1592	L1578-I1590 HydrophobicContact CD2-CG2 3.56Å; I1590-H1592 PolarHBondContact O-CD2 3.4Å; I1590-H1592 PolarHBondContact O-N 2.96Å; I1590-H1592 VanDerWaalsContact O-N 3.17Å
1591	K	56.4	Low	61.5	Low	186 Å²	186	116.6 Å²	116.6	81%	0.809	59%	0.594	S	S	*	*			trans	-79.8	100.6	174.8	-166.3	177.8	-177	-175	0	109.8
1592	H	59.8	Low	63.4	Low	132 Å²	132	113.5 Å²	113.5	61%	0.611	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-66.9	134.5	170.8	-66	-93.1	0	0	0	110.4	I1590	I1590-H1592 PolarHBondContact O-CD2 3.4Å; I1590-H1592 PolarHBondContact O-N 2.96Å; I1590-H1592 VanDerWaalsContact O-N 3.17Å
1593	M	67.3	Low	64.9	Low	48 Å²	48	108.5 Å²	108.5	24%	0.236	56%	0.555	C	S	.	*	P	Polyproline II helix	trans	-75.2	136	168	-164	171.7	-177.8	0	0	108.2	F1579 D1597 I1598	F1579-M1593 HydrophobicContact CE2-CB 4.49Å; F1579-M1593 HydrophobicContact CZ-SD 4.26Å; M1593-D1597 HydrophobicContact CE-CB 3.95Å; M1593-D1597 WeakPolarHBondContact CE-O 3.47Å; M1593-D1597 HydrophobicContact CG-CB 3.74Å; M1593-I1598 HydrophobicContact CB-CD1 4.24Å; M1593-I1598 HydrophobicContact CB-CG1 3.87Å; M1593-I1598 HydrophobicContact CG-CG1 3.67Å; M1593-I1598 HydrophobicContact SD-CG1 3.78Å
1594	T	74.5	Confident	66.7	Low	76 Å²	76	104.2 Å²	104.2	47%	0.466	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-71.8	155	-179.8	76.1	0	0	0	0	110.5	A1596 D1597 I1598	T1594-A1596 PolarHBondContact O-N 3.46Å; T1594-D1597 VanDerWaalsContact CB-OD2 3.28Å; T1594-D1597 WeakPolarHBondContact CB-OD2 3.16Å; T1594-D1597 WeakPolarHBondContact CG2-OD2 3.15Å; T1594-D1597 PolarHBondContact N-OD2 3.42Å; T1594-D1597 VanDerWaalsContact N-OD2 3.14Å; T1594-D1597 WeakPolarHBondContact O-CB 3.36Å; T1594-D1597 PolarHBondContact O-N 2.82Å; T1594-D1597 VanDerWaalsContact O-N 3.09Å; T1594-D1597 PolarHBondContact OG1-N 3.02Å; T1594-D1597 VanDerWaalsContact OG1-N 3.15Å; T1594-D1597 PolarHBondContact OG1-OD2 3.43Å; T1594-I1598 WeakPolarHBondContact O-CG1 2.78Å; T1594-I1598 PolarHBondContact O-N 2.92Å
1595	F	78.2	Confident	68.7	Low	164 Å²	164	97.7 Å²	97.7	72%	0.719	50%	0.504	S	S	*	.	H	α-helix	trans	-57.4	-36.4	178.2	-176.8	-109.8	0	0	0	112.4	I1598 I1599	F1595-I1598 PolarHBondContact O-N 3.04Å; F1595-I1599 HydrophobicContact CD1-CD1 3.96Å; F1595-I1599 HydrophobicContact CE1-CD1 3.44Å; F1595-I1599 VanDerWaalsContact CE1-CD1 3.44Å; F1595-I1599 HydrophobicContact CE2-CD1 4.08Å; F1595-I1599 HydrophobicContact CG-CD1 4.49Å; F1595-I1599 HydrophobicContact CZ-CD1 3.52Å; F1595-I1599 HydrophobicContact CZ-CG1 4.48Å; F1595-I1599 WeakPolarHBondContact O-CG1 3.4Å; F1595-I1599 PolarHBondContact O-N 2.88Å
1596	A	78.1	Confident	70.8	Confident	67 Å²	67	93.6 Å²	93.6	55%	0.554	48%	0.479	S	S	*	.	H	α-helix	trans	-66	-45.7	173.9	0	0	0	0	0	112.2	T1594 I1598 I1599 F1600	T1594-A1596 PolarHBondContact O-N 3.46Å; A1596-I1598 VanDerWaalsContact C-N 3.32Å; A1596-I1598 PolarHBondContact O-N 3.01Å; A1596-I1599 PolarHBondContact O-N 3.29Å; A1596-F1600 VanDerWaalsContact O-CB 3.29Å; A1596-F1600 WeakPolarHBondContact O-CB 3.32Å; A1596-F1600 PolarHBondContact O-N 3.2Å
1597	D	76.6	Confident	72.7	Confident	80 Å²	80	89.9 Å²	89.9	43%	0.428	45%	0.454	S	S	.	.	H	α-helix	trans	-60.1	-43	175.3	-60	-48.4	0	0	0	111.2	M1593 T1594 S1601	M1593-D1597 HydrophobicContact CE-CB 3.95Å; M1593-D1597 WeakPolarHBondContact CE-O 3.47Å; M1593-D1597 HydrophobicContact CG-CB 3.74Å; T1594-D1597 VanDerWaalsContact CB-OD2 3.28Å; T1594-D1597 WeakPolarHBondContact CB-OD2 3.16Å; T1594-D1597 WeakPolarHBondContact CG2-OD2 3.15Å; T1594-D1597 PolarHBondContact N-OD2 3.42Å; T1594-D1597 VanDerWaalsContact N-OD2 3.14Å; T1594-D1597 WeakPolarHBondContact O-CB 3.36Å; T1594-D1597 PolarHBondContact O-N 2.82Å; T1594-D1597 VanDerWaalsContact O-N 3.09Å; T1594-D1597 PolarHBondContact OG1-N 3.02Å; T1594-D1597 VanDerWaalsContact OG1-N 3.15Å; T1594-D1597 PolarHBondContact OG1-OD2 3.43Å; D1597-S1601 WeakPolarHBondContact O-CB 3.27Å; D1597-S1601 PolarHBondContact O-N 2.94Å
1598	I	79.7	Confident	74.4	Confident	49 Å²	49	87.6 Å²	87.6	25%	0.251	44%	0.436	S	S	.	.	H	α-helix	trans	-59.6	-53.9	179.1	-67.3	168.7	0	0	0	109.6	M1593 T1594 F1595 A1596 M1602	M1593-I1598 HydrophobicContact CB-CD1 4.24Å; M1593-I1598 HydrophobicContact CB-CG1 3.87Å; M1593-I1598 HydrophobicContact CG-CG1 3.67Å; M1593-I1598 HydrophobicContact SD-CG1 3.78Å; T1594-I1598 WeakPolarHBondContact O-CG1 2.78Å; T1594-I1598 PolarHBondContact O-N 2.92Å; F1595-I1598 PolarHBondContact O-N 3.04Å; A1596-I1598 VanDerWaalsContact C-N 3.32Å; A1596-I1598 PolarHBondContact O-N 3.01Å; I1598-M1602 WeakPolarHBondContact O-CB 3.03Å; I1598-M1602 PolarHBondContact O-N 3.4Å
1599	I	83.6	Confident	76.3	Confident	82 Å²	82	85.1 Å²	85.1	42%	0.421	42%	0.419	S	S	.	.	H	α-helix	trans	-61.3	-47.8	-179.7	-72.6	176.2	0	0	0	111.1	F1595 A1596 M1602 Y1603	F1595-I1599 HydrophobicContact CD1-CD1 3.96Å; F1595-I1599 HydrophobicContact CE1-CD1 3.44Å; F1595-I1599 VanDerWaalsContact CE1-CD1 3.44Å; F1595-I1599 HydrophobicContact CE2-CD1 4.08Å; F1595-I1599 HydrophobicContact CG-CD1 4.49Å; F1595-I1599 HydrophobicContact CZ-CD1 3.52Å; F1595-I1599 HydrophobicContact CZ-CG1 4.48Å; F1595-I1599 WeakPolarHBondContact O-CG1 3.4Å; F1595-I1599 PolarHBondContact O-N 2.88Å; A1596-I1599 PolarHBondContact O-N 3.29Å; I1599-M1602 PolarHBondContact O-N 2.92Å; I1599-Y1603 VanDerWaalsContact O-CB 3.32Å; I1599-Y1603 WeakPolarHBondContact O-CB 3.38Å; I1599-Y1603 PolarHBondContact O-N 3.49Å
1600	F	83	Confident	78.2	Confident	147 Å²	147	77.7 Å²	77.7	65%	0.645	39%	0.385	S	S	*	.	H	α-helix	trans	-61.8	-51.1	-177.8	-174.2	-99.9	0	0	0	111	A1596 M1602 Y1603 T1604	A1596-F1600 VanDerWaalsContact O-CB 3.29Å; A1596-F1600 WeakPolarHBondContact O-CB 3.32Å; A1596-F1600 PolarHBondContact O-N 3.2Å; F1600-M1602 PolarHBondContact O-N 3.03Å; F1600-Y1603 PolarHBondContact O-N 3.36Å; F1600-T1604 HydrophobicContact CD1-CG2 4.17Å; F1600-T1604 HydrophobicContact CD2-CG2 4.33Å; F1600-T1604 HydrophobicContact CE1-CG2 3.81Å; F1600-T1604 HydrophobicContact CE2-CG2 3.99Å; F1600-T1604 HydrophobicContact CG-CG2 4.42Å; F1600-T1604 HydrophobicContact CZ-CG2 3.71Å; F1600-T1604 WeakPolarHBondContact O-CB 3.03Å; F1600-T1604 WeakPolarHBondContact O-CG2 3.3Å; F1600-T1604 PolarHBondContact O-N 3.45Å; F1600-T1604 PolarHBondContact O-OG1 2.93Å
1601	S	78.1	Confident	79.7	Confident	43 Å²	43	79 Å²	79	30%	0.301	39%	0.386	S	S	.	.	H	α-helix	trans	-59.9	-43.6	178.6	-175.7	0	0	0	0	112.6	D1597 T1604 T1605	D1597-S1601 WeakPolarHBondContact O-CB 3.27Å; D1597-S1601 PolarHBondContact O-N 2.94Å; S1601-T1604 PolarHBondContact O-OG1 3.33Å; S1601-T1605 WeakPolarHBondContact O-CB 3.31Å; S1601-T1605 PolarHBondContact O-N 3.34Å; S1601-T1605 PolarHBondContact O-OG1 3.31Å
1602	M	85.7	Confident	81	Confident	27 Å²	27	71.8 Å²	71.8	13%	0.133	36%	0.364	C	S	.	.	H	α-helix	trans	-63.3	-46.1	177.8	166.3	-87.6	-148.6	0	0	111.7	V1563 A1566 V1567 Q1570 I1598 I1599 F1600 A1606	V1563-M1602 HydrophobicContact CG1-CE 4.44Å; A1566-M1602 HydrophobicContact CB-CE 3.76Å; A1566-M1602 HydrophobicContact CB-CG 3.69Å; A1566-M1602 HydrophobicContact CB-SD 3.49Å; A1566-M1602 WeakPolarHBondContact CB-SD 2.92Å; V1567-M1602 HydrophobicContact CB-CE 4.28Å; V1567-M1602 HydrophobicContact CG2-CE 3.35Å; Q1570-M1602 HydrophobicContact CB-CB 4.35Å; Q1570-M1602 HydrophobicContact CB-CG 4.02Å; Q1570-M1602 HydrophobicContact CG-CB 4.19Å; Q1570-M1602 HydrophobicContact CG-CG 4.32Å; I1598-M1602 WeakPolarHBondContact O-CB 3.03Å; I1598-M1602 PolarHBondContact O-N 3.4Å; I1599-M1602 PolarHBondContact O-N 2.92Å; F1600-M1602 PolarHBondContact O-N 3.03Å; M1602-A1606 PolarHBondContact O-N 3.32Å
1603	Y	85.6	Confident	82.2	Confident	89 Å²	89	69.9 Å²	69.9	35%	0.349	36%	0.359	S	S	.	.	H	α-helix	trans	-69.1	-47.3	178.6	-173.1	-90.8	0	0	0	112	M1562 I1599 F1600 T1605 A1606 Y1607	M1562-Y1603 HydrophobicContact SD-CD2 4.04Å; M1562-Y1603 HydrophobicContact SD-CE1 4.21Å; M1562-Y1603 HydrophobicContact SD-CE2 3.52Å; M1562-Y1603 VanDerWaalsContact SD-CE2 3.52Å; I1599-Y1603 VanDerWaalsContact O-CB 3.32Å; I1599-Y1603 WeakPolarHBondContact O-CB 3.38Å; I1599-Y1603 PolarHBondContact O-N 3.49Å; F1600-Y1603 PolarHBondContact O-N 3.36Å; Y1603-T1605 VanDerWaalsContact C-N 3.3Å; Y1603-T1605 PolarHBondContact O-N 2.93Å; Y1603-A1606 PolarHBondContact O-N 2.76Å; Y1603-Y1607 VanDerWaalsContact O-CB 3.29Å; Y1603-Y1607 WeakPolarHBondContact O-CB 3.46Å; Y1603-Y1607 PolarHBondContact O-N 3.34Å
1604	T	84.4	Confident	82.8	Confident	35 Å²	35	70.7 Å²	70.7	22%	0.215	36%	0.361	C	S	.	.	H	α-helix	trans	-62.1	-39.1	179	53.9	0	0	0	0	111.9	F1600 S1601 Y1607 F1608	F1600-T1604 HydrophobicContact CD1-CG2 4.17Å; F1600-T1604 HydrophobicContact CD2-CG2 4.33Å; F1600-T1604 HydrophobicContact CE1-CG2 3.81Å; F1600-T1604 HydrophobicContact CE2-CG2 3.99Å; F1600-T1604 HydrophobicContact CG-CG2 4.42Å; F1600-T1604 HydrophobicContact CZ-CG2 3.71Å; F1600-T1604 WeakPolarHBondContact O-CB 3.03Å; F1600-T1604 WeakPolarHBondContact O-CG2 3.3Å; F1600-T1604 PolarHBondContact O-N 3.45Å; F1600-T1604 PolarHBondContact O-OG1 2.93Å; S1601-T1604 PolarHBondContact O-OG1 3.33Å; T1604-Y1607 PolarHBondContact O-N 2.98Å; T1604-F1608 WeakPolarHBondContact O-CD2 3.35Å; T1604-F1608 PolarHBondContact O-N 2.9Å
1605	T	83.4	Confident	82.9	Confident	52 Å²	52	70.2 Å²	70.2	32%	0.319	36%	0.361	S	S	.	.	H	α-helix	trans	-62.9	-48.9	179.1	-60.5	0	0	0	0	110.9	S1601 Y1603 Y1607 F1608 Q1609	S1601-T1605 WeakPolarHBondContact O-CB 3.31Å; S1601-T1605 PolarHBondContact O-N 3.34Å; S1601-T1605 PolarHBondContact O-OG1 3.31Å; Y1603-T1605 VanDerWaalsContact C-N 3.3Å; Y1603-T1605 PolarHBondContact O-N 2.93Å; T1605-Y1607 PolarHBondContact O-N 3.28Å; T1605-F1608 PolarHBondContact O-N 2.68Å; T1605-Q1609 VanDerWaalsContact O-CB 3.28Å; T1605-Q1609 WeakPolarHBondContact O-CB 3.06Å; T1605-Q1609 VanDerWaalsContact O-CD 3.29Å; T1605-Q1609 VanDerWaalsContact O-CG 3.23Å; T1605-Q1609 WeakPolarHBondContact O-CG 3.01Å; T1605-Q1609 PolarHBondContact O-N 3.33Å; T1605-Q1609 PolarHBondContact O-OE1 3.46Å
1606	A	87.9	Confident	82.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.008	34%	0.342	C	S	.	.	H	α-helix	trans	-67.9	-32.5	178	0	0	0	0	0	113.6	M1562 Y1565 A1566 M1602 Y1603 M1610 Y1647	M1562-A1606 HydrophobicContact CG-CB 3.89Å; Y1565-A1606 HydrophobicContact CD1-CB 4.03Å; Y1565-A1606 HydrophobicContact CE1-CB 4.38Å; A1566-A1606 HydrophobicContact CB-CB 3.57Å; M1602-A1606 PolarHBondContact O-N 3.32Å; Y1603-A1606 PolarHBondContact O-N 2.76Å; A1606-M1610 PolarHBondContact O-N 3.17Å; A1606-Y1647 PolarHBondContact O-OH 2.79Å
1607	Y	87.9	Confident	82.3	Confident	94 Å²	94	67.1 Å²	67.1	37%	0.369	34%	0.342	S	S	.	.	H	α-helix	trans	-64.1	-53.1	173.1	179.2	-91.5	0	0	0	111.2	M1562 Y1603 T1604 T1605 Q1609 M1610 F1611	M1562-Y1607 HydrophobicContact CE-CD2 4.04Å; M1562-Y1607 HydrophobicContact SD-CD2 4.35Å; Y1603-Y1607 VanDerWaalsContact O-CB 3.29Å; Y1603-Y1607 WeakPolarHBondContact O-CB 3.46Å; Y1603-Y1607 PolarHBondContact O-N 3.34Å; T1604-Y1607 PolarHBondContact O-N 2.98Å; T1605-Y1607 PolarHBondContact O-N 3.28Å; Y1607-Q1609 VanDerWaalsContact C-N 3.31Å; Y1607-Q1609 PolarHBondContact O-N 2.88Å; Y1607-M1610 VanDerWaalsContact O-CB 3.25Å; Y1607-M1610 WeakPolarHBondContact O-CB 2.98Å; Y1607-M1610 PolarHBondContact O-N 3.18Å; Y1607-F1611 HydrophobicContact CD1-CD2 4.32Å; Y1607-F1611 HydrophobicContact CD1-CE2 4.18Å; Y1607-F1611 HydrophobicContact CD2-CE2 4.35Å; Y1607-F1611 HydrophobicContact CE1-CD2 4.05Å; Y1607-F1611 AromaticContact CE1-CE2 3.64Å; Y1607-F1611 HydrophobicContact CE1-CE2 3.64Å; Y1607-F1611 AromaticContact CE2-CE2 3.84Å; Y1607-F1611 HydrophobicContact CE2-CE2 3.84Å; Y1607-F1611 HydrophobicContact CG-CE2 4.5Å; Y1607-F1611 AromaticContact CZ-CE2 3.45Å; Y1607-F1611 VanDerWaalsContact CZ-CE2 3.45Å; Y1607-F1611 WeakPolarHBondContact O-CD2 3.34Å
1608	F	87.2	Confident	82	Confident	108 Å²	108	65.3 Å²	65.3	47%	0.474	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-33.4	178.9	-73.6	-58.9	0	0	0	112.7	T1604 T1605 M1610 F1611 G1612 D1613	T1604-F1608 WeakPolarHBondContact O-CD2 3.35Å; T1604-F1608 PolarHBondContact O-N 2.9Å; T1605-F1608 PolarHBondContact O-N 2.68Å; F1608-M1610 PolarHBondContact O-N 3.29Å; F1608-F1611 PolarHBondContact O-N 3.37Å; F1608-F1611 VanDerWaalsContact O-N 3.1Å; F1608-G1612 PolarHBondContact O-N 3.21Å; F1608-D1613 CarbonylContact C-O 3.57Å; F1608-D1613 HydrophobicContact CB-CB 4.24Å; F1608-D1613 PolarHBondContact O-N 3.18Å; F1608-D1613 VanDerWaalsContact O-N 3.08Å
1609	Q	87	Confident	81.5	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.019	33%	0.333	C	S	.	.	H	α-helix	trans	-61.7	-27.4	170.7	-80.4	160.3	-8.6	0	0	113.7	Y1565 T1605 Y1607 G1612 D1613 F1614 L1644 Y1647	Y1565-Q1609 PolarHBondContact OH-OE1 3.07Å; T1605-Q1609 VanDerWaalsContact O-CB 3.28Å; T1605-Q1609 WeakPolarHBondContact O-CB 3.06Å; T1605-Q1609 VanDerWaalsContact O-CD 3.29Å; T1605-Q1609 VanDerWaalsContact O-CG 3.23Å; T1605-Q1609 WeakPolarHBondContact O-CG 3.01Å; T1605-Q1609 PolarHBondContact O-N 3.33Å; T1605-Q1609 PolarHBondContact O-OE1 3.46Å; Y1607-Q1609 VanDerWaalsContact C-N 3.31Å; Y1607-Q1609 PolarHBondContact O-N 2.88Å; Q1609-G1612 PolarHBondContact O-N 2.76Å; Q1609-D1613 WeakPolarHBondContact CA-O 3.37Å; Q1609-D1613 WeakPolarHBondContact CG-O 3.4Å; Q1609-D1613 PolarHBondContact N-O 3.37Å; Q1609-F1614 PolarHBondContact NE2-O 3.06Å; Q1609-F1614 WeakPolarHBondContact O-CE1 3.08Å; Q1609-L1644 HydrophobicContact CB-CD1 4.19Å; Q1609-L1644 HydrophobicContact CG-CD1 4.24Å; Q1609-Y1647 HydrophobicContact CB-CE1 4.22Å
1610	M	85.6	Confident	80.9	Confident	34 Å²	34	63.5 Å²	63.5	17%	0.167	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-40.5	172.3	-171.3	-166.7	170.7	0	0	111.6	L1558 A1606 Y1607 F1608 G1612 Y1647 T1651	L1558-M1610 HydrophobicContact CD1-CE 3.67Å; L1558-M1610 HydrophobicContact CD1-SD 3.8Å; L1558-M1610 HydrophobicContact CD2-CE 3.77Å; L1558-M1610 HydrophobicContact CD2-SD 3.88Å; L1558-M1610 HydrophobicContact CG-CE 4.36Å; L1558-M1610 HydrophobicContact CG-SD 4.31Å; A1606-M1610 PolarHBondContact O-N 3.17Å; Y1607-M1610 VanDerWaalsContact O-CB 3.25Å; Y1607-M1610 WeakPolarHBondContact O-CB 2.98Å; Y1607-M1610 PolarHBondContact O-N 3.18Å; F1608-M1610 PolarHBondContact O-N 3.29Å; M1610-G1612 PolarHBondContact O-N 3.48Å; M1610-Y1647 HydrophobicContact CB-CE1 4.44Å; M1610-T1651 HydrophobicContact CG-CG2 4.41Å
1611	F	83.1	Confident	80.1	Confident	141 Å²	141	56.9 Å²	56.9	62%	0.618	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-4.6	178.9	-70.3	-82.8	0	0	0	114	Y1607 F1608	Y1607-F1611 HydrophobicContact CD1-CD2 4.32Å; Y1607-F1611 HydrophobicContact CD1-CE2 4.18Å; Y1607-F1611 HydrophobicContact CD2-CE2 4.35Å; Y1607-F1611 HydrophobicContact CE1-CD2 4.05Å; Y1607-F1611 AromaticContact CE1-CE2 3.64Å; Y1607-F1611 HydrophobicContact CE1-CE2 3.64Å; Y1607-F1611 AromaticContact CE2-CE2 3.84Å; Y1607-F1611 HydrophobicContact CE2-CE2 3.84Å; Y1607-F1611 HydrophobicContact CG-CE2 4.5Å; Y1607-F1611 AromaticContact CZ-CE2 3.45Å; Y1607-F1611 VanDerWaalsContact CZ-CE2 3.45Å; Y1607-F1611 WeakPolarHBondContact O-CD2 3.34Å; F1608-F1611 PolarHBondContact O-N 3.37Å; F1608-F1611 VanDerWaalsContact O-N 3.1Å
1612	G	83.4	Confident	79.6	Confident	34 Å²	34	62.3 Å²	62.3	35%	0.351	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	99	1.1	178.7	0	0	0	0	0	115.4	F1608 Q1609 M1610 F1614	F1608-G1612 PolarHBondContact O-N 3.21Å; Q1609-G1612 PolarHBondContact O-N 2.76Å; M1610-G1612 PolarHBondContact O-N 3.48Å; G1612-F1614 VanDerWaalsContact C-N 3.34Å; G1612-F1614 PolarHBondContact O-N 3.15Å; G1612-F1614 VanDerWaalsContact O-N 3.1Å
1613	D	85.2	Confident	78.5	Confident	92 Å²	92	63.7 Å²	63.7	49%	0.492	33%	0.33	S	S	.	.			trans	-81.1	88.5	166.7	-174.8	-11.7	0	0	0	108.7	F1608 Q1609 S1615	F1608-D1613 CarbonylContact C-O 3.57Å; F1608-D1613 HydrophobicContact CB-CB 4.24Å; F1608-D1613 PolarHBondContact O-N 3.18Å; F1608-D1613 VanDerWaalsContact O-N 3.08Å; Q1609-D1613 WeakPolarHBondContact CA-O 3.37Å; Q1609-D1613 WeakPolarHBondContact CG-O 3.4Å; Q1609-D1613 PolarHBondContact N-O 3.37Å; D1613-S1615 PolarHBondContact OD1-N 3.18Å; D1613-S1615 PolarHBondContact OD1-OG 3.03Å
1614	F	80.7	Confident	77.2	Confident	65 Å²	65	69.9 Å²	69.9	29%	0.285	35%	0.352	S	S	.	.			trans	-78.6	-22.2	-173.1	-59.7	-46	0	0	0	114.2	Q1609 G1612 L1616 L1644 V1648	Q1609-F1614 PolarHBondContact NE2-O 3.06Å; Q1609-F1614 WeakPolarHBondContact O-CE1 3.08Å; G1612-F1614 VanDerWaalsContact C-N 3.34Å; G1612-F1614 PolarHBondContact O-N 3.15Å; G1612-F1614 VanDerWaalsContact O-N 3.1Å; F1614-L1616 HydrophobicContact CB-CD2 4.41Å; F1614-L1616 HydrophobicContact CB-CG 3.91Å; F1614-L1616 PolarHBondContact O-N 3.15Å; F1614-L1644 HydrophobicContact CB-CD2 3.96Å; F1614-L1644 HydrophobicContact CD1-CD1 3.85Å; F1614-L1644 HydrophobicContact CD1-CD2 3.98Å; F1614-L1644 HydrophobicContact CD1-CG 4.32Å; F1614-L1644 HydrophobicContact CE1-CD1 4.27Å; F1614-L1644 HydrophobicContact CG-CD2 4.06Å; F1614-V1648 HydrophobicContact CD1-CG2 4.35Å; F1614-V1648 HydrophobicContact CE1-CG2 3.45Å; F1614-V1648 VanDerWaalsContact CE1-CG2 3.45Å; F1614-V1648 HydrophobicContact CZ-CG1 4.4Å; F1614-V1648 HydrophobicContact CZ-CG2 3.91Å
1615	S	75.8	Confident	75.8	Confident	66 Å²	66	71.7 Å²	71.7	46%	0.462	36%	0.364	S	S	.	.			trans	45.2	45.2	-172.3	-72.1	0	0	0	0	113.4	D1613 D1617 A1618 L1619	D1613-S1615 PolarHBondContact OD1-N 3.18Å; D1613-S1615 PolarHBondContact OD1-OG 3.03Å; S1615-D1617 VanDerWaalsContact C-N 3.28Å; S1615-D1617 PolarHBondContact O-N 3.4Å; S1615-A1618 PolarHBondContact O-N 3.39Å; S1615-A1618 VanDerWaalsContact O-N 3.12Å; S1615-L1619 PolarHBondContact O-N 3.37Å
1616	L	72.1	Confident	74.5	Confident	63 Å²	63	69.9 Å²	69.9	33%	0.33	35%	0.353	S	S	.	.	H	α-helix	trans	-55	-39.2	-174.3	-76.3	172.3	0	0	0	113.2	F1614 A1618 L1619 Q1620 L1644	F1614-L1616 HydrophobicContact CB-CD2 4.41Å; F1614-L1616 HydrophobicContact CB-CG 3.91Å; F1614-L1616 PolarHBondContact O-N 3.15Å; L1616-A1618 PolarHBondContact O-N 3.44Å; L1616-L1619 HydrophobicContact CD2-CD1 4.47Å; L1616-L1619 PolarHBondContact O-N 2.95Å; L1616-Q1620 WeakPolarHBondContact O-CB 3.32Å; L1616-Q1620 PolarHBondContact O-N 3.28Å; L1616-L1644 HydrophobicContact CD2-CD2 3.86Å
1617	D	71.7	Confident	72.9	Confident	103 Å²	103	78 Å²	78	55%	0.551	39%	0.391	S	S	*	.	H	α-helix	trans	-56	-37.2	-179.3	-53.2	3.9	0	0	0	111.9	S1615 G1621 E1622 D1623	S1615-D1617 VanDerWaalsContact C-N 3.28Å; S1615-D1617 PolarHBondContact O-N 3.4Å; D1617-G1621 WeakPolarHBondContact O-CA 3.4Å; D1617-G1621 PolarHBondContact O-N 3.28Å; D1617-G1621 VanDerWaalsContact O-N 3.08Å; D1617-E1622 PolarHBondContact O-N 3.18Å; D1617-D1623 HydrophobicContact CB-CB 3.93Å; D1617-D1623 PolarHBondContact O-N 2.99Å
1618	A	70.1	Confident	71.1	Confident	43 Å²	43	78.9 Å²	78.9	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-77.5	-37.4	176.3	0	0	0	0	0	112.4	S1615 L1616 G1621	S1615-A1618 PolarHBondContact O-N 3.39Å; S1615-A1618 VanDerWaalsContact O-N 3.12Å; L1616-A1618 PolarHBondContact O-N 3.44Å; A1618-G1621 PolarHBondContact O-N 3.33Å
1619	L	70.4	Confident	69.4	Low	25 Å²	25	79.3 Å²	79.3	13%	0.131	41%	0.405	C	S	.	.	H	α-helix	trans	-69.8	-38.3	177.1	-64.9	-179.9	0	0	0	113	S1615 L1616 G1621 V1640 L1644	S1615-L1619 PolarHBondContact O-N 3.37Å; L1616-L1619 HydrophobicContact CD2-CD1 4.47Å; L1616-L1619 PolarHBondContact O-N 2.95Å; L1619-G1621 VanDerWaalsContact C-N 3.34Å; L1619-V1640 HydrophobicContact CD1-CG1 4.34Å; L1619-V1640 HydrophobicContact CD2-CG1 4.06Å; L1619-L1644 HydrophobicContact CD1-CD2 4.21Å
1620	Q	71.8	Confident	68.2	Low	68 Å²	68	84 Å²	84	32%	0.318	43%	0.428	S	S	.	.	H	α-helix	trans	-83	-15.8	177.4	-67.1	177.8	-31.9	0	0	111.5	L1616 E1622 R1637 P1641	L1616-Q1620 WeakPolarHBondContact O-CB 3.32Å; L1616-Q1620 PolarHBondContact O-N 3.28Å; Q1620-E1622 VanDerWaalsContact C-N 3.32Å; Q1620-E1622 HydrophobicContact CB-CG 4.48Å; Q1620-R1637 WeakPolarHBondContact O-CG 3.43Å; Q1620-R1637 PolarHBondContact O-NE 3.45Å; Q1620-P1641 HydrophobicContact CG-CG 4.2Å
1621	G	65.5	Low	67.2	Low	7 Å²	7	85 Å²	85	7%	0.072	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	62	40.7	-175.4	0	0	0	0	0	111.9	D1617 A1618 L1619 R1637	D1617-G1621 WeakPolarHBondContact O-CA 3.4Å; D1617-G1621 PolarHBondContact O-N 3.28Å; D1617-G1621 VanDerWaalsContact O-N 3.08Å; A1618-G1621 PolarHBondContact O-N 3.33Å; L1619-G1621 VanDerWaalsContact C-N 3.34Å; G1621-R1637 PolarHBondContact O-NH2 3.1Å
1622	E	66.3	Low	66.6	Low	158 Å²	158	78.9 Å²	78.9	74%	0.738	41%	0.412	S	S	*	.			trans	-98.6	-14.4	166.6	-68.5	-155.3	140.2	0	0	112	D1617 Q1620	D1617-E1622 PolarHBondContact O-N 3.18Å; Q1620-E1622 VanDerWaalsContact C-N 3.32Å; Q1620-E1622 HydrophobicContact CB-CG 4.48Å
1623	D	63.2	Low	66	Low	56 Å²	56	79.2 Å²	79.2	30%	0.299	41%	0.407	S	S	.	.	S	Bend	trans	-56	141	174	-174.7	15	0	0	0	111.2	D1617 T1625 C1626	D1617-D1623 HydrophobicContact CB-CB 3.93Å; D1617-D1623 PolarHBondContact O-N 2.99Å; D1623-T1625 PolarHBondContact O-N 3.09Å; D1623-T1625 VanDerWaalsContact O-N 3.11Å; D1623-T1625 WeakPolarHBondContact OD2-CB 3.33Å; D1623-T1625 WeakPolarHBondContact OD2-CG2 3.22Å; D1623-T1625 PolarHBondContact OD2-OG1 3.3Å; D1623-C1626 WeakPolarHBondContact O-CB 3.44Å; D1623-C1626 PolarHBondContact O-N 3.06Å
1624	R	58.1	Low	65.5	Low	218 Å²	218	83.7 Å²	83.7	82%	0.823	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-63.1	-18.6	-179.4	-61.8	177.3	-178.8	167.1	2	112	C1626	R1624-C1626 VanDerWaalsContact C-N 3.29Å
1625	T	55.8	Low	65.5	Low	74 Å²	74	84.3 Å²	84.3	45%	0.454	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-66.3	-26.1	170.5	64	0	0	0	0	113.3	D1623 Q1627 N1628	D1623-T1625 PolarHBondContact O-N 3.09Å; D1623-T1625 VanDerWaalsContact O-N 3.11Å; D1623-T1625 WeakPolarHBondContact OD2-CB 3.33Å; D1623-T1625 WeakPolarHBondContact OD2-CG2 3.22Å; D1623-T1625 PolarHBondContact OD2-OG1 3.3Å; T1625-Q1627 PolarHBondContact O-N 3.01Å; T1625-N1628 CarbonylContact O-C 3.57Å; T1625-N1628 WeakPolarHBondContact O-CA 3.33Å; T1625-N1628 PolarHBondContact O-N 3.29Å
1626	C	56.8	Low	65.6	Low	14 Å²	14	81.2 Å²	81.2	10%	0.095	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-60.2	-31.9	-179.2	-150.6	0	0	0	0	111.8	D1623 R1624 N1628 M1630 C1631	D1623-C1626 WeakPolarHBondContact O-CB 3.44Å; D1623-C1626 PolarHBondContact O-N 3.06Å; R1624-C1626 VanDerWaalsContact C-N 3.29Å; C1626-N1628 PolarHBondContact O-N 3.27Å; C1626-N1628 VanDerWaalsContact O-N 3.11Å; C1626-M1630 WeakPolarHBondContact CA-O 3.28Å; C1626-C1631 VanDerWaalsContact C-SG 3.53Å; C1626-C1631 VanDerWaalsContact CA-SG 3.55Å; C1626-C1631 WeakPolarHBondContact CB-SG 3.3Å; C1626-C1631 PolarHBondContact O-SG 3.36Å; C1626-C1631 WeakPolarHBondContact SG-CA 3.12Å; C1626-C1631 WeakPolarHBondContact SG-CB 3.42Å; C1626-C1631 CovalentContact SG-SG 2.04Å; C1626-C1631 PolarHBondContact SG-SG 2.92Å
1627	Q	52.3	Low	66	Low	171 Å²	171	83.7 Å²	83.7	80%	0.799	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-61.6	-17.8	172.9	-69.3	-171.9	-23.8	0	0	113.6	T1625	T1625-Q1627 PolarHBondContact O-N 3.01Å
1628	N	51	Low	66.6	Low	112 Å²	112	86.1 Å²	86.1	60%	0.599	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-111.9	59.4	-179.1	-63.6	-65.1	0	0	0	111.7	T1625 C1626 M1630	T1625-N1628 CarbonylContact O-C 3.57Å; T1625-N1628 WeakPolarHBondContact O-CA 3.33Å; T1625-N1628 PolarHBondContact O-N 3.29Å; C1626-N1628 PolarHBondContact O-N 3.27Å; C1626-N1628 VanDerWaalsContact O-N 3.11Å; N1628-M1630 PolarHBondContact O-N 3.3Å
1629	H	51.8	Low	67.4	Low	118 Å²	118	86.3 Å²	86.3	55%	0.546	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.7	12.8	164.6	-41.4	-46.2	0	0	0	117.5
1630	M	61.8	Low	68	Low	101 Å²	101	85.2 Å²	85.2	50%	0.498	41%	0.406	S	S	.	.			trans	-128.7	79.5	-179.3	-63.5	-174.9	71.6	0	0	111.7	F1579 C1626 N1628	F1579-M1630 HydrophobicContact CD1-CG 4.43Å; F1579-M1630 HydrophobicContact CE1-CE 3.94Å; F1579-M1630 HydrophobicContact CZ-CE 4.43Å; C1626-M1630 WeakPolarHBondContact CA-O 3.28Å; N1628-M1630 PolarHBondContact O-N 3.3Å
1631	C	64.7	Low	68.7	Low	57 Å²	57	83.4 Å²	83.4	39%	0.385	40%	0.4	S	S	.	.			trans	-122.3	136.6	175.2	-70.2	0	0	0	0	111.9	C1626	C1626-C1631 VanDerWaalsContact C-SG 3.53Å; C1626-C1631 VanDerWaalsContact CA-SG 3.55Å; C1626-C1631 WeakPolarHBondContact CB-SG 3.3Å; C1626-C1631 PolarHBondContact O-SG 3.36Å; C1626-C1631 WeakPolarHBondContact SG-CA 3.12Å; C1626-C1631 WeakPolarHBondContact SG-CB 3.42Å; C1626-C1631 CovalentContact SG-SG 2.04Å; C1626-C1631 PolarHBondContact SG-SG 2.92Å
1632	P	69.3	Low	69.8	Low	11 Å²	11	87 Å²	87	7%	0.071	42%	0.417	C	S	.	.			trans	-83.8	165.9	-178.4	38.2	-38.8	0	0	0	111.6	A1573 S1636	A1573-P1632 HydrophobicContact CB-CB 4.33Å; P1632-S1636 WeakPolarHBondContact CB-OG 3.49Å
1633	T	72.5	Confident	70.8	Confident	41 Å²	41	82.7 Å²	82.7	25%	0.252	40%	0.398	S	S	.	.			trans	-58.5	150	-172.1	71.4	0	0	0	0	113.7	I1572 A1573 P1575 T1635 S1636 R1637	I1572-T1633 PolarHBondContact O-OG1 3.41Å; A1573-T1633 PolarHBondContact O-N 2.75Å; P1575-T1633 HydrophobicContact CG-CG2 3.7Å; T1633-T1635 PolarHBondContact O-N 3.14Å; T1633-S1636 PolarHBondContact N-OG 2.86Å; T1633-S1636 WeakPolarHBondContact O-CB 3.32Å; T1633-S1636 PolarHBondContact O-N 3.23Å; T1633-S1636 PolarHBondContact O-OG 3.29Å; T1633-S1636 WeakPolarHBondContact OG1-CB 3.41Å; T1633-S1636 PolarHBondContact OG1-N 3.16Å; T1633-S1636 VanDerWaalsContact OG1-N 3.08Å; T1633-R1637 PolarHBondContact O-N 3.09Å
1634	K	74.7	Confident	72	Confident	187 Å²	187	80.5 Å²	80.5	81%	0.813	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-26	176.6	-170.6	174	-179.9	178.6	0	113.3
1635	T	79.5	Confident	73.4	Confident	78 Å²	78	72.2 Å²	72.2	48%	0.479	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-37.8	174.6	-43.3	0	0	0	0	112.2	T1633 R1637 W1638 L1639	T1633-T1635 PolarHBondContact O-N 3.14Å; T1635-R1637 VanDerWaalsContact C-N 3.33Å; T1635-R1637 PolarHBondContact O-N 3.45Å; T1635-W1638 HydrophobicContact CG2-CZ2 4.33Å; T1635-W1638 PolarHBondContact O-NE1 2.79Å; T1635-L1639 HydrophobicContact CG2-CD2 4.42Å; T1635-L1639 WeakPolarHBondContact O-CB 3.35Å; T1635-L1639 PolarHBondContact O-N 2.92Å
1636	S	79	Confident	74.9	Confident	1 Å²	1	75.3 Å²	75.3	1%	0.007	38%	0.375	C	S	.	.	H	α-helix	trans	-61.1	-37.1	-179	70.4	0	0	0	0	113.9	P1632 T1633 W1638 L1639 V1640 P1641	P1632-S1636 WeakPolarHBondContact CB-OG 3.49Å; T1633-S1636 PolarHBondContact N-OG 2.86Å; T1633-S1636 WeakPolarHBondContact O-CB 3.32Å; T1633-S1636 PolarHBondContact O-N 3.23Å; T1633-S1636 PolarHBondContact O-OG 3.29Å; T1633-S1636 WeakPolarHBondContact OG1-CB 3.41Å; T1633-S1636 PolarHBondContact OG1-N 3.16Å; T1633-S1636 VanDerWaalsContact OG1-N 3.08Å; S1636-W1638 PolarHBondContact O-N 3.01Å; S1636-L1639 PolarHBondContact O-N 3.29Å; S1636-L1639 VanDerWaalsContact O-N 3.14Å; S1636-V1640 PolarHBondContact O-N 3.45Å; S1636-P1641 WeakPolarHBondContact O-CD 3.43Å
1637	R	80.8	Confident	76.6	Confident	115 Å²	115	75.1 Å²	75.1	43%	0.434	37%	0.373	S	S	.	.	H	α-helix	trans	-53	-29	-174.6	-76.2	-174.7	145.8	148.4	-4.5	115	Q1620 G1621 T1633 T1635	Q1620-R1637 WeakPolarHBondContact O-CG 3.43Å; Q1620-R1637 PolarHBondContact O-NE 3.45Å; G1621-R1637 PolarHBondContact O-NH2 3.1Å; T1633-R1637 PolarHBondContact O-N 3.09Å; T1635-R1637 VanDerWaalsContact C-N 3.33Å; T1635-R1637 PolarHBondContact O-N 3.45Å
1638	W	83.6	Confident	78.2	Confident	153 Å²	153	68.5 Å²	68.5	58%	0.58	34%	0.344	S	S	*	.	H	α-helix	trans	-108.3	-32.5	175.5	68.3	-88.3	0	0	0	112.6	T1635 S1636 I1642	T1635-W1638 HydrophobicContact CG2-CZ2 4.33Å; T1635-W1638 PolarHBondContact O-NE1 2.79Å; S1636-W1638 PolarHBondContact O-N 3.01Å; W1638-I1642 HydrophobicContact CE3-CD1 3.81Å; W1638-I1642 HydrophobicContact CZ3-CD1 4.15Å; W1638-I1642 WeakPolarHBondContact O-CD1 3.49Å; W1638-I1642 WeakPolarHBondContact O-CG1 3.48Å
1639	L	86.3	Confident	79.9	Confident	47 Å²	47	68 Å²	68	25%	0.246	34%	0.341	C	S	.	.	H	α-helix	trans	-76.9	-40.6	-175.1	-174.2	58.5	0	0	0	113.1	I1572 T1635 S1636 I1642 M1643	I1572-L1639 HydrophobicContact CD1-CD2 3.89Å; I1572-L1639 HydrophobicContact CD1-CG 4.26Å; I1572-L1639 HydrophobicContact CG1-CD2 4.46Å; I1572-L1639 HydrophobicContact CG2-CD2 4.1Å; T1635-L1639 HydrophobicContact CG2-CD2 4.42Å; T1635-L1639 WeakPolarHBondContact O-CB 3.35Å; T1635-L1639 PolarHBondContact O-N 2.92Å; S1636-L1639 PolarHBondContact O-N 3.29Å; S1636-L1639 VanDerWaalsContact O-N 3.14Å; L1639-I1642 PolarHBondContact O-N 2.87Å; L1639-M1643 WeakPolarHBondContact O-CG 3.39Å; L1639-M1643 PolarHBondContact O-N 2.87Å
1640	V	84	Confident	81.6	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.012	33%	0.332	C	S	.	.	H	α-helix	trans	-69.8	-39.8	-178.1	-176.9	0	0	0	0	112.3	A1569 I1572 L1619 S1636 I1642 M1643 L1644	A1569-V1640 HydrophobicContact CB-CG1 4.19Å; I1572-V1640 HydrophobicContact CB-CG2 4.05Å; I1572-V1640 HydrophobicContact CG2-CG2 3.57Å; L1619-V1640 HydrophobicContact CD1-CG1 4.34Å; L1619-V1640 HydrophobicContact CD2-CG1 4.06Å; S1636-V1640 PolarHBondContact O-N 3.45Å; V1640-I1642 VanDerWaalsContact C-N 3.29Å; V1640-I1642 PolarHBondContact O-N 3.43Å; V1640-M1643 PolarHBondContact O-N 2.88Å; V1640-L1644 WeakPolarHBondContact O-CB 3.44Å; V1640-L1644 PolarHBondContact O-N 2.88Å
1641	P	86.1	Confident	82.8	Confident	31 Å²	31	60.9 Å²	60.9	20%	0.201	31%	0.308	C	S	.	.	H	α-helix	trans	-60.6	-33.4	170.6	-27.6	37.3	0	0	0	114.1	Q1620 S1636 G1645	Q1620-P1641 HydrophobicContact CG-CG 4.2Å; S1636-P1641 WeakPolarHBondContact O-CD 3.43Å; P1641-G1645 PolarHBondContact O-N 3.47Å
1642	I	88.1	Confident	83.7	Confident	83 Å²	83	61.8 Å²	61.8	43%	0.426	31%	0.31	S	S	.	.	H	α-helix	trans	-68.1	-46.3	173.6	-67.9	170.8	0	0	0	110.5	W1638 L1639 V1640 L1644 G1645 F1646	W1638-I1642 HydrophobicContact CE3-CD1 3.81Å; W1638-I1642 HydrophobicContact CZ3-CD1 4.15Å; W1638-I1642 WeakPolarHBondContact O-CD1 3.49Å; W1638-I1642 WeakPolarHBondContact O-CG1 3.48Å; L1639-I1642 PolarHBondContact O-N 2.87Å; V1640-I1642 VanDerWaalsContact C-N 3.29Å; V1640-I1642 PolarHBondContact O-N 3.43Å; I1642-L1644 VanDerWaalsContact C-N 3.31Å; I1642-L1644 PolarHBondContact O-N 2.99Å; I1642-G1645 PolarHBondContact O-N 3.18Å; I1642-G1645 VanDerWaalsContact O-N 3.14Å; I1642-F1646 HydrophobicContact CG2-CD2 4.02Å; I1642-F1646 HydrophobicContact CG2-CE2 3.8Å; I1642-F1646 WeakPolarHBondContact O-CD2 3.49Å; I1642-F1646 PolarHBondContact O-N 3.47Å; I1642-F1646 VanDerWaalsContact O-N 3.13Å
1643	M	87.6	Confident	84.5	Confident	67 Å²	67	66.2 Å²	66.2	33%	0.33	33%	0.332	S	S	.	.	H	α-helix	trans	-60.6	-39.4	175.6	-69.2	-63.4	-66.4	0	0	112.2	Y1565 A1568 L1639 V1640 F1646 Y1647	Y1565-M1643 HydrophobicContact CE2-CB 4.16Å; A1568-M1643 HydrophobicContact CB-CE 4.25Å; L1639-M1643 WeakPolarHBondContact O-CG 3.39Å; L1639-M1643 PolarHBondContact O-N 2.87Å; V1640-M1643 PolarHBondContact O-N 2.88Å; M1643-F1646 PolarHBondContact O-N 2.79Å; M1643-Y1647 WeakPolarHBondContact O-CB 3.49Å; M1643-Y1647 PolarHBondContact O-N 2.85Å
1644	L	87.8	Confident	85.1	Confident	9 Å²	9	68.9 Å²	68.9	5%	0.047	34%	0.344	C	S	.	.	H	α-helix	trans	-60.7	-44.1	172.8	176.9	63.6	0	0	0	111.3	Y1565 Q1609 F1614 L1616 L1619 V1640 I1642 F1646 Y1647 V1648	Y1565-L1644 HydrophobicContact CE1-CD1 4.5Å; Y1565-L1644 WeakPolarHBondContact OH-CB 3.49Å; Y1565-L1644 WeakPolarHBondContact OH-CD1 3.44Å; Q1609-L1644 HydrophobicContact CB-CD1 4.19Å; Q1609-L1644 HydrophobicContact CG-CD1 4.24Å; F1614-L1644 HydrophobicContact CB-CD2 3.96Å; F1614-L1644 HydrophobicContact CD1-CD1 3.85Å; F1614-L1644 HydrophobicContact CD1-CD2 3.98Å; F1614-L1644 HydrophobicContact CD1-CG 4.32Å; F1614-L1644 HydrophobicContact CE1-CD1 4.27Å; F1614-L1644 HydrophobicContact CG-CD2 4.06Å; L1616-L1644 HydrophobicContact CD2-CD2 3.86Å; L1619-L1644 HydrophobicContact CD1-CD2 4.21Å; V1640-L1644 WeakPolarHBondContact O-CB 3.44Å; V1640-L1644 PolarHBondContact O-N 2.88Å; I1642-L1644 VanDerWaalsContact C-N 3.31Å; I1642-L1644 PolarHBondContact O-N 2.99Å; L1644-F1646 VanDerWaalsContact C-N 3.32Å; L1644-F1646 PolarHBondContact O-N 2.79Å; L1644-Y1647 HydrophobicContact CD1-CD1 4.29Å; L1644-Y1647 PolarHBondContact O-N 2.78Å; L1644-V1648 HydrophobicContact CD1-CG2 3.86Å; L1644-V1648 HydrophobicContact CG-CG2 4.26Å; L1644-V1648 WeakPolarHBondContact O-CB 3.31Å; L1644-V1648 VanDerWaalsContact O-CG2 3.29Å; L1644-V1648 WeakPolarHBondContact O-CG2 3.34Å; L1644-V1648 PolarHBondContact O-N 2.84Å
1645	G	87.7	Confident	85.7	Confident	44 Å²	44	60.7 Å²	60.7	45%	0.454	31%	0.309	S	S	.	.	H	α-helix	trans	-57.5	-42.5	175.8	0	0	0	0	0	113.2	P1641 I1642 L1649	P1641-G1645 PolarHBondContact O-N 3.47Å; I1642-G1645 PolarHBondContact O-N 3.18Å; I1642-G1645 VanDerWaalsContact O-N 3.14Å; G1645-L1649 WeakPolarHBondContact O-CB 3.46Å; G1645-L1649 PolarHBondContact O-N 2.63Å; G1645-L1649 VanDerWaalsContact O-N 3.13Å
1646	F	88.8	Confident	86	Confident	139 Å²	139	62.8 Å²	62.8	61%	0.61	31%	0.311	S	S	*	.	H	α-helix	trans	-67.3	-42.2	173.4	-77.6	-70.6	0	0	0	112.8	I1642 M1643 L1644 L1649 L1650	I1642-F1646 HydrophobicContact CG2-CD2 4.02Å; I1642-F1646 HydrophobicContact CG2-CE2 3.8Å; I1642-F1646 WeakPolarHBondContact O-CD2 3.49Å; I1642-F1646 PolarHBondContact O-N 3.47Å; I1642-F1646 VanDerWaalsContact O-N 3.13Å; M1643-F1646 PolarHBondContact O-N 2.79Å; L1644-F1646 VanDerWaalsContact C-N 3.32Å; L1644-F1646 PolarHBondContact O-N 2.79Å; F1646-L1649 PolarHBondContact O-N 3.16Å; F1646-L1650 WeakPolarHBondContact O-CB 3.42Å; F1646-L1650 PolarHBondContact O-N 3.23Å
1647	Y	90.9	Very high	86.5	Confident	10 Å²	10	67.3 Å²	67.3	4%	0.039	34%	0.335	C	S	.	.	H	α-helix	trans	-61	-45.5	177.3	174.6	-114.5	0	0	0	112.3	I1561 Y1565 A1606 Q1609 M1610 M1643 L1644 L1650 T1651	I1561-Y1647 HydrophobicContact CG2-CD2 4.31Å; I1561-Y1647 HydrophobicContact CG2-CE2 4.16Å; Y1565-Y1647 AromaticContact CD1-CD1 3.48Å; Y1565-Y1647 HydrophobicContact CD1-CD1 3.48Å; Y1565-Y1647 VanDerWaalsContact CD1-CD1 3.48Å; Y1565-Y1647 AromaticContact CD1-CD2 3.65Å; Y1565-Y1647 HydrophobicContact CD1-CD2 3.65Å; Y1565-Y1647 AromaticContact CD1-CE1 3.55Å; Y1565-Y1647 HydrophobicContact CD1-CE1 3.55Å; Y1565-Y1647 AromaticContact CD1-CE2 3.73Å; Y1565-Y1647 HydrophobicContact CD1-CE2 3.73Å; Y1565-Y1647 AromaticContact CD1-CG 3.5Å; Y1565-Y1647 HydrophobicContact CD1-CG 3.5Å; Y1565-Y1647 AromaticContact CD1-CZ 3.66Å; Y1565-Y1647 HydrophobicContact CD2-CD2 4.32Å; Y1565-Y1647 HydrophobicContact CD2-CG 4.01Å; Y1565-Y1647 AromaticContact CE1-CD1 3.48Å; Y1565-Y1647 HydrophobicContact CE1-CD1 3.48Å; Y1565-Y1647 VanDerWaalsContact CE1-CD1 3.48Å; Y1565-Y1647 HydrophobicContact CE1-CD2 4.46Å; Y1565-Y1647 AromaticContact CE1-CE1 3.7Å; Y1565-Y1647 HydrophobicContact CE1-CE1 3.7Å; Y1565-Y1647 AromaticContact CE1-CG 3.88Å; Y1565-Y1647 HydrophobicContact CE1-CG 3.88Å; Y1565-Y1647 HydrophobicContact CE2-CG 4.36Å; Y1565-Y1647 HydrophobicContact CG-CD1 4.06Å; Y1565-Y1647 AromaticContact CG-CD2 3.56Å; Y1565-Y1647 HydrophobicContact CG-CD2 3.56Å; Y1565-Y1647 HydrophobicContact CG-CE1 4.43Å; Y1565-Y1647 AromaticContact CG-CE2 4Å; Y1565-Y1647 HydrophobicContact CG-CE2 4Å; Y1565-Y1647 AromaticContact CG-CG 3.58Å; Y1565-Y1647 HydrophobicContact CG-CG 3.58Å; A1606-Y1647 PolarHBondContact O-OH 2.79Å; Q1609-Y1647 HydrophobicContact CB-CE1 4.22Å; M1610-Y1647 HydrophobicContact CB-CE1 4.44Å; M1643-Y1647 WeakPolarHBondContact O-CB 3.49Å; M1643-Y1647 PolarHBondContact O-N 2.85Å; L1644-Y1647 HydrophobicContact CD1-CD1 4.29Å; L1644-Y1647 PolarHBondContact O-N 2.78Å; Y1647-L1650 PolarHBondContact O-N 3.16Å; Y1647-T1651 HydrophobicContact CD2-CG2 3.98Å; Y1647-T1651 HydrophobicContact CE2-CG2 3.68Å; Y1647-T1651 WeakPolarHBondContact O-CB 3.46Å; Y1647-T1651 WeakPolarHBondContact O-CG2 3.46Å; Y1647-T1651 PolarHBondContact O-N 3.32Å; Y1647-T1651 PolarHBondContact O-OG1 3.39Å
1648	V	87.5	Confident	86.9	Confident	33 Å²	33	64.9 Å²	64.9	20%	0.2	33%	0.331	C	S	.	.	H	α-helix	trans	-65	-40.5	177.9	171.7	0	0	0	0	111.6	F1614 L1644 T1651 N1652	F1614-V1648 HydrophobicContact CD1-CG2 4.35Å; F1614-V1648 HydrophobicContact CE1-CG2 3.45Å; F1614-V1648 VanDerWaalsContact CE1-CG2 3.45Å; F1614-V1648 HydrophobicContact CZ-CG1 4.4Å; F1614-V1648 HydrophobicContact CZ-CG2 3.91Å; L1644-V1648 HydrophobicContact CD1-CG2 3.86Å; L1644-V1648 HydrophobicContact CG-CG2 4.26Å; L1644-V1648 WeakPolarHBondContact O-CB 3.31Å; L1644-V1648 VanDerWaalsContact O-CG2 3.29Å; L1644-V1648 WeakPolarHBondContact O-CG2 3.34Å; L1644-V1648 PolarHBondContact O-N 2.84Å; V1648-T1651 PolarHBondContact O-OG1 2.89Å; V1648-N1652 WeakPolarHBondContact O-CB 3.4Å; V1648-N1652 PolarHBondContact O-N 2.69Å
1649	L	86.1	Confident	87.1	Confident	100 Å²	100	58.8 Å²	58.8	52%	0.524	31%	0.309	S	S	.	.	H	α-helix	trans	-62.3	-46.1	174.9	-176.7	152.4	0	0	0	111.3	G1645 F1646 I1653	G1645-L1649 WeakPolarHBondContact O-CB 3.46Å; G1645-L1649 PolarHBondContact O-N 2.63Å; G1645-L1649 VanDerWaalsContact O-N 3.13Å; F1646-L1649 PolarHBondContact O-N 3.16Å; L1649-I1653 HydrophobicContact CG-CD1 4.18Å; L1649-I1653 VanDerWaalsContact O-CB 3.29Å; L1649-I1653 WeakPolarHBondContact O-CB 3.42Å; L1649-I1653 PolarHBondContact O-N 3.31Å; L1649-I1653 VanDerWaalsContact O-N 3.11Å
1650	L	87.7	Confident	87.4	Confident	69 Å²	69	60.6 Å²	60.6	36%	0.361	32%	0.318	S	S	.	.	I	π-helix	trans	-71.5	-39.9	-176.1	-171.5	149.3	0	0	0	112.5	I1561 F1646 Y1647 L1654 M1655	I1561-L1650 HydrophobicContact CD1-CD2 3.85Å; I1561-L1650 HydrophobicContact CG1-CD2 4.25Å; I1561-L1650 HydrophobicContact CG2-CD2 3.66Å; F1646-L1650 WeakPolarHBondContact O-CB 3.42Å; F1646-L1650 PolarHBondContact O-N 3.23Å; Y1647-L1650 PolarHBondContact O-N 3.16Å; L1650-L1654 WeakPolarHBondContact O-CB 3.45Å; L1650-L1654 PolarHBondContact O-N 3Å; L1650-M1655 PolarHBondContact O-N 2.92Å
1651	T	86.7	Confident	87.7	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.006	34%	0.343	C	S	.	.	I	π-helix	trans	-72.3	-53.3	176.9	48.9	0	0	0	0	112.1	L1558 I1561 M1610 Y1647 V1648 M1655 F1656	L1558-T1651 HydrophobicContact CD1-CG2 4.46Å; I1561-T1651 HydrophobicContact CG2-CG2 4.32Å; M1610-T1651 HydrophobicContact CG-CG2 4.41Å; Y1647-T1651 HydrophobicContact CD2-CG2 3.98Å; Y1647-T1651 HydrophobicContact CE2-CG2 3.68Å; Y1647-T1651 WeakPolarHBondContact O-CB 3.46Å; Y1647-T1651 WeakPolarHBondContact O-CG2 3.46Å; Y1647-T1651 PolarHBondContact O-N 3.32Å; Y1647-T1651 PolarHBondContact O-OG1 3.39Å; V1648-T1651 PolarHBondContact O-OG1 2.89Å; T1651-M1655 WeakPolarHBondContact O-CB 3.42Å; T1651-M1655 PolarHBondContact O-N 3.03Å; T1651-F1656 PolarHBondContact O-N 3.4Å
1652	N	83.6	Confident	87.9	Confident	77 Å²	77	64.6 Å²	64.6	41%	0.412	35%	0.346	S	S	.	.	I	π-helix	trans	-80.9	-27.5	-170.6	-69	-27.2	0	0	0	114.4	V1648	V1648-N1652 WeakPolarHBondContact O-CB 3.4Å; V1648-N1652 PolarHBondContact O-N 2.69Å
1653	I	84.9	Confident	88.1	Confident	104 Å²	104	63.4 Å²	63.4	53%	0.533	34%	0.338	S	S	.	.	I	π-helix	trans	-94.5	-48	178.2	-51	-173.2	0	0	0	111.6	L1649 N1657	L1649-I1653 HydrophobicContact CG-CD1 4.18Å; L1649-I1653 VanDerWaalsContact O-CB 3.29Å; L1649-I1653 WeakPolarHBondContact O-CB 3.42Å; L1649-I1653 PolarHBondContact O-N 3.31Å; L1649-I1653 VanDerWaalsContact O-N 3.11Å; I1653-N1657 PolarHBondContact O-ND2 3.36Å
1654	L	85.7	Confident	88.3	Confident	96 Å²	96	62.9 Å²	62.9	50%	0.503	34%	0.34	S	S	.	.	I	π-helix	trans	-86.7	-50.3	-170.6	-173.5	151.3	0	0	0	112.1	L1650 L1658	L1650-L1654 WeakPolarHBondContact O-CB 3.45Å; L1650-L1654 PolarHBondContact O-N 3Å; L1654-L1658 WeakPolarHBondContact O-CB 3.38Å; L1654-L1658 PolarHBondContact O-N 3.17Å
1655	M	86.8	Confident	88.4	Confident	16 Å²	16	69.9 Å²	69.9	8%	0.079	37%	0.37	C	S	.	.	I	π-helix	trans	-69.3	-40.7	-176.9	-69.4	-79.1	131.3	0	0	112.9	F1554 I1557 I1561 L1650 T1651 N1657 L1658 L1659	F1554-M1655 HydrophobicContact CE2-CB 3.96Å; F1554-M1655 VanDerWaalsContact CE2-O 3.32Å; F1554-M1655 WeakPolarHBondContact CE2-O 3.06Å; F1554-M1655 HydrophobicContact CE2-SD 4.07Å; F1554-M1655 HydrophobicContact CZ-CB 3.97Å; I1557-M1655 HydrophobicContact CG2-CE 3.79Å; I1557-M1655 HydrophobicContact CG2-SD 3.79Å; I1561-M1655 HydrophobicContact CD1-CE 3.55Å; I1561-M1655 HydrophobicContact CD1-CG 4.01Å; I1561-M1655 HydrophobicContact CD1-SD 3.65Å; L1650-M1655 PolarHBondContact O-N 2.92Å; T1651-M1655 WeakPolarHBondContact O-CB 3.42Å; T1651-M1655 PolarHBondContact O-N 3.03Å; M1655-N1657 PolarHBondContact O-N 3.34Å; M1655-L1658 PolarHBondContact O-N 3.4Å; M1655-L1659 PolarHBondContact O-N 3.05Å
1656	F	85.9	Confident	88.4	Confident	121 Å²	121	68.5 Å²	68.5	53%	0.531	35%	0.353	S	S	.	.	H	α-helix	trans	-64.4	-41.6	-179.8	-173	-114	0	0	0	113.3	T1651 L1658 L1659 I1660	T1651-F1656 PolarHBondContact O-N 3.4Å; F1656-L1658 VanDerWaalsContact C-N 3.34Å; F1656-L1659 PolarHBondContact O-N 2.84Å; F1656-I1660 HydrophobicContact CD1-CD1 3.89Å; F1656-I1660 HydrophobicContact CE1-CD1 3.56Å; F1656-I1660 HydrophobicContact CZ-CD1 3.97Å; F1656-I1660 WeakPolarHBondContact O-CG1 3.27Å; F1656-I1660 PolarHBondContact O-N 2.75Å; F1656-I1660 VanDerWaalsContact O-N 3.12Å
1657	N	89.4	Confident	88.4	Confident	96 Å²	96	66 Å²	66	51%	0.513	34%	0.34	S	S	.	.	H	α-helix	trans	-67.2	-34.9	176	-77.5	-48.4	0	0	0	112.4	I1653 M1655 I1660 A1661	I1653-N1657 PolarHBondContact O-ND2 3.36Å; M1655-N1657 PolarHBondContact O-N 3.34Å; N1657-I1660 PolarHBondContact O-N 2.63Å; N1657-A1661 PolarHBondContact O-N 3.11Å; N1657-A1661 VanDerWaalsContact O-N 3.09Å
1658	L	89	Confident	88.3	Confident	65 Å²	65	71.3 Å²	71.3	34%	0.34	37%	0.366	S	S	.	.	H	α-helix	trans	-63.9	-44.5	174.1	-168.9	160.4	0	0	0	110.9	F1554 L1654 M1655 F1656 I1660 A1661 M1662	F1554-L1658 HydrophobicContact CD2-CD2 4.44Å; L1654-L1658 WeakPolarHBondContact O-CB 3.38Å; L1654-L1658 PolarHBondContact O-N 3.17Å; M1655-L1658 PolarHBondContact O-N 3.4Å; F1656-L1658 VanDerWaalsContact C-N 3.34Å; L1658-I1660 PolarHBondContact O-N 2.96Å; L1658-A1661 PolarHBondContact O-N 3.29Å; L1658-M1662 HydrophobicContact CD2-CE 3.62Å; L1658-M1662 HydrophobicContact CD2-CG 4.12Å; L1658-M1662 HydrophobicContact CD2-SD 3.67Å; L1658-M1662 WeakPolarHBondContact O-CG 3.46Å; L1658-M1662 PolarHBondContact O-N 3.18Å; L1658-M1662 VanDerWaalsContact O-N 3.07Å
1659	L	89.5	Confident	88.1	Confident	25 Å²	25	76.1 Å²	76.1	13%	0.131	39%	0.386	C	S	.	.	H	α-helix	trans	-60	-43.6	176.4	-175.3	62.8	0	0	0	112.5	L1551 F1554 M1655 F1656 A1661 M1662 F1663	L1551-L1659 HydrophobicContact CD1-CD1 4.47Å; F1554-L1659 HydrophobicContact CB-CD1 4.18Å; F1554-L1659 HydrophobicContact CD1-CD1 3.94Å; F1554-L1659 HydrophobicContact CD1-CD2 4.26Å; F1554-L1659 HydrophobicContact CD2-CB 4.19Å; F1554-L1659 HydrophobicContact CD2-CD1 4.09Å; F1554-L1659 HydrophobicContact CE1-CB 4.5Å; F1554-L1659 HydrophobicContact CE1-CD1 4.34Å; F1554-L1659 HydrophobicContact CE1-CD2 3.91Å; F1554-L1659 HydrophobicContact CE1-CG 4.49Å; F1554-L1659 HydrophobicContact CE2-CB 3.86Å; F1554-L1659 HydrophobicContact CE2-CD1 4.48Å; F1554-L1659 HydrophobicContact CG-CD1 3.8Å; F1554-L1659 HydrophobicContact CZ-CB 4.02Å; F1554-L1659 HydrophobicContact CZ-CD2 4.15Å; F1554-L1659 HydrophobicContact CZ-CG 4.49Å; M1655-L1659 PolarHBondContact O-N 3.05Å; F1656-L1659 PolarHBondContact O-N 2.84Å; L1659-A1661 VanDerWaalsContact C-N 3.34Å; L1659-A1661 PolarHBondContact O-N 3.42Å; L1659-M1662 HydrophobicContact CD1-CE 4.33Å; L1659-M1662 PolarHBondContact O-N 2.98Å; L1659-F1663 HydrophobicContact CD1-CD1 4.43Å; L1659-F1663 HydrophobicContact CD1-CD2 4.08Å; L1659-F1663 HydrophobicContact CD1-CE1 4Å; L1659-F1663 HydrophobicContact CD1-CE2 3.62Å; L1659-F1663 HydrophobicContact CD1-CG 4.49Å; L1659-F1663 HydrophobicContact CD1-CZ 3.58Å; L1659-F1663 HydrophobicContact CD2-CE2 4Å; L1659-F1663 HydrophobicContact CG-CD2 3.94Å; L1659-F1663 HydrophobicContact CG-CE2 3.65Å; L1659-F1663 HydrophobicContact CG-CZ 4.16Å; L1659-F1663 WeakPolarHBondContact O-CG 3.36Å; L1659-F1663 PolarHBondContact O-N 3.36Å
1660	I	91.3	Very high	87.9	Confident	84 Å²	84	71.8 Å²	71.8	43%	0.431	36%	0.363	S	S	.	.	H	α-helix	trans	-60.2	-43.9	175.2	-68.4	167.8	0	0	0	111.1	F1656 N1657 L1658 M1662 F1663 S1664	F1656-I1660 HydrophobicContact CD1-CD1 3.89Å; F1656-I1660 HydrophobicContact CE1-CD1 3.56Å; F1656-I1660 HydrophobicContact CZ-CD1 3.97Å; F1656-I1660 WeakPolarHBondContact O-CG1 3.27Å; F1656-I1660 PolarHBondContact O-N 2.75Å; F1656-I1660 VanDerWaalsContact O-N 3.12Å; N1657-I1660 PolarHBondContact O-N 2.63Å; L1658-I1660 PolarHBondContact O-N 2.96Å; I1660-M1662 PolarHBondContact O-N 3.33Å; I1660-F1663 PolarHBondContact O-N 3.38Å; I1660-S1664 WeakPolarHBondContact O-CB 3.04Å; I1660-S1664 PolarHBondContact O-N 3.08Å
1661	A	91.7	Very high	87.8	Confident	64 Å²	64	72.3 Å²	72.3	53%	0.529	36%	0.364	S	S	.	.	H	α-helix	trans	-63.8	-40.9	-179.3	0	0	0	0	0	112.6	N1657 L1658 L1659 K1665	N1657-A1661 PolarHBondContact O-N 3.11Å; N1657-A1661 VanDerWaalsContact O-N 3.09Å; L1658-A1661 PolarHBondContact O-N 3.29Å; L1659-A1661 VanDerWaalsContact C-N 3.34Å; L1659-A1661 PolarHBondContact O-N 3.42Å; A1661-K1665 PolarHBondContact O-N 2.81Å
1662	M	90.3	Very high	87.6	Confident	53 Å²	53	76.5 Å²	76.5	26%	0.261	39%	0.393	S	S	.	.	H	α-helix	trans	-65.7	-50.8	175.5	-63.2	-169.5	-52.5	0	0	111.3	D1550 F1554 L1658 L1659 I1660 S1664 K1665 T1666	D1550-M1662 HydrophobicContact CB-CB 4.19Å; D1550-M1662 HydrophobicContact CB-CE 4.44Å; F1554-M1662 HydrophobicContact CB-CE 3.98Å; F1554-M1662 HydrophobicContact CD2-CE 4.11Å; F1554-M1662 HydrophobicContact CG-CE 4.44Å; L1658-M1662 HydrophobicContact CD2-CE 3.62Å; L1658-M1662 HydrophobicContact CD2-CG 4.12Å; L1658-M1662 HydrophobicContact CD2-SD 3.67Å; L1658-M1662 WeakPolarHBondContact O-CG 3.46Å; L1658-M1662 PolarHBondContact O-N 3.18Å; L1658-M1662 VanDerWaalsContact O-N 3.07Å; L1659-M1662 HydrophobicContact CD1-CE 4.33Å; L1659-M1662 PolarHBondContact O-N 2.98Å; I1660-M1662 PolarHBondContact O-N 3.33Å; M1662-S1664 VanDerWaalsContact C-N 3.34Å; M1662-S1664 PolarHBondContact O-N 2.88Å; M1662-K1665 PolarHBondContact O-N 3.31Å; M1662-T1666 PolarHBondContact O-N 3.23Å; M1662-T1666 VanDerWaalsContact O-N 3.14Å; M1662-T1666 PolarHBondContact O-OG1 2.8Å
1663	F	91.8	Very high	87.6	Confident	58 Å²	58	74.1 Å²	74.1	25%	0.254	38%	0.384	S	S	.	.	H	α-helix	trans	-62.4	-33.8	179.3	-73.3	-21.7	0	0	0	113.8	M1546 D1550 L1551 L1659 I1660 T1666 Y1667	M1546-F1663 HydrophobicContact CB-CD1 4.11Å; M1546-F1663 HydrophobicContact CB-CE1 4.01Å; M1546-F1663 WeakPolarHBondContact CE-O 3.22Å; M1546-F1663 HydrophobicContact CG-CD1 4.28Å; D1550-F1663 HydrophobicContact CB-CD1 3.83Å; D1550-F1663 HydrophobicContact CB-CE1 3.82Å; L1551-F1663 HydrophobicContact CB-CE1 4.4Å; L1551-F1663 HydrophobicContact CB-CZ 4.35Å; L1551-F1663 HydrophobicContact CD1-CZ 4.27Å; L1659-F1663 HydrophobicContact CD1-CD1 4.43Å; L1659-F1663 HydrophobicContact CD1-CD2 4.08Å; L1659-F1663 HydrophobicContact CD1-CE1 4Å; L1659-F1663 HydrophobicContact CD1-CE2 3.62Å; L1659-F1663 HydrophobicContact CD1-CG 4.49Å; L1659-F1663 HydrophobicContact CD1-CZ 3.58Å; L1659-F1663 HydrophobicContact CD2-CE2 4Å; L1659-F1663 HydrophobicContact CG-CD2 3.94Å; L1659-F1663 HydrophobicContact CG-CE2 3.65Å; L1659-F1663 HydrophobicContact CG-CZ 4.16Å; L1659-F1663 WeakPolarHBondContact O-CG 3.36Å; L1659-F1663 PolarHBondContact O-N 3.36Å; I1660-F1663 PolarHBondContact O-N 3.38Å; F1663-T1666 PolarHBondContact O-OG1 3.44Å; F1663-Y1667 WeakPolarHBondContact O-CB 3.23Å; F1663-Y1667 PolarHBondContact O-N 3.38Å
1664	S	90.3	Very high	87.5	Confident	56 Å²	56	69.8 Å²	69.8	39%	0.392	36%	0.363	S	S	.	.	H	α-helix	trans	-65.6	-43.1	175.8	-157.3	0	0	0	0	111.2	I1660 M1662 Y1667 E1668	I1660-S1664 WeakPolarHBondContact O-CB 3.04Å; I1660-S1664 PolarHBondContact O-N 3.08Å; M1662-S1664 VanDerWaalsContact C-N 3.34Å; M1662-S1664 PolarHBondContact O-N 2.88Å; S1664-Y1667 WeakPolarHBondContact O-CB 3.46Å; S1664-Y1667 PolarHBondContact O-N 2.78Å; S1664-E1668 WeakPolarHBondContact O-CG 3.39Å; S1664-E1668 PolarHBondContact O-N 2.68Å; S1664-E1668 VanDerWaalsContact O-N 3.09Å; S1664-E1668 PolarHBondContact OG-OE1 3.28Å; S1664-E1668 VanDerWaalsContact OG-OE1 3.1Å
1665	K	90.7	Very high	87.4	Confident	156 Å²	156	69 Å²	69	68%	0.678	36%	0.362	S	S	*	.	H	α-helix	trans	-62.1	-46.3	178.9	-175.9	175.1	179.3	175.1	0	111.9	A1661 M1662 E1669	A1661-K1665 PolarHBondContact O-N 2.81Å; M1662-K1665 PolarHBondContact O-N 3.31Å; K1665-E1669 PolarHBondContact O-N 3.03Å
1666	T	87.9	Confident	87.4	Confident	15 Å²	15	73.6 Å²	73.6	9%	0.092	38%	0.38	C	S	.	.	H	α-helix	trans	-74.5	-27.6	178.5	56.7	0	0	0	0	112.9	D1550 M1662 F1663 I1670	D1550-T1666 VanDerWaalsContact OD1-CG2 3.31Å; D1550-T1666 WeakPolarHBondContact OD1-CG2 3.45Å; D1550-T1666 WeakPolarHBondContact OD2-CB 3.45Å; D1550-T1666 WeakPolarHBondContact OD2-CG2 3.42Å; D1550-T1666 PolarHBondContact OD2-OG1 3.04Å; M1662-T1666 PolarHBondContact O-N 3.23Å; M1662-T1666 VanDerWaalsContact O-N 3.14Å; M1662-T1666 PolarHBondContact O-OG1 2.8Å; F1663-T1666 PolarHBondContact O-OG1 3.44Å; T1666-I1670 VanDerWaalsContact O-CB 3.28Å; T1666-I1670 WeakPolarHBondContact O-CB 3.43Å; T1666-I1670 VanDerWaalsContact O-CD1 3.28Å; T1666-I1670 WeakPolarHBondContact O-CD1 3.44Å; T1666-I1670 WeakPolarHBondContact O-CG1 3.29Å; T1666-I1670 PolarHBondContact O-N 3.36Å; T1666-I1670 VanDerWaalsContact O-N 3.12Å
1667	Y	89.1	Confident	87.3	Confident	86 Å²	86	71.8 Å²	71.8	34%	0.337	37%	0.37	S	S	.	.	H	α-helix	trans	-57.6	-56.1	169.2	-175.5	-83	0	0	0	111.1	M1542 M1546 F1663 S1664 E1669 I1670 E1671	M1542-Y1667 HydrophobicContact CE-CD1 4.45Å; M1542-Y1667 HydrophobicContact CE-CD2 3.68Å; M1542-Y1667 HydrophobicContact CE-CE1 4.41Å; M1542-Y1667 HydrophobicContact CE-CE2 3.67Å; M1542-Y1667 HydrophobicContact CE-CG 4.07Å; M1542-Y1667 HydrophobicContact SD-CD2 3.37Å; M1542-Y1667 WeakPolarHBondContact SD-CD2 3.19Å; M1542-Y1667 HydrophobicContact SD-CE2 3.4Å; M1542-Y1667 WeakPolarHBondContact SD-CE2 3.47Å; M1542-Y1667 HydrophobicContact SD-CG 4.27Å; M1546-Y1667 HydrophobicContact CE-CD2 3.92Å; M1546-Y1667 HydrophobicContact CE-CG 4.24Å; F1663-Y1667 WeakPolarHBondContact O-CB 3.23Å; F1663-Y1667 PolarHBondContact O-N 3.38Å; S1664-Y1667 WeakPolarHBondContact O-CB 3.46Å; S1664-Y1667 PolarHBondContact O-N 2.78Å; Y1667-E1669 PolarHBondContact O-N 3.19Å; Y1667-I1670 PolarHBondContact O-N 2.88Å; Y1667-E1671 HydrophobicContact CD1-CB 4.45Å; Y1667-E1671 HydrophobicContact CE1-CB 4.13Å; Y1667-E1671 VanDerWaalsContact CE1-CD 3.43Å; Y1667-E1671 HydrophobicContact CE1-CG 4.32Å; Y1667-E1671 WeakPolarHBondContact CE1-OE1 3.24Å; Y1667-E1671 WeakPolarHBondContact CE1-OE2 3.08Å; Y1667-E1671 VanDerWaalsContact O-CB 3.32Å; Y1667-E1671 WeakPolarHBondContact O-CB 3.46Å; Y1667-E1671 PolarHBondContact O-N 3.45Å; Y1667-E1671 PolarHBondContact OH-OE1 3.37Å
1668	E	88.4	Confident	87.2	Confident	123 Å²	123	68.2 Å²	68.2	58%	0.575	35%	0.349	S	S	*	.	H	α-helix	trans	-64.3	-43	-173.5	-70.1	167.6	-140.9	0	0	112	S1664	S1664-E1668 WeakPolarHBondContact O-CG 3.39Å; S1664-E1668 PolarHBondContact O-N 2.68Å; S1664-E1668 VanDerWaalsContact O-N 3.09Å; S1664-E1668 PolarHBondContact OG-OE1 3.28Å; S1664-E1668 VanDerWaalsContact OG-OE1 3.1Å
1669	E	83.5	Confident	87.1	Confident	134 Å²	134	66.5 Å²	66.5	63%	0.626	34%	0.341	S	S	*	.	H	α-helix	trans	-59.7	-50	174.9	-169.9	-168.4	145.2	0	0	111.2	K1665 Y1667 S1672	K1665-E1669 PolarHBondContact O-N 3.03Å; Y1667-E1669 PolarHBondContact O-N 3.19Å; E1669-S1672 PolarHBondContact O-OG 3.01Å
1670	I	82.3	Confident	87	Confident	9 Å²	9	67.5 Å²	67.5	5%	0.046	34%	0.343	C	S	.	.	H	α-helix	trans	-73.7	-37.8	-173.7	-64.6	166.5	0	0	0	111.8	M1542 K1545 T1666 Y1667 S1672 A1673 S1674	M1542-I1670 HydrophobicContact CB-CG2 4Å; M1542-I1670 HydrophobicContact CE-CB 4.45Å; M1542-I1670 HydrophobicContact CE-CG2 4.37Å; M1542-I1670 HydrophobicContact CG-CG2 4.28Å; K1545-I1670 HydrophobicContact CB-CD1 3.52Å; K1545-I1670 HydrophobicContact CD-CD1 3.69Å; K1545-I1670 HydrophobicContact CD-CG1 4.08Å; K1545-I1670 HydrophobicContact CG-CD1 4.25Å; T1666-I1670 VanDerWaalsContact O-CB 3.28Å; T1666-I1670 WeakPolarHBondContact O-CB 3.43Å; T1666-I1670 VanDerWaalsContact O-CD1 3.28Å; T1666-I1670 WeakPolarHBondContact O-CD1 3.44Å; T1666-I1670 WeakPolarHBondContact O-CG1 3.29Å; T1666-I1670 PolarHBondContact O-N 3.36Å; T1666-I1670 VanDerWaalsContact O-N 3.12Å; Y1667-I1670 PolarHBondContact O-N 2.88Å; I1670-S1672 VanDerWaalsContact C-N 3.28Å; I1670-S1672 PolarHBondContact O-N 3.03Å; I1670-A1673 PolarHBondContact O-N 2.84Å; I1670-A1673 VanDerWaalsContact O-N 3.16Å; I1670-S1674 WeakPolarHBondContact O-CA 2.72Å; I1670-S1674 VanDerWaalsContact O-CB 3.3Å; I1670-S1674 WeakPolarHBondContact O-CB 3.48Å; I1670-S1674 PolarHBondContact O-N 2.85Å
1671	E	85.5	Confident	86.7	Confident	79 Å²	79	65 Å²	65	37%	0.369	33%	0.329	S	S	.	.	H	α-helix	trans	-55.4	-45.4	-178.9	-174.4	171.2	-119.3	0	0	111.1	M1542 Y1667 A1673 S1674	M1542-E1671 HydrophobicContact CE-CB 3.81Å; Y1667-E1671 HydrophobicContact CD1-CB 4.45Å; Y1667-E1671 HydrophobicContact CE1-CB 4.13Å; Y1667-E1671 VanDerWaalsContact CE1-CD 3.43Å; Y1667-E1671 HydrophobicContact CE1-CG 4.32Å; Y1667-E1671 WeakPolarHBondContact CE1-OE1 3.24Å; Y1667-E1671 WeakPolarHBondContact CE1-OE2 3.08Å; Y1667-E1671 VanDerWaalsContact O-CB 3.32Å; Y1667-E1671 WeakPolarHBondContact O-CB 3.46Å; Y1667-E1671 PolarHBondContact O-N 3.45Å; Y1667-E1671 PolarHBondContact OH-OE1 3.37Å; E1671-A1673 PolarHBondContact O-N 3.34Å; E1671-S1674 WeakPolarHBondContact O-CB 3.18Å; E1671-S1674 PolarHBondContact O-N 2.59Å; E1671-S1674 VanDerWaalsContact O-N 3.11Å; E1671-S1674 PolarHBondContact O-OG 2.63Å
1672	S	82.9	Confident	86.6	Confident	90 Å²	90	63.3 Å²	63.3	63%	0.629	31%	0.309	S	S	*	.	H	α-helix	trans	-55.5	-33.9	-179.9	77.2	0	0	0	0	114.1	E1669 I1670	E1669-S1672 PolarHBondContact O-OG 3.01Å; I1670-S1672 VanDerWaalsContact C-N 3.28Å; I1670-S1672 PolarHBondContact O-N 3.03Å
1673	A	82.4	Confident	86.5	Confident	27 Å²	27	61.6 Å²	61.6	22%	0.223	30%	0.3	C	S	.	.	H	α-helix	trans	-102.7	-9.1	-178.7	0	0	0	0	0	113.5	I1670 E1671 T1675 Y1676 Y1677	I1670-A1673 PolarHBondContact O-N 2.84Å; I1670-A1673 VanDerWaalsContact O-N 3.16Å; E1671-A1673 PolarHBondContact O-N 3.34Å; A1673-T1675 VanDerWaalsContact C-N 3.3Å; A1673-T1675 PolarHBondContact O-N 3.37Å; A1673-Y1676 WeakPolarHBondContact O-CB 3.44Å; A1673-Y1676 PolarHBondContact O-N 2.74Å; A1673-Y1676 VanDerWaalsContact O-N 3.12Å; A1673-Y1677 HydrophobicContact CB-CD2 3.85Å; A1673-Y1677 HydrophobicContact CB-CE2 3.53Å; A1673-Y1677 VanDerWaalsContact O-CD2 3.25Å; A1673-Y1677 WeakPolarHBondContact O-CD2 3.17Å; A1673-Y1677 PolarHBondContact O-N 3.45Å; A1673-Y1677 VanDerWaalsContact O-N 3.13Å
1674	S	84.3	Confident	86.2	Confident	13 Å²	13	62.8 Å²	62.8	9%	0.091	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-33.3	-167	68.7	0	0	0	0	114.2	I1670 E1671 W1678	I1670-S1674 WeakPolarHBondContact O-CA 2.72Å; I1670-S1674 VanDerWaalsContact O-CB 3.3Å; I1670-S1674 WeakPolarHBondContact O-CB 3.48Å; I1670-S1674 PolarHBondContact O-N 2.85Å; E1671-S1674 WeakPolarHBondContact O-CB 3.18Å; E1671-S1674 PolarHBondContact O-N 2.59Å; E1671-S1674 VanDerWaalsContact O-N 3.11Å; E1671-S1674 PolarHBondContact O-OG 2.63Å; S1674-W1678 WeakPolarHBondContact O-CB 3.45Å; S1674-W1678 PolarHBondContact O-N 3.08Å
1675	T	82.4	Confident	86	Confident	78 Å²	78	60.4 Å²	60.4	48%	0.479	29%	0.289	S	S	.	.	H	α-helix	trans	-68.2	-41	176.7	52.9	0	0	0	0	112.2	A1673 W1678 N1679	A1673-T1675 VanDerWaalsContact C-N 3.3Å; A1673-T1675 PolarHBondContact O-N 3.37Å; T1675-W1678 PolarHBondContact O-N 2.73Å; T1675-N1679 WeakPolarHBondContact O-CB 3.27Å; T1675-N1679 VanDerWaalsContact O-CG 3.32Å; T1675-N1679 PolarHBondContact O-N 2.88Å
1676	Y	86.3	Confident	85.9	Confident	113 Å²	113	53 Å²	53	44%	0.443	26%	0.257	S	S	.	.	H	α-helix	trans	-65	-46.1	174.9	-61.8	-82.9	0	0	0	111.1	I1278 A1282 A1673 W1678 N1679 Y1680	I1278-Y1676 WeakPolarHBondContact CG2-O 3.44Å; A1282-Y1676 HydrophobicContact CB-CD1 3.61Å; A1282-Y1676 HydrophobicContact CB-CE1 4.16Å; A1673-Y1676 WeakPolarHBondContact O-CB 3.44Å; A1673-Y1676 PolarHBondContact O-N 2.74Å; A1673-Y1676 VanDerWaalsContact O-N 3.12Å; Y1676-W1678 PolarHBondContact O-N 2.6Å; Y1676-N1679 PolarHBondContact O-N 2.99Å; Y1676-Y1680 PolarHBondContact O-N 2.93Å; Y1676-Y1680 VanDerWaalsContact O-N 3.08Å
1677	Y	84.2	Confident	85.8	Confident	84 Å²	84	54 Å²	54	33%	0.329	26%	0.262	S	S	.	.	H	α-helix	trans	-61.1	-41.8	175.6	-73.3	-63.5	0	0	0	112.4	I1278 A1673 Y1680 Q1681	I1278-Y1677 HydrophobicContact CD1-CD1 4.16Å; I1278-Y1677 HydrophobicContact CD1-CE1 3.8Å; A1673-Y1677 HydrophobicContact CB-CD2 3.85Å; A1673-Y1677 HydrophobicContact CB-CE2 3.53Å; A1673-Y1677 VanDerWaalsContact O-CD2 3.25Å; A1673-Y1677 WeakPolarHBondContact O-CD2 3.17Å; A1673-Y1677 PolarHBondContact O-N 3.45Å; A1673-Y1677 VanDerWaalsContact O-N 3.13Å; Y1677-Y1680 PolarHBondContact O-N 3.01Å; Y1677-Q1681 WeakPolarHBondContact O-CB 3.3Å; Y1677-Q1681 PolarHBondContact O-N 3.28Å
1678	W	86.7	Confident	85.4	Confident	20 Å²	20	53.4 Å²	53.4	8%	0.076	26%	0.264	C	S	.	.	H	α-helix	trans	-67.3	-42	176.3	-179.1	74.4	0	0	0	112.8	S1531 I1534 P1538 S1674 T1675 Y1676 Y1680 Q1681 R1682	S1531-W1678 PolarHBondContact O-NE1 3.36Å; I1534-W1678 HydrophobicContact CB-CH2 3.77Å; I1534-W1678 HydrophobicContact CB-CZ2 3.83Å; I1534-W1678 HydrophobicContact CB-CZ3 4.36Å; I1534-W1678 HydrophobicContact CD1-CH2 3.93Å; I1534-W1678 HydrophobicContact CD1-CZ3 3.91Å; I1534-W1678 HydrophobicContact CG1-CE3 4.23Å; I1534-W1678 HydrophobicContact CG1-CH2 3.67Å; I1534-W1678 HydrophobicContact CG1-CZ2 4.11Å; I1534-W1678 HydrophobicContact CG1-CZ3 3.74Å; P1538-W1678 HydrophobicContact CG-CB 3.89Å; P1538-W1678 HydrophobicContact CG-CG 4.01Å; S1674-W1678 WeakPolarHBondContact O-CB 3.45Å; S1674-W1678 PolarHBondContact O-N 3.08Å; T1675-W1678 PolarHBondContact O-N 2.73Å; Y1676-W1678 PolarHBondContact O-N 2.6Å; W1678-Y1680 PolarHBondContact O-N 3.49Å; W1678-Q1681 PolarHBondContact O-N 2.9Å; W1678-R1682 VanDerWaalsContact O-CB 3.26Å; W1678-R1682 WeakPolarHBondContact O-CB 3.4Å; W1678-R1682 PolarHBondContact O-N 3.37Å
1679	N	87	Confident	85.3	Confident	30 Å²	30	48.1 Å²	48.1	16%	0.16	24%	0.239	C	C	.	.	H	α-helix	trans	-58.8	-32.8	174.8	-83.1	-15.7	0	0	0	112.6	A1282 Q1287 T1675 Y1676	A1282-N1679 HydrophobicContact CB-CB 4.05Å; Q1287-N1679 PolarHBondContact NE2-O 3.22Å; T1675-N1679 WeakPolarHBondContact O-CB 3.27Å; T1675-N1679 VanDerWaalsContact O-CG 3.32Å; T1675-N1679 PolarHBondContact O-N 2.88Å; Y1676-N1679 PolarHBondContact O-N 2.99Å
1680	Y	87.7	Confident	85.4	Confident	45 Å²	45	42.6 Å²	42.6	18%	0.176	22%	0.215	C	C	.	.	H	α-helix	trans	-77.6	-45.8	173.3	177.4	-91.5	0	0	0	112.8	A1273 M1281 Y1676 Y1677 W1678 R1682 Y1683 Q1684	A1273-Y1680 HydrophobicContact CB-CE2 4.5Å; A1273-Y1680 PolarHBondContact O-OH 2.71Å; M1281-Y1680 HydrophobicContact CB-CD2 4.42Å; M1281-Y1680 HydrophobicContact CG-CD2 4.24Å; Y1676-Y1680 PolarHBondContact O-N 2.93Å; Y1676-Y1680 VanDerWaalsContact O-N 3.08Å; Y1677-Y1680 PolarHBondContact O-N 3.01Å; W1678-Y1680 PolarHBondContact O-N 3.49Å; Y1680-R1682 PolarHBondContact O-N 2.84Å; Y1680-Y1683 WeakPolarHBondContact O-CB 3.32Å; Y1680-Y1683 PolarHBondContact O-N 2.73Å; Y1680-Q1684 HydrophobicContact CE1-CG 4.17Å; Y1680-Q1684 PolarHBondContact O-N 2.71Å
1681	Q	85.1	Confident	85	Confident	31 Å²	31	46.1 Å²	46.1	15%	0.145	23%	0.231	C	C	.	.	H	α-helix	trans	-58	-35.1	174.8	-166.3	-173.7	32.4	0	0	111.6	Y1677 W1678 Y1683 Q1684 M1685	Y1677-Q1681 WeakPolarHBondContact O-CB 3.3Å; Y1677-Q1681 PolarHBondContact O-N 3.28Å; W1678-Q1681 PolarHBondContact O-N 2.9Å; Q1681-Y1683 VanDerWaalsContact C-N 3.33Å; Q1681-Y1683 PolarHBondContact O-N 3.08Å; Q1681-Q1684 PolarHBondContact O-N 3.12Å; Q1681-M1685 HydrophobicContact CG-CE 4.15Å; Q1681-M1685 PolarHBondContact O-N 2.79Å
1682	R	89.2	Confident	84.7	Confident	29 Å²	29	44.5 Å²	44.5	11%	0.109	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-36.9	173.6	-174.6	179.9	-176.4	-128.5	-1.4	112.8	Q1287 T1291 W1678 Y1680 I1686	Q1287-R1682 PolarHBondContact O-NH1 3.35Å; Q1287-R1682 VanDerWaalsContact O-NH1 3.17Å; T1291-R1682 PolarHBondContact OG1-NH1 3.29Å; T1291-R1682 PolarHBondContact OG1-NH2 2.84Å; W1678-R1682 VanDerWaalsContact O-CB 3.26Å; W1678-R1682 WeakPolarHBondContact O-CB 3.4Å; W1678-R1682 PolarHBondContact O-N 3.37Å; Y1680-R1682 PolarHBondContact O-N 2.84Å; R1682-I1686 HydrophobicContact CG-CD1 3.81Å; R1682-I1686 WeakPolarHBondContact O-CB 3.21Å; R1682-I1686 WeakPolarHBondContact O-CD1 3.48Å; R1682-I1686 WeakPolarHBondContact O-CG1 3.37Å; R1682-I1686 PolarHBondContact O-N 3.11Å
1683	Y	89.1	Confident	84.6	Confident	18 Å²	18	40.7 Å²	40.7	7%	0.071	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-49.4	171.8	164.9	-90.1	0	0	0	110.9	I1269 A1273 M1281 L1290 Y1680 Q1681 I1686 N1687 F1730	I1269-Y1683 HydrophobicContact CD1-CD2 3.86Å; I1269-Y1683 HydrophobicContact CD1-CE2 3.93Å; I1269-Y1683 HydrophobicContact CG1-CD2 3.97Å; I1269-Y1683 HydrophobicContact CG1-CE2 3.75Å; A1273-Y1683 HydrophobicContact CB-CD1 3.78Å; A1273-Y1683 HydrophobicContact CB-CE1 3.31Å; A1273-Y1683 HydrophobicContact CB-CE2 4.28Å; A1273-Y1683 HydrophobicContact CB-CG 4.45Å; M1281-Y1683 HydrophobicContact CE-CD1 4.38Å; M1281-Y1683 HydrophobicContact CE-CD2 3.49Å; M1281-Y1683 VanDerWaalsContact CE-CD2 3.49Å; M1281-Y1683 HydrophobicContact CE-CE2 4.3Å; M1281-Y1683 HydrophobicContact CE-CG 3.55Å; L1290-Y1683 HydrophobicContact CD2-CD2 4.05Å; Y1680-Y1683 WeakPolarHBondContact O-CB 3.32Å; Y1680-Y1683 PolarHBondContact O-N 2.73Å; Q1681-Y1683 VanDerWaalsContact C-N 3.33Å; Q1681-Y1683 PolarHBondContact O-N 3.08Å; Y1683-I1686 PolarHBondContact O-N 3.48Å; Y1683-N1687 WeakPolarHBondContact O-CB 3.2Å; Y1683-N1687 PolarHBondContact O-N 2.79Å; Y1683-F1730 AromaticContact CD2-CE1 3.99Å; Y1683-F1730 HydrophobicContact CD2-CE1 3.99Å; Y1683-F1730 AromaticContact CE2-CD1 3.82Å; Y1683-F1730 HydrophobicContact CE2-CD1 3.82Å; Y1683-F1730 AromaticContact CE2-CE1 3.68Å; Y1683-F1730 HydrophobicContact CE2-CE1 3.68Å; Y1683-F1730 HydrophobicContact CE2-CZ 4.47Å
1684	Q	86.1	Confident	84.3	Confident	82 Å²	82	40 Å²	40	38%	0.383	19%	0.188	S	C	.	.	H	α-helix	trans	-58.5	-54.1	-177.1	-61.7	178.5	-64.5	0	0	110.8	Y1680 Q1681 I1686 N1687 D1688	Y1680-Q1684 HydrophobicContact CE1-CG 4.17Å; Y1680-Q1684 PolarHBondContact O-N 2.71Å; Q1681-Q1684 PolarHBondContact O-N 3.12Å; Q1684-I1686 VanDerWaalsContact C-N 3.31Å; Q1684-I1686 PolarHBondContact O-N 3.18Å; Q1684-N1687 WeakPolarHBondContact O-CB 3.26Å; Q1684-N1687 PolarHBondContact O-N 3.45Å; Q1684-N1687 VanDerWaalsContact O-N 3.08Å; Q1684-D1688 PolarHBondContact O-N 3.48Å
1685	M	85.1	Confident	84.3	Confident	6 Å²	6	42.3 Å²	42.3	3%	0.03	20%	0.199	C	C	.	.	H	α-helix	trans	-55.8	-40.8	176.7	-71.7	-175.9	-76.5	0	0	113.7	S1531 F1532 Q1681 D1688 Y1689	S1531-M1685 PolarHBondContact OG-SD 3.31Å; F1532-M1685 HydrophobicContact CB-CE 4.33Å; F1532-M1685 HydrophobicContact CB-SD 4.04Å; F1532-M1685 HydrophobicContact CD2-CE 4.27Å; F1532-M1685 HydrophobicContact CD2-SD 4.37Å; Q1681-M1685 HydrophobicContact CG-CE 4.15Å; Q1681-M1685 PolarHBondContact O-N 2.79Å; M1685-D1688 PolarHBondContact O-N 3.36Å; M1685-Y1689 WeakPolarHBondContact O-CD2 3.42Å; M1685-Y1689 PolarHBondContact O-N 2.96Å
1686	I	88.9	Confident	84.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-70.2	-37.9	-179.8	-66	169.1	0	0	0	110.4	L1290 T1293 W1294 R1682 Y1683 Q1684 V1690 F1730	L1290-I1686 HydrophobicContact CB-CD1 3.96Å; L1290-I1686 HydrophobicContact CD2-CB 4.15Å; L1290-I1686 HydrophobicContact CD2-CD1 3.98Å; L1290-I1686 HydrophobicContact CD2-CG2 4.11Å; L1290-I1686 HydrophobicContact CG-CD1 4.48Å; T1293-I1686 HydrophobicContact CG2-CG2 4.13Å; W1294-I1686 HydrophobicContact CB-CD1 4.16Å; W1294-I1686 HydrophobicContact CB-CG1 4.48Å; W1294-I1686 HydrophobicContact CB-CG2 4.49Å; W1294-I1686 HydrophobicContact CD2-CG1 4.26Å; W1294-I1686 HydrophobicContact CE3-CB 4.42Å; W1294-I1686 HydrophobicContact CE3-CG1 3.72Å; W1294-I1686 HydrophobicContact CE3-CG2 4.31Å; W1294-I1686 HydrophobicContact CZ3-CG1 4.23Å; R1682-I1686 HydrophobicContact CG-CD1 3.81Å; R1682-I1686 WeakPolarHBondContact O-CB 3.21Å; R1682-I1686 WeakPolarHBondContact O-CD1 3.48Å; R1682-I1686 WeakPolarHBondContact O-CG1 3.37Å; R1682-I1686 PolarHBondContact O-N 3.11Å; Y1683-I1686 PolarHBondContact O-N 3.48Å; Q1684-I1686 VanDerWaalsContact C-N 3.31Å; Q1684-I1686 PolarHBondContact O-N 3.18Å; I1686-V1690 HydrophobicContact CG2-CG2 4.4Å; I1686-V1690 VanDerWaalsContact O-CB 3.31Å; I1686-V1690 WeakPolarHBondContact O-CB 3.43Å; I1686-V1690 WeakPolarHBondContact O-CG2 3.3Å; I1686-V1690 PolarHBondContact O-N 3.03Å; I1686-F1730 HydrophobicContact CG2-CZ 4.1Å
1687	N	85.6	Confident	83.9	Confident	38 Å²	38	34.6 Å²	34.6	20%	0.203	17%	0.166	C	C	.	.	H	α-helix	trans	-58.5	-47.1	172.5	173.8	82.8	0	0	0	111.6	Y1683 Q1684 V1690 H1691 F1730	Y1683-N1687 WeakPolarHBondContact O-CB 3.2Å; Y1683-N1687 PolarHBondContact O-N 2.79Å; Q1684-N1687 WeakPolarHBondContact O-CB 3.26Å; Q1684-N1687 PolarHBondContact O-N 3.45Å; Q1684-N1687 VanDerWaalsContact O-N 3.08Å; N1687-V1690 WeakPolarHBondContact O-CB 3.05Å; N1687-V1690 PolarHBondContact O-N 3.07Å; N1687-H1691 PolarHBondContact O-CD2 3.41Å; N1687-H1691 VanDerWaalsContact O-CD2 3.31Å; N1687-H1691 PolarHBondContact O-N 2.93Å; N1687-H1691 VanDerWaalsContact O-N 3.11Å; N1687-F1730 HydrophobicContact CB-CE2 4.09Å; N1687-F1730 HydrophobicContact CB-CZ 4.17Å
1688	D	81.3	Confident	83.6	Confident	72 Å²	72	32.9 Å²	32.9	39%	0.385	17%	0.165	S	C	.	.	H	α-helix	trans	-65.4	-46.2	-177.5	-53.4	-23.2	0	0	0	111	Q1684 M1685 V1690 H1691 R1692	Q1684-D1688 PolarHBondContact O-N 3.48Å; M1685-D1688 PolarHBondContact O-N 3.36Å; D1688-V1690 VanDerWaalsContact C-N 3.31Å; D1688-V1690 PolarHBondContact O-N 2.87Å; D1688-H1691 CarbonylContact O-C 3.57Å; D1688-H1691 PolarHBondContact O-N 3.35Å; D1688-R1692 WeakPolarHBondContact O-CB 3.48Å; D1688-R1692 PolarHBondContact O-N 3.47Å
1689	Y	85.5	Confident	83.5	Confident	13 Å²	13	37.1 Å²	37.1	5%	0.051	19%	0.188	C	C	.	.	H	α-helix	trans	-72.3	-17.9	176.3	-82.1	-77.1	0	0	0	114.6	R1395 F1396 N1399 M1685	R1395-Y1689 PolarHBondContact NH1-O 2.72Å; F1396-Y1689 HydrophobicContact CB-CD1 4.07Å; F1396-Y1689 HydrophobicContact CB-CE1 4.16Å; F1396-Y1689 HydrophobicContact CB-CG 4.33Å; F1396-Y1689 HydrophobicContact CD2-CD2 4.26Å; F1396-Y1689 HydrophobicContact CD2-CE1 4.19Å; F1396-Y1689 AromaticContact CD2-CE2 3.73Å; F1396-Y1689 HydrophobicContact CD2-CE2 3.73Å; F1396-Y1689 AromaticContact CD2-CZ 3.7Å; F1396-Y1689 HydrophobicContact CE2-CE2 4.44Å; N1399-Y1689 HydrophobicContact CB-CE1 4.24Å; N1399-Y1689 PolarHBondContact ND2-OH 3.1Å; N1399-Y1689 VanDerWaalsContact ND2-OH 3.15Å; M1685-Y1689 WeakPolarHBondContact O-CD2 3.42Å; M1685-Y1689 PolarHBondContact O-N 2.96Å
1690	V	85	Confident	83.3	Confident	18 Å²	18	35.8 Å²	35.8	11%	0.109	18%	0.181	C	C	.	.	H	α-helix	trans	-70.5	-40.7	167.5	155.3	0	0	0	0	111	T1293 P1392 R1395 I1686 N1687 D1688 P1729 F1730	T1293-V1690 HydrophobicContact CG2-CG2 3.89Å; P1392-V1690 HydrophobicContact CB-CG2 4.3Å; P1392-V1690 HydrophobicContact CG-CG2 3.48Å; P1392-V1690 VanDerWaalsContact CG-CG2 3.48Å; R1395-V1690 PolarHBondContact NH1-O 3.2Å; I1686-V1690 HydrophobicContact CG2-CG2 4.4Å; I1686-V1690 VanDerWaalsContact O-CB 3.31Å; I1686-V1690 WeakPolarHBondContact O-CB 3.43Å; I1686-V1690 WeakPolarHBondContact O-CG2 3.3Å; I1686-V1690 PolarHBondContact O-N 3.03Å; N1687-V1690 WeakPolarHBondContact O-CB 3.05Å; N1687-V1690 PolarHBondContact O-N 3.07Å; D1688-V1690 VanDerWaalsContact C-N 3.31Å; D1688-V1690 PolarHBondContact O-N 2.87Å; V1690-P1729 HydrophobicContact CB-CG 4.44Å; V1690-P1729 VanDerWaalsContact CG1-CD 3.49Å; V1690-P1729 HydrophobicContact CG1-CG 3.55Å; V1690-P1729 HydrophobicContact CG2-CG 3.98Å; V1690-F1730 HydrophobicContact CB-CE2 4.08Å; V1690-F1730 HydrophobicContact CG1-CD2 4.4Å; V1690-F1730 HydrophobicContact CG1-CE2 4.05Å; V1690-F1730 HydrophobicContact CG2-CE2 3.98Å
1691	H	75.5	Confident	83.1	Confident	83 Å²	83	36 Å²	36	38%	0.384	19%	0.185	S	C	.	.	H	α-helix	trans	-84.4	-23.3	179.7	-74.5	-64.8	0	0	0	113.8	N1687 D1688	N1687-H1691 PolarHBondContact O-CD2 3.41Å; N1687-H1691 VanDerWaalsContact O-CD2 3.31Å; N1687-H1691 PolarHBondContact O-N 2.93Å; N1687-H1691 VanDerWaalsContact O-N 3.11Å; D1688-H1691 CarbonylContact O-C 3.57Å; D1688-H1691 PolarHBondContact O-N 3.35Å
1692	R	78.6	Confident	83.2	Confident	45 Å²	45	39 Å²	39	17%	0.17	21%	0.205	C	C	.	.	S	Bend	trans	-67.4	146.5	178.2	-157.7	169.3	-159.4	161	10.7	113.1	R1395 E1439 E1440 D1688	R1395-R1692 PolarHBondContact NH1-O 3.08Å; E1439-R1692 VanDerWaalsContact CG-NH2 3.29Å; E1439-R1692 VanDerWaalsContact OE1-CG 3.25Å; E1439-R1692 WeakPolarHBondContact OE1-CG 3.16Å; E1439-R1692 IonicContact OE1-CZ 2.76Å; E1439-R1692 IonicContact OE1-NE 3.45Å; E1439-R1692 PolarHBondContact OE1-NE 3.04Å; E1439-R1692 IonicContact OE1-NH2 3.01Å; E1440-R1692 IonicContact OE1-NH2 2.74Å; D1688-R1692 WeakPolarHBondContact O-CB 3.48Å; D1688-R1692 PolarHBondContact O-N 3.47Å
1693	S	79.7	Confident	83	Confident	9 Å²	9	40.3 Å²	40.3	6%	0.063	21%	0.21	C	C	.	.			trans	-52.2	144	178.7	-50.8	0	0	0	0	112.7	L1695	S1693-L1695 VanDerWaalsContact C-N 3.31Å; S1693-L1695 PolarHBondContact O-N 3.44Å
1694	P	78	Confident	82.6	Confident	14 Å²	14	40.7 Å²	40.7	9%	0.091	21%	0.212	C	C	.	.	S	Bend	trans	-78.9	-9.2	-178.6	33.6	-36.9	0	0	0	114.5	M1390 R1395 W1703	M1390-P1694 HydrophobicContact CE-CB 3.97Å; M1390-P1694 HydrophobicContact CE-CG 3.85Å; M1390-P1694 HydrophobicContact SD-CB 4.49Å; R1395-P1694 HydrophobicContact CG-CB 4.5Å; P1694-W1703 HydrophobicContact CG-CD2 3.61Å; P1694-W1703 HydrophobicContact CG-CE3 3.65Å; P1694-W1703 HydrophobicContact CG-CG 4.33Å; P1694-W1703 HydrophobicContact CG-CH2 3.8Å; P1694-W1703 HydrophobicContact CG-CZ2 3.75Å; P1694-W1703 HydrophobicContact CG-CZ3 3.74Å
1695	L	82.4	Confident	82.5	Confident	61 Å²	61	44 Å²	44	32%	0.319	23%	0.225	S	C	.	.	S	Bend	trans	-102	131.2	173.9	-60.5	-174.4	0	0	0	109.3	S1693 I1699 I1700 V1702 W1703	S1693-L1695 VanDerWaalsContact C-N 3.31Å; S1693-L1695 PolarHBondContact O-N 3.44Å; L1695-I1699 HydrophobicContact CD1-CG2 4.15Å; L1695-I1700 WeakPolarHBondContact O-CB 3.4Å; L1695-I1700 VanDerWaalsContact O-CG1 3.31Å; L1695-I1700 WeakPolarHBondContact O-CG1 3.44Å; L1695-V1702 HydrophobicContact CD1-CB 4.27Å; L1695-W1703 HydrophobicContact CB-CB 4.41Å; L1695-W1703 HydrophobicContact CD1-CB 4.03Å; L1695-W1703 HydrophobicContact CG-CB 4.25Å
1696	A	82.8	Confident	82.5	Confident	23 Å²	23	49.8 Å²	49.8	19%	0.19	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-74.1	156.8	172.8	0	0	0	0	0	111.6	I1699 I1700	A1696-I1699 PolarHBondContact O-N 3.32Å; A1696-I1700 PolarHBondContact O-N 2.93Å; A1696-I1700 VanDerWaalsContact O-N 3.07Å
1697	P	77.9	Confident	81.8	Confident	5 Å²	5	53.2 Å²	53.2	3%	0.032	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	144.3	161.5	-29.4	38	0	0	0	112.3	S1402 L1436 I1700	S1402-P1697 PolarHBondContact OG-O 2.87Å; L1436-P1697 HydrophobicContact CD2-CB 4.43Å; L1436-P1697 HydrophobicContact CD2-CG 3.95Å; P1697-I1700 HydrophobicContact CG-CG2 4.34Å
1698	P	78.1	Confident	81.4	Confident	49 Å²	49	53.5 Å²	53.5	32%	0.318	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	cis	-84.3	-4.3	-4.8	35.9	-36.3	0	0	0	113.5	W1432 T1435 I1700	W1432-P1698 HydrophobicContact CD2-CB 4.44Å; W1432-P1698 HydrophobicContact CD2-CG 4.41Å; W1432-P1698 HydrophobicContact CE3-CG 4.17Å; W1432-P1698 HydrophobicContact CZ3-CG 4.26Å; T1435-P1698 HydrophobicContact CG2-CB 3.81Å; T1435-P1698 WeakPolarHBondContact CG2-O 3.35Å; P1698-I1700 PolarHBondContact O-N 3.46Å
1699	I	84	Confident	81.5	Confident	108 Å²	108	58.5 Å²	58.5	55%	0.554	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-14.4	-173.2	-40.1	-177.7	0	0	0	111.8	L1695 A1696 I1701 V1702	L1695-I1699 HydrophobicContact CD1-CG2 4.15Å; A1696-I1699 PolarHBondContact O-N 3.32Å; I1699-I1701 PolarHBondContact O-N 3.08Å; I1699-V1702 HydrophobicContact CG2-CG2 4.18Å; I1699-V1702 WeakPolarHBondContact O-CB 3.3Å; I1699-V1702 PolarHBondContact O-N 3.34Å
1700	I	84.8	Confident	81.1	Confident	2 Å²	2	61.6 Å²	61.6	1%	0.01	30%	0.3	C	S	.	.	H	α-helix	trans	-49.8	-32	178.1	-159	175.3	0	0	0	114.3	E1439 L1695 A1696 P1697 P1698 V1702 W1703 H1704	E1439-I1700 HydrophobicContact CB-CD1 4.31Å; E1439-I1700 VanDerWaalsContact CD-CD1 3.47Å; E1439-I1700 HydrophobicContact CG-CD1 4.06Å; E1439-I1700 WeakPolarHBondContact OE2-CD1 2.96Å; L1695-I1700 WeakPolarHBondContact O-CB 3.4Å; L1695-I1700 VanDerWaalsContact O-CG1 3.31Å; L1695-I1700 WeakPolarHBondContact O-CG1 3.44Å; A1696-I1700 PolarHBondContact O-N 2.93Å; A1696-I1700 VanDerWaalsContact O-N 3.07Å; P1697-I1700 HydrophobicContact CG-CG2 4.34Å; P1698-I1700 PolarHBondContact O-N 3.46Å; I1700-V1702 PolarHBondContact O-N 3.35Å; I1700-W1703 WeakPolarHBondContact O-CA 3.34Å; I1700-W1703 WeakPolarHBondContact O-CB 3.45Å; I1700-W1703 PolarHBondContact O-N 2.86Å; I1700-H1704 WeakPolarHBondContact CG1-NE2 3.28Å; I1700-H1704 PolarHBondContact O-N 3.21Å
1701	I	83.4	Confident	80.3	Confident	51 Å²	51	61.9 Å²	61.9	26%	0.262	30%	0.304	S	S	.	.	H	α-helix	trans	-54.6	-34.9	173.9	-75	177.8	0	0	0	112.5	T1435 I1438 I1699 W1703 H1704 F1705	T1435-I1701 HydrophobicContact CG2-CD1 3.43Å; T1435-I1701 VanDerWaalsContact CG2-CD1 3.43Å; T1435-I1701 HydrophobicContact CG2-CG1 3.86Å; I1438-I1701 HydrophobicContact CD1-CD1 4.1Å; I1438-I1701 HydrophobicContact CD1-CG1 4.39Å; I1699-I1701 PolarHBondContact O-N 3.08Å; I1701-W1703 VanDerWaalsContact C-N 3.3Å; I1701-W1703 PolarHBondContact O-N 2.67Å; I1701-H1704 PolarHBondContact O-N 2.94Å; I1701-F1705 HydrophobicContact CG2-CD2 3.58Å; I1701-F1705 HydrophobicContact CG2-CE2 3.38Å; I1701-F1705 HydrophobicContact CG2-CZ 4.45Å; I1701-F1705 VanDerWaalsContact O-CD2 3.26Å; I1701-F1705 WeakPolarHBondContact O-CD2 3.25Å; I1701-F1705 PolarHBondContact O-N 2.74Å
1702	V	86.3	Confident	80.4	Confident	93 Å²	93	62.8 Å²	62.8	56%	0.564	31%	0.311	S	S	*	.	H	α-helix	trans	-67.2	-33.9	176.5	-176.5	0	0	0	0	111.2	L1695 I1699 I1700 Y1706	L1695-V1702 HydrophobicContact CD1-CB 4.27Å; I1699-V1702 HydrophobicContact CG2-CG2 4.18Å; I1699-V1702 WeakPolarHBondContact O-CB 3.3Å; I1699-V1702 PolarHBondContact O-N 3.34Å; I1700-V1702 PolarHBondContact O-N 3.35Å; V1702-Y1706 PolarHBondContact O-N 3.03Å; V1702-Y1706 VanDerWaalsContact O-N 3.12Å
1703	W	84.3	Confident	80	Confident	56 Å²	56	62 Å²	62	21%	0.212	32%	0.316	C	S	.	.	H	α-helix	trans	-73.5	-41	173.3	-167.1	-95.9	0	0	0	111.4	M1390 P1694 L1695 I1700 I1701 F1705 Y1706 E1707	M1390-W1703 HydrophobicContact CE-CH2 3.93Å; M1390-W1703 HydrophobicContact CE-CZ3 4.3Å; P1694-W1703 HydrophobicContact CG-CD2 3.61Å; P1694-W1703 HydrophobicContact CG-CE3 3.65Å; P1694-W1703 HydrophobicContact CG-CG 4.33Å; P1694-W1703 HydrophobicContact CG-CH2 3.8Å; P1694-W1703 HydrophobicContact CG-CZ2 3.75Å; P1694-W1703 HydrophobicContact CG-CZ3 3.74Å; L1695-W1703 HydrophobicContact CB-CB 4.41Å; L1695-W1703 HydrophobicContact CD1-CB 4.03Å; L1695-W1703 HydrophobicContact CG-CB 4.25Å; I1700-W1703 WeakPolarHBondContact O-CA 3.34Å; I1700-W1703 WeakPolarHBondContact O-CB 3.45Å; I1700-W1703 PolarHBondContact O-N 2.86Å; I1701-W1703 VanDerWaalsContact C-N 3.3Å; I1701-W1703 PolarHBondContact O-N 2.67Å; W1703-F1705 VanDerWaalsContact C-N 3.34Å; W1703-F1705 PolarHBondContact O-N 3.02Å; W1703-Y1706 HydrophobicContact CD2-CD1 4.3Å; W1703-Y1706 HydrophobicContact CE3-CD1 4.17Å; W1703-Y1706 HydrophobicContact CH2-CD1 4.09Å; W1703-Y1706 AromaticContact CH2-CE1 3.94Å; W1703-Y1706 HydrophobicContact CH2-CE1 3.94Å; W1703-Y1706 HydrophobicContact CZ2-CD1 4.21Å; W1703-Y1706 HydrophobicContact CZ2-CE1 4.2Å; W1703-Y1706 HydrophobicContact CZ3-CD1 4.07Å; W1703-Y1706 HydrophobicContact CZ3-CE1 4.25Å; W1703-Y1706 CarbonylContact O-C 3.59Å; W1703-Y1706 WeakPolarHBondContact O-CA 3.5Å; W1703-Y1706 WeakPolarHBondContact O-CB 3.43Å; W1703-Y1706 PolarHBondContact O-N 3.37Å; W1703-Y1706 VanDerWaalsContact O-N 3.08Å; W1703-E1707 VanDerWaalsContact CD1-OE2 3.31Å; W1703-E1707 PolarHBondContact NE1-OE1 2.85Å; W1703-E1707 PolarHBondContact NE1-OE2 3.34Å; W1703-E1707 PolarHBondContact O-N 3.04Å
1704	H	80.9	Confident	79.3	Confident	27 Å²	27	62.9 Å²	62.9	13%	0.125	32%	0.321	C	S	.	.	H	α-helix	trans	-60.7	-40.9	173.4	-59.7	-36.2	0	0	0	112.3	E1439 I1700 I1701 Y1706 E1707 A1708	E1439-H1704 IonicContact OE2-CE1 3.89Å; E1439-H1704 PolarHBondContact OE2-CE1 3.25Å; E1439-H1704 IonicContact OE2-NE2 2.62Å; I1700-H1704 WeakPolarHBondContact CG1-NE2 3.28Å; I1700-H1704 PolarHBondContact O-N 3.21Å; I1701-H1704 PolarHBondContact O-N 2.94Å; H1704-Y1706 VanDerWaalsContact C-N 3.33Å; H1704-Y1706 PolarHBondContact O-N 3.04Å; H1704-E1707 PolarHBondContact O-N 2.77Å; H1704-A1708 WeakPolarHBondContact O-CB 3.47Å; H1704-A1708 PolarHBondContact O-N 3.3Å
1705	F	84	Confident	78.6	Confident	150 Å²	150	67.3 Å²	67.3	66%	0.658	34%	0.34	S	S	*	.	H	α-helix	trans	-65.5	-34.5	172.7	-79.7	-55.5	0	0	0	112.6	I1701 W1703 Y1709	I1701-F1705 HydrophobicContact CG2-CD2 3.58Å; I1701-F1705 HydrophobicContact CG2-CE2 3.38Å; I1701-F1705 HydrophobicContact CG2-CZ 4.45Å; I1701-F1705 VanDerWaalsContact O-CD2 3.26Å; I1701-F1705 WeakPolarHBondContact O-CD2 3.25Å; I1701-F1705 PolarHBondContact O-N 2.74Å; W1703-F1705 VanDerWaalsContact C-N 3.34Å; W1703-F1705 PolarHBondContact O-N 3.02Å; F1705-Y1709 WeakPolarHBondContact O-CB 3.47Å; F1705-Y1709 PolarHBondContact O-N 2.81Å
1706	Y	84.5	Confident	77.3	Confident	128 Å²	128	68.5 Å²	68.5	50%	0.502	35%	0.352	S	S	.	.	H	α-helix	trans	-68.9	-41.5	173.1	171.2	-106.5	0	0	0	112.4	V1702 W1703 H1704 K1710	V1702-Y1706 PolarHBondContact O-N 3.03Å; V1702-Y1706 VanDerWaalsContact O-N 3.12Å; W1703-Y1706 HydrophobicContact CD2-CD1 4.3Å; W1703-Y1706 HydrophobicContact CE3-CD1 4.17Å; W1703-Y1706 HydrophobicContact CH2-CD1 4.09Å; W1703-Y1706 AromaticContact CH2-CE1 3.94Å; W1703-Y1706 HydrophobicContact CH2-CE1 3.94Å; W1703-Y1706 HydrophobicContact CZ2-CD1 4.21Å; W1703-Y1706 HydrophobicContact CZ2-CE1 4.2Å; W1703-Y1706 HydrophobicContact CZ3-CD1 4.07Å; W1703-Y1706 HydrophobicContact CZ3-CE1 4.25Å; W1703-Y1706 CarbonylContact O-C 3.59Å; W1703-Y1706 WeakPolarHBondContact O-CA 3.5Å; W1703-Y1706 WeakPolarHBondContact O-CB 3.43Å; W1703-Y1706 PolarHBondContact O-N 3.37Å; W1703-Y1706 VanDerWaalsContact O-N 3.08Å; H1704-Y1706 VanDerWaalsContact C-N 3.33Å; H1704-Y1706 PolarHBondContact O-N 3.04Å; Y1706-K1710 WeakPolarHBondContact O-CB 3.13Å; Y1706-K1710 PolarHBondContact O-N 3.48Å
1707	E	76	Confident	75.9	Confident	72 Å²	72	68.8 Å²	68.8	34%	0.336	36%	0.355	S	S	.	.	H	α-helix	trans	-71.3	-38.2	176.9	-76.2	-174.9	151.6	0	0	112.4	W1703 H1704 K1710 A1711	W1703-E1707 VanDerWaalsContact CD1-OE2 3.31Å; W1703-E1707 PolarHBondContact NE1-OE1 2.85Å; W1703-E1707 PolarHBondContact NE1-OE2 3.34Å; W1703-E1707 PolarHBondContact O-N 3.04Å; H1704-E1707 PolarHBondContact O-N 2.77Å; E1707-K1710 PolarHBondContact O-N 2.88Å; E1707-A1711 WeakPolarHBondContact O-CB 3.38Å; E1707-A1711 PolarHBondContact O-N 2.68Å
1708	A	76.2	Confident	74.5	Confident	44 Å²	44	70 Å²	70	36%	0.364	36%	0.363	S	S	.	.	H	α-helix	trans	-67.2	-42.4	171.8	0	0	0	0	0	111.3	H1704 K1710 A1711 I1712	H1704-A1708 WeakPolarHBondContact O-CB 3.47Å; H1704-A1708 PolarHBondContact O-N 3.3Å; A1708-K1710 VanDerWaalsContact C-N 3.34Å; A1708-K1710 PolarHBondContact O-N 3.06Å; A1708-A1711 PolarHBondContact O-N 3.13Å; A1708-I1712 VanDerWaalsContact O-CB 3.29Å; A1708-I1712 WeakPolarHBondContact O-CB 3.46Å; A1708-I1712 WeakPolarHBondContact O-CD1 3.26Å; A1708-I1712 WeakPolarHBondContact O-CG1 3.33Å; A1708-I1712 PolarHBondContact O-N 3.06Å
1709	Y	82.6	Confident	72.9	Confident	177 Å²	177	70.4 Å²	70.4	69%	0.694	36%	0.363	S	S	*	.	H	α-helix	trans	-65.9	-35.4	174	-179.8	-100.8	0	0	0	112.3	F1705 G1713	F1705-Y1709 WeakPolarHBondContact O-CB 3.47Å; F1705-Y1709 PolarHBondContact O-N 2.81Å; Y1709-G1713 WeakPolarHBondContact O-CA 3.14Å; Y1709-G1713 PolarHBondContact O-N 3.22Å
1710	K	78	Confident	70.9	Confident	78 Å²	78	76 Å²	76	34%	0.339	38%	0.377	S	S	.	.	H	α-helix	trans	-70.5	-40.2	172.3	-178.8	-169.4	168.4	-157.7	0	111.4	Y1706 E1707 A1708 G1713 N1714	Y1706-K1710 WeakPolarHBondContact O-CB 3.13Å; Y1706-K1710 PolarHBondContact O-N 3.48Å; E1707-K1710 PolarHBondContact O-N 2.88Å; A1708-K1710 VanDerWaalsContact C-N 3.34Å; A1708-K1710 PolarHBondContact O-N 3.06Å; K1710-G1713 PolarHBondContact O-N 3.23Å; K1710-N1714 WeakPolarHBondContact O-CB 3.46Å; K1710-N1714 PolarHBondContact O-N 3.01Å
1711	A	69.1	Low	68.5	Low	24 Å²	24	80.3 Å²	80.3	20%	0.198	40%	0.4	C	S	.	.	H	α-helix	trans	-60.8	-60.8	174.6	0	0	0	0	0	109	M968 E1707 A1708 G1713 N1714 Q1715	M968-A1711 HydrophobicContact CE-CB 3.71Å; E1707-A1711 WeakPolarHBondContact O-CB 3.38Å; E1707-A1711 PolarHBondContact O-N 2.68Å; A1708-A1711 PolarHBondContact O-N 3.13Å; A1711-G1713 VanDerWaalsContact C-N 3.27Å; A1711-G1713 PolarHBondContact O-N 2.94Å; A1711-N1714 CarbonylContact O-C 3.54Å; A1711-N1714 PolarHBondContact O-N 3.32Å; A1711-N1714 VanDerWaalsContact O-N 3.09Å; A1711-Q1715 WeakPolarHBondContact O-CB 3.48Å; A1711-Q1715 PolarHBondContact O-N 2.9Å
1712	I	76.7	Confident	66.3	Low	102 Å²	102	82.1 Å²	82.1	52%	0.523	42%	0.423	S	S	.	.	H	α-helix	trans	-57.1	-36.5	176.1	-64.3	163.5	0	0	0	112.2	A1708 Q1715 C1716	A1708-I1712 VanDerWaalsContact O-CB 3.29Å; A1708-I1712 WeakPolarHBondContact O-CB 3.46Å; A1708-I1712 WeakPolarHBondContact O-CD1 3.26Å; A1708-I1712 WeakPolarHBondContact O-CG1 3.33Å; A1708-I1712 PolarHBondContact O-N 3.06Å; I1712-Q1715 CarbonylContact O-C 3.56Å; I1712-Q1715 VanDerWaalsContact O-CA 3.31Å; I1712-Q1715 WeakPolarHBondContact O-CA 3.37Å; I1712-Q1715 WeakPolarHBondContact O-CB 3.46Å; I1712-Q1715 PolarHBondContact O-N 3.36Å; I1712-C1716 PolarHBondContact O-N 2.87Å; I1712-C1716 PolarHBondContact O-SG 3.49Å
1713	G	70.8	Confident	64	Low	28 Å²	28	85 Å²	85	29%	0.289	43%	0.43	S	S	.	.	H	α-helix	trans	-70.2	-36.7	177.6	0	0	0	0	0	113	Y1709 K1710 A1711 C1716 A1717	Y1709-G1713 WeakPolarHBondContact O-CA 3.14Å; Y1709-G1713 PolarHBondContact O-N 3.22Å; K1710-G1713 PolarHBondContact O-N 3.23Å; A1711-G1713 VanDerWaalsContact C-N 3.27Å; A1711-G1713 PolarHBondContact O-N 2.94Å; G1713-C1716 CarbonylContact O-C 3.6Å; G1713-C1716 VanDerWaalsContact O-C 3.25Å; G1713-C1716 WeakPolarHBondContact O-CA 3.39Å; G1713-C1716 WeakPolarHBondContact O-CB 3.44Å; G1713-C1716 PolarHBondContact O-N 2.96Å; G1713-C1716 VanDerWaalsContact O-N 3.12Å; G1713-A1717 WeakPolarHBondContact O-CB 3.45Å; G1713-A1717 PolarHBondContact O-N 2.94Å
1714	N	65.2	Low	61.6	Low	29 Å²	29	86.1 Å²	86.1	16%	0.155	44%	0.443	C	S	.	.	H	α-helix	trans	-74.1	-31.6	168.8	-68.6	-7.7	0	0	0	110.4	D967 M968 K1710 A1711 C1716 A1717 S1718	D967-N1714 VanDerWaalsContact CB-C 3.46Å; D967-N1714 HydrophobicContact CB-CB 3.65Å; D967-N1714 VanDerWaalsContact CB-O 3.23Å; D967-N1714 WeakPolarHBondContact CB-O 3.46Å; D967-N1714 PolarHBondContact N-O 2.83Å; D967-N1714 WeakPolarHBondContact OD2-CB 3.41Å; M968-N1714 HydrophobicContact CB-CB 4.27Å; M968-N1714 HydrophobicContact SD-CB 4.15Å; M968-N1714 PolarHBondContact SD-ND2 3.01Å; K1710-N1714 WeakPolarHBondContact O-CB 3.46Å; K1710-N1714 PolarHBondContact O-N 3.01Å; A1711-N1714 CarbonylContact O-C 3.54Å; A1711-N1714 PolarHBondContact O-N 3.32Å; A1711-N1714 VanDerWaalsContact O-N 3.09Å; N1714-C1716 PolarHBondContact O-N 3.11Å; N1714-C1716 VanDerWaalsContact O-N 3.11Å; N1714-A1717 CarbonylContact O-C 3.58Å; N1714-A1717 WeakPolarHBondContact O-CA 3.48Å; N1714-A1717 PolarHBondContact O-N 3.03Å; N1714-S1718 PolarHBondContact O-N 3.13Å; N1714-S1718 VanDerWaalsContact O-N 3.08Å
1715	Q	61.6	Low	59.6	Low	107 Å²	107	89.8 Å²	89.8	50%	0.5	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	9.2	164.6	-133.1	153.7	13.5	0	0	112.7	H966 D967 A1711 I1712	H966-Q1715 WeakPolarHBondContact CB-O 3.4Å; D967-Q1715 VanDerWaalsContact O-CA 3.24Å; D967-Q1715 WeakPolarHBondContact O-CA 3.42Å; D967-Q1715 WeakPolarHBondContact O-CB 3.45Å; D967-Q1715 WeakPolarHBondContact O-CG 3.5Å; D967-Q1715 PolarHBondContact O-N 3.25Å; D967-Q1715 VanDerWaalsContact O-N 3.13Å; A1711-Q1715 WeakPolarHBondContact O-CB 3.48Å; A1711-Q1715 PolarHBondContact O-N 2.9Å; I1712-Q1715 CarbonylContact O-C 3.56Å; I1712-Q1715 VanDerWaalsContact O-CA 3.31Å; I1712-Q1715 WeakPolarHBondContact O-CA 3.37Å; I1712-Q1715 WeakPolarHBondContact O-CB 3.46Å; I1712-Q1715 PolarHBondContact O-N 3.36Å
1716	C	55.7	Low	57.9	Low	85 Å²	85	89.9 Å²	89.9	57%	0.574	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.8	18.1	159.2	-61.5	0	0	0	0	112.4	H966 I1712 G1713 N1714	H966-C1716 VanDerWaalsContact CD2-CA 3.43Å; H966-C1716 WeakPolarHBondContact CD2-CA 3.28Å; H966-C1716 PolarHBondContact CE1-O 2.87Å; H966-C1716 VanDerWaalsContact CG-C 3.49Å; H966-C1716 PolarHBondContact NE2-O 3.26Å; I1712-C1716 PolarHBondContact O-N 2.87Å; I1712-C1716 PolarHBondContact O-SG 3.49Å; G1713-C1716 CarbonylContact O-C 3.6Å; G1713-C1716 VanDerWaalsContact O-C 3.25Å; G1713-C1716 WeakPolarHBondContact O-CA 3.39Å; G1713-C1716 WeakPolarHBondContact O-CB 3.44Å; G1713-C1716 PolarHBondContact O-N 2.96Å; G1713-C1716 VanDerWaalsContact O-N 3.12Å; N1714-C1716 PolarHBondContact O-N 3.11Å; N1714-C1716 VanDerWaalsContact O-N 3.11Å
1717	A	53.9	Low	56.5	Low	29 Å²	29	94 Å²	94	24%	0.24	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143.7	-13.9	-176.5	0	0	0	0	0	121.1	H966 G1713 N1714 L1719 R1720	H966-A1717 PolarHBondContact CE1-N 3.2Å; H966-A1717 VanDerWaalsContact CE1-N 3.33Å; H966-A1717 VanDerWaalsContact ND1-C 3.29Å; H966-A1717 VanDerWaalsContact ND1-CA 3.34Å; H966-A1717 WeakPolarHBondContact ND1-CA 3.19Å; H966-A1717 PolarHBondContact ND1-N 3.49Å; G1713-A1717 WeakPolarHBondContact O-CB 3.45Å; G1713-A1717 PolarHBondContact O-N 2.94Å; N1714-A1717 CarbonylContact O-C 3.58Å; N1714-A1717 WeakPolarHBondContact O-CA 3.48Å; N1714-A1717 PolarHBondContact O-N 3.03Å; A1717-L1719 PolarHBondContact O-N 3.02Å; A1717-R1720 PolarHBondContact O-N 3.31Å
1718	S	48.4	Very low	56.1	Low	30 Å²	30	93 Å²	93	21%	0.21	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-27.9	-168.2	77.2	0	0	0	0	119.3	H966 D967 N1714 R1720	H966-S1718 VanDerWaalsContact C-OG 3.22Å; H966-S1718 VanDerWaalsContact CA-CB 3.49Å; H966-S1718 WeakPolarHBondContact CA-OG 3.42Å; H966-S1718 PolarHBondContact N-OG 2.85Å; H966-S1718 PolarHBondContact ND1-N 3.3Å; H966-S1718 VanDerWaalsContact ND1-N 3.16Å; H966-S1718 PolarHBondContact O-OG 2.88Å; D967-S1718 WeakPolarHBondContact OD1-CA 3.29Å; D967-S1718 WeakPolarHBondContact OD1-CB 3.35Å; D967-S1718 WeakPolarHBondContact OD2-CA 3.33Å; D967-S1718 WeakPolarHBondContact OD2-CB 3.37Å; D967-S1718 PolarHBondContact OD2-N 2.73Å; N1714-S1718 PolarHBondContact O-N 3.13Å; N1714-S1718 VanDerWaalsContact O-N 3.08Å; S1718-R1720 PolarHBondContact O-N 2.93Å
1719	L	44.5	Very low	55.9	Low	59 Å²	59	92.6 Å²	92.6	31%	0.309	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-5.8	-173.9	-60.2	170.7	0	0	0	113.7	N964 E965 A1717	N964-L1719 HydrophobicContact CB-CD1 3.63Å; N964-L1719 HydrophobicContact CB-CD2 4.3Å; N964-L1719 WeakPolarHBondContact ND2-CD1 3.32Å; N964-L1719 WeakPolarHBondContact OD1-CD1 3.15Å; N964-L1719 WeakPolarHBondContact OD1-CD2 3.2Å; E965-L1719 HydrophobicContact CB-CD1 4.26Å; E965-L1719 HydrophobicContact CG-CD1 3.55Å; A1717-L1719 PolarHBondContact O-N 3.02Å
1720	R	42	Very low	55.8	Low	224 Å²	224	84.4 Å²	84.4	85%	0.845	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133	-25.5	177	-75.5	169.3	55.5	172.2	-5.3	116.3	A1717 S1718	A1717-R1720 PolarHBondContact O-N 3.31Å; S1718-R1720 PolarHBondContact O-N 2.93Å
1721	N	34.8	Very low	55.9	Low	94 Å²	94	82.5 Å²	82.5	50%	0.503	45%	0.449	S	S	.	.			trans	-130.2	48.4	-159.7	-70.7	-3.1	0	0	0	115.9	E1723	N1721-E1723 PolarHBondContact O-N 2.8Å
1722	A	36.1	Very low	56.3	Low	89 Å²	89	83.7 Å²	83.7	74%	0.736	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	26.3	174.9	0	0	0	0	0	115.6
1723	E	38.7	Very low	56.2	Low	154 Å²	154	86.3 Å²	86.3	72%	0.72	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	1.8	-174.8	-68.4	-161.7	131.7	0	0	114.6	N1721 A1725	N1721-E1723 PolarHBondContact O-N 2.8Å; E1723-A1725 VanDerWaalsContact C-N 3.31Å; E1723-A1725 PolarHBondContact O-N 2.87Å
1724	T	34.8	Very low	56.3	Low	78 Å²	78	86.5 Å²	86.5	48%	0.479	45%	0.45	S	S	.	.			trans	-82.8	6.3	-173.1	45.8	0	0	0	0	116	K1726	T1724-K1726 PolarHBondContact O-N 2.76Å
1725	A	37.7	Very low	56.5	Low	104 Å²	104	91 Å²	91	86%	0.86	48%	0.479	S	S	*	.			trans	-76.3	33.7	176.5	0	0	0	0	0	114.1	E1723	E1723-A1725 VanDerWaalsContact C-N 3.31Å; E1723-A1725 PolarHBondContact O-N 2.87Å
1726	K	48.3	Very low	57.3	Low	153 Å²	153	88.7 Å²	88.7	67%	0.665	47%	0.47	S	S	*	.			trans	-92.3	141.6	-178.6	-78.8	172.7	175.7	159.4	0	111.4	T1724	T1724-K1726 PolarHBondContact O-N 2.76Å
1727	Y	55.6	Low	58.5	Low	214 Å²	214	86.5 Å²	86.5	84%	0.839	45%	0.454	S	S	*	.			trans	74.2	58.7	-177.2	-69	-83.9	0	0	0	116.6
1728	N	66.9	Low	60	Low	51 Å²	51	88.6 Å²	88.6	27%	0.273	46%	0.457	S	S	.	.			trans	-91.8	120.7	134.3	-172	-26.9	0	0	0	107.3	F1730 C1731	N1728-F1730 VanDerWaalsContact C-N 3.28Å; N1728-F1730 PolarHBondContact O-N 3.43Å; N1728-F1730 WeakPolarHBondContact OD1-CB 3.12Å; N1728-F1730 WeakPolarHBondContact OD1-CD2 3.03Å; N1728-F1730 PolarHBondContact OD1-N 3.49Å; N1728-C1731 VanDerWaalsContact O-O 3.12Å
1729	P	72.4	Confident	61.7	Low	36 Å²	36	91.9 Å²	91.9	23%	0.234	47%	0.468	C	S	.	.	S	Bend	trans	-70.1	-23.8	178.5	28.8	-34.6	0	0	0	113.3	N1257 T1293 V1690	N1257-P1729 PolarHBondContact ND2-O 2.93Å; T1293-P1729 HydrophobicContact CG2-CB 3.95Å; T1293-P1729 HydrophobicContact CG2-CG 3.79Å; V1690-P1729 HydrophobicContact CB-CG 4.44Å; V1690-P1729 VanDerWaalsContact CG1-CD 3.49Å; V1690-P1729 HydrophobicContact CG1-CG 3.55Å; V1690-P1729 HydrophobicContact CG2-CG 3.98Å
1730	F	79.8	Confident	63.5	Low	4 Å²	4	90.7 Å²	90.7	2%	0.018	46%	0.461	C	S	.	.	S	Bend	trans	-81.6	-18.6	-179.8	-61.4	-81.5	0	0	0	113.8	S1267 I1269 F1289 L1290 T1293 Y1683 I1686 N1687 V1690 N1728	S1267-F1730 WeakPolarHBondContact CB-O 3.24Å; S1267-F1730 PolarHBondContact OG-O 3.28Å; I1269-F1730 HydrophobicContact CD1-CD1 4.24Å; I1269-F1730 HydrophobicContact CD1-CE1 4.37Å; I1269-F1730 HydrophobicContact CG2-CB 4.29Å; I1269-F1730 HydrophobicContact CG2-CD1 4.03Å; F1289-F1730 AromaticContact CE1-CD1 3.82Å; F1289-F1730 HydrophobicContact CE1-CD1 3.82Å; F1289-F1730 HydrophobicContact CE1-CE1 4.05Å; F1289-F1730 HydrophobicContact CZ-CD1 4.46Å; L1290-F1730 HydrophobicContact CD2-CE1 3.85Å; L1290-F1730 HydrophobicContact CD2-CZ 4.28Å; T1293-F1730 HydrophobicContact CG2-CE2 4.38Å; T1293-F1730 HydrophobicContact CG2-CZ 4.12Å; Y1683-F1730 AromaticContact CD2-CE1 3.99Å; Y1683-F1730 HydrophobicContact CD2-CE1 3.99Å; Y1683-F1730 AromaticContact CE2-CD1 3.82Å; Y1683-F1730 HydrophobicContact CE2-CD1 3.82Å; Y1683-F1730 AromaticContact CE2-CE1 3.68Å; Y1683-F1730 HydrophobicContact CE2-CE1 3.68Å; Y1683-F1730 HydrophobicContact CE2-CZ 4.47Å; I1686-F1730 HydrophobicContact CG2-CZ 4.1Å; N1687-F1730 HydrophobicContact CB-CE2 4.09Å; N1687-F1730 HydrophobicContact CB-CZ 4.17Å; V1690-F1730 HydrophobicContact CB-CE2 4.08Å; V1690-F1730 HydrophobicContact CG1-CD2 4.4Å; V1690-F1730 HydrophobicContact CG1-CE2 4.05Å; V1690-F1730 HydrophobicContact CG2-CE2 3.98Å; N1728-F1730 VanDerWaalsContact C-N 3.28Å; N1728-F1730 PolarHBondContact O-N 3.43Å; N1728-F1730 WeakPolarHBondContact OD1-CB 3.12Å; N1728-F1730 WeakPolarHBondContact OD1-CD2 3.03Å; N1728-F1730 PolarHBondContact OD1-N 3.49Å
1731	C	80.9	Confident	65.6	Low	39 Å²	39	86.9 Å²	86.9	26%	0.264	45%	0.446	S	S	.	.	S	Bend	trans	-137.6	101.9	178	-170.9	0	0	0	0	110	N1257 N1728	N1257-C1731 CarbonylContact O-C 3.6Å; N1257-C1731 WeakPolarHBondContact O-CA 3.13Å; N1728-C1731 VanDerWaalsContact O-O 3.12Å
1732	V	77.6	Confident	68.2	Low	49 Å²	49	86.7 Å²	86.7	30%	0.297	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-115.6	116.5	-174	179.6	0	0	0	0	109.1	N1257 E1259	N1257-V1732 WeakPolarHBondContact ND2-CG2 3.13Å; N1257-V1732 PolarHBondContact O-N 2.95Å; E1259-V1732 PolarHBondContact N-O 3.25Å
1733	R	73.8	Confident	70.5	Confident	157 Å²	157	83.2 Å²	83.2	59%	0.592	41%	0.411	S	S	*	.			trans	-80.7	129.2	173.6	-165.4	179.8	179.7	146.8	0.4	111.2	E1259 T1735	E1259-R1733 HydrophobicContact CB-CB 4.34Å; E1259-R1733 VanDerWaalsContact OE2-CB 3.25Å; E1259-R1733 WeakPolarHBondContact OE2-CB 3.22Å; E1259-R1733 VanDerWaalsContact OE2-CD 3.23Å; E1259-R1733 WeakPolarHBondContact OE2-CD 3.33Å; E1259-R1733 WeakPolarHBondContact OE2-CG 3.22Å; R1733-T1735 PolarHBondContact O-N 3.35Å
1734	F	73.9	Confident	72.8	Confident	31 Å²	31	76.9 Å²	76.9	14%	0.136	38%	0.383	C	S	.	.			trans	-67.1	134.3	169.8	-63.1	-48.8	0	0	0	111.3	L1254 H1258 E1740 M1743	L1254-F1734 HydrophobicContact CD1-CE1 3.88Å; L1254-F1734 HydrophobicContact CD1-CZ 4.4Å; L1254-F1734 HydrophobicContact CD2-CE1 4.14Å; L1254-F1734 HydrophobicContact CG-CE1 3.78Å; L1254-F1734 HydrophobicContact CG-CZ 3.97Å; H1258-F1734 HydrophobicContact CB-CE2 4.07Å; H1258-F1734 HydrophobicContact CB-CZ 4.2Å; H1258-F1734 AromaticContact CD2-CD2 3.21Å; H1258-F1734 WeakPolarHBondContact CD2-CD2 3.14Å; H1258-F1734 AromaticContact CD2-CE2 3.07Å; H1258-F1734 WeakPolarHBondContact CD2-CE2 3.42Å; H1258-F1734 AromaticContact CD2-CZ 3.81Å; H1258-F1734 AromaticContact CG-CE2 3.47Å; H1258-F1734 VanDerWaalsContact CG-CE2 3.47Å; H1258-F1734 AromaticContact NE2-CD2 3.24Å; H1258-F1734 WeakPolarHBondContact NE2-CD2 3.46Å; H1258-F1734 AromaticContact NE2-CE2 3.46Å; H1258-F1734 WeakPolarHBondContact NE2-CE2 3.24Å; F1734-E1740 HydrophobicContact CB-CB 4.24Å; F1734-E1740 HydrophobicContact CD2-CB 3.71Å; F1734-E1740 HydrophobicContact CD2-CG 4Å; F1734-E1740 HydrophobicContact CG-CB 4.35Å; F1734-M1743 HydrophobicContact CD1-CE 3.93Å; F1734-M1743 HydrophobicContact CD2-CE 3.97Å; F1734-M1743 HydrophobicContact CE1-CE 3.47Å; F1734-M1743 VanDerWaalsContact CE1-CE 3.47Å; F1734-M1743 HydrophobicContact CE1-SD 4.1Å; F1734-M1743 HydrophobicContact CE2-CE 3.47Å; F1734-M1743 VanDerWaalsContact CE2-CE 3.47Å; F1734-M1743 HydrophobicContact CE2-SD 4.12Å; F1734-M1743 HydrophobicContact CG-CE 4.19Å; F1734-M1743 HydrophobicContact CZ-CE 3.23Å; F1734-M1743 HydrophobicContact CZ-SD 3.57Å; F1734-M1743 VanDerWaalsContact CZ-SD 3.57Å
1735	T	69	Low	75.5	Confident	125 Å²	125	80.7 Å²	80.7	77%	0.767	39%	0.393	S	S	*	.	S	Bend	trans	-87.6	-13.3	172.7	47.2	0	0	0	0	112.4	R1733	R1733-T1735 PolarHBondContact O-N 3.35Å
1736	D	79.7	Confident	78.1	Confident	58 Å²	58	76.3 Å²	76.3	31%	0.31	35%	0.354	S	S	.	.			trans	-121.9	100.7	-178.7	-173.2	-2	0	0	0	109.7	K1738 K1739 E1740	D1736-K1738 PolarHBondContact O-N 2.9Å; D1736-K1738 VanDerWaalsContact O-N 3.13Å; D1736-K1738 WeakPolarHBondContact OD1-CB 2.95Å; D1736-K1738 PolarHBondContact OD1-N 3.3Å; D1736-K1738 VanDerWaalsContact OD1-N 3.1Å; D1736-K1739 HydrophobicContact CB-CB 4.39Å; D1736-K1739 HydrophobicContact CB-CD 4.25Å; D1736-K1739 HydrophobicContact CB-CG 4.2Å; D1736-K1739 PolarHBondContact O-N 2.93Å; D1736-K1739 WeakPolarHBondContact OD2-CE 3.31Å; D1736-E1740 PolarHBondContact O-N 2.98Å
1737	V	80.8	Confident	80.2	Confident	38 Å²	38	69.2 Å²	69.2	23%	0.23	32%	0.323	C	S	.	.	H	α-helix	trans	-61.9	-18.6	-179.8	-176.6	0	0	0	0	111.8	L1124 R1741	L1124-V1737 HydrophobicContact CD1-CG1 4.18Å; L1124-V1737 HydrophobicContact CD1-CG2 4.44Å; V1737-R1741 WeakPolarHBondContact O-CD 3.27Å; V1737-R1741 VanDerWaalsContact O-CG 3.26Å; V1737-R1741 WeakPolarHBondContact O-CG 3.45Å; V1737-R1741 PolarHBondContact O-N 3.16Å
1738	K	85.6	Confident	81.8	Confident	74 Å²	74	61.8 Å²	61.8	32%	0.322	30%	0.296	S	S	.	.	H	α-helix	trans	-64.7	-50.4	171.2	-169.4	-167.7	-165.6	66.9	0	110.7	E1120 D1736 R1741 E1742	E1120-K1738 VanDerWaalsContact CD-NZ 3.26Å; E1120-K1738 IonicContact OE1-NZ 2.88Å; E1120-K1738 PolarHBondContact OE1-NZ 3.26Å; E1120-K1738 WeakPolarHBondContact OE2-CG 3.49Å; E1120-K1738 IonicContact OE2-NZ 3.12Å; E1120-K1738 PolarHBondContact OE2-NZ 3.32Å; D1736-K1738 PolarHBondContact O-N 2.9Å; D1736-K1738 VanDerWaalsContact O-N 3.13Å; D1736-K1738 WeakPolarHBondContact OD1-CB 2.95Å; D1736-K1738 PolarHBondContact OD1-N 3.3Å; D1736-K1738 VanDerWaalsContact OD1-N 3.1Å; K1738-R1741 WeakPolarHBondContact O-CB 3.48Å; K1738-R1741 PolarHBondContact O-N 3.32Å; K1738-E1742 WeakPolarHBondContact CE-OE1 3.28Å; K1738-E1742 WeakPolarHBondContact CG-OE1 2.96Å; K1738-E1742 WeakPolarHBondContact O-CG 3.46Å; K1738-E1742 PolarHBondContact O-N 2.83Å
1739	K	82.2	Confident	83	Confident	99 Å²	99	63.4 Å²	63.4	43%	0.43	30%	0.303	S	S	.	.	H	α-helix	trans	-67.3	-39.1	-177.7	-65.5	-174.4	-178.3	-166.6	0	111.9	D1736 R1741 E1742 M1743	D1736-K1739 HydrophobicContact CB-CB 4.39Å; D1736-K1739 HydrophobicContact CB-CD 4.25Å; D1736-K1739 HydrophobicContact CB-CG 4.2Å; D1736-K1739 PolarHBondContact O-N 2.93Å; D1736-K1739 WeakPolarHBondContact OD2-CE 3.31Å; K1739-R1741 VanDerWaalsContact C-N 3.32Å; K1739-R1741 PolarHBondContact O-N 2.79Å; K1739-E1742 CarbonylContact O-C 3.41Å; K1739-E1742 PolarHBondContact O-N 3.16Å; K1739-M1743 VanDerWaalsContact C-CE 3.46Å; K1739-M1743 HydrophobicContact CB-CE 3.86Å; K1739-M1743 WeakPolarHBondContact O-CE 3.5Å; K1739-M1743 PolarHBondContact O-N 3.5Å
1740	E	83.5	Confident	83.9	Confident	34 Å²	34	62 Å²	62	16%	0.159	29%	0.294	C	S	.	.	H	α-helix	trans	-50.1	-52.8	169.1	-177.9	-173.9	159.3	0	0	110.9	F1734 D1736 E1742 M1743 V1744	F1734-E1740 HydrophobicContact CB-CB 4.24Å; F1734-E1740 HydrophobicContact CD2-CB 3.71Å; F1734-E1740 HydrophobicContact CD2-CG 4Å; F1734-E1740 HydrophobicContact CG-CB 4.35Å; D1736-E1740 PolarHBondContact O-N 2.98Å; E1740-E1742 PolarHBondContact O-N 3.37Å; E1740-M1743 PolarHBondContact O-N 3.14Å; E1740-V1744 WeakPolarHBondContact O-CG2 3.42Å; E1740-V1744 PolarHBondContact O-N 3.4Å
1741	R	85.9	Confident	84.3	Confident	144 Å²	144	61.9 Å²	61.9	54%	0.543	29%	0.293	S	S	.	.	H	α-helix	trans	-65	-36.8	177.6	-67.6	167.2	178.9	-155.9	-4	113.2	V1737 K1738 K1739 M1743 K1745	V1737-R1741 WeakPolarHBondContact O-CD 3.27Å; V1737-R1741 VanDerWaalsContact O-CG 3.26Å; V1737-R1741 WeakPolarHBondContact O-CG 3.45Å; V1737-R1741 PolarHBondContact O-N 3.16Å; K1738-R1741 WeakPolarHBondContact O-CB 3.48Å; K1738-R1741 PolarHBondContact O-N 3.32Å; K1739-R1741 VanDerWaalsContact C-N 3.32Å; K1739-R1741 PolarHBondContact O-N 2.79Å; R1741-M1743 VanDerWaalsContact C-N 3.34Å; R1741-K1745 WeakPolarHBondContact O-CB 3.44Å; R1741-K1745 PolarHBondContact O-N 3.22Å
1742	E	88.4	Confident	84.7	Confident	90 Å²	90	63.1 Å²	63.1	42%	0.421	30%	0.296	S	S	.	.	H	α-helix	trans	-70.5	-27.9	176.8	-71.8	165.5	174.9	0	0	112.7	R1251 K1738 K1739 E1740 W1746	R1251-E1742 PolarHBondContact NH2-O 3.37Å; K1738-E1742 WeakPolarHBondContact CE-OE1 3.28Å; K1738-E1742 WeakPolarHBondContact CG-OE1 2.96Å; K1738-E1742 WeakPolarHBondContact O-CG 3.46Å; K1738-E1742 PolarHBondContact O-N 2.83Å; K1739-E1742 CarbonylContact O-C 3.41Å; K1739-E1742 PolarHBondContact O-N 3.16Å; E1740-E1742 PolarHBondContact O-N 3.37Å; E1742-W1746 WeakPolarHBondContact O-CB 2.95Å; E1742-W1746 PolarHBondContact O-N 3.46Å
1743	M	85.9	Confident	85.2	Confident	15 Å²	15	63 Å²	63	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-80.2	-48.2	172.4	-80	174	-76	0	0	111.9	R1251 L1254 I1255 F1734 K1739 E1740 R1741 K1745 W1746 E1747	R1251-M1743 HydrophobicContact CG-CG 4.23Å; L1254-M1743 HydrophobicContact CB-SD 4.47Å; L1254-M1743 HydrophobicContact CD2-CE 4.36Å; L1254-M1743 HydrophobicContact CD2-SD 3.7Å; L1254-M1743 HydrophobicContact CG-SD 3.94Å; I1255-M1743 HydrophobicContact CG1-CB 4.42Å; F1734-M1743 HydrophobicContact CD1-CE 3.93Å; F1734-M1743 HydrophobicContact CD2-CE 3.97Å; F1734-M1743 HydrophobicContact CE1-CE 3.47Å; F1734-M1743 VanDerWaalsContact CE1-CE 3.47Å; F1734-M1743 HydrophobicContact CE1-SD 4.1Å; F1734-M1743 HydrophobicContact CE2-CE 3.47Å; F1734-M1743 VanDerWaalsContact CE2-CE 3.47Å; F1734-M1743 HydrophobicContact CE2-SD 4.12Å; F1734-M1743 HydrophobicContact CG-CE 4.19Å; F1734-M1743 HydrophobicContact CZ-CE 3.23Å; F1734-M1743 HydrophobicContact CZ-SD 3.57Å; F1734-M1743 VanDerWaalsContact CZ-SD 3.57Å; K1739-M1743 VanDerWaalsContact C-CE 3.46Å; K1739-M1743 HydrophobicContact CB-CE 3.86Å; K1739-M1743 WeakPolarHBondContact O-CE 3.5Å; K1739-M1743 PolarHBondContact O-N 3.5Å; E1740-M1743 PolarHBondContact O-N 3.14Å; R1741-M1743 VanDerWaalsContact C-N 3.34Å; M1743-K1745 VanDerWaalsContact C-N 3.32Å; M1743-K1745 PolarHBondContact O-N 3.42Å; M1743-W1746 CarbonylContact O-C 3.42Å; M1743-W1746 WeakPolarHBondContact O-CA 3.45Å; M1743-W1746 WeakPolarHBondContact O-CB 3.41Å; M1743-W1746 PolarHBondContact O-N 2.93Å; M1743-E1747 PolarHBondContact O-N 3.32Å
1744	V	87.4	Confident	85.8	Confident	22 Å²	22	58.2 Å²	58.2	13%	0.133	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-40.9	176.6	172.4	0	0	0	0	111.5	K1197 E1198 E1740 W1746 E1747 H1748	K1197-V1744 HydrophobicContact CB-CG1 4.15Å; K1197-V1744 VanDerWaalsContact O-CG1 3.27Å; K1197-V1744 WeakPolarHBondContact O-CG1 3.37Å; E1198-V1744 HydrophobicContact CG-CG1 4.04Å; E1198-V1744 HydrophobicContact CG-CG2 4.1Å; E1740-V1744 WeakPolarHBondContact O-CG2 3.42Å; E1740-V1744 PolarHBondContact O-N 3.4Å; V1744-W1746 VanDerWaalsContact C-N 3.25Å; V1744-W1746 PolarHBondContact O-N 3.24Å; V1744-E1747 PolarHBondContact O-N 3.2Å; V1744-H1748 WeakPolarHBondContact O-CB 3.4Å; V1744-H1748 PolarHBondContact O-N 2.82Å; V1744-H1748 VanDerWaalsContact O-N 3.09Å
1745	K	90.8	Very high	86.3	Confident	158 Å²	158	59.9 Å²	59.9	69%	0.687	29%	0.286	S	S	*	.	H	α-helix	trans	-60.7	-35.6	173.1	-174.5	-173.8	175.1	-165.4	0	112.1	R1741 M1743 M1749	R1741-K1745 WeakPolarHBondContact O-CB 3.44Å; R1741-K1745 PolarHBondContact O-N 3.22Å; M1743-K1745 VanDerWaalsContact C-N 3.32Å; M1743-K1745 PolarHBondContact O-N 3.42Å; K1745-M1749 WeakPolarHBondContact O-CB 3.28Å; K1745-M1749 PolarHBondContact O-N 2.83Å
1746	W	92	Very high	86.9	Confident	11 Å²	11	60.9 Å²	60.9	4%	0.042	28%	0.275	C	S	.	.	H	α-helix	trans	-78	-40.3	-179	179.5	80.6	0	0	0	112.3	C1244 E1247 D1248 R1251 I1255 E1742 M1743 V1744 H1748 M1749 K1750	C1244-W1746 HydrophobicContact CB-CH2 4.02Å; C1244-W1746 HydrophobicContact CB-CZ3 4.03Å; C1244-W1746 WeakPolarHBondContact O-CH2 3.26Å; E1247-W1746 HydrophobicContact CB-CZ2 4.12Å; E1247-W1746 HydrophobicContact CG-CZ2 4.17Å; E1247-W1746 PolarHBondContact OE1-NE1 2.95Å; D1248-W1746 HydrophobicContact CB-CH2 3.96Å; D1248-W1746 HydrophobicContact CB-CZ2 3.91Å; R1251-W1746 HydrophobicContact CB-CH2 4.1Å; R1251-W1746 HydrophobicContact CB-CZ3 4.08Å; R1251-W1746 HydrophobicContact CG-CD2 4.38Å; R1251-W1746 HydrophobicContact CG-CE3 3.81Å; R1251-W1746 HydrophobicContact CG-CH2 4.08Å; R1251-W1746 HydrophobicContact CG-CZ3 3.64Å; R1251-W1746 VanDerWaalsContact NH2-CB 3.26Å; I1255-W1746 HydrophobicContact CD1-CE3 3.67Å; I1255-W1746 HydrophobicContact CD1-CZ3 3.68Å; E1742-W1746 WeakPolarHBondContact O-CB 2.95Å; E1742-W1746 PolarHBondContact O-N 3.46Å; M1743-W1746 CarbonylContact O-C 3.42Å; M1743-W1746 WeakPolarHBondContact O-CA 3.45Å; M1743-W1746 WeakPolarHBondContact O-CB 3.41Å; M1743-W1746 PolarHBondContact O-N 2.93Å; V1744-W1746 VanDerWaalsContact C-N 3.25Å; V1744-W1746 PolarHBondContact O-N 3.24Å; W1746-H1748 VanDerWaalsContact C-N 3.33Å; W1746-H1748 PolarHBondContact O-N 2.91Å; W1746-M1749 WeakPolarHBondContact O-CB 3.38Å; W1746-M1749 PolarHBondContact O-N 3.43Å; W1746-M1749 VanDerWaalsContact O-N 3.14Å; W1746-K1750 HydrophobicContact CD2-CG 4.1Å; W1746-K1750 HydrophobicContact CZ2-CD 4.34Å; W1746-K1750 HydrophobicContact CZ2-CG 4.14Å; W1746-K1750 WeakPolarHBondContact O-CG 3.43Å; W1746-K1750 PolarHBondContact O-N 3.23Å
1747	E	91.9	Very high	86.4	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.019	27%	0.273	C	S	.	.	H	α-helix	trans	-54.1	-50.8	170.1	-169.6	-167.2	151.5	0	0	110.6	E1198 P1199 I1200 I1255 M1743 V1744 M1749 K1750 A1751	E1198-E1747 VanDerWaalsContact C-OE1 3.22Å; E1198-E1747 WeakPolarHBondContact CA-OE1 3.23Å; P1199-E1747 VanDerWaalsContact CD-OE1 3.24Å; P1199-E1747 WeakPolarHBondContact CD-OE1 3.28Å; P1199-E1747 HydrophobicContact CG-CG 4.18Å; P1199-E1747 VanDerWaalsContact N-OE1 3.14Å; I1200-E1747 WeakPolarHBondContact CB-OE1 3.27Å; I1200-E1747 HydrophobicContact CD1-CG 4.03Å; I1200-E1747 HydrophobicContact CG1-CG 4.18Å; I1200-E1747 WeakPolarHBondContact CG1-OE1 3.29Å; I1200-E1747 PolarHBondContact N-OE1 3.49Å; I1255-E1747 HydrophobicContact CD1-CB 4.16Å; M1743-E1747 PolarHBondContact O-N 3.32Å; V1744-E1747 PolarHBondContact O-N 3.2Å; E1747-M1749 VanDerWaalsContact C-N 3.34Å; E1747-M1749 PolarHBondContact O-N 2.71Å; E1747-K1750 PolarHBondContact O-N 3.22Å; E1747-A1751 WeakPolarHBondContact O-CB 3.35Å; E1747-A1751 PolarHBondContact O-N 2.92Å
1748	H	90.6	Very high	85.3	Confident	59 Å²	59	62.7 Å²	62.7	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-37.7	177.1	-176.1	81.8	0	0	0	112.3	E1196 V1744 W1746 A1751 M1752	E1196-H1748 PolarHBondContact O-ND1 3.42Å; V1744-H1748 WeakPolarHBondContact O-CB 3.4Å; V1744-H1748 PolarHBondContact O-N 2.82Å; V1744-H1748 VanDerWaalsContact O-N 3.09Å; W1746-H1748 VanDerWaalsContact C-N 3.33Å; W1746-H1748 PolarHBondContact O-N 2.91Å; H1748-A1751 PolarHBondContact O-N 2.61Å; H1748-M1752 WeakPolarHBondContact O-CG 3.43Å; H1748-M1752 PolarHBondContact O-N 2.73Å
1749	M	90.8	Very high	83.7	Confident	84 Å²	84	62.6 Å²	62.6	41%	0.414	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-46.5	175.3	-169.9	-179.4	84.2	0	0	112.3	K1745 W1746 E1747 A1751 M1752 D1753	K1745-M1749 WeakPolarHBondContact O-CB 3.28Å; K1745-M1749 PolarHBondContact O-N 2.83Å; W1746-M1749 WeakPolarHBondContact O-CB 3.38Å; W1746-M1749 PolarHBondContact O-N 3.43Å; W1746-M1749 VanDerWaalsContact O-N 3.14Å; E1747-M1749 VanDerWaalsContact C-N 3.34Å; E1747-M1749 PolarHBondContact O-N 2.71Å; M1749-A1751 VanDerWaalsContact C-N 3.28Å; M1749-A1751 PolarHBondContact O-N 3.22Å; M1749-M1752 WeakPolarHBondContact O-CB 3.32Å; M1749-M1752 PolarHBondContact O-N 2.81Å; M1749-M1752 VanDerWaalsContact O-N 3.14Å; M1749-D1753 PolarHBondContact O-N 3.38Å
1750	K	90.7	Very high	82.3	Confident	8 Å²	8	61.2 Å²	61.2	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-62.7	-34.2	174.7	-66	-61.6	87.5	-161.6	0	112	E1243 C1244 E1247 W1746 E1747 D1753 Y1754	E1243-K1750 HydrophobicContact CG-CB 4.49Å; E1243-K1750 HydrophobicContact CG-CD 4.49Å; C1244-K1750 VanDerWaalsContact SG-CB 3.56Å; E1247-K1750 HydrophobicContact CB-CD 4.3Å; E1247-K1750 IonicContact OE1-NZ 2.63Å; E1247-K1750 WeakPolarHBondContact OE2-CD 3.35Å; E1247-K1750 VanDerWaalsContact OE2-CE 3.22Å; E1247-K1750 WeakPolarHBondContact OE2-CE 3.5Å; E1247-K1750 IonicContact OE2-NZ 3.64Å; E1247-K1750 PolarHBondContact OE2-NZ 3.07Å; W1746-K1750 HydrophobicContact CD2-CG 4.1Å; W1746-K1750 HydrophobicContact CZ2-CD 4.34Å; W1746-K1750 HydrophobicContact CZ2-CG 4.14Å; W1746-K1750 WeakPolarHBondContact O-CG 3.43Å; W1746-K1750 PolarHBondContact O-N 3.23Å; E1747-K1750 PolarHBondContact O-N 3.22Å; K1750-D1753 VanDerWaalsContact CE-OD2 3.28Å; K1750-D1753 WeakPolarHBondContact CE-OD2 3.33Å; K1750-D1753 IonicContact NZ-OD2 3.78Å; K1750-D1753 PolarHBondContact NZ-OD2 3.08Å; K1750-D1753 PolarHBondContact O-N 3.39Å; K1750-Y1754 WeakPolarHBondContact O-CB 3.39Å; K1750-Y1754 PolarHBondContact O-N 2.94Å
1751	A	90	Very high	80.7	Confident	1 Å²	1	65 Å²	65	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-67.9	-35.5	172.7	0	0	0	0	0	113.4	P1199 V1240 E1747 H1748 M1749 L1755	P1199-A1751 HydrophobicContact CB-CB 4.02Å; P1199-A1751 HydrophobicContact CG-CB 3.44Å; P1199-A1751 VanDerWaalsContact CG-CB 3.44Å; V1240-A1751 HydrophobicContact CG1-CB 3.77Å; V1240-A1751 HydrophobicContact CG2-CB 3.88Å; E1747-A1751 WeakPolarHBondContact O-CB 3.35Å; E1747-A1751 PolarHBondContact O-N 2.92Å; H1748-A1751 PolarHBondContact O-N 2.61Å; M1749-A1751 VanDerWaalsContact C-N 3.28Å; M1749-A1751 PolarHBondContact O-N 3.22Å; A1751-L1755 WeakPolarHBondContact O-CB 3.3Å; A1751-L1755 WeakPolarHBondContact O-CG 3.26Å; A1751-L1755 PolarHBondContact O-N 3.18Å
1752	M	88.6	Confident	78.6	Confident	65 Å²	65	61.9 Å²	61.9	32%	0.32	32%	0.315	S	S	.	.	H	α-helix	trans	-67.2	-37.8	171.5	-68.7	-60.1	104.3	0	0	112	T1194 H1748 M1749 L1755 R1756	T1194-M1752 WeakPolarHBondContact O-CE 3.47Å; H1748-M1752 WeakPolarHBondContact O-CG 3.43Å; H1748-M1752 PolarHBondContact O-N 2.73Å; M1749-M1752 WeakPolarHBondContact O-CB 3.32Å; M1749-M1752 PolarHBondContact O-N 2.81Å; M1749-M1752 VanDerWaalsContact O-N 3.14Å; M1752-L1755 HydrophobicContact CE-CD1 3.73Å; M1752-L1755 PolarHBondContact O-N 2.97Å; M1752-R1756 WeakPolarHBondContact O-CB 3.35Å; M1752-R1756 PolarHBondContact O-N 2.99Å
1753	D	87.6	Confident	76.6	Confident	45 Å²	45	62.9 Å²	62.9	24%	0.241	33%	0.328	C	S	.	.	H	α-helix	trans	-67.1	-43	174.8	-66.9	-32.2	0	0	0	111.4	M1749 K1750 L1755 R1756 E1757	M1749-D1753 PolarHBondContact O-N 3.38Å; K1750-D1753 VanDerWaalsContact CE-OD2 3.28Å; K1750-D1753 WeakPolarHBondContact CE-OD2 3.33Å; K1750-D1753 IonicContact NZ-OD2 3.78Å; K1750-D1753 PolarHBondContact NZ-OD2 3.08Å; K1750-D1753 PolarHBondContact O-N 3.39Å; D1753-L1755 PolarHBondContact O-N 3.32Å; D1753-R1756 WeakPolarHBondContact O-CB 3.4Å; D1753-R1756 PolarHBondContact O-N 3.3Å; D1753-R1756 VanDerWaalsContact O-N 3.17Å; D1753-R1756 IonicContact OD1-NH1 3.57Å; D1753-R1756 PolarHBondContact OD1-NH1 3.05Å; D1753-R1756 VanDerWaalsContact OD1-NH1 3.14Å; D1753-E1757 PolarHBondContact O-N 3.03Å
1754	Y	87.6	Confident	74.6	Confident	57 Å²	57	65.2 Å²	65.2	22%	0.224	36%	0.356	C	S	.	.	H	α-helix	trans	-57.5	-45.9	170.7	168.2	-102.5	0	0	0	112.2	W1193 G1239 V1240 K1750 R1756 E1757 P1758	W1193-Y1754 HydrophobicContact CH2-CE1 4.42Å; G1239-Y1754 VanDerWaalsContact CA-CE2 3.49Å; V1240-Y1754 HydrophobicContact CG2-CD1 3.58Å; V1240-Y1754 HydrophobicContact CG2-CE1 4.12Å; V1240-Y1754 HydrophobicContact CG2-CG 4.08Å; K1750-Y1754 WeakPolarHBondContact O-CB 3.39Å; K1750-Y1754 PolarHBondContact O-N 2.94Å; Y1754-R1756 VanDerWaalsContact C-N 3.27Å; Y1754-R1756 PolarHBondContact O-N 2.63Å; Y1754-E1757 PolarHBondContact O-N 2.62Å; Y1754-P1758 WeakPolarHBondContact O-CD 3.09Å
1755	L	84.4	Confident	72.3	Confident	66 Å²	66	70.8 Å²	70.8	35%	0.346	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-26.9	176.7	-81.8	169.8	0	0	0	113.3	W1193 T1194 A1751 M1752 D1753	W1193-L1755 HydrophobicContact CZ3-CD1 4.25Å; W1193-L1755 HydrophobicContact CZ3-CD2 4.12Å; W1193-L1755 HydrophobicContact CZ3-CG 4.38Å; T1194-L1755 HydrophobicContact CG2-CD1 3.87Å; A1751-L1755 WeakPolarHBondContact O-CB 3.3Å; A1751-L1755 WeakPolarHBondContact O-CG 3.26Å; A1751-L1755 PolarHBondContact O-N 3.18Å; M1752-L1755 HydrophobicContact CE-CD1 3.73Å; M1752-L1755 PolarHBondContact O-N 2.97Å; D1753-L1755 PolarHBondContact O-N 3.32Å
1756	R	80.9	Confident	69.6	Low	146 Å²	146	71 Å²	71	55%	0.551	38%	0.375	S	S	*	.	H	α-helix	trans	-74.1	-33.4	172.9	-172	-178.8	-69.9	129.7	-1.6	111.9	M1752 D1753 Y1754 S1759 T1760	M1752-R1756 WeakPolarHBondContact O-CB 3.35Å; M1752-R1756 PolarHBondContact O-N 2.99Å; D1753-R1756 WeakPolarHBondContact O-CB 3.4Å; D1753-R1756 PolarHBondContact O-N 3.3Å; D1753-R1756 VanDerWaalsContact O-N 3.17Å; D1753-R1756 IonicContact OD1-NH1 3.57Å; D1753-R1756 PolarHBondContact OD1-NH1 3.05Å; D1753-R1756 VanDerWaalsContact OD1-NH1 3.14Å; Y1754-R1756 VanDerWaalsContact C-N 3.27Å; Y1754-R1756 PolarHBondContact O-N 2.63Å; R1756-S1759 PolarHBondContact O-N 2.77Å; R1756-S1759 VanDerWaalsContact O-N 3.11Å; R1756-S1759 PolarHBondContact O-OG 2.89Å; R1756-T1760 HydrophobicContact CG-CG2 4.21Å; R1756-T1760 PolarHBondContact O-N 3.16Å
1757	E	69	Low	66.7	Low	58 Å²	58	73.7 Å²	73.7	27%	0.271	41%	0.406	S	S	.	.	H	α-helix	trans	-56.2	-46	-171.2	-150.2	-155.7	-160.9	0	0	114.4	D1753 Y1754 S1759 T1760 K1761	D1753-E1757 PolarHBondContact O-N 3.03Å; Y1754-E1757 PolarHBondContact O-N 2.62Å; E1757-S1759 VanDerWaalsContact C-N 3.31Å; E1757-S1759 PolarHBondContact O-N 2.67Å; E1757-T1760 PolarHBondContact O-N 2.9Å; E1757-T1760 VanDerWaalsContact O-N 3.11Å; E1757-T1760 PolarHBondContact O-OG1 2.99Å; E1757-K1761 HydrophobicContact CG-CD 4.27Å; E1757-K1761 PolarHBondContact O-N 3.18Å; E1757-K1761 WeakPolarHBondContact OE1-CE 3.32Å; E1757-K1761 IonicContact OE1-NZ 2.92Å; E1757-K1761 PolarHBondContact OE1-NZ 2.91Å; E1757-K1761 WeakPolarHBondContact OE2-CE 3.4Å; E1757-K1761 IonicContact OE2-NZ 2.97Å; E1757-K1761 PolarHBondContact OE2-NZ 3.06Å
1758	P	57.9	Low	63.8	Low	77 Å²	77	80.3 Å²	80.3	50%	0.5	45%	0.447	S	S	.	.	H	α-helix	trans	-54.9	-41.7	175.2	-28	35.1	0	0	0	113.8	Y1754 T1760 K1761 A1762	Y1754-P1758 WeakPolarHBondContact O-CD 3.09Å; P1758-T1760 VanDerWaalsContact C-N 3.3Å; P1758-T1760 PolarHBondContact O-N 2.81Å; P1758-K1761 PolarHBondContact O-N 3.2Å; P1758-A1762 WeakPolarHBondContact O-CB 3.39Å; P1758-A1762 PolarHBondContact O-N 2.85Å
1759	S	51.5	Low	60.9	Low	71 Å²	71	81.3 Å²	81.3	50%	0.497	47%	0.465	S	S	.	.	H	α-helix	trans	-63.5	-35.7	179.4	73.9	0	0	0	0	112.5	R1756 E1757 T1763	R1756-S1759 PolarHBondContact O-N 2.77Å; R1756-S1759 VanDerWaalsContact O-N 3.11Å; R1756-S1759 PolarHBondContact O-OG 2.89Å; E1757-S1759 VanDerWaalsContact C-N 3.31Å; E1757-S1759 PolarHBondContact O-N 2.67Å; S1759-T1763 PolarHBondContact O-N 3.16Å; S1759-T1763 PolarHBondContact O-OG1 2.63Å
1760	T	52	Low	58.1	Low	70 Å²	70	84.8 Å²	84.8	43%	0.429	48%	0.48	S	S	.	.	H	α-helix	trans	-77	-37	177.3	65.4	0	0	0	0	112.5	R1756 E1757 P1758 A1762 T1763 G1764	R1756-T1760 HydrophobicContact CG-CG2 4.21Å; R1756-T1760 PolarHBondContact O-N 3.16Å; E1757-T1760 PolarHBondContact O-N 2.9Å; E1757-T1760 VanDerWaalsContact O-N 3.11Å; E1757-T1760 PolarHBondContact O-OG1 2.99Å; P1758-T1760 VanDerWaalsContact C-N 3.3Å; P1758-T1760 PolarHBondContact O-N 2.81Å; T1760-A1762 VanDerWaalsContact C-N 3.34Å; T1760-T1763 PolarHBondContact O-N 2.86Å; T1760-T1763 PolarHBondContact O-OG1 3.24Å; T1760-G1764 PolarHBondContact O-N 2.99Å
1761	K	49.9	Very low	55.3	Low	114 Å²	114	89.2 Å²	89.2	50%	0.496	51%	0.513	S	S	.	.	H	α-helix	trans	-67.1	-35.8	175.9	-75.4	176.1	173.6	168.9	0	111.8	E1757 P1758 K1765	E1757-K1761 HydrophobicContact CG-CD 4.27Å; E1757-K1761 PolarHBondContact O-N 3.18Å; E1757-K1761 WeakPolarHBondContact OE1-CE 3.32Å; E1757-K1761 IonicContact OE1-NZ 2.92Å; E1757-K1761 PolarHBondContact OE1-NZ 2.91Å; E1757-K1761 WeakPolarHBondContact OE2-CE 3.4Å; E1757-K1761 IonicContact OE2-NZ 2.97Å; E1757-K1761 PolarHBondContact OE2-NZ 3.06Å; P1758-K1761 PolarHBondContact O-N 3.2Å; K1761-K1765 PolarHBondContact O-N 3.32Å
1762	A	43	Very low	52.3	Low	78 Å²	78	100.9 Å²	100.9	65%	0.645	56%	0.557	S	S	*	*	H	α-helix	trans	-67	-34.2	175.2	0	0	0	0	0	113.5	P1758 T1760	P1758-A1762 WeakPolarHBondContact O-CB 3.39Å; P1758-A1762 PolarHBondContact O-N 2.85Å; T1760-A1762 VanDerWaalsContact C-N 3.34Å
1763	T	46.4	Very low	49.3	Very low	111 Å²	111	101.5 Å²	101.5	68%	0.681	57%	0.572	S	S	*	*	H	α-helix	trans	-85.4	-30.7	178.2	35.2	0	0	0	0	113.6	S1759 T1760	S1759-T1763 PolarHBondContact O-N 3.16Å; S1759-T1763 PolarHBondContact O-OG1 2.63Å; T1760-T1763 PolarHBondContact O-N 2.86Å; T1760-T1763 PolarHBondContact O-OG1 3.24Å
1764	G	43.4	Very low	46.6	Very low	65 Å²	65	106.5 Å²	106.5	67%	0.67	60%	0.603	S	S	*	*	H	α-helix	trans	-83.7	-24.4	-175.3	0	0	0	0	0	116.8	T1760 R1766	T1760-G1764 PolarHBondContact O-N 2.99Å; G1764-R1766 PolarHBondContact O-N 2.87Å
1765	K	39.9	Very low	43.8	Very low	139 Å²	139	109 Å²	109	60%	0.604	63%	0.625	S	S	*	*			trans	-101.7	64	-174.1	-83.4	-168.3	160.4	-170.8	0	114.1	K1761 E1770	K1761-K1765 PolarHBondContact O-N 3.32Å; K1765-E1770 IonicContact NZ-OE1 2.83Å; K1765-E1770 PolarHBondContact NZ-OE1 3.12Å; K1765-E1770 IonicContact NZ-OE2 3.63Å; K1765-E1770 PolarHBondContact NZ-OE2 2.76Å
1766	R	32.6	Very low	41.1	Very low	161 Å²	161	115.9 Å²	115.9	61%	0.608	65%	0.652	S	S	*	*			trans	-106.9	80.5	163.9	-79	-169.9	172.2	-151.1	-5.5	111.4	G1764 D1823 R1827	G1764-R1766 PolarHBondContact O-N 2.87Å; R1766-D1823 IonicContact NH2-OD2 2.68Å; R1766-D1823 PolarHBondContact NH2-OD2 2.96Å; R1766-R1827 VanDerWaalsContact NH2-CD 3.31Å
1767	G	31.8	Very low	38.7	Very low	68 Å²	68	121 Å²	121	70%	0.701	67%	0.671	S	S	*	*	S	Bend	trans	166.4	122.8	171.5	0	0	0	0	0	114.9
1768	V	31.6	Very low	36.6	Very low	143 Å²	143	122.1 Å²	122.1	87%	0.867	70%	0.699	S	S	*	*	S	Bend	trans	61.2	100.3	159.6	-168.8	0	0	0	0	117.9
1769	A	28.9	Very low	35	Very low	81 Å²	81	122.5 Å²	122.5	67%	0.669	72%	0.717	S	S	*	*			trans	47.8	88.4	144.7	0	0	0	0	0	119.9
1770	E	31.8	Very low	33.8	Very low	156 Å²	156	123.2 Å²	123.2	73%	0.729	74%	0.735	S	S	*	*			trans	-110.4	55.3	150.3	-78.2	175.1	153	0	0	110.2	K1765	K1765-E1770 IonicContact NZ-OE1 2.83Å; K1765-E1770 PolarHBondContact NZ-OE1 3.12Å; K1765-E1770 IonicContact NZ-OE2 3.63Å; K1765-E1770 PolarHBondContact NZ-OE2 2.76Å
1771	S	31.7	Very low	32.6	Very low	102 Å²	102	123.6 Å²	123.6	71%	0.713	75%	0.753	S	S	*	*	S	Bend	trans	-148.3	108.5	169.6	-85.7	0	0	0	0	109
1772	R	27.4	Very low	31.6	Very low	246 Å²	246	125.6 Å²	125.6	93%	0.928	77%	0.774	S	S	*	*	S	Bend	trans	73.6	147.3	-159.1	-58	174.7	160	155.3	-5.3	114.9
1773	A	26.7	Very low	30.9	Very low	77 Å²	77	125.1 Å²	125.1	64%	0.636	78%	0.778	S	S	*	*			trans	82.1	73.7	157.3	0	0	0	0	0	121.7	V1775	A1773-V1775 HydrophobicContact CB-CG2 3.85Å
1774	V	29.3	Very low	30.2	Very low	150 Å²	150	126.1 Å²	126.1	91%	0.909	79%	0.786	S	S	*	*			trans	-134.8	85.5	133.4	-176.2	0	0	0	0	106
1775	V	30	Very low	29.5	Very low	111 Å²	111	126.4 Å²	126.4	67%	0.673	79%	0.789	S	S	*	*			cis	58.3	107.1	48.4	179.1	0	0	0	0	112.1	A1773	A1773-V1775 HydrophobicContact CB-CG2 3.85Å
1776	F	26.8	Very low	29.2	Very low	210 Å²	210	129.3 Å²	129.3	92%	0.921	81%	0.805	S	S	*	*			trans	-60.5	135.5	-179.3	-74.2	-108.5	0	0	0	112.6
1777	R	30	Very low	29.3	Very low	252 Å²	252	125.2 Å²	125.2	95%	0.951	81%	0.812	S	S	*	*			trans	-133	116	152.1	-98.8	-172.4	172.2	-175.2	-1.1	109.8
1778	G	25.7	Very low	29.6	Very low	83 Å²	83	127.5 Å²	127.5	86%	0.856	82%	0.815	S	S	*	*			trans	-81.8	156.7	172.3	0	0	0	0	0	112.1
1779	G	25.5	Very low	29.6	Very low	84 Å²	84	127.3 Å²	127.3	87%	0.866	81%	0.813	S	S	*	*			trans	-161.2	31.3	-170.8	0	0	0	0	0	117
1780	G	24.9	Very low	30	Very low	86 Å²	86	131.2 Å²	131.2	89%	0.887	82%	0.82	S	S	*	*			trans	75	98.6	163.2	0	0	0	0	0	117.8
1781	G	27.1	Very low	30.3	Very low	78 Å²	78	129 Å²	129	80%	0.804	81%	0.813	S	S	*	*			trans	-178.7	110.3	167.6	0	0	0	0	0	111.3
1782	V	28.6	Very low	30.7	Very low	156 Å²	156	130.4 Å²	130.4	95%	0.945	81%	0.812	S	S	*	*			trans	-96	122.9	-169.4	178.9	0	0	0	0	112.2
1783	G	29.8	Very low	31.4	Very low	69 Å²	69	126.5 Å²	126.5	71%	0.711	80%	0.801	S	S	*	*			trans	-166.9	107.5	169	0	0	0	0	0	109.8
1784	P	31.4	Very low	32.5	Very low	131 Å²	131	126.1 Å²	126.1	85%	0.851	79%	0.794	S	S	*	*			trans	-93.6	151.7	-162.4	35.2	-36	0	0	0	114.2
1785	G	27.9	Very low	33.3	Very low	71 Å²	71	124.9 Å²	124.9	73%	0.732	78%	0.779	S	S	*	*			trans	177	36.9	176.8	0	0	0	0	0	120.9
1786	Q	33.5	Very low	33.7	Very low	201 Å²	201	127.1 Å²	127.1	94%	0.939	78%	0.783	S	S	*	*			trans	51	113	159.1	-65.4	178.9	-16.8	0	0	120.4
1787	G	35.2	Very low	34.5	Very low	74 Å²	74	121.3 Å²	121.3	76%	0.763	77%	0.769	S	S	*	*			trans	-143.9	145.2	143.5	0	0	0	0	0	108.8
1788	P	37.5	Very low	35.1	Very low	117 Å²	117	112.7 Å²	112.7	76%	0.76	75%	0.748	S	S	*	*			trans	-123.9	127.3	173.7	35.1	-21.4	0	0	0	114.7
1789	V	32.5	Very low	36	Very low	138 Å²	138	113.7 Å²	113.7	84%	0.836	74%	0.737	S	S	*	*			trans	50.9	105.4	132.2	-170.2	0	0	0	0	118.4
1790	M	35.9	Very low	37	Very low	163 Å²	163	115 Å²	115	80%	0.803	73%	0.728	S	S	*	*			trans	-77.7	139.8	151.5	-81.7	-76.5	-111.6	0	0	110
1791	D	38.5	Very low	37.9	Very low	109 Å²	109	119.4 Å²	119.4	58%	0.583	73%	0.726	S	S	*	*			trans	-91.9	143.5	-174.3	-170.3	16.6	0	0	0	112.8	K1793 S1794	D1791-K1793 PolarHBondContact O-N 3.49Å; D1791-S1794 PolarHBondContact O-N 3.45Å; D1791-S1794 PolarHBondContact O-OG 2.93Å
1792	L	40.9	Very low	38.7	Very low	132 Å²	132	116.7 Å²	116.7	69%	0.691	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-11	-175.1	-161	71.5	0	0	0	113	S1794 E1795	L1792-S1794 VanDerWaalsContact C-N 3.33Å; L1792-S1794 PolarHBondContact O-N 2.97Å; L1792-E1795 WeakPolarHBondContact CD1-OE2 3.3Å
1793	K	41.1	Very low	39.3	Very low	164 Å²	164	115.4 Å²	115.4	71%	0.713	68%	0.684	S	S	*	*	H	α-helix	trans	-70.4	-25.4	-179.1	-161.3	176.4	-179.2	-173.4	0	113.6	D1791	D1791-K1793 PolarHBondContact O-N 3.49Å
1794	S	50.8	Low	40.2	Very low	69 Å²	69	114.5 Å²	114.5	48%	0.483	67%	0.674	S	S	.	*	H	α-helix	trans	-69.3	-42.6	178.7	54.5	0	0	0	0	112.7	D1791 L1792 M1796 S1797 S1798	D1791-S1794 PolarHBondContact O-N 3.45Å; D1791-S1794 PolarHBondContact O-OG 2.93Å; L1792-S1794 VanDerWaalsContact C-N 3.33Å; L1792-S1794 PolarHBondContact O-N 2.97Å; S1794-M1796 PolarHBondContact O-N 2.89Å; S1794-S1797 PolarHBondContact O-N 3.31Å; S1794-S1798 PolarHBondContact O-N 3.49Å
1795	E	45.7	Very low	41.1	Very low	125 Å²	125	115.1 Å²	115.1	58%	0.584	67%	0.668	S	S	*	*	H	α-helix	trans	-54.4	-39.2	175.7	-84.9	-172.2	131.7	0	0	111.6	L1792 S1797 S1798 V1799	L1792-E1795 WeakPolarHBondContact CD1-OE2 3.3Å; E1795-S1797 VanDerWaalsContact C-N 3.33Å; E1795-S1797 PolarHBondContact O-N 3.06Å; E1795-S1798 PolarHBondContact O-N 3.28Å; E1795-S1798 PolarHBondContact O-OG 3.39Å; E1795-V1799 WeakPolarHBondContact O-CG2 3.41Å; E1795-V1799 PolarHBondContact O-N 3.42Å
1796	M	37.7	Very low	42.1	Very low	157 Å²	157	115.8 Å²	115.8	77%	0.773	65%	0.652	S	S	*	*	H	α-helix	trans	-73.8	-20.2	-174.9	-154.7	165.1	-172.2	0	0	114.2	S1794	S1794-M1796 PolarHBondContact O-N 2.89Å
1797	S	44.3	Very low	42.8	Very low	89 Å²	89	110.9 Å²	110.9	62%	0.622	63%	0.632	S	S	*	*	H	α-helix	trans	-78.7	-43.4	168.5	-162.2	0	0	0	0	110.8	S1794 E1795 V1799 T1800	S1794-S1797 PolarHBondContact O-N 3.31Å; E1795-S1797 VanDerWaalsContact C-N 3.33Å; E1795-S1797 PolarHBondContact O-N 3.06Å; S1797-V1799 PolarHBondContact O-N 2.93Å; S1797-V1799 VanDerWaalsContact O-N 3.14Å; S1797-T1800 PolarHBondContact O-N 3.25Å; S1797-T1800 VanDerWaalsContact O-N 3.07Å; S1797-T1800 PolarHBondContact O-OG1 3.29Å
1798	S	43.4	Very low	43.6	Very low	71 Å²	71	112.2 Å²	112.2	50%	0.497	62%	0.618	S	S	.	*	H	α-helix	trans	-61.2	-23.1	-179.9	75.6	0	0	0	0	114.1	S1794 E1795 T1800 G1802	S1794-S1798 PolarHBondContact O-N 3.49Å; E1795-S1798 PolarHBondContact O-N 3.28Å; E1795-S1798 PolarHBondContact O-OG 3.39Å; S1798-T1800 VanDerWaalsContact C-N 3.27Å; S1798-T1800 PolarHBondContact O-N 2.61Å; S1798-G1802 WeakPolarHBondContact O-CA 3.34Å; S1798-G1802 PolarHBondContact O-N 3.04Å
1799	V	43.6	Very low	44.3	Very low	103 Å²	103	113.6 Å²	113.6	62%	0.624	61%	0.612	S	S	*	*	H	α-helix	trans	-67.9	-21.1	175.9	166.3	0	0	0	0	113.4	E1795 S1797	E1795-V1799 WeakPolarHBondContact O-CG2 3.41Å; E1795-V1799 PolarHBondContact O-N 3.42Å; S1797-V1799 PolarHBondContact O-N 2.93Å; S1797-V1799 VanDerWaalsContact O-N 3.14Å
1800	T	46	Very low	45.4	Very low	112 Å²	112	114.1 Å²	114.1	69%	0.687	60%	0.599	S	S	*	*	H	α-helix	trans	-87.7	-39.7	-175.6	-34.6	0	0	0	0	113.1	S1797 S1798	S1797-T1800 PolarHBondContact O-N 3.25Å; S1797-T1800 VanDerWaalsContact O-N 3.07Å; S1797-T1800 PolarHBondContact O-OG1 3.29Å; S1798-T1800 VanDerWaalsContact C-N 3.27Å; S1798-T1800 PolarHBondContact O-N 2.61Å
1801	E	45.1	Very low	46.5	Very low	179 Å²	179	111.9 Å²	111.9	84%	0.836	59%	0.585	S	S	*	*	H	α-helix	trans	-85.1	-19.8	169.2	-65.2	-176.8	140.6	0	0	111.9	I1803 G1804	E1801-I1803 PolarHBondContact O-N 3.48Å; E1801-G1804 PolarHBondContact O-N 2.86Å
1802	G	42.8	Very low	47.2	Very low	21 Å²	21	112.2 Å²	112.2	22%	0.216	58%	0.581	C	S	.	*	H	α-helix	trans	-64.1	-6.9	-174.9	0	0	0	0	0	115.9	S1798 G1804 E1806	S1798-G1802 WeakPolarHBondContact O-CA 3.34Å; S1798-G1802 PolarHBondContact O-N 3.04Å; G1802-G1804 VanDerWaalsContact C-N 3.3Å; G1802-G1804 PolarHBondContact O-N 2.88Å; G1802-E1806 WeakPolarHBondContact O-CA 3.36Å; G1802-E1806 WeakPolarHBondContact O-CB 3.48Å; G1802-E1806 PolarHBondContact O-N 3.49Å
1803	I	42.6	Very low	48.2	Very low	129 Å²	129	110.1 Å²	110.1	66%	0.662	57%	0.568	S	S	*	*	H	α-helix	trans	-60.6	-41.4	175.9	-61.2	178.5	0	0	0	110.7	E1801 L1807	E1801-I1803 PolarHBondContact O-N 3.48Å; I1803-L1807 WeakPolarHBondContact O-CB 3.34Å; I1803-L1807 PolarHBondContact O-N 3.18Å
1804	G	47.2	Very low	49	Very low	49 Å²	49	105.2 Å²	105.2	51%	0.505	55%	0.549	S	S	.	.	H	α-helix	trans	-74.1	-50.9	-179.1	0	0	0	0	0	113.7	E1801 G1802 L1807 E1808	E1801-G1804 PolarHBondContact O-N 2.86Å; G1802-G1804 VanDerWaalsContact C-N 3.3Å; G1802-G1804 PolarHBondContact O-N 2.88Å; G1804-L1807 CarbonylContact O-C 3.59Å; G1804-L1807 WeakPolarHBondContact O-CA 3.37Å; G1804-L1807 WeakPolarHBondContact O-CB 3.39Å; G1804-L1807 PolarHBondContact O-N 2.63Å; G1804-L1807 VanDerWaalsContact O-N 3.16Å; G1804-E1808 PolarHBondContact O-N 2.65Å
1805	M	51.1	Low	49.1	Very low	145 Å²	145	106 Å²	106	71%	0.714	55%	0.548	S	S	*	.	H	α-helix	trans	-75.2	-29.1	-178.9	-73.8	-173.1	71.5	0	0	113.6	L1807 E1808 K1809	M1805-L1807 VanDerWaalsContact C-N 3.35Å; M1805-E1808 PolarHBondContact O-N 3.03Å; M1805-K1809 WeakPolarHBondContact O-CB 3.15Å; M1805-K1809 PolarHBondContact O-N 3.32Å
1806	E	48	Very low	49.7	Very low	85 Å²	85	103.7 Å²	103.7	40%	0.397	54%	0.539	S	S	.	.	H	α-helix	trans	-70.6	-33.7	166.2	-174.5	67.1	-175.5	0	0	109.5	G1802 R1810	G1802-E1806 WeakPolarHBondContact O-CA 3.36Å; G1802-E1806 WeakPolarHBondContact O-CB 3.48Å; G1802-E1806 PolarHBondContact O-N 3.49Å; E1806-R1810 HydrophobicContact CG-CG 4.15Å; E1806-R1810 WeakPolarHBondContact O-CA 3.21Å; E1806-R1810 WeakPolarHBondContact O-CB 3.37Å; E1806-R1810 WeakPolarHBondContact O-CG 3.32Å; E1806-R1810 PolarHBondContact O-N 2.73Å; E1806-R1810 IonicContact OE1-CZ 3.73Å; E1806-R1810 IonicContact OE1-NE 3.28Å; E1806-R1810 PolarHBondContact OE1-NE 3.1Å; E1806-R1810 IonicContact OE1-NH2 2.73Å; E1806-R1810 PolarHBondContact OE1-NH2 2.83Å
1807	L	48.9	Very low	50.4	Low	98 Å²	98	100.2 Å²	100.2	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-61.1	-44.4	168.4	-129.6	78.6	0	0	0	111.6	I1803 G1804 M1805 R1810 F1811	I1803-L1807 WeakPolarHBondContact O-CB 3.34Å; I1803-L1807 PolarHBondContact O-N 3.18Å; G1804-L1807 CarbonylContact O-C 3.59Å; G1804-L1807 WeakPolarHBondContact O-CA 3.37Å; G1804-L1807 WeakPolarHBondContact O-CB 3.39Å; G1804-L1807 PolarHBondContact O-N 2.63Å; G1804-L1807 VanDerWaalsContact O-N 3.16Å; M1805-L1807 VanDerWaalsContact C-N 3.35Å; L1807-R1810 CarbonylContact O-C 3.54Å; L1807-R1810 WeakPolarHBondContact O-CB 3.4Å; L1807-R1810 PolarHBondContact O-N 2.76Å; L1807-F1811 HydrophobicContact CD2-CD2 4.34Å; L1807-F1811 HydrophobicContact CD2-CE2 4.03Å; L1807-F1811 HydrophobicContact CG-CD2 4.21Å; L1807-F1811 HydrophobicContact CG-CE2 4.25Å; L1807-F1811 WeakPolarHBondContact O-CB 3.3Å; L1807-F1811 WeakPolarHBondContact O-CD2 3.49Å; L1807-F1811 PolarHBondContact O-N 3.5Å
1808	E	51	Low	50.7	Low	102 Å²	102	101.5 Å²	101.5	48%	0.477	52%	0.516	S	S	.	.	H	α-helix	trans	-70.8	-36.4	-178.8	-156.1	-154.2	138.5	0	0	112.2	G1804 M1805 F1811 K1812	G1804-E1808 PolarHBondContact O-N 2.65Å; M1805-E1808 PolarHBondContact O-N 3.03Å; E1808-F1811 PolarHBondContact O-N 2.69Å; E1808-K1812 WeakPolarHBondContact O-CB 3.11Å; E1808-K1812 PolarHBondContact O-N 2.8Å; E1808-K1812 IonicContact OE1-NZ 3.81Å; E1808-K1812 PolarHBondContact OE1-NZ 2.89Å
1809	K	53.8	Low	51.3	Low	146 Å²	146	104.7 Å²	104.7	64%	0.635	52%	0.523	S	S	*	.	H	α-helix	trans	-64.3	-42.3	167.4	-91.8	-175.5	176	175.3	0	111.6	M1805 F1811 K1812 E1813	M1805-K1809 WeakPolarHBondContact O-CB 3.15Å; M1805-K1809 PolarHBondContact O-N 3.32Å; K1809-F1811 VanDerWaalsContact C-N 3.3Å; K1809-F1811 PolarHBondContact O-N 3.01Å; K1809-K1812 PolarHBondContact O-N 3.18Å; K1809-E1813 WeakPolarHBondContact O-CB 3.15Å; K1809-E1813 PolarHBondContact O-N 3.08Å
1810	R	54.8	Low	51.9	Low	148 Å²	148	106.6 Å²	106.6	56%	0.558	52%	0.519	S	S	*	.	H	α-helix	trans	-63.2	-38.4	174.2	-70.7	-80.8	175.9	115	13.3	110.1	E1806 L1807 E1813 I1814	E1806-R1810 HydrophobicContact CG-CG 4.15Å; E1806-R1810 WeakPolarHBondContact O-CA 3.21Å; E1806-R1810 WeakPolarHBondContact O-CB 3.37Å; E1806-R1810 WeakPolarHBondContact O-CG 3.32Å; E1806-R1810 PolarHBondContact O-N 2.73Å; E1806-R1810 IonicContact OE1-CZ 3.73Å; E1806-R1810 IonicContact OE1-NE 3.28Å; E1806-R1810 PolarHBondContact OE1-NE 3.1Å; E1806-R1810 IonicContact OE1-NH2 2.73Å; E1806-R1810 PolarHBondContact OE1-NH2 2.83Å; L1807-R1810 CarbonylContact O-C 3.54Å; L1807-R1810 WeakPolarHBondContact O-CB 3.4Å; L1807-R1810 PolarHBondContact O-N 2.76Å; R1810-E1813 CarbonylContact O-C 2.88Å; R1810-E1813 PolarHBondContact O-N 3.2Å; R1810-I1814 HydrophobicContact CB-CD1 4.44Å; R1810-I1814 WeakPolarHBondContact O-CA 3.37Å; R1810-I1814 WeakPolarHBondContact O-CB 3.36Å; R1810-I1814 WeakPolarHBondContact O-CD1 3.24Å; R1810-I1814 WeakPolarHBondContact O-CG1 3.37Å; R1810-I1814 PolarHBondContact O-N 3.13Å
1811	F	58.7	Low	52.3	Low	117 Å²	117	106.4 Å²	106.4	51%	0.513	51%	0.509	S	S	.	.	H	α-helix	trans	-71.3	-34.5	175.5	-95	-74.4	0	0	0	112.4	L1807 E1808 K1809 I1814 D1815	L1807-F1811 HydrophobicContact CD2-CD2 4.34Å; L1807-F1811 HydrophobicContact CD2-CE2 4.03Å; L1807-F1811 HydrophobicContact CG-CD2 4.21Å; L1807-F1811 HydrophobicContact CG-CE2 4.25Å; L1807-F1811 WeakPolarHBondContact O-CB 3.3Å; L1807-F1811 WeakPolarHBondContact O-CD2 3.49Å; L1807-F1811 PolarHBondContact O-N 3.5Å; E1808-F1811 PolarHBondContact O-N 2.69Å; K1809-F1811 VanDerWaalsContact C-N 3.3Å; K1809-F1811 PolarHBondContact O-N 3.01Å; F1811-I1814 CarbonylContact O-C 3.5Å; F1811-I1814 PolarHBondContact O-N 2.97Å; F1811-D1815 WeakPolarHBondContact O-CA 3.2Å; F1811-D1815 VanDerWaalsContact O-CB 3.24Å; F1811-D1815 WeakPolarHBondContact O-CB 3.41Å; F1811-D1815 PolarHBondContact O-N 3.23Å
1812	K	54.3	Low	52.7	Low	115 Å²	115	102.7 Å²	102.7	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-76.7	-29.6	171.6	-82.3	168.5	175.5	159.9	0	113.3	E1808 K1809 N1816	E1808-K1812 WeakPolarHBondContact O-CB 3.11Å; E1808-K1812 PolarHBondContact O-N 2.8Å; E1808-K1812 IonicContact OE1-NZ 3.81Å; E1808-K1812 PolarHBondContact OE1-NZ 2.89Å; K1809-K1812 PolarHBondContact O-N 3.18Å; K1812-N1816 VanDerWaalsContact O-CB 3.28Å; K1812-N1816 WeakPolarHBondContact O-CB 3.4Å; K1812-N1816 PolarHBondContact O-N 3.22Å; K1812-N1816 PolarHBondContact O-ND2 3.09Å
1813	E	60.5	Low	53.6	Low	89 Å²	89	104.7 Å²	104.7	42%	0.416	50%	0.5	S	S	.	.	H	α-helix	trans	-75.1	-32.7	169.5	-168.2	64.8	-134.4	0	0	110.3	K1809 R1810 Q1817 R1820	K1809-E1813 WeakPolarHBondContact O-CB 3.15Å; K1809-E1813 PolarHBondContact O-N 3.08Å; R1810-E1813 CarbonylContact O-C 2.88Å; R1810-E1813 PolarHBondContact O-N 3.2Å; E1813-Q1817 WeakPolarHBondContact O-CA 3.39Å; E1813-Q1817 WeakPolarHBondContact O-CB 3.11Å; E1813-Q1817 WeakPolarHBondContact O-CG 3.23Å; E1813-Q1817 PolarHBondContact O-N 2.89Å; E1813-R1820 IonicContact OE1-NH1 2.69Å; E1813-R1820 PolarHBondContact OE1-NH1 3.35Å
1814	I	59.1	Low	54.6	Low	60 Å²	60	101.5 Å²	101.5	31%	0.308	49%	0.487	S	S	.	.	H	α-helix	trans	-74.7	-30.6	171.9	-75.5	164.1	0	0	0	111.1	R1810 F1811 Q1817 F1818	R1810-I1814 HydrophobicContact CB-CD1 4.44Å; R1810-I1814 WeakPolarHBondContact O-CA 3.37Å; R1810-I1814 WeakPolarHBondContact O-CB 3.36Å; R1810-I1814 WeakPolarHBondContact O-CD1 3.24Å; R1810-I1814 WeakPolarHBondContact O-CG1 3.37Å; R1810-I1814 PolarHBondContact O-N 3.13Å; F1811-I1814 CarbonylContact O-C 3.5Å; F1811-I1814 PolarHBondContact O-N 2.97Å; I1814-Q1817 CarbonylContact O-C 3.57Å; I1814-Q1817 PolarHBondContact O-N 3.17Å; I1814-F1818 HydrophobicContact CG2-CD2 3.49Å; I1814-F1818 VanDerWaalsContact CG2-CD2 3.49Å; I1814-F1818 HydrophobicContact CG2-CE2 3.58Å; I1814-F1818 WeakPolarHBondContact O-CA 3.36Å; I1814-F1818 VanDerWaalsContact O-CB 3.24Å; I1814-F1818 WeakPolarHBondContact O-CB 3.36Å; I1814-F1818 VanDerWaalsContact O-CD2 3.23Å; I1814-F1818 WeakPolarHBondContact O-CD2 3.39Å; I1814-F1818 PolarHBondContact O-N 3.48Å
1815	D	51.8	Low	55.3	Low	87 Å²	87	102.1 Å²	102.1	47%	0.465	48%	0.478	S	S	.	.	H	α-helix	trans	-76.6	-39.6	172.2	-82	-23.6	0	0	0	110.8	F1811 Q1817 F1818 Q1819	F1811-D1815 WeakPolarHBondContact O-CA 3.2Å; F1811-D1815 VanDerWaalsContact O-CB 3.24Å; F1811-D1815 WeakPolarHBondContact O-CB 3.41Å; F1811-D1815 PolarHBondContact O-N 3.23Å; D1815-Q1817 VanDerWaalsContact C-N 3.28Å; D1815-F1818 CarbonylContact O-C 3.51Å; D1815-F1818 PolarHBondContact O-N 2.87Å; D1815-F1818 VanDerWaalsContact O-N 3.16Å; D1815-Q1819 WeakPolarHBondContact O-CB 3.46Å; D1815-Q1819 WeakPolarHBondContact O-CG 3.28Å; D1815-Q1819 PolarHBondContact O-N 3.43Å
1816	N	58	Low	56	Low	76 Å²	76	97.8 Å²	97.8	41%	0.406	46%	0.462	S	S	.	.	H	α-helix	trans	-65.8	-34.8	168	-79.8	-62.4	0	0	0	110.8	K1812 R1820	K1812-N1816 VanDerWaalsContact O-CB 3.28Å; K1812-N1816 WeakPolarHBondContact O-CB 3.4Å; K1812-N1816 PolarHBondContact O-N 3.22Å; K1812-N1816 PolarHBondContact O-ND2 3.09Å; N1816-R1820 VanDerWaalsContact O-CB 3.27Å; N1816-R1820 WeakPolarHBondContact O-CB 3.27Å; N1816-R1820 WeakPolarHBondContact O-CD 3.39Å; N1816-R1820 WeakPolarHBondContact O-CG 3.19Å; N1816-R1820 PolarHBondContact O-N 2.97Å
1817	Q	53	Low	57.1	Low	83 Å²	83	98.6 Å²	98.6	39%	0.388	46%	0.462	S	S	.	.	H	α-helix	trans	-73.2	-26.3	169.5	-74.3	168.5	29.9	0	0	112.1	E1813 I1814 D1815 R1820 F1821	E1813-Q1817 WeakPolarHBondContact O-CA 3.39Å; E1813-Q1817 WeakPolarHBondContact O-CB 3.11Å; E1813-Q1817 WeakPolarHBondContact O-CG 3.23Å; E1813-Q1817 PolarHBondContact O-N 2.89Å; I1814-Q1817 CarbonylContact O-C 3.57Å; I1814-Q1817 PolarHBondContact O-N 3.17Å; D1815-Q1817 VanDerWaalsContact C-N 3.28Å; Q1817-R1820 CarbonylContact O-C 3.48Å; Q1817-F1821 HydrophobicContact CB-CD2 4.47Å; Q1817-F1821 WeakPolarHBondContact O-CA 3.16Å; Q1817-F1821 WeakPolarHBondContact O-CB 3.14Å; Q1817-F1821 WeakPolarHBondContact O-CD2 3.46Å; Q1817-F1821 WeakPolarHBondContact O-CG 3.45Å; Q1817-F1821 PolarHBondContact O-N 2.96Å
1818	F	51.1	Low	58	Low	116 Å²	116	97.9 Å²	97.9	51%	0.509	46%	0.458	S	S	.	.	H	α-helix	trans	-81.7	-29.6	175.2	-94.9	-60.1	0	0	0	111.8	I1814 D1815 F1821 N1822	I1814-F1818 HydrophobicContact CG2-CD2 3.49Å; I1814-F1818 VanDerWaalsContact CG2-CD2 3.49Å; I1814-F1818 HydrophobicContact CG2-CE2 3.58Å; I1814-F1818 WeakPolarHBondContact O-CA 3.36Å; I1814-F1818 VanDerWaalsContact O-CB 3.24Å; I1814-F1818 WeakPolarHBondContact O-CB 3.36Å; I1814-F1818 VanDerWaalsContact O-CD2 3.23Å; I1814-F1818 WeakPolarHBondContact O-CD2 3.39Å; I1814-F1818 PolarHBondContact O-N 3.48Å; D1815-F1818 CarbonylContact O-C 3.51Å; D1815-F1818 PolarHBondContact O-N 2.87Å; D1815-F1818 VanDerWaalsContact O-N 3.16Å; F1818-F1821 HydrophobicContact CD1-CB 4.41Å; F1818-F1821 CarbonylContact O-C 3.27Å; F1818-F1821 PolarHBondContact O-N 3.48Å; F1818-N1822 VanDerWaalsContact O-CB 3.27Å; F1818-N1822 WeakPolarHBondContact O-CB 3.24Å; F1818-N1822 PolarHBondContact O-N 3.23Å; F1818-N1822 PolarHBondContact O-ND2 3.2Å; F1818-N1822 VanDerWaalsContact O-ND2 3.08Å
1819	Q	55.6	Low	58.9	Low	138 Å²	138	98 Å²	98	65%	0.645	46%	0.462	S	S	*	.	H	α-helix	trans	-73.2	-36.4	166.2	-71.9	-174.2	2.2	0	0	110.9	D1815 N1822 D1823	D1815-Q1819 WeakPolarHBondContact O-CB 3.46Å; D1815-Q1819 WeakPolarHBondContact O-CG 3.28Å; D1815-Q1819 PolarHBondContact O-N 3.43Å; Q1819-N1822 PolarHBondContact O-N 3.45Å; Q1819-D1823 PolarHBondContact O-N 3.08Å
1820	R	57.4	Low	59.9	Low	143 Å²	143	95.1 Å²	95.1	54%	0.54	45%	0.453	S	S	.	.	H	α-helix	trans	-70.7	-30.8	168.2	-70.4	167.1	-168.7	156	7	112.5	E1813 N1816 Q1817 D1823 V1824	E1813-R1820 IonicContact OE1-NH1 2.69Å; E1813-R1820 PolarHBondContact OE1-NH1 3.35Å; N1816-R1820 VanDerWaalsContact O-CB 3.27Å; N1816-R1820 WeakPolarHBondContact O-CB 3.27Å; N1816-R1820 WeakPolarHBondContact O-CD 3.39Å; N1816-R1820 WeakPolarHBondContact O-CG 3.19Å; N1816-R1820 PolarHBondContact O-N 2.97Å; Q1817-R1820 CarbonylContact O-C 3.48Å; R1820-D1823 CarbonylContact O-C 3.48Å; R1820-D1823 PolarHBondContact O-N 3.27Å; R1820-V1824 WeakPolarHBondContact O-CA 3.41Å; R1820-V1824 WeakPolarHBondContact O-CB 3.12Å; R1820-V1824 WeakPolarHBondContact O-CG2 3.49Å; R1820-V1824 PolarHBondContact O-N 3.04Å
1821	F	54.1	Low	60.8	Low	109 Å²	109	91.2 Å²	91.2	48%	0.478	45%	0.446	S	S	.	.	H	α-helix	trans	-75.3	-28.7	171.1	-91.6	-71	0	0	0	109.5	Q1817 F1818 V1824 D1825	Q1817-F1821 HydrophobicContact CB-CD2 4.47Å; Q1817-F1821 WeakPolarHBondContact O-CA 3.16Å; Q1817-F1821 WeakPolarHBondContact O-CB 3.14Å; Q1817-F1821 WeakPolarHBondContact O-CD2 3.46Å; Q1817-F1821 WeakPolarHBondContact O-CG 3.45Å; Q1817-F1821 PolarHBondContact O-N 2.96Å; F1818-F1821 HydrophobicContact CD1-CB 4.41Å; F1818-F1821 CarbonylContact O-C 3.27Å; F1818-F1821 PolarHBondContact O-N 3.48Å; F1821-V1824 CarbonylContact O-C 3.34Å; F1821-V1824 PolarHBondContact O-N 2.93Å; F1821-D1825 VanDerWaalsContact O-CA 3.28Å; F1821-D1825 WeakPolarHBondContact O-CA 3.42Å; F1821-D1825 WeakPolarHBondContact O-CB 3.48Å; F1821-D1825 PolarHBondContact O-N 3.24Å
1822	N	53.4	Low	61.4	Low	100 Å²	100	88.6 Å²	88.6	54%	0.535	44%	0.44	S	S	.	.	H	α-helix	trans	-75.2	-32.6	169.3	-73.7	-34.2	0	0	0	112	F1818 Q1819 S1826	F1818-N1822 VanDerWaalsContact O-CB 3.27Å; F1818-N1822 WeakPolarHBondContact O-CB 3.24Å; F1818-N1822 PolarHBondContact O-N 3.23Å; F1818-N1822 PolarHBondContact O-ND2 3.2Å; F1818-N1822 VanDerWaalsContact O-ND2 3.08Å; Q1819-N1822 PolarHBondContact O-N 3.45Å; N1822-S1826 VanDerWaalsContact O-CB 3.27Å; N1822-S1826 WeakPolarHBondContact O-CB 3.31Å; N1822-S1826 PolarHBondContact O-N 2.74Å; N1822-S1826 PolarHBondContact O-OG 3.49Å
1823	D	61.5	Low	62.1	Low	63 Å²	63	89.1 Å²	89.1	34%	0.337	44%	0.444	S	S	.	.	H	α-helix	trans	-74	-25.2	167.9	-178.5	81.9	0	0	0	112	R1766 Q1819 R1820 S1826 R1827	R1766-D1823 IonicContact NH2-OD2 2.68Å; R1766-D1823 PolarHBondContact NH2-OD2 2.96Å; Q1819-D1823 PolarHBondContact O-N 3.08Å; R1820-D1823 CarbonylContact O-C 3.48Å; R1820-D1823 PolarHBondContact O-N 3.27Å; D1823-S1826 WeakPolarHBondContact CA-OG 3.35Å; D1823-S1826 PolarHBondContact O-OG 2.67Å; D1823-R1827 VanDerWaalsContact CG-NE 3.31Å; D1823-R1827 VanDerWaalsContact O-CB 3.24Å; D1823-R1827 WeakPolarHBondContact O-CB 3.47Å; D1823-R1827 WeakPolarHBondContact O-CD 3.34Å; D1823-R1827 WeakPolarHBondContact O-CG 3.45Å; D1823-R1827 PolarHBondContact O-N 3.46Å; D1823-R1827 PolarHBondContact O-NE 3.23Å; D1823-R1827 IonicContact OD1-CZ 3.98Å; D1823-R1827 IonicContact OD1-NE 2.65Å; D1823-R1827 PolarHBondContact OD1-NE 3.07Å; D1823-R1827 IonicContact OD1-NH2 3.81Å; D1823-R1827 PolarHBondContact OD1-NH2 3.15Å; D1823-R1827 IonicContact OD2-CZ 2.98Å; D1823-R1827 IonicContact OD2-NE 2.64Å; D1823-R1827 PolarHBondContact OD2-NE 3.04Å; D1823-R1827 IonicContact OD2-NH2 3.32Å; D1823-R1827 PolarHBondContact OD2-NH2 3.03Å; D1823-R1827 VanDerWaalsContact OD2-NH2 3.08Å
1824	V	64.1	Low	62.8	Low	63 Å²	63	90.3 Å²	90.3	38%	0.382	45%	0.453	S	S	.	.	H	α-helix	trans	-86.8	-25.5	172.5	165.1	0	0	0	0	111.6	R1820 F1821 R1827 L1828	R1820-V1824 WeakPolarHBondContact O-CA 3.41Å; R1820-V1824 WeakPolarHBondContact O-CB 3.12Å; R1820-V1824 WeakPolarHBondContact O-CG2 3.49Å; R1820-V1824 PolarHBondContact O-N 3.04Å; F1821-V1824 CarbonylContact O-C 3.34Å; F1821-V1824 PolarHBondContact O-N 2.93Å; V1824-R1827 CarbonylContact O-C 3.37Å; V1824-L1828 VanDerWaalsContact O-CA 3.31Å; V1824-L1828 WeakPolarHBondContact O-CA 3.39Å; V1824-L1828 WeakPolarHBondContact O-CB 3.21Å; V1824-L1828 PolarHBondContact O-N 3.35Å
1825	D	61	Low	63.5	Low	62 Å²	62	92.1 Å²	92.1	33%	0.332	46%	0.462	S	S	.	.	H	α-helix	trans	-91.4	-31.1	-179.3	-72.3	-14.4	0	0	0	110.6	F1821 L1828 N1829	F1821-D1825 VanDerWaalsContact O-CA 3.28Å; F1821-D1825 WeakPolarHBondContact O-CA 3.42Å; F1821-D1825 WeakPolarHBondContact O-CB 3.48Å; F1821-D1825 PolarHBondContact O-N 3.24Å; D1825-L1828 PolarHBondContact O-N 3.23Å; D1825-N1829 VanDerWaalsContact O-CB 3.22Å; D1825-N1829 WeakPolarHBondContact O-CB 3.46Å; D1825-N1829 PolarHBondContact O-N 3.46Å; D1825-N1829 PolarHBondContact O-ND2 2.84Å; D1825-N1829 VanDerWaalsContact O-ND2 3.08Å
1826	S	65.2	Low	64.5	Low	54 Å²	54	91.6 Å²	91.6	38%	0.378	46%	0.462	S	S	.	.	H	α-helix	trans	-62.3	-50.5	159.5	49.7	0	0	0	0	109.7	N1822 D1823 L1828 N1829 D1830	N1822-S1826 VanDerWaalsContact O-CB 3.27Å; N1822-S1826 WeakPolarHBondContact O-CB 3.31Å; N1822-S1826 PolarHBondContact O-N 2.74Å; N1822-S1826 PolarHBondContact O-OG 3.49Å; D1823-S1826 WeakPolarHBondContact CA-OG 3.35Å; D1823-S1826 PolarHBondContact O-OG 2.67Å; S1826-L1828 VanDerWaalsContact C-N 3.27Å; S1826-L1828 PolarHBondContact O-N 3.47Å; S1826-N1829 CarbonylContact O-C 3.55Å; S1826-N1829 WeakPolarHBondContact O-CB 2.92Å; S1826-N1829 PolarHBondContact O-N 3.32Å; S1826-N1829 VanDerWaalsContact O-N 3.14Å; S1826-D1830 PolarHBondContact O-N 3.13Å
1827	R	71.1	Confident	65.3	Low	102 Å²	102	91.9 Å²	91.9	39%	0.385	46%	0.464	S	S	.	.	H	α-helix	trans	-67.1	-21.2	174.1	-69.2	173	-152.6	-99.5	0.7	114.8	R1766 D1823 V1824 D1830 V1831	R1766-R1827 VanDerWaalsContact NH2-CD 3.31Å; D1823-R1827 VanDerWaalsContact CG-NE 3.31Å; D1823-R1827 VanDerWaalsContact O-CB 3.24Å; D1823-R1827 WeakPolarHBondContact O-CB 3.47Å; D1823-R1827 WeakPolarHBondContact O-CD 3.34Å; D1823-R1827 WeakPolarHBondContact O-CG 3.45Å; D1823-R1827 PolarHBondContact O-N 3.46Å; D1823-R1827 PolarHBondContact O-NE 3.23Å; D1823-R1827 IonicContact OD1-CZ 3.98Å; D1823-R1827 IonicContact OD1-NE 2.65Å; D1823-R1827 PolarHBondContact OD1-NE 3.07Å; D1823-R1827 IonicContact OD1-NH2 3.81Å; D1823-R1827 PolarHBondContact OD1-NH2 3.15Å; D1823-R1827 IonicContact OD2-CZ 2.98Å; D1823-R1827 IonicContact OD2-NE 2.64Å; D1823-R1827 PolarHBondContact OD2-NE 3.04Å; D1823-R1827 IonicContact OD2-NH2 3.32Å; D1823-R1827 PolarHBondContact OD2-NH2 3.03Å; D1823-R1827 VanDerWaalsContact OD2-NH2 3.08Å; V1824-R1827 CarbonylContact O-C 3.37Å; R1827-D1830 WeakPolarHBondContact CA-OD2 3.24Å; R1827-V1831 WeakPolarHBondContact O-CB 3.24Å; R1827-V1831 WeakPolarHBondContact O-CG2 3.43Å; R1827-V1831 PolarHBondContact O-N 3.35Å
1828	L	69.4	Low	66.3	Low	82 Å²	82	92.5 Å²	92.5	43%	0.429	47%	0.469	S	S	.	.	H	α-helix	trans	-88.5	-23.7	175	-177.6	64.1	0	0	0	109.6	V1824 D1825 S1826 T1832	V1824-L1828 VanDerWaalsContact O-CA 3.31Å; V1824-L1828 WeakPolarHBondContact O-CA 3.39Å; V1824-L1828 WeakPolarHBondContact O-CB 3.21Å; V1824-L1828 PolarHBondContact O-N 3.35Å; D1825-L1828 PolarHBondContact O-N 3.23Å; S1826-L1828 VanDerWaalsContact C-N 3.27Å; S1826-L1828 PolarHBondContact O-N 3.47Å; L1828-T1832 WeakPolarHBondContact O-CA 3.49Å; L1828-T1832 WeakPolarHBondContact O-CB 3.42Å; L1828-T1832 PolarHBondContact O-N 2.86Å; L1828-T1832 PolarHBondContact O-OG1 2.87Å
1829	N	69.8	Low	67.3	Low	104 Å²	104	90.6 Å²	90.6	56%	0.556	47%	0.47	S	S	*	.	H	α-helix	trans	-69.7	-44.7	161.7	-70.9	-28.1	0	0	0	109.6	D1825 S1826 V1831 T1832 Q1833	D1825-N1829 VanDerWaalsContact O-CB 3.22Å; D1825-N1829 WeakPolarHBondContact O-CB 3.46Å; D1825-N1829 PolarHBondContact O-N 3.46Å; D1825-N1829 PolarHBondContact O-ND2 2.84Å; D1825-N1829 VanDerWaalsContact O-ND2 3.08Å; S1826-N1829 CarbonylContact O-C 3.55Å; S1826-N1829 WeakPolarHBondContact O-CB 2.92Å; S1826-N1829 PolarHBondContact O-N 3.32Å; S1826-N1829 VanDerWaalsContact O-N 3.14Å; N1829-V1831 PolarHBondContact O-N 2.69Å; N1829-T1832 PolarHBondContact O-N 3.24Å; N1829-Q1833 WeakPolarHBondContact O-CB 3.31Å; N1829-Q1833 VanDerWaalsContact O-CG 3.31Å; N1829-Q1833 WeakPolarHBondContact O-CG 3.47Å; N1829-Q1833 PolarHBondContact O-N 2.97Å
1830	D	74	Confident	68	Low	86 Å²	86	89.8 Å²	89.8	46%	0.46	47%	0.466	S	S	.	.	H	α-helix	trans	-58.4	-45.7	171.9	-57.3	-25.1	0	0	0	111.2	S1826 R1827 L1834	S1826-D1830 PolarHBondContact O-N 3.13Å; R1827-D1830 WeakPolarHBondContact CA-OD2 3.24Å; D1830-L1834 WeakPolarHBondContact O-CB 3.47Å; D1830-L1834 VanDerWaalsContact O-CG 3.3Å; D1830-L1834 WeakPolarHBondContact O-CG 3.38Å; D1830-L1834 PolarHBondContact O-N 2.8Å
1831	V	73	Confident	69	Low	67 Å²	67	87.1 Å²	87.1	41%	0.406	47%	0.466	S	S	.	.	H	α-helix	trans	-76.3	-27.4	179.4	166.5	0	0	0	0	112.1	R1827 N1829 L1834 L1835	R1827-V1831 WeakPolarHBondContact O-CB 3.24Å; R1827-V1831 WeakPolarHBondContact O-CG2 3.43Å; R1827-V1831 PolarHBondContact O-N 3.35Å; N1829-V1831 PolarHBondContact O-N 2.69Å; V1831-L1834 CarbonylContact O-C 3.59Å; V1831-L1834 PolarHBondContact O-N 2.69Å; V1831-L1835 HydrophobicContact CG1-CD1 3.9Å; V1831-L1835 HydrophobicContact CG1-CG 4.32Å; V1831-L1835 WeakPolarHBondContact O-CB 3.26Å; V1831-L1835 WeakPolarHBondContact O-CG 3.49Å; V1831-L1835 PolarHBondContact O-N 2.9Å
1832	T	71.7	Confident	69.8	Low	62 Å²	62	86.4 Å²	86.4	38%	0.38	47%	0.466	S	S	.	.	H	α-helix	trans	-73.9	-41.7	172.3	-64.6	0	0	0	0	109.9	L1828 N1829 L1834 L1835 T1836	L1828-T1832 WeakPolarHBondContact O-CA 3.49Å; L1828-T1832 WeakPolarHBondContact O-CB 3.42Å; L1828-T1832 PolarHBondContact O-N 2.86Å; L1828-T1832 PolarHBondContact O-OG1 2.87Å; N1829-T1832 PolarHBondContact O-N 3.24Å; T1832-L1834 VanDerWaalsContact C-N 3.33Å; T1832-L1834 PolarHBondContact O-N 2.88Å; T1832-L1835 CarbonylContact O-C 3.28Å; T1832-L1835 PolarHBondContact O-N 2.67Å; T1832-L1835 VanDerWaalsContact O-N 3.09Å; T1832-T1836 HydrophobicContact CG2-CG2 4.39Å; T1832-T1836 WeakPolarHBondContact O-CG2 3.23Å; T1832-T1836 PolarHBondContact O-N 3.05Å; T1832-T1836 PolarHBondContact O-OG1 3.46Å; T1832-T1836 VanDerWaalsContact O-OG1 3.13Å
1833	Q	69.7	Low	70.7	Confident	125 Å²	125	84.7 Å²	84.7	58%	0.584	46%	0.462	S	S	*	.	H	α-helix	trans	-59.2	-43.2	168.6	-74.6	179	-12.4	0	0	110.9	N1829 L1835 T1836 N1837	N1829-Q1833 WeakPolarHBondContact O-CB 3.31Å; N1829-Q1833 VanDerWaalsContact O-CG 3.31Å; N1829-Q1833 WeakPolarHBondContact O-CG 3.47Å; N1829-Q1833 PolarHBondContact O-N 2.97Å; Q1833-L1835 VanDerWaalsContact C-N 3.33Å; Q1833-L1835 PolarHBondContact O-N 3.01Å; Q1833-T1836 WeakPolarHBondContact CA-OG1 3.41Å; Q1833-T1836 PolarHBondContact O-OG1 3.19Å; Q1833-N1837 VanDerWaalsContact O-CB 3.32Å; Q1833-N1837 WeakPolarHBondContact O-CB 3.49Å; Q1833-N1837 PolarHBondContact O-N 3.5Å; Q1833-N1837 VanDerWaalsContact O-N 3.1Å; Q1833-N1837 PolarHBondContact O-ND2 3.27Å; Q1833-N1837 PolarHBondContact O-OD1 3.07Å
1834	L	75.7	Confident	71.2	Confident	115 Å²	115	86 Å²	86	60%	0.602	47%	0.469	S	S	*	.	H	α-helix	trans	-64.8	-33.9	172.4	-75.5	164.1	0	0	0	112.9	D1830 V1831 T1832 L1838	D1830-L1834 WeakPolarHBondContact O-CB 3.47Å; D1830-L1834 VanDerWaalsContact O-CG 3.3Å; D1830-L1834 WeakPolarHBondContact O-CG 3.38Å; D1830-L1834 PolarHBondContact O-N 2.8Å; V1831-L1834 CarbonylContact O-C 3.59Å; V1831-L1834 PolarHBondContact O-N 2.69Å; T1832-L1834 VanDerWaalsContact C-N 3.33Å; T1832-L1834 PolarHBondContact O-N 2.88Å; L1834-L1838 WeakPolarHBondContact O-CB 3.25Å; L1834-L1838 PolarHBondContact O-N 3.39Å
1835	L	73.6	Confident	71.7	Confident	98 Å²	98	86.6 Å²	86.6	51%	0.513	47%	0.473	S	S	.	.	H	α-helix	trans	-78.4	-34.3	178.9	-82.1	167.7	0	0	0	113.3	V1831 T1832 Q1833 L1838 S1839	V1831-L1835 HydrophobicContact CG1-CD1 3.9Å; V1831-L1835 HydrophobicContact CG1-CG 4.32Å; V1831-L1835 WeakPolarHBondContact O-CB 3.26Å; V1831-L1835 WeakPolarHBondContact O-CG 3.49Å; V1831-L1835 PolarHBondContact O-N 2.9Å; T1832-L1835 CarbonylContact O-C 3.28Å; T1832-L1835 PolarHBondContact O-N 2.67Å; T1832-L1835 VanDerWaalsContact O-N 3.09Å; Q1833-L1835 VanDerWaalsContact C-N 3.33Å; Q1833-L1835 PolarHBondContact O-N 3.01Å; L1835-L1838 PolarHBondContact O-N 2.96Å; L1835-S1839 WeakPolarHBondContact O-CB 3.48Å; L1835-S1839 PolarHBondContact O-N 2.89Å
1836	T	72.2	Confident	72.1	Confident	75 Å²	75	86.8 Å²	86.8	46%	0.46	48%	0.476	S	S	.	.	H	α-helix	trans	-63.9	-49.3	170.9	48.9	0	0	0	0	109.1	T1832 Q1833 L1838 S1839 E1840	T1832-T1836 HydrophobicContact CG2-CG2 4.39Å; T1832-T1836 WeakPolarHBondContact O-CG2 3.23Å; T1832-T1836 PolarHBondContact O-N 3.05Å; T1832-T1836 PolarHBondContact O-OG1 3.46Å; T1832-T1836 VanDerWaalsContact O-OG1 3.13Å; Q1833-T1836 WeakPolarHBondContact CA-OG1 3.41Å; Q1833-T1836 PolarHBondContact O-OG1 3.19Å; T1836-L1838 VanDerWaalsContact C-N 3.28Å; T1836-L1838 PolarHBondContact O-N 3.31Å; T1836-S1839 WeakPolarHBondContact O-CB 3.41Å; T1836-S1839 PolarHBondContact O-N 3.2Å; T1836-S1839 VanDerWaalsContact O-N 3.16Å; T1836-E1840 WeakPolarHBondContact O-CB 3.5Å; T1836-E1840 PolarHBondContact O-N 3.49Å
1837	N	74.2	Confident	72.4	Confident	82 Å²	82	88.6 Å²	88.6	44%	0.439	48%	0.479	S	S	.	.	H	α-helix	trans	-63.2	-34.7	178.9	-59.5	6	0	0	0	111.6	Q1833 V1841	Q1833-N1837 VanDerWaalsContact O-CB 3.32Å; Q1833-N1837 WeakPolarHBondContact O-CB 3.49Å; Q1833-N1837 PolarHBondContact O-N 3.5Å; Q1833-N1837 VanDerWaalsContact O-N 3.1Å; Q1833-N1837 PolarHBondContact O-ND2 3.27Å; Q1833-N1837 PolarHBondContact O-OD1 3.07Å; N1837-V1841 WeakPolarHBondContact O-CG2 3.48Å; N1837-V1841 PolarHBondContact O-N 2.84Å
1838	L	74.1	Confident	72.6	Confident	97 Å²	97	87 Å²	87	51%	0.508	48%	0.481	S	S	.	.	H	α-helix	trans	-79.2	-31.1	176.5	-168.4	146.3	0	0	0	112.7	L1834 L1835 T1836 V1841 I1842	L1834-L1838 WeakPolarHBondContact O-CB 3.25Å; L1834-L1838 PolarHBondContact O-N 3.39Å; L1835-L1838 PolarHBondContact O-N 2.96Å; T1836-L1838 VanDerWaalsContact C-N 3.28Å; T1836-L1838 PolarHBondContact O-N 3.31Å; L1838-V1841 PolarHBondContact O-N 3.19Å; L1838-I1842 HydrophobicContact CD2-CD1 3.59Å; L1838-I1842 HydrophobicContact CD2-CG1 4.22Å; L1838-I1842 WeakPolarHBondContact O-CG1 3.5Å; L1838-I1842 PolarHBondContact O-N 2.94Å
1839	S	72.6	Confident	72.5	Confident	76 Å²	76	88.8 Å²	88.8	53%	0.531	49%	0.487	S	S	.	.	H	α-helix	trans	-65.8	-40.7	171.5	-175.9	0	0	0	0	111.3	L1835 T1836 I1842 S1843	L1835-S1839 WeakPolarHBondContact O-CB 3.48Å; L1835-S1839 PolarHBondContact O-N 2.89Å; T1836-S1839 WeakPolarHBondContact O-CB 3.41Å; T1836-S1839 PolarHBondContact O-N 3.2Å; T1836-S1839 VanDerWaalsContact O-N 3.16Å; S1839-I1842 PolarHBondContact O-N 3.45Å; S1839-S1843 WeakPolarHBondContact O-CB 2.87Å; S1839-S1843 PolarHBondContact O-N 3.24Å
1840	E	71	Confident	72.7	Confident	120 Å²	120	88.9 Å²	88.9	56%	0.561	48%	0.484	S	S	*	.	H	α-helix	trans	-61.6	-45.8	173.5	-173.6	177.2	-156.1	0	0	111.3	T1836 I1842 S1843 N1844	T1836-E1840 WeakPolarHBondContact O-CB 3.5Å; T1836-E1840 PolarHBondContact O-N 3.49Å; E1840-I1842 PolarHBondContact O-N 2.84Å; E1840-S1843 WeakPolarHBondContact O-CB 3.25Å; E1840-S1843 PolarHBondContact O-N 2.88Å; E1840-N1844 PolarHBondContact O-N 3.11Å; E1840-N1844 PolarHBondContact O-ND2 3.11Å
1841	V	77.7	Confident	72.4	Confident	88 Å²	88	90.3 Å²	90.3	53%	0.533	48%	0.483	S	S	.	.	H	α-helix	trans	-60.4	-42.4	172.4	169.4	0	0	0	0	112.1	N1837 L1838 N1844 V1845	N1837-V1841 WeakPolarHBondContact O-CG2 3.48Å; N1837-V1841 PolarHBondContact O-N 2.84Å; L1838-V1841 PolarHBondContact O-N 3.19Å; V1841-N1844 PolarHBondContact O-N 3.45Å; V1841-V1845 VanDerWaalsContact O-CG2 3.32Å; V1841-V1845 WeakPolarHBondContact O-CG2 3.3Å; V1841-V1845 PolarHBondContact O-N 3.33Å
1842	I	70.8	Confident	72.3	Confident	93 Å²	93	91.4 Å²	91.4	48%	0.477	49%	0.485	S	S	.	.	H	α-helix	trans	-64.8	-41.3	176.1	-73.1	174.7	0	0	0	111.2	L1838 S1839 E1840 N1844 V1845 T1846	L1838-I1842 HydrophobicContact CD2-CD1 3.59Å; L1838-I1842 HydrophobicContact CD2-CG1 4.22Å; L1838-I1842 WeakPolarHBondContact O-CG1 3.5Å; L1838-I1842 PolarHBondContact O-N 2.94Å; S1839-I1842 PolarHBondContact O-N 3.45Å; E1840-I1842 PolarHBondContact O-N 2.84Å; I1842-N1844 PolarHBondContact O-N 3.42Å; I1842-V1845 PolarHBondContact O-N 3.38Å; I1842-T1846 HydrophobicContact CG2-CG2 4.26Å; I1842-T1846 WeakPolarHBondContact O-CG2 3.49Å; I1842-T1846 PolarHBondContact O-N 2.94Å; I1842-T1846 PolarHBondContact O-OG1 2.9Å
1843	S	72.2	Confident	72	Confident	65 Å²	65	93.6 Å²	93.6	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-53.5	-55.1	175.3	-172	0	0	0	0	110.3	S1839 E1840 V1845 T1846 E1847	S1839-S1843 WeakPolarHBondContact O-CB 2.87Å; S1839-S1843 PolarHBondContact O-N 3.24Å; E1840-S1843 WeakPolarHBondContact O-CB 3.25Å; E1840-S1843 PolarHBondContact O-N 2.88Å; S1843-V1845 VanDerWaalsContact C-N 3.29Å; S1843-V1845 PolarHBondContact O-N 3.18Å; S1843-T1846 PolarHBondContact O-N 3.42Å; S1843-T1846 PolarHBondContact O-OG1 3.46Å; S1843-E1847 PolarHBondContact O-N 3.06Å
1844	N	72.8	Confident	71.8	Confident	89 Å²	89	95.2 Å²	95.2	48%	0.476	49%	0.494	S	S	.	.	H	α-helix	trans	-61.7	-34.3	-179.2	-64.4	-16.9	0	0	0	112.6	E1840 V1841 I1842 T1848	E1840-N1844 PolarHBondContact O-N 3.11Å; E1840-N1844 PolarHBondContact O-ND2 3.11Å; V1841-N1844 PolarHBondContact O-N 3.45Å; I1842-N1844 PolarHBondContact O-N 3.42Å; N1844-T1848 WeakPolarHBondContact O-CG2 3.39Å; N1844-T1848 PolarHBondContact O-N 3.3Å; N1844-T1848 VanDerWaalsContact O-N 3.11Å; N1844-T1848 PolarHBondContact O-OG1 2.87Å
1845	V	73	Confident	71.1	Confident	77 Å²	77	96 Å²	96	47%	0.467	50%	0.495	S	S	.	.	H	α-helix	trans	-71.5	-38.5	174	170.6	0	0	0	0	112.5	V1841 I1842 S1843 T1848 Q1849	V1841-V1845 VanDerWaalsContact O-CG2 3.32Å; V1841-V1845 WeakPolarHBondContact O-CG2 3.3Å; V1841-V1845 PolarHBondContact O-N 3.33Å; I1842-V1845 PolarHBondContact O-N 3.38Å; S1843-V1845 VanDerWaalsContact C-N 3.29Å; S1843-V1845 PolarHBondContact O-N 3.18Å; V1845-T1848 WeakPolarHBondContact CA-OG1 3.41Å; V1845-T1848 PolarHBondContact O-OG1 2.98Å; V1845-Q1849 PolarHBondContact O-N 3.47Å; V1845-Q1849 VanDerWaalsContact O-N 3.09Å
1846	T	71	Confident	70.4	Confident	66 Å²	66	96.3 Å²	96.3	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-71	-37	176.3	57.7	0	0	0	0	112.2	I1842 S1843 Q1849 Q1850	I1842-T1846 HydrophobicContact CG2-CG2 4.26Å; I1842-T1846 WeakPolarHBondContact O-CG2 3.49Å; I1842-T1846 PolarHBondContact O-N 2.94Å; I1842-T1846 PolarHBondContact O-OG1 2.9Å; S1843-T1846 PolarHBondContact O-N 3.42Å; S1843-T1846 PolarHBondContact O-OG1 3.46Å; T1846-Q1849 PolarHBondContact O-N 2.99Å; T1846-Q1850 WeakPolarHBondContact O-CG 3.25Å; T1846-Q1850 PolarHBondContact O-N 3.16Å
1847	E	71.4	Confident	69.6	Low	92 Å²	92	99.7 Å²	99.7	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-69.1	-38.7	178.3	-151.6	-167.1	-151.6	0	0	111.6	S1843 Q1850 R1851	S1843-E1847 PolarHBondContact O-N 3.06Å; E1847-Q1850 PolarHBondContact O-N 3.34Å; E1847-R1851 VanDerWaalsContact CD-NH1 3.29Å; E1847-R1851 WeakPolarHBondContact O-CG 3.49Å; E1847-R1851 PolarHBondContact O-N 3.04Å; E1847-R1851 IonicContact OE1-NH2 3.49Å; E1847-R1851 PolarHBondContact OE1-NH2 2.93Å; E1847-R1851 IonicContact OE2-CZ 3.89Å; E1847-R1851 IonicContact OE2-NH1 3.6Å; E1847-R1851 PolarHBondContact OE2-NH1 2.87Å; E1847-R1851 IonicContact OE2-NH2 3.31Å; E1847-R1851 PolarHBondContact OE2-NH2 3.2Å
1848	T	74.6	Confident	68.7	Low	69 Å²	69	102.7 Å²	102.7	42%	0.423	52%	0.523	S	S	.	.	H	α-helix	trans	-66.6	-37.3	172.1	46	0	0	0	0	112.8	N1844 V1845 Q1850 R1851 I1852	N1844-T1848 WeakPolarHBondContact O-CG2 3.39Å; N1844-T1848 PolarHBondContact O-N 3.3Å; N1844-T1848 VanDerWaalsContact O-N 3.11Å; N1844-T1848 PolarHBondContact O-OG1 2.87Å; V1845-T1848 WeakPolarHBondContact CA-OG1 3.41Å; V1845-T1848 PolarHBondContact O-OG1 2.98Å; T1848-Q1850 PolarHBondContact O-N 3.47Å; T1848-R1851 PolarHBondContact O-N 2.96Å; T1848-I1852 WeakPolarHBondContact O-CG1 3.25Å; T1848-I1852 PolarHBondContact O-N 3.1Å; T1848-I1852 VanDerWaalsContact O-N 3.09Å
1849	Q	67.3	Low	66.7	Low	118 Å²	118	104.8 Å²	104.8	55%	0.551	53%	0.534	S	S	*	.	H	α-helix	trans	-62	-40	170.4	-78.1	-167.7	-13.7	0	0	112.7	V1845 T1846 I1852 I1853	V1845-Q1849 PolarHBondContact O-N 3.47Å; V1845-Q1849 VanDerWaalsContact O-N 3.09Å; T1846-Q1849 PolarHBondContact O-N 2.99Å; Q1849-I1852 PolarHBondContact O-N 2.78Å; Q1849-I1853 WeakPolarHBondContact O-CG1 3.13Å; Q1849-I1853 PolarHBondContact O-N 3.27Å
1850	Q	73.7	Confident	65.1	Low	106 Å²	106	106.5 Å²	106.5	50%	0.495	54%	0.543	S	S	.	.	H	α-helix	trans	-67.3	-34.6	176.1	-71.3	-171.4	16.4	0	0	113	T1846 E1847 T1848 R1854	T1846-Q1850 WeakPolarHBondContact O-CG 3.25Å; T1846-Q1850 PolarHBondContact O-N 3.16Å; E1847-Q1850 PolarHBondContact O-N 3.34Å; T1848-Q1850 PolarHBondContact O-N 3.47Å; Q1850-R1854 WeakPolarHBondContact O-CG 3.33Å; Q1850-R1854 PolarHBondContact O-N 3.2Å
1851	R	67.6	Low	63.1	Low	117 Å²	117	107.7 Å²	107.7	44%	0.442	56%	0.558	S	S	.	*	H	α-helix	trans	-60.7	-47.6	171.1	-71.5	179.5	-178.9	95.9	3.9	111.3	E1847 T1848 I1853 R1854 Q1855	E1847-R1851 VanDerWaalsContact CD-NH1 3.29Å; E1847-R1851 WeakPolarHBondContact O-CG 3.49Å; E1847-R1851 PolarHBondContact O-N 3.04Å; E1847-R1851 IonicContact OE1-NH2 3.49Å; E1847-R1851 PolarHBondContact OE1-NH2 2.93Å; E1847-R1851 IonicContact OE2-CZ 3.89Å; E1847-R1851 IonicContact OE2-NH1 3.6Å; E1847-R1851 PolarHBondContact OE2-NH1 2.87Å; E1847-R1851 IonicContact OE2-NH2 3.31Å; E1847-R1851 PolarHBondContact OE2-NH2 3.2Å; T1848-R1851 PolarHBondContact O-N 2.96Å; R1851-I1853 PolarHBondContact O-N 2.89Å; R1851-R1854 PolarHBondContact O-N 3.14Å; R1851-Q1855 WeakPolarHBondContact O-CG 3.47Å; R1851-Q1855 PolarHBondContact O-N 3.24Å
1852	I	72.2	Confident	61.3	Low	89 Å²	89	108.6 Å²	108.6	46%	0.456	57%	0.568	S	S	.	*	H	α-helix	trans	-62.8	-42.4	-179.9	-66.5	164.1	0	0	0	112.1	T1848 Q1849 R1854 Q1855 I1856	T1848-I1852 WeakPolarHBondContact O-CG1 3.25Å; T1848-I1852 PolarHBondContact O-N 3.1Å; T1848-I1852 VanDerWaalsContact O-N 3.09Å; Q1849-I1852 PolarHBondContact O-N 2.78Å; I1852-R1854 VanDerWaalsContact C-N 3.34Å; I1852-R1854 PolarHBondContact O-N 3.33Å; I1852-Q1855 PolarHBondContact O-N 2.75Å; I1852-I1856 HydrophobicContact CG2-CD1 3.87Å; I1852-I1856 WeakPolarHBondContact O-CG1 3.46Å; I1852-I1856 PolarHBondContact O-N 3.39Å; I1852-I1856 VanDerWaalsContact O-N 3.15Å
1853	I	63.8	Low	59.3	Low	109 Å²	109	113.2 Å²	113.2	56%	0.559	59%	0.587	S	S	*	*	H	α-helix	trans	-66.5	-35.2	-179.1	-69.7	169.7	0	0	0	111.9	Q1849 R1851	Q1849-I1853 WeakPolarHBondContact O-CG1 3.13Å; Q1849-I1853 PolarHBondContact O-N 3.27Å; R1851-I1853 PolarHBondContact O-N 2.89Å
1854	R	67.2	Low	57.8	Low	158 Å²	158	116 Å²	116	60%	0.596	61%	0.605	S	S	*	*	H	α-helix	trans	-64.1	-47	172.8	-71.9	175	178.7	139	4.1	111.1	Q1850 R1851 I1852 I1856 N1857	Q1850-R1854 WeakPolarHBondContact O-CG 3.33Å; Q1850-R1854 PolarHBondContact O-N 3.2Å; R1851-R1854 PolarHBondContact O-N 3.14Å; I1852-R1854 VanDerWaalsContact C-N 3.34Å; I1852-R1854 PolarHBondContact O-N 3.33Å; R1854-I1856 VanDerWaalsContact C-N 3.31Å; R1854-I1856 PolarHBondContact O-N 3.36Å; R1854-N1857 PolarHBondContact O-N 2.79Å
1855	Q	60.4	Low	56	Low	131 Å²	131	118.9 Å²	118.9	61%	0.612	62%	0.621	S	S	*	*	H	α-helix	trans	-60.8	-32.7	-179.7	-71.4	170.7	-24.5	0	0	114.2	R1851 I1852	R1851-Q1855 WeakPolarHBondContact O-CG 3.47Å; R1851-Q1855 PolarHBondContact O-N 3.24Å; I1852-Q1855 PolarHBondContact O-N 2.75Å
1856	I	59.5	Low	53.9	Low	106 Å²	106	123 Å²	123	54%	0.544	64%	0.635	S	S	.	*	H	α-helix	trans	-73	-34.2	-178.5	-69.7	169.1	0	0	0	112.6	I1852 R1854 E1858	I1852-I1856 HydrophobicContact CG2-CD1 3.87Å; I1852-I1856 WeakPolarHBondContact O-CG1 3.46Å; I1852-I1856 PolarHBondContact O-N 3.39Å; I1852-I1856 VanDerWaalsContact O-N 3.15Å; R1854-I1856 VanDerWaalsContact C-N 3.31Å; R1854-I1856 PolarHBondContact O-N 3.36Å; I1856-E1858 VanDerWaalsContact C-N 3.33Å
1857	N	54.4	Low	52.1	Low	146 Å²	146	127.5 Å²	127.5	78%	0.781	65%	0.649	S	S	*	*	H	α-helix	trans	-78.7	-15.6	178.4	-84.2	-17.2	0	0	0	113.6	R1854	R1854-N1857 PolarHBondContact O-N 2.79Å
1858	E	55.8	Low	50.5	Low	145 Å²	145	127.1 Å²	127.1	68%	0.678	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	-0.6	-174.9	-69.9	-179.8	170.2	0	0	114.1	I1856 P1860	I1856-E1858 VanDerWaalsContact C-N 3.33Å; E1858-P1860 WeakPolarHBondContact O-CD 3.44Å; E1858-P1860 WeakPolarHBondContact O-CG 3.44Å
1859	L	32.5	Very low	49.5	Very low	141 Å²	141	130.6 Å²	130.6	74%	0.738	67%	0.669	S	S	*	*			trans	-39.5	100.2	-179.8	-93.7	168.5	0	0	0	114.4
1860	P	37.7	Very low	48.5	Very low	112 Å²	112	133.1 Å²	133.1	73%	0.727	68%	0.681	S	S	*	*			trans	-90.3	148.4	176.1	4.6	15.9	0	0	0	110	E1858 C1862	E1858-P1860 WeakPolarHBondContact O-CD 3.44Å; E1858-P1860 WeakPolarHBondContact O-CG 3.44Å; P1860-C1862 VanDerWaalsContact C-N 3.32Å; P1860-C1862 PolarHBondContact O-N 3.22Å
1861	T	29.4	Very low	47	Very low	144 Å²	144	131.4 Å²	131.4	88%	0.883	68%	0.678	S	S	*	*	S	Bend	trans	-77.9	82.1	171.8	45.3	0	0	0	0	111.5
1862	C	40.4	Very low	45.5	Very low	108 Å²	108	128 Å²	128	73%	0.73	67%	0.67	S	S	*	*	S	Bend	trans	83	117.1	158.1	-48.6	0	0	0	0	120.3	P1860	P1860-C1862 VanDerWaalsContact C-N 3.32Å; P1860-C1862 PolarHBondContact O-N 3.22Å
1863	Q	29.1	Very low	44	Very low	189 Å²	189	127.8 Å²	127.8	88%	0.883	67%	0.674	S	S	*	*				149.1	140.7	129.6	-78.3	170	-6.7	0	0	115.8
1864	C	40.5	Very low	42.8	Very low	124 Å²	124	128.3 Å²	128.3	84%	0.838	68%	0.682	S	S	*	*			trans	89.7	159.3	166.6	-54.4	0	0	0	0	121.4
1865	N	34.8	Very low	41.2	Very low	150 Å²	150	124.1 Å²	124.1	80%	0.802	67%	0.669	S	S	*	*			trans	-143.2	151.3	-152.2	-46.7	0.3	0	0	0	121
1866	E	29.4	Very low	40.2	Very low	164 Å²	164	120.3 Å²	120.3	77%	0.766	65%	0.651	S	S	*	*			trans	90.5	143	131.2	-102.7	166	-171.8	0	0	131.2
1867	F	31.7	Very low	39.4	Very low	159 Å²	159	118 Å²	118	70%	0.697	64%	0.644	S	S	*	*			trans	92.2	162.4	159.4	-81	-74.1	0	0	0	127.3
1868	T	39.6	Very low	38.9	Very low	84 Å²	84	112 Å²	112	52%	0.515	61%	0.613	S	S	.	*			trans	-156.3	152.5	-141.4	54.9	0	0	0	0	121.4
1869	D	51.8	Low	38.3	Very low	143 Å²	143	108.1 Å²	108.1	77%	0.765	60%	0.599	S	S	*	*			trans	55.9	170.2	147.2	-48.5	-17.9	0	0	0	120.9
1870	E	47.2	Very low	38.9	Very low	171 Å²	171	101.6 Å²	101.6	80%	0.799	57%	0.565	S	S	*	*			cis	-152.6	-142.1	7.5	-158.1	-133.6	-105.7	0	0	112.1
1871	V	42.7	Very low	39.2	Very low	70 Å²	70	96.9 Å²	96.9	42%	0.424	53%	0.533	S	S	.	.			trans	75.6	144.8	158.5	170.5	0	0	0	0	119.9	E459	E459-V1871 HydrophobicContact CG-CG1 3.77Å
1872	V	36.3	Very low	39.7	Very low	45 Å²	45	92.2 Å²	92.2	27%	0.273	51%	0.505	S	S	.	.			cis	-145.6	150.3	-20.6	124.5	0	0	0	0	109.7
1873	P	39.4	Very low	39.4	Very low	85 Å²	85	89.7 Å²	89.7	55%	0.552	48%	0.484	S	S	*	.			trans	-97.5	-175	-173.8	36.8	-33	0	0	0	114.8	Q1875	P1873-Q1875 PolarHBondContact O-NE2 3.48Å
1874	V	40.1	Very low	39.5	Very low	119 Å²	119	83.4 Å²	83.4	72%	0.721	46%	0.461	S	S	*	.			trans	69	-179.3	172.7	-161	0	0	0	0	111
1875	Q	33.2	Very low	39.3	Very low	70 Å²	70	79.3 Å²	79.3	33%	0.327	44%	0.439	S	S	.	.			trans	86.6	156.4	155	-60.5	155.9	83.4	0	0	116.3	P1873	P1873-Q1875 PolarHBondContact O-NE2 3.48Å
1876	K	39.7	Very low	39.3	Very low	51 Å²	51	77.2 Å²	77.2	22%	0.222	43%	0.432	C	S	.	.			cis	-117.3	91.3	-16.6	-118	136.6	-173.4	161.2	0	106.8	N454 V512 T1878	N454-K1876 WeakPolarHBondContact ND2-CD 3.17Å; N454-K1876 PolarHBondContact OD1-NZ 3.42Å; V512-K1876 CarbonylContact C-O 3.09Å; V512-K1876 WeakPolarHBondContact CA-O 3.43Å; V512-K1876 VanDerWaalsContact CB-O 3.23Å; V512-K1876 WeakPolarHBondContact CB-O 3.43Å; V512-K1876 PolarHBondContact N-O 2.99Å; V512-K1876 CarbonylContact O-C 3.55Å; K1876-T1878 HydrophobicContact CB-CG2 4Å; K1876-T1878 HydrophobicContact CG-CG2 3.98Å; K1876-T1878 PolarHBondContact O-OG1 3.12Å
1877	S	42.8	Very low	39.6	Very low	58 Å²	58	71 Å²	71	41%	0.406	41%	0.409	S	S	.	.				57.9	-128	89	79.1	0	0	0	0	109.9	V512 Y524	V512-S1877 PolarHBondContact O-N 2.8Å; Y524-S1877 WeakPolarHBondContact CD1-O 3.44Å; Y524-S1877 WeakPolarHBondContact CE1-O 3.45Å
1878	T	43.1	Very low	40.2	Very low	20 Å²	20	68.2 Å²	68.2	12%	0.123	40%	0.398	C	S	.	.			trans	64.3	109.6	161.6	46.6	0	0	0	0	115.6	S511 V512 S527 K1876 H1880	S511-T1878 WeakPolarHBondContact CA-OG1 3.09Å; S511-T1878 WeakPolarHBondContact CB-O 3.18Å; S511-T1878 VanDerWaalsContact CB-OG1 3.31Å; S511-T1878 WeakPolarHBondContact CB-OG1 3.16Å; V512-T1878 PolarHBondContact N-OG1 3.47Å; V512-T1878 VanDerWaalsContact N-OG1 3.11Å; S527-T1878 PolarHBondContact OG-O 2.99Å; K1876-T1878 HydrophobicContact CB-CG2 4Å; K1876-T1878 HydrophobicContact CG-CG2 3.98Å; K1876-T1878 PolarHBondContact O-OG1 3.12Å; T1878-H1880 WeakPolarHBondContact CB-NE2 3.49Å; T1878-H1880 VanDerWaalsContact CG2-CE1 3.5Å; T1878-H1880 WeakPolarHBondContact CG2-CE1 3.21Å
1879	T	43.8	Very low	40.7	Very low	63 Å²	63	70 Å²	70	39%	0.387	41%	0.409	S	S	.	.				67	162.7	71.1	67.3	0	0	0	0	112.5	S511 S527 S528 A531	S511-T1879 WeakPolarHBondContact CB-O 3.24Å; S511-T1879 PolarHBondContact OG-O 2.94Å; S527-T1879 PolarHBondContact OG-N 3.09Å; S528-T1879 WeakPolarHBondContact CA-O 3.29Å; S528-T1879 VanDerWaalsContact CB-O 3.24Å; S528-T1879 WeakPolarHBondContact CB-O 3.33Å; A531-T1879 HydrophobicContact CB-CG2 4.4Å
1880	H	44	Very low	40.6	Very low	5 Å²	5	72.1 Å²	72.1	2%	0.023	41%	0.407	C	S	.	.				-173.2	124.1	85.3	-95.8	-45.7	0	0	0	115.6	T507 N508 L509 V510 S511 S528 A531 S532 T1878	T507-H1880 PolarHBondContact O-CE1 2.66Å; N508-H1880 VanDerWaalsContact CA-CE1 3.47Å; N508-H1880 WeakPolarHBondContact CA-CE1 3.4Å; N508-H1880 WeakPolarHBondContact CA-ND1 3.5Å; N508-H1880 CarbonylContact O-C 3.56Å; N508-H1880 WeakPolarHBondContact O-CB 3Å; N508-H1880 VanDerWaalsContact O-CG 3.26Å; N508-H1880 PolarHBondContact O-ND1 3.05Å; N508-H1880 VanDerWaalsContact O-ND1 3.08Å; L509-H1880 WeakPolarHBondContact O-CB 3.28Å; L509-H1880 PolarHBondContact O-CD2 2.9Å; L509-H1880 VanDerWaalsContact O-CD2 3.28Å; V510-H1880 PolarHBondContact N-CD2 2.9Å; V510-H1880 PolarHBondContact N-NE2 3.48Å; V510-H1880 PolarHBondContact O-CD2 3.44Å; V510-H1880 PolarHBondContact O-NE2 3.09Å; S511-H1880 VanDerWaalsContact CA-CD2 3.46Å; S511-H1880 WeakPolarHBondContact CA-CD2 3.26Å; S511-H1880 WeakPolarHBondContact CB-CD2 3.34Å; S511-H1880 PolarHBondContact N-CD2 2.96Å; S511-H1880 PolarHBondContact N-NE2 2.89Å; S528-H1880 PolarHBondContact O-N 3.48Å; A531-H1880 VanDerWaalsContact CB-N 3.29Å; S532-H1880 WeakPolarHBondContact CA-O 3.15Å; S532-H1880 WeakPolarHBondContact CB-O 3.38Å; S532-H1880 VanDerWaalsContact N-C 3.35Å; S532-H1880 PolarHBondContact N-O 3.23Å; T1878-H1880 WeakPolarHBondContact CB-NE2 3.49Å; T1878-H1880 VanDerWaalsContact CG2-CE1 3.5Å; T1878-H1880 WeakPolarHBondContact CG2-CE1 3.21Å
1881	Q	45	Very low	40.7	Very low	12 Å²	12	69.1 Å²	69.1	6%	0.056	39%	0.391	C	S	.	.				129	127.5	127.7	-160.6	158.9	70.7	0	0	115.3	N508 L509 A531 S532 S535	N508-Q1881 WeakPolarHBondContact O-CA 3.04Å; N508-Q1881 WeakPolarHBondContact O-CB 3.26Å; N508-Q1881 WeakPolarHBondContact O-CG 3.38Å; N508-Q1881 PolarHBondContact O-N 2.96Å; N508-Q1881 PolarHBondContact OD1-NE2 2.65Å; L509-Q1881 HydrophobicContact CD2-CB 4Å; L509-Q1881 VanDerWaalsContact CD2-CD 3.47Å; L509-Q1881 HydrophobicContact CD2-CG 4.25Å; A531-Q1881 CarbonylContact C-O 3.54Å; A531-Q1881 CarbonylContact O-C 3.52Å; A531-Q1881 PolarHBondContact O-N 3.45Å; S532-Q1881 CarbonylContact C-O 3.55Å; S532-Q1881 VanDerWaalsContact CA-O 3.22Å; S532-Q1881 WeakPolarHBondContact CA-O 3.02Å; S535-Q1881 VanDerWaalsContact CA-O 3.25Å; S535-Q1881 WeakPolarHBondContact CA-O 3.21Å; S535-Q1881 WeakPolarHBondContact CB-O 3.19Å; S535-Q1881 PolarHBondContact N-O 2.96Å; S535-Q1881 PolarHBondContact OG-O 3.12Å
1882	T	39.6	Very low	40.8	Very low	47 Å²	47	73.9 Å²	73.9	29%	0.288	40%	0.401	S	S	.	.			cis	-135.8	-140.9	0.5	45	0	0	0	0	105.7	S535	S535-T1882 VanDerWaalsContact CA-N 3.26Å; S535-T1882 VanDerWaalsContact CA-OG1 3.22Å; S535-T1882 WeakPolarHBondContact CA-OG1 3.34Å; S535-T1882 VanDerWaalsContact CB-N 3.31Å; S535-T1882 WeakPolarHBondContact CB-OG1 3.44Å
1883	D	33.1	Very low	40.8	Very low	54 Å²	54	75.2 Å²	75.2	29%	0.289	41%	0.409	S	S	.	.			trans	65.6	51.4	143.6	-73.9	41.2	0	0	0	118.2	S353 A354 S535	S353-D1883 VanDerWaalsContact O-OD2 3.11Å; A354-D1883 PolarHBondContact N-OD2 2.67Å; A354-D1883 VanDerWaalsContact N-OD2 3.15Å; S535-D1883 WeakPolarHBondContact O-CB 3.46Å
1884	S	31.1	Very low	40.7	Very low	57 Å²	57	77 Å²	77	40%	0.399	41%	0.409	S	S	.	.				70.5	154.3	115.8	77.1	0	0	0	0	120.3	N352 S353 S539	N352-S1884 VanDerWaalsContact C-OG 3.25Å; N352-S1884 WeakPolarHBondContact CA-OG 3.22Å; N352-S1884 WeakPolarHBondContact CB-OG 3.29Å; N352-S1884 PolarHBondContact N-O 2.83Å; N352-S1884 VanDerWaalsContact N-O 3.08Å; N352-S1884 VanDerWaalsContact O-O 3.08Å; N352-S1884 PolarHBondContact O-OG 3.17Å; N352-S1884 VanDerWaalsContact O-OG 3.13Å; S353-S1884 PolarHBondContact O-OG 3.17Å; S539-S1884 PolarHBondContact OG-O 2.97Å
1885	G	36.7	Very low	40.4	Very low	38 Å²	38	79.6 Å²	79.6	39%	0.392	42%	0.417	S	S	.	.			trans	87.2	96.1	-158.4	0	0	0	0	0	108.3	S351	S351-G1885 WeakPolarHBondContact O-CA 3.08Å
1886	T	34.4	Very low	40.9	Very low	106 Å²	106	82.8 Å²	82.8	65%	0.65	43%	0.432	S	S	*	.			cis	52.6	137.1	41.1	3.1	0	0	0	0	114.6	S350 S351 E1888	S350-T1886 CarbonylContact C-O 3.39Å; S350-T1886 CarbonylContact O-C 3.6Å; S350-T1886 VanDerWaalsContact O-C 3.27Å; S351-T1886 PolarHBondContact N-O 2.82Å; S351-T1886 PolarHBondContact OG-OG1 2.86Å; T1886-E1888 PolarHBondContact O-N 3.18Å
1887	A	37.3	Very low	40.8	Very low	35 Å²	35	81.6 Å²	81.6	29%	0.289	43%	0.429	S	S	.	.			trans	50	56.9	142.8	0	0	0	0	0	118.8	S349 S350	S349-A1887 CarbonylContact C-O 3.56Å; S349-A1887 PolarHBondContact N-O 3.5Å; S349-A1887 WeakPolarHBondContact O-CB 3.48Å; S350-A1887 CarbonylContact O-C 3.58Å; S350-A1887 WeakPolarHBondContact O-CA 3.33Å; S350-A1887 VanDerWaalsContact O-CB 3.26Å; S350-A1887 WeakPolarHBondContact O-CB 3.46Å
1888	E	43.9	Very low	40.5	Very low	99 Å²	99	82.6 Å²	82.6	46%	0.463	44%	0.441	S	S	.	.				38.5	109.3	103.2	-54.2	174.9	85	0	0	116.5	G348 T1886 R1890 K1891	G348-E1888 VanDerWaalsContact O-O 3.08Å; T1886-E1888 PolarHBondContact O-N 3.18Å; E1888-R1890 WeakPolarHBondContact O-CB 3.49Å; E1888-R1890 PolarHBondContact O-N 2.84Å; E1888-K1891 WeakPolarHBondContact OE1-CE 3.37Å; E1888-K1891 IonicContact OE1-NZ 2.74Å; E1888-K1891 PolarHBondContact OE1-NZ 3.28Å; E1888-K1891 IonicContact OE2-NZ 3.15Å
1889	T	49.3	Very low	40.3	Very low	121 Å²	121	88.4 Å²	88.4	74%	0.742	47%	0.47	S	S	*	.	S	Bend		-78.6	80.6	127.1	49.1	0	0	0	0	106.6
1890	R	50	Low	40.2	Very low	189 Å²	189	88.2 Å²	88.2	71%	0.713	46%	0.464	S	S	*	.				92.2	123.7	65.9	-171.4	173.5	-177.5	177.9	3.4	110.5	E1888	E1888-R1890 WeakPolarHBondContact O-CB 3.49Å; E1888-R1890 PolarHBondContact O-N 2.84Å
1891	K	49.2	Very low	40	Very low	107 Å²	107	89.8 Å²	89.8	47%	0.465	48%	0.476	S	S	.	.			trans	-93.7	-176.8	-161.3	-47.6	176.3	174.8	91.4	0	114.4	E1888	E1888-K1891 WeakPolarHBondContact OE1-CE 3.37Å; E1888-K1891 IonicContact OE1-NZ 2.74Å; E1888-K1891 PolarHBondContact OE1-NZ 3.28Å; E1888-K1891 IonicContact OE2-NZ 3.15Å
1892	R	45.8	Very low	39.5	Very low	170 Å²	170	92.7 Å²	92.7	64%	0.642	50%	0.502	S	S	*	.			trans	71	134.5	152.6	-86.1	-171.2	160.4	153.3	-3.8	117.1	D1908	R1892-D1908 IonicContact CZ-OD1 3.94Å; R1892-D1908 IonicContact NE-OD1 2.97Å; R1892-D1908 IonicContact NH2-OD1 2.67Å; R1892-D1908 PolarHBondContact NH2-OD1 3.44Å; R1892-D1908 VanDerWaalsContact NH2-OD1 3.16Å; R1892-D1908 IonicContact NH2-OD2 3.69Å
1893	T	35	Very low	39.6	Very low	73 Å²	73	95.5 Å²	95.5	45%	0.448	52%	0.515	S	S	.	.			cis	-167.9	-177	-14	-2.2	0	0	0	0	110.5	E1904	T1893-E1904 WeakPolarHBondContact CG2-OE2 3.35Å
1894	K	36.8	Very low	40.2	Very low	124 Å²	124	94.2 Å²	94.2	54%	0.539	51%	0.507	S	S	.	.			trans	80.6	87	141.7	-83.6	158.8	-179.1	174.7	0	119.8	V1897	K1894-V1897 HydrophobicContact CB-CB 4.22Å; K1894-V1897 HydrophobicContact CB-CG1 4.44Å; K1894-V1897 HydrophobicContact CB-CG2 4.33Å; K1894-V1897 HydrophobicContact CD-CG1 3.95Å; K1894-V1897 HydrophobicContact CG-CB 3.55Å; K1894-V1897 HydrophobicContact CG-CG1 3.27Å; K1894-V1897 HydrophobicContact CG-CG2 3.87Å
1895	L	35.7	Very low	40.6	Very low	172 Å²	172	93.6 Å²	93.6	90%	0.901	51%	0.506	S	S	*	.	S	Bend	trans	-144.5	-44.6	146.8	-169.5	56.8	0	0	0	116.4	V1897	L1895-V1897 PolarHBondContact O-N 3.26Å
1896	E	43.4	Very low	40.5	Very low	137 Å²	137	93.9 Å²	93.9	64%	0.64	50%	0.504	S	S	*	.	S	Bend	trans	-66.9	2	168.5	-68.2	169.4	133.3	0	0	113	A1898 Q1900	E1896-A1898 PolarHBondContact O-N 3.22Å; E1896-Q1900 HydrophobicContact CB-CB 3.84Å; E1896-Q1900 HydrophobicContact CB-CG 4.49Å; E1896-Q1900 WeakPolarHBondContact O-CA 3.28Å; E1896-Q1900 WeakPolarHBondContact O-CB 3.08Å; E1896-Q1900 PolarHBondContact O-N 3.17Å; E1896-Q1900 VanDerWaalsContact O-N 3.07Å; E1896-Q1900 PolarHBondContact OE2-NE2 2.97Å
1897	V	36.4	Very low	41.2	Very low	26 Å²	26	94.6 Å²	94.6	16%	0.158	50%	0.498	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	68.5	-164.2	-173.5	0	0	0	0	109.8	K1894 L1895 Q1900 S1901 E1904	K1894-V1897 HydrophobicContact CB-CB 4.22Å; K1894-V1897 HydrophobicContact CB-CG1 4.44Å; K1894-V1897 HydrophobicContact CB-CG2 4.33Å; K1894-V1897 HydrophobicContact CD-CG1 3.95Å; K1894-V1897 HydrophobicContact CG-CB 3.55Å; K1894-V1897 HydrophobicContact CG-CG1 3.27Å; K1894-V1897 HydrophobicContact CG-CG2 3.87Å; L1895-V1897 PolarHBondContact O-N 3.26Å; V1897-Q1900 VanDerWaalsContact CA-C 3.47Å; V1897-Q1900 WeakPolarHBondContact CA-O 3.29Å; V1897-Q1900 WeakPolarHBondContact CB-O 3.49Å; V1897-Q1900 VanDerWaalsContact CG1-O 3.26Å; V1897-Q1900 WeakPolarHBondContact CG1-O 3.47Å; V1897-Q1900 HydrophobicContact CG2-CB 4.38Å; V1897-Q1900 WeakPolarHBondContact CG2-O 3.4Å; V1897-S1901 WeakPolarHBondContact CG1-OG 3.33Å; V1897-S1901 WeakPolarHBondContact O-CB 3.36Å; V1897-E1904 HydrophobicContact CG1-CB 4.44Å; V1897-E1904 VanDerWaalsContact CG2-CD 3.4Å; V1897-E1904 WeakPolarHBondContact CG2-OE1 3.3Å; V1897-E1904 VanDerWaalsContact CG2-OE2 3.25Å; V1897-E1904 WeakPolarHBondContact CG2-OE2 3.42Å
1898	A	38.1	Very low	41.2	Very low	79 Å²	79	95 Å²	95	65%	0.653	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.6	-62.5	154.9	0	0	0	0	0	108.9	E1896 S1901 A1902	E1896-A1898 PolarHBondContact O-N 3.22Å; A1898-S1901 VanDerWaalsContact C-N 3.28Å; A1898-S1901 CarbonylContact O-C 3.34Å; A1898-S1901 WeakPolarHBondContact O-CA 3.45Å; A1898-S1901 WeakPolarHBondContact O-CB 3.16Å; A1898-S1901 PolarHBondContact O-N 2.64Å; A1898-A1902 PolarHBondContact O-N 2.95Å
1899	I	38.1	Very low	41.2	Very low	143 Å²	143	96 Å²	96	73%	0.733	51%	0.508	S	S	*	.	H	α-helix	trans	-70.1	-49	165.5	-72.5	176.6	0	0	0	109.1	S1901 A1902 L1903	I1899-S1901 PolarHBondContact O-N 3.09Å; I1899-A1902 PolarHBondContact O-N 3.22Å; I1899-A1902 VanDerWaalsContact O-N 3.07Å; I1899-L1903 WeakPolarHBondContact O-CA 3.21Å; I1899-L1903 WeakPolarHBondContact O-CB 3.38Å; I1899-L1903 PolarHBondContact O-N 3.11Å
1900	Q	42.5	Very low	40.6	Very low	58 Å²	58	97.1 Å²	97.1	27%	0.271	51%	0.509	S	S	.	.	H	α-helix	trans	-70	23.1	162.5	-125.4	158.5	-87.4	0	0	111.7	E1896 V1897 E1904	E1896-Q1900 HydrophobicContact CB-CB 3.84Å; E1896-Q1900 HydrophobicContact CB-CG 4.49Å; E1896-Q1900 WeakPolarHBondContact O-CA 3.28Å; E1896-Q1900 WeakPolarHBondContact O-CB 3.08Å; E1896-Q1900 PolarHBondContact O-N 3.17Å; E1896-Q1900 VanDerWaalsContact O-N 3.07Å; E1896-Q1900 PolarHBondContact OE2-NE2 2.97Å; V1897-Q1900 VanDerWaalsContact CA-C 3.47Å; V1897-Q1900 WeakPolarHBondContact CA-O 3.29Å; V1897-Q1900 WeakPolarHBondContact CB-O 3.49Å; V1897-Q1900 VanDerWaalsContact CG1-O 3.26Å; V1897-Q1900 WeakPolarHBondContact CG1-O 3.47Å; V1897-Q1900 HydrophobicContact CG2-CB 4.38Å; V1897-Q1900 WeakPolarHBondContact CG2-O 3.4Å; Q1900-E1904 HydrophobicContact CB-CG 4.44Å; Q1900-E1904 HydrophobicContact CG-CG 4.12Å; Q1900-E1904 WeakPolarHBondContact O-CA 3.29Å; Q1900-E1904 WeakPolarHBondContact O-CB 3.34Å; Q1900-E1904 WeakPolarHBondContact O-CG 3.39Å; Q1900-E1904 PolarHBondContact O-N 3.26Å; Q1900-E1904 VanDerWaalsContact O-N 3.15Å
1901	S	38.3	Very low	39.8	Very low	39 Å²	39	91.6 Å²	91.6	27%	0.273	49%	0.488	S	S	.	.	H	α-helix	trans	-124.4	-11.9	162.2	-160.8	0	0	0	0	113.3	V1897 A1898 I1899 A1905	V1897-S1901 WeakPolarHBondContact CG1-OG 3.33Å; V1897-S1901 WeakPolarHBondContact O-CB 3.36Å; A1898-S1901 VanDerWaalsContact C-N 3.28Å; A1898-S1901 CarbonylContact O-C 3.34Å; A1898-S1901 WeakPolarHBondContact O-CA 3.45Å; A1898-S1901 WeakPolarHBondContact O-CB 3.16Å; A1898-S1901 PolarHBondContact O-N 2.64Å; I1899-S1901 PolarHBondContact O-N 3.09Å; S1901-A1905 WeakPolarHBondContact O-CA 3.25Å; S1901-A1905 WeakPolarHBondContact O-CB 3.48Å; S1901-A1905 PolarHBondContact O-N 3.29Å
1902	A	34.3	Very low	39.3	Very low	72 Å²	72	90.7 Å²	90.7	60%	0.595	49%	0.493	S	S	*	.	H	α-helix	trans	-80.5	-41.7	152.7	0	0	0	0	0	108.8	A1898 I1899 A1905 A1906	A1898-A1902 PolarHBondContact O-N 2.95Å; I1899-A1902 PolarHBondContact O-N 3.22Å; I1899-A1902 VanDerWaalsContact O-N 3.07Å; A1902-A1905 PolarHBondContact O-N 3.16Å; A1902-A1906 WeakPolarHBondContact O-CB 3.37Å; A1902-A1906 PolarHBondContact O-N 3.43Å
1903	L	43.1	Very low	39.1	Very low	106 Å²	106	87.7 Å²	87.7	56%	0.555	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	7	171.8	-159.1	74.6	0	0	0	113.2	I1899 K1907	I1899-L1903 WeakPolarHBondContact O-CA 3.21Å; I1899-L1903 WeakPolarHBondContact O-CB 3.38Å; I1899-L1903 PolarHBondContact O-N 3.11Å; L1903-K1907 WeakPolarHBondContact O-CB 3.47Å
1904	E	44.3	Very low	39.3	Very low	27 Å²	27	88.4 Å²	88.4	13%	0.126	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.8	-11.2	147.6	-65.5	170.4	-156.5	0	0	114.1	T1893 V1897 Q1900 K1907 D1908	T1893-E1904 WeakPolarHBondContact CG2-OE2 3.35Å; V1897-E1904 HydrophobicContact CG1-CB 4.44Å; V1897-E1904 VanDerWaalsContact CG2-CD 3.4Å; V1897-E1904 WeakPolarHBondContact CG2-OE1 3.3Å; V1897-E1904 VanDerWaalsContact CG2-OE2 3.25Å; V1897-E1904 WeakPolarHBondContact CG2-OE2 3.42Å; Q1900-E1904 HydrophobicContact CB-CG 4.44Å; Q1900-E1904 HydrophobicContact CG-CG 4.12Å; Q1900-E1904 WeakPolarHBondContact O-CA 3.29Å; Q1900-E1904 WeakPolarHBondContact O-CB 3.34Å; Q1900-E1904 WeakPolarHBondContact O-CG 3.39Å; Q1900-E1904 PolarHBondContact O-N 3.26Å; Q1900-E1904 VanDerWaalsContact O-N 3.15Å; E1904-K1907 HydrophobicContact CB-CB 4.31Å; E1904-K1907 HydrophobicContact CG-CB 4.36Å; E1904-K1907 HydrophobicContact CG-CD 4.31Å; E1904-K1907 CarbonylContact O-C 3.55Å; E1904-K1907 PolarHBondContact O-N 2.9Å; E1904-D1908 WeakPolarHBondContact O-CA 3.39Å; E1904-D1908 WeakPolarHBondContact O-CB 3.45Å; E1904-D1908 VanDerWaalsContact O-CG 3.24Å; E1904-D1908 PolarHBondContact O-N 3.18Å
1905	A	39.1	Very low	40.1	Very low	45 Å²	45	88.5 Å²	88.5	37%	0.372	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-50.3	161.6	0	0	0	0	0	109.3	S1901 A1902 K1907 D1908 V1909	S1901-A1905 WeakPolarHBondContact O-CA 3.25Å; S1901-A1905 WeakPolarHBondContact O-CB 3.48Å; S1901-A1905 PolarHBondContact O-N 3.29Å; A1902-A1905 PolarHBondContact O-N 3.16Å; A1905-K1907 PolarHBondContact O-N 2.77Å; A1905-D1908 CarbonylContact O-C 3.59Å; A1905-D1908 PolarHBondContact O-N 2.73Å; A1905-V1909 WeakPolarHBondContact O-CB 3.45Å; A1905-V1909 WeakPolarHBondContact O-CG2 3.31Å; A1905-V1909 PolarHBondContact O-N 2.95Å
1906	A	36	Very low	40.2	Very low	44 Å²	44	85.6 Å²	85.6	36%	0.364	51%	0.505	S	S	.	.	H	α-helix	trans	-57.5	-30.3	170.5	0	0	0	0	0	112.3	A1902 L1910	A1902-A1906 WeakPolarHBondContact O-CB 3.37Å; A1902-A1906 PolarHBondContact O-N 3.43Å; A1906-L1910 WeakPolarHBondContact O-CB 3.35Å; A1906-L1910 WeakPolarHBondContact O-CD1 3.26Å; A1906-L1910 WeakPolarHBondContact O-CG 3.34Å; A1906-L1910 PolarHBondContact O-N 3.09Å
1907	K	48.4	Very low	39.9	Very low	120 Å²	120	84.4 Å²	84.4	52%	0.522	51%	0.509	S	S	.	.	H	α-helix	trans	-89.6	-6.6	177.5	-138.8	173.2	-175	175.1	0	113.8	L1903 E1904 A1905 R1911	L1903-K1907 WeakPolarHBondContact O-CB 3.47Å; E1904-K1907 HydrophobicContact CB-CB 4.31Å; E1904-K1907 HydrophobicContact CG-CB 4.36Å; E1904-K1907 HydrophobicContact CG-CD 4.31Å; E1904-K1907 CarbonylContact O-C 3.55Å; E1904-K1907 PolarHBondContact O-N 2.9Å; A1905-K1907 PolarHBondContact O-N 2.77Å; K1907-R1911 VanDerWaalsContact O-CZ 3.27Å; K1907-R1911 PolarHBondContact O-NE 2.92Å; K1907-R1911 PolarHBondContact O-NH2 3.25Å
1908	D	38.5	Very low	40.4	Very low	45 Å²	45	88.9 Å²	88.9	24%	0.241	54%	0.539	C	S	.	.	H	α-helix	trans	-96.1	-30.4	168.8	-86.7	-18	0	0	0	109.6	R1892 E1904 A1905 R1911	R1892-D1908 IonicContact CZ-OD1 3.94Å; R1892-D1908 IonicContact NE-OD1 2.97Å; R1892-D1908 IonicContact NH2-OD1 2.67Å; R1892-D1908 PolarHBondContact NH2-OD1 3.44Å; R1892-D1908 VanDerWaalsContact NH2-OD1 3.16Å; R1892-D1908 IonicContact NH2-OD2 3.69Å; E1904-D1908 WeakPolarHBondContact O-CA 3.39Å; E1904-D1908 WeakPolarHBondContact O-CB 3.45Å; E1904-D1908 VanDerWaalsContact O-CG 3.24Å; E1904-D1908 PolarHBondContact O-N 3.18Å; A1905-D1908 CarbonylContact O-C 3.59Å; A1905-D1908 PolarHBondContact O-N 2.73Å; D1908-R1911 IonicContact OD1-CZ 2.69Å; D1908-R1911 IonicContact OD1-NH1 3.46Å; D1908-R1911 PolarHBondContact OD1-NH1 2.76Å; D1908-R1911 IonicContact OD1-NH2 3.45Å; D1908-R1911 PolarHBondContact OD1-NH2 3.21Å
1909	V	43.1	Very low	40.5	Very low	119 Å²	119	90.2 Å²	90.2	72%	0.721	54%	0.541	S	S	*	.	H	α-helix	trans	-74	-46.5	169.6	170.5	0	0	0	0	111	A1905 R1911	A1905-V1909 WeakPolarHBondContact O-CB 3.45Å; A1905-V1909 WeakPolarHBondContact O-CG2 3.31Å; A1905-V1909 PolarHBondContact O-N 2.95Å; V1909-R1911 PolarHBondContact O-N 3.34Å
1910	L	35.7	Very low	40.9	Very low	144 Å²	144	89.7 Å²	89.7	75%	0.754	55%	0.547	S	S	*	.	S	Bend	trans	-77.6	45.9	173.1	-63.7	169	0	0	0	112	A1906	A1906-L1910 WeakPolarHBondContact O-CB 3.35Å; A1906-L1910 WeakPolarHBondContact O-CD1 3.26Å; A1906-L1910 WeakPolarHBondContact O-CG 3.34Å; A1906-L1910 PolarHBondContact O-N 3.09Å
1911	R	33.9	Very low	40.8	Very low	73 Å²	73	92.5 Å²	92.5	28%	0.275	57%	0.57	S	S	.	*	S	Bend	trans	-148.5	123.1	178.2	-164.7	-170.4	-54.3	139.1	8	111	K1907 D1908 V1909	K1907-R1911 VanDerWaalsContact O-CZ 3.27Å; K1907-R1911 PolarHBondContact O-NE 2.92Å; K1907-R1911 PolarHBondContact O-NH2 3.25Å; D1908-R1911 IonicContact OD1-CZ 2.69Å; D1908-R1911 IonicContact OD1-NH1 3.46Å; D1908-R1911 PolarHBondContact OD1-NH1 2.76Å; D1908-R1911 IonicContact OD1-NH2 3.45Å; D1908-R1911 PolarHBondContact OD1-NH2 3.21Å; V1909-R1911 PolarHBondContact O-N 3.34Å
1912	P	39.2	Very low	40.2	Very low	89 Å²	89	96 Å²	96	58%	0.578	59%	0.591	S	S	*	*			trans	-61.8	141	179.9	23.9	-32.8	0	0	0	111.8
1913	P	40.5	Very low	40.3	Very low	106 Å²	106	98.2 Å²	98.2	69%	0.688	60%	0.6	S	S	*	*			trans	-66.5	142.4	-173.9	26.2	-33.9	0	0	0	111.9
1914	T	40.1	Very low	40.1	Very low	89 Å²	89	98.6 Å²	98.6	55%	0.546	61%	0.609	S	S	.	*			trans	-133.3	117.8	171.9	10.2	0	0	0	0	108.2
1915	P	53.3	Low	39.2	Very low	125 Å²	125	103.2 Å²	103.2	81%	0.812	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-69.7	134.3	-169.3	25.2	-33.5	0	0	0	112.3
1916	P	38.3	Very low	38.5	Very low	112 Å²	112	110.7 Å²	110.7	73%	0.727	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-77.6	147.6	174.6	32.3	-33.9	0	0	0	111.3
1917	P	37.1	Very low	38	Very low	112 Å²	112	111.6 Å²	111.6	73%	0.727	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-70.2	134.4	-177.8	28.3	-34.7	0	0	0	111.8
1918	P	47.5	Very low	37.1	Very low	120 Å²	120	115.7 Å²	115.7	78%	0.779	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-63.7	129.7	177.4	24	-32.5	0	0	0	111.4
1919	P	38.6	Very low	36.7	Very low	107 Å²	107	122.1 Å²	122.1	70%	0.695	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-75.2	150.6	-179.5	31.1	-35.1	0	0	0	111.9	P1921	P1919-P1921 WeakPolarHBondContact O-CD 3.31Å
1920	P	47.6	Very low	36.5	Very low	132 Å²	132	121.5 Å²	121.5	86%	0.857	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-75.7	119.4	-160.7	28.2	-36.1	0	0	0	115.3
1921	P	40.1	Very low	36.5	Very low	116 Å²	116	120.1 Å²	120.1	75%	0.753	73%	0.729	S	S	*	*			trans	-96.3	176.5	168.2	-1.8	26.6	0	0	0	111.7	P1919	P1919-P1921 WeakPolarHBondContact O-CD 3.31Å
1922	P	26.5	Very low	36.2	Very low	113 Å²	113	123 Å²	123	73%	0.734	75%	0.754	S	S	*	*			trans	-98.5	157.2	-138.9	36.5	-38.6	0	0	0	116.7
1923	P	35.4	Very low	35.6	Very low	119 Å²	119	126.5 Å²	126.5	77%	0.773	77%	0.768	S	S	*	*			trans	-85.8	155.9	153.1	35.9	-31.9	0	0	0	111.4
1924	P	39.8	Very low	35	Very low	114 Å²	114	129.3 Å²	129.3	74%	0.74	78%	0.776	S	S	*	*			cis	-110.1	-161.9	-26.6	41.7	-26.6	0	0	0	109.7
1925	P	24.9	Very low	34.4	Very low	124 Å²	124	129 Å²	129	81%	0.805	78%	0.783	S	S	*	*				-144.7	-168.5	72.2	40.3	-20.5	0	0	0	114.8
1926	Q	24.1	Very low	33.2	Very low	201 Å²	201	127.7 Å²	127.7	94%	0.939	78%	0.782	S	S	*	*			trans	-90.2	142.2	-169	-59.3	152.8	-26.2	0	0	114.2
1927	G	26	Very low	32.6	Very low	64 Å²	64	129 Å²	129	66%	0.66	79%	0.788	S	S	*	*			trans	180	115	163.2	0	0	0	0	0	108.9
1928	K	28	Very low	32.4	Very low	206 Å²	206	130.2 Å²	130.2	90%	0.896	79%	0.793	S	S	*	*				53.7	114.4	83.7	-64.3	-175.2	179	-177.7	0	110.4
1929	E	31.7	Very low	31.4	Very low	179 Å²	179	130.1 Å²	130.1	84%	0.836	79%	0.792	S	S	*	*			cis	-143.5	122.5	34.1	-73.4	154.6	-174.7	0	0	109.6
1930	S	37.6	Very low	30.9	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	79%	0.791	S	S	*	*				74.8	138.8	73.7	73.2	0	0	0	0	117.1
1931	P	35.8	Very low	29.9	Very low	116 Å²	116	126.8 Å²	126.8	75%	0.753	79%	0.785	S	S	*	*			cis	-141.5	-162.5	-30.2	39	-18.5	0	0	0	114.4
1932	V	27.7	Very low	29.3	Very low	132 Å²	132	129 Å²	129	80%	0.8	79%	0.785	S	S	*	*			trans	87.6	123.5	173	-174.8	0	0	0	0	115.7
1933	L	27.5	Very low	29.6	Very low	164 Å²	164	130.5 Å²	130.5	86%	0.859	79%	0.787	S	S	*	*			cis	-150.7	149.7	-16.3	-118.3	176.7	0	0	0	108.5
1934	L	27.5	Very low	29.6	Very low	165 Å²	165	132.2 Å²	132.2	86%	0.864	79%	0.79	S	S	*	*			trans	-128.9	151.3	-173.5	-152.1	151.3	0	0	0	111.5
1935	A	26.5	Very low	29.3	Very low	83 Å²	83	132.1 Å²	132.1	69%	0.686	79%	0.791	S	S	*	*			trans	-83.5	154.7	-173.7	0	0	0	0	0	115.5
1936	A	28.3	Very low	29.6	Very low	97 Å²	97	132.2 Å²	132.2	80%	0.802	80%	0.795	S	S	*	*			trans	56.1	102.7	152.5	0	0	0	0	0	120.4
1937	V	26	Very low	30.1	Very low	140 Å²	140	126.6 Å²	126.6	85%	0.848	79%	0.791	S	S	*	*			trans	-138.5	139.8	143.8	178.7	0	0	0	0	109.1
1938	V	33.1	Very low	30.7	Very low	137 Å²	137	128.5 Å²	128.5	83%	0.83	79%	0.794	S	S	*	*			trans	-117.9	129	171.5	165.9	0	0	0	0	107.1
1939	P	27.4	Very low	31.2	Very low	117 Å²	117	126.5 Å²	126.5	76%	0.76	79%	0.788	S	S	*	*				-155.5	141.6	112.7	36.6	-17.4	0	0	0	117.8
1940	G	26.4	Very low	31.4	Very low	65 Å²	65	127 Å²	127	67%	0.67	79%	0.791	S	S	*	*			trans	96.9	137.7	132.5	0	0	0	0	0	119.5
1941	S	26.9	Very low	31.2	Very low	104 Å²	104	125.3 Å²	125.3	73%	0.727	79%	0.79	S	S	*	*			trans	62.8	138.4	171.6	68.9	0	0	0	0	117.1
1942	E	28.6	Very low	31.1	Very low	164 Å²	164	123.6 Å²	123.6	77%	0.766	79%	0.793	S	S	*	*			cis	-160.8	154.8	-20.3	-123.2	135.5	-131.9	0	0	107.8
1943	D	32.8	Very low	31.4	Very low	143 Å²	143	125.1 Å²	125.1	77%	0.765	80%	0.797	S	S	*	*			trans	61.5	149.9	166.6	-48.8	-24.8	0	0	0	118.1
1944	D	34.1	Very low	32	Very low	156 Å²	156	122.8 Å²	122.8	83%	0.834	79%	0.791	S	S	*	*			cis	-144.6	162.8	2.1	-148.8	-17.6	0	0	0	111.9
1945	S	34.8	Very low	32.5	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	79%	0.787	S	S	*	*			trans	-126.3	115.4	-180	-170.8	0	0	0	0	112.8
1946	S	31.4	Very low	33.1	Very low	126 Å²	126	120.4 Å²	120.4	88%	0.881	79%	0.789	S	S	*	*			trans	-157	137.9	150.1	55.4	0	0	0	0	111.5
1947	G	34.8	Very low	34.1	Very low	84 Å²	84	120.6 Å²	120.6	87%	0.866	78%	0.776	S	S	*	*			trans	163.5	111.3	-178.8	0	0	0	0	0	111.1
1948	S	38.3	Very low	35.2	Very low	103 Å²	103	118.8 Å²	118.8	72%	0.72	77%	0.768	S	S	*	*			trans	-103	146.6	-164.2	53.5	0	0	0	0	114.8
1949	E	37.2	Very low	36.3	Very low	165 Å²	165	117.3 Å²	117.3	77%	0.771	76%	0.759	S	S	*	*			trans	47.5	110.1	135.7	-66.4	171.1	170	0	0	118.8
1950	E	37.1	Very low	37.6	Very low	190 Å²	190	116.6 Å²	116.6	89%	0.888	75%	0.748	S	S	*	*				112.1	153.7	99.5	-85.7	-170.5	165.8	0	0	109.9
1951	G	34.1	Very low	39.1	Very low	70 Å²	70	118.2 Å²	118.2	72%	0.722	74%	0.744	S	S	*	*			cis	-160.3	-169.2	-1.7	0	0	0	0	0	111.3
1952	G	32.1	Very low	40.5	Very low	79 Å²	79	115.2 Å²	115.2	81%	0.814	72%	0.723	S	S	*	*			trans	-69.1	178.7	179.8	0	0	0	0	0	114.5
1953	D	34.8	Very low	41.5	Very low	164 Å²	164	116.8 Å²	116.8	88%	0.877	73%	0.73	S	S	*	*			cis	-149.2	-170.1	18.3	-107.4	-17.3	0	0	0	107.8
1954	P	40.4	Very low	42.3	Very low	116 Å²	116	111.1 Å²	111.1	75%	0.753	70%	0.7	S	S	*	*			cis	-144.9	-161	15.7	43.2	-21	0	0	0	116.4
1955	S	37.2	Very low	43.2	Very low	109 Å²	109	110 Å²	110	76%	0.762	70%	0.702	S	S	*	*			trans	84.8	159.1	149.6	-156.1	0	0	0	0	119.7
1956	A	39.6	Very low	44.1	Very low	89 Å²	89	108.4 Å²	108.4	74%	0.736	69%	0.685	S	S	*	*			trans	-108.5	137.1	170.1	0	0	0	0	0	110.1
1957	D	48.3	Very low	45.2	Very low	100 Å²	100	105.8 Å²	105.8	54%	0.535	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-89.4	145.8	-175.2	-67.5	-40.3	0	0	0	113.3
1958	P	50.7	Low	46.1	Very low	103 Å²	103	110 Å²	110	67%	0.669	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-78.5	141.5	176.7	32.3	-34.6	0	0	0	112.6
1959	V	55.8	Low	46.9	Very low	105 Å²	105	107.8 Å²	107.8	64%	0.636	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-89.8	119.7	169.8	-176.5	0	0	0	0	109.3	V1961	V1959-V1961 HydrophobicContact CG1-CG2 3.97Å
1960	L	55.1	Low	48	Very low	102 Å²	102	100.4 Å²	100.4	53%	0.534	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-85.8	134.6	170.4	-87.3	73.4	0	0	0	110.6
1961	V	56.5	Low	49.3	Very low	99 Å²	99	93.1 Å²	93.1	60%	0.6	57%	0.569	S	S	*	*			trans	-142.2	122.8	175.2	-172.7	0	0	0	0	109.1	V1959	V1959-V1961 HydrophobicContact CG1-CG2 3.97Å
1962	P	56.1	Low	51	Low	42 Å²	42	90.1 Å²	90.1	27%	0.273	54%	0.536	S	S	.	.			trans	-63.6	133.3	172.2	-22.2	33.8	0	0	0	111.8	V1964	P1962-V1964 HydrophobicContact CB-CG2 4.36Å
1963	Q	51.2	Low	52.9	Low	197 Å²	197	88.1 Å²	88.1	92%	0.921	51%	0.507	S	S	*	.			trans	-87.7	127.7	169.5	-65	-163.9	18.8	0	0	110
1964	V	49.7	Very low	54.7	Low	23 Å²	23	81.5 Å²	81.5	14%	0.139	47%	0.471	C	S	.	.			trans	-134	130.9	-172.8	-173.3	0	0	0	0	109.7	N366 P1962 L2025	N366-V1964 PolarHBondContact ND2-O 3.13Å; P1962-V1964 HydrophobicContact CB-CG2 4.36Å; V1964-L2025 HydrophobicContact CG1-CD1 4.23Å; V1964-L2025 HydrophobicContact CG2-CD1 3.66Å
1965	P	52.8	Low	56.3	Low	133 Å²	133	78.3 Å²	78.3	86%	0.864	44%	0.444	S	S	*	.	S	Bend	trans	-77.5	-21.9	-175.5	30.4	-35.8	0	0	0	114.2
1966	D	53.3	Low	57.9	Low	78 Å²	78	76.2 Å²	76.2	42%	0.417	43%	0.426	S	S	.	.			trans	-99.1	155.6	176	-151.3	-46.5	0	0	0	111.6	K1968 R1971	D1966-K1968 WeakPolarHBondContact OD1-CG 3.25Å; D1966-K1968 PolarHBondContact OD1-N 3.16Å; D1966-R1971 PolarHBondContact O-NH2 3.39Å
1967	I	54.5	Low	59.3	Low	71 Å²	71	72.8 Å²	72.8	36%	0.364	40%	0.395	S	S	.	.	S	Bend	trans	-94.2	-19.4	-179.5	-76.3	167.9	0	0	0	111.3	V363 V364	V363-I1967 HydrophobicContact CB-CG2 4.46Å; V363-I1967 HydrophobicContact CG1-CG2 4.08Å; V363-I1967 HydrophobicContact CG2-CG2 4.04Å; V364-I1967 WeakPolarHBondContact O-CG2 3.25Å
1968	K	53.3	Low	60.3	Low	171 Å²	171	71 Å²	71	74%	0.743	40%	0.401	S	S	*	.	S	Bend	trans	-82.7	-14.1	-169.9	-65.5	170.5	-177.7	172.5	0	115.9	D1966	D1966-K1968 WeakPolarHBondContact OD1-CG 3.25Å; D1966-K1968 PolarHBondContact OD1-N 3.16Å
1969	T	54.6	Low	61.3	Low	58 Å²	58	71.8 Å²	71.8	36%	0.356	40%	0.399	S	S	.	.	S	Bend	trans	-91.8	141.9	-175.4	48.3	0	0	0	0	112.8
1970	G	60	Low	62.2	Low	9 Å²	9	67.9 Å²	67.9	9%	0.093	37%	0.374	C	S	.	.			trans	-66.2	150.2	177.2	0	0	0	0	0	112.7
1971	R	65.9	Low	63.2	Low	38 Å²	38	66.5 Å²	66.5	14%	0.143	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	133.7	-176.2	-58.6	-173.4	-174.9	-178.1	3.9	111.1	V364 N366 D1966 A1986	V364-R1971 VanDerWaalsContact CG1-NH1 3.34Å; N366-R1971 PolarHBondContact OD1-NH1 2.85Å; N366-R1971 VanDerWaalsContact OD1-NH1 3.12Å; N366-R1971 PolarHBondContact OD1-NH2 2.7Å; D1966-R1971 PolarHBondContact O-NH2 3.39Å; R1971-A1986 WeakPolarHBondContact O-CB 3.47Å; R1971-A1986 PolarHBondContact O-N 3.04Å
1972	V	69.2	Low	64.4	Low	6 Å²	6	61.9 Å²	61.9	4%	0.036	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	130.2	173.5	-174.4	0	0	0	0	109.5	W1983 M1985 L2024 F2026	V1972-W1983 HydrophobicContact CG1-CB 4.17Å; V1972-W1983 HydrophobicContact CG1-CE3 4.03Å; V1972-M1985 HydrophobicContact CG2-CG 4.47Å; V1972-L2024 HydrophobicContact CG2-CD2 4.5Å; V1972-F2026 HydrophobicContact CB-CD1 4.48Å; V1972-F2026 HydrophobicContact CG2-CD1 3.94Å; V1972-F2026 HydrophobicContact CG2-CE1 4Å
1973	I	71.7	Confident	65.4	Low	37 Å²	37	60.1 Å²	60.1	19%	0.19	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	115.5	177.8	-53.6	173.6	0	0	0	108.6	W1983 R1984	I1973-W1983 WeakPolarHBondContact O-CA 3.46Å; I1973-R1984 HydrophobicContact CB-CB 4.35Å; I1973-R1984 PolarHBondContact N-O 3.49Å; I1973-R1984 PolarHBondContact O-N 3.45Å
1974	E	72.5	Confident	66.5	Low	25 Å²	25	51.5 Å²	51.5	12%	0.117	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	144	175.9	-174.9	171.6	-170.1	0	0	111.3	R1981 L1982 W1983 P2027	E1974-R1981 WeakPolarHBondContact OE1-CD 3.41Å; E1974-R1981 IonicContact OE1-CZ 2.65Å; E1974-R1981 IonicContact OE1-NH1 2.84Å; E1974-R1981 PolarHBondContact OE1-NH1 2.87Å; E1974-L1982 CarbonylContact C-O 3.58Å; E1974-L1982 WeakPolarHBondContact CA-O 3.43Å; E1974-W1983 HydrophobicContact CB-CE3 3.8Å; E1974-W1983 HydrophobicContact CB-CZ3 3.6Å; E1974-W1983 HydrophobicContact CG-CE3 3.88Å; E1974-W1983 HydrophobicContact CG-CH2 3.84Å; E1974-W1983 HydrophobicContact CG-CZ3 3.41Å; E1974-W1983 VanDerWaalsContact CG-CZ3 3.41Å; E1974-W1983 WeakPolarHBondContact OE1-CH2 3.45Å; E1974-W1983 WeakPolarHBondContact OE2-CZ3 3.44Å; E1974-P2027 HydrophobicContact CB-CG 4.11Å
1975	R	73.6	Confident	67.5	Low	50 Å²	50	50.8 Å²	50.8	19%	0.189	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	131.4	169.7	-72.9	-173.7	169.1	131.4	12.8	111.3	L1977 L1982 E2242	R1975-L1977 HydrophobicContact CB-CD1 4.12Å; R1975-L1982 HydrophobicContact CB-CB 4.29Å; R1975-L1982 PolarHBondContact N-O 2.79Å; R1975-L1982 PolarHBondContact O-N 2.68Å; R1975-E2242 IonicContact CZ-OE1 3.64Å; R1975-E2242 IonicContact CZ-OE2 3.59Å; R1975-E2242 IonicContact NH1-OE1 3.37Å; R1975-E2242 PolarHBondContact NH1-OE1 3.03Å; R1975-E2242 IonicContact NH1-OE2 3.89Å; R1975-E2242 VanDerWaalsContact NH2-CD 3.25Å; R1975-E2242 IonicContact NH2-OE1 2.69Å; R1975-E2242 PolarHBondContact NH2-OE1 3.47Å; R1975-E2242 VanDerWaalsContact NH2-OE1 3.17Å; R1975-E2242 IonicContact NH2-OE2 3.9Å; R1975-E2242 PolarHBondContact NH2-OE2 2.8Å
1976	T	71.1	Confident	67.9	Low	64 Å²	64	44.9 Å²	44.9	39%	0.393	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	126.6	170.5	45.9	0	0	0	0	111.2
1977	L	69.3	Low	68	Low	17 Å²	17	43.1 Å²	43.1	9%	0.089	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	89.3	171.1	-86.4	88.7	0	0	0	109.4	R1975 D1979 H1980 L1982 L2170	R1975-L1977 HydrophobicContact CB-CD1 4.12Å; L1977-D1979 PolarHBondContact O-N 2.9Å; L1977-H1980 PolarHBondContact N-O 3.14Å; L1977-H1980 PolarHBondContact O-N 3.14Å; L1977-L1982 HydrophobicContact CB-CD1 4.01Å; L1977-L1982 HydrophobicContact CD1-CD1 4.01Å; L1977-L1982 HydrophobicContact CD1-CD2 4.17Å; L1977-L2170 HydrophobicContact CD2-CB 4.09Å
1978	G	69.2	Low	68	Low	64 Å²	64	42.2 Å²	42.2	66%	0.66	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.9	-132.1	-173.1	0	0	0	0	0	110.5	H1980	G1978-H1980 PolarHBondContact O-N 3.28Å; G1978-H1980 VanDerWaalsContact O-N 3.12Å
1979	D	71.3	Confident	68	Low	118 Å²	118	36.7 Å²	36.7	63%	0.631	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-1.3	178.3	-75.7	4.4	0	0	0	114.3	L1977 T2154	L1977-D1979 PolarHBondContact O-N 2.9Å; D1979-T2154 HydrophobicContact CB-CG2 4.04Å; D1979-T2154 WeakPolarHBondContact O-CG2 3.33Å
1980	H	75.4	Confident	67.9	Low	24 Å²	24	36.4 Å²	36.4	11%	0.111	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.7	-172.7	-60.6	-62.5	0	0	0	113.7	L1977 G1978 L1982 D2152 C2162 I2166	L1977-H1980 PolarHBondContact N-O 3.14Å; L1977-H1980 PolarHBondContact O-N 3.14Å; G1978-H1980 PolarHBondContact O-N 3.28Å; G1978-H1980 VanDerWaalsContact O-N 3.12Å; H1980-L1982 HydrophobicContact CB-CD1 4.19Å; H1980-D2152 PolarHBondContact ND1-O 3.19Å; H1980-C2162 PolarHBondContact CE1-SG 3.38Å; H1980-C2162 PolarHBondContact NE2-SG 3.31Å; H1980-C2162 VanDerWaalsContact NE2-SG 3.35Å; H1980-I2166 HydrophobicContact CB-CD1 4.11Å; H1980-I2166 HydrophobicContact CB-CG1 4.46Å
1981	R	76.4	Confident	67.6	Low	73 Å²	73	40.3 Å²	40.3	28%	0.275	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.7	163.8	-53.2	-178.7	-172	-139.1	18.5	108.7	E1974 W1983 E2030 T2151 D2152	E1974-R1981 WeakPolarHBondContact OE1-CD 3.41Å; E1974-R1981 IonicContact OE1-CZ 2.65Å; E1974-R1981 IonicContact OE1-NH1 2.84Å; E1974-R1981 PolarHBondContact OE1-NH1 2.87Å; R1981-W1983 HydrophobicContact CB-CZ2 3.86Å; R1981-W1983 HydrophobicContact CG-CZ2 4.38Å; R1981-E2030 IonicContact CZ-OE2 2.82Å; R1981-E2030 IonicContact NH2-OE2 3.44Å; R1981-E2030 PolarHBondContact NH2-OE2 3.19Å; R1981-T2151 WeakPolarHBondContact O-CA 3.5Å; R1981-D2152 HydrophobicContact CB-CB 4.13Å; R1981-D2152 PolarHBondContact O-N 3.26Å
1982	L	80.5	Confident	66.9	Low	2 Å²	2	44 Å²	44	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.7	171.6	-75.3	69.3	0	0	0	108.9	E1974 R1975 L1977 H1980 F2108 L2150 T2151 I2166 L2170	E1974-L1982 CarbonylContact C-O 3.58Å; E1974-L1982 WeakPolarHBondContact CA-O 3.43Å; R1975-L1982 HydrophobicContact CB-CB 4.29Å; R1975-L1982 PolarHBondContact N-O 2.79Å; R1975-L1982 PolarHBondContact O-N 2.68Å; L1977-L1982 HydrophobicContact CB-CD1 4.01Å; L1977-L1982 HydrophobicContact CD1-CD1 4.01Å; L1977-L1982 HydrophobicContact CD1-CD2 4.17Å; H1980-L1982 HydrophobicContact CB-CD1 4.19Å; L1982-F2108 HydrophobicContact CD2-CE1 4.19Å; L1982-F2108 HydrophobicContact CD2-CZ 4.24Å; L1982-L2150 CarbonylContact C-O 3.56Å; L1982-L2150 VanDerWaalsContact CA-O 3.32Å; L1982-L2150 WeakPolarHBondContact CA-O 3.38Å; L1982-T2151 HydrophobicContact CD1-CG2 4.46Å; L1982-T2151 HydrophobicContact CG-CG2 4.01Å; L1982-I2166 HydrophobicContact CD1-CG2 4.04Å; L1982-I2166 HydrophobicContact CD2-CG2 3.83Å; L1982-I2166 HydrophobicContact CG-CG2 4.22Å; L1982-L2170 HydrophobicContact CD2-CD2 4.44Å
1983	W	77.1	Confident	66	Low	4 Å²	4	49.5 Å²	49.5	2%	0.015	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	123.6	174.6	-38	91.6	0	0	0	110.1	V1972 I1973 E1974 R1981 P2027 L2150 D2152	V1972-W1983 HydrophobicContact CG1-CB 4.17Å; V1972-W1983 HydrophobicContact CG1-CE3 4.03Å; I1973-W1983 WeakPolarHBondContact O-CA 3.46Å; E1974-W1983 HydrophobicContact CB-CE3 3.8Å; E1974-W1983 HydrophobicContact CB-CZ3 3.6Å; E1974-W1983 HydrophobicContact CG-CE3 3.88Å; E1974-W1983 HydrophobicContact CG-CH2 3.84Å; E1974-W1983 HydrophobicContact CG-CZ3 3.41Å; E1974-W1983 VanDerWaalsContact CG-CZ3 3.41Å; E1974-W1983 WeakPolarHBondContact OE1-CH2 3.45Å; E1974-W1983 WeakPolarHBondContact OE2-CZ3 3.44Å; R1981-W1983 HydrophobicContact CB-CZ2 3.86Å; R1981-W1983 HydrophobicContact CG-CZ2 4.38Å; W1983-P2027 HydrophobicContact CZ3-CG 4.43Å; W1983-L2150 HydrophobicContact CB-CB 4.1Å; W1983-L2150 HydrophobicContact CG-CB 4.45Å; W1983-L2150 PolarHBondContact N-O 2.86Å; W1983-L2150 PolarHBondContact O-N 3.35Å; W1983-D2152 WeakPolarHBondContact CZ2-OD2 3.24Å; W1983-D2152 PolarHBondContact NE1-OD1 3.48Å; W1983-D2152 VanDerWaalsContact NE1-OD1 3.16Å; W1983-D2152 PolarHBondContact NE1-OD2 2.98Å
1984	R	75.2	Confident	64.9	Low	16 Å²	16	53.5 Å²	53.5	6%	0.06	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	108.2	166.2	-179.5	178.7	-179.8	151.8	4	107.7	I1973 A1986 Y2149 L2240 E2242 E2247	I1973-R1984 HydrophobicContact CB-CB 4.35Å; I1973-R1984 PolarHBondContact N-O 3.49Å; I1973-R1984 PolarHBondContact O-N 3.45Å; R1984-A1986 PolarHBondContact O-N 3.05Å; R1984-Y2149 HydrophobicContact CB-CD1 4.04Å; R1984-Y2149 HydrophobicContact CB-CE1 4.19Å; R1984-Y2149 HydrophobicContact CG-CE1 4.46Å; R1984-L2240 PolarHBondContact NH1-O 2.9Å; R1984-L2240 PolarHBondContact NH2-O 2.87Å; R1984-E2242 IonicContact CZ-OE1 3.17Å; R1984-E2242 IonicContact NE-OE1 3.83Å; R1984-E2242 IonicContact NH1-OE1 2.83Å; R1984-E2242 PolarHBondContact NH1-OE1 2.99Å; R1984-E2247 IonicContact CZ-OE2 3.69Å; R1984-E2247 IonicContact NE-OE2 3.82Å; R1984-E2247 IonicContact NH2-OE2 3.93Å; R1984-E2247 PolarHBondContact NH2-OE2 3.31Å
1985	M	71.4	Confident	64	Low	9 Å²	9	55.9 Å²	55.9	4%	0.044	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	118.7	166.7	-69.4	175.4	170.3	0	0	108.1	V1972 P1987 L2024 L2098 W2148 L2150	V1972-M1985 HydrophobicContact CG2-CG 4.47Å; M1985-P1987 WeakPolarHBondContact O-CD 3.25Å; M1985-L2024 HydrophobicContact CE-CD1 4.37Å; M1985-L2098 WeakPolarHBondContact CE-O 3.48Å; M1985-W2148 HydrophobicContact CB-CH2 4.25Å; M1985-W2148 HydrophobicContact CB-CZ2 4.22Å; M1985-W2148 HydrophobicContact CG-CH2 4.42Å; M1985-W2148 HydrophobicContact SD-CH2 3.89Å; M1985-L2150 HydrophobicContact CE-CD1 3.79Å; M1985-L2150 HydrophobicContact CG-CD1 4.46Å; M1985-L2150 HydrophobicContact SD-CD1 4.13Å
1986	A	61.4	Low	63.5	Low	8 Å²	8	55.9 Å²	55.9	7%	0.066	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	117.4	164.1	0	0	0	0	0	106.5	R1971 R1984 F1988	R1971-A1986 WeakPolarHBondContact O-CB 3.47Å; R1971-A1986 PolarHBondContact O-N 3.04Å; R1984-A1986 PolarHBondContact O-N 3.05Å; A1986-F1988 PolarHBondContact O-N 3.14Å
1987	P	54.8	Low	63.4	Low	41 Å²	41	56.4 Å²	56.4	27%	0.266	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-63.6	125.9	-161.3	22.7	-33.2	0	0	0	111.6	M1985 F1990 R2140	M1985-P1987 WeakPolarHBondContact O-CD 3.25Å; P1987-F1990 HydrophobicContact CB-CE2 3.87Å; P1987-R2140 HydrophobicContact CG-CG 4.41Å
1988	F	53.3	Low	63.9	Low	52 Å²	52	57.8 Å²	57.8	23%	0.228	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-67.1	164.3	168.7	-178.6	-110.9	0	0	0	110	A1986 F1990 E2022 L2098	A1986-F1988 PolarHBondContact O-N 3.14Å; F1988-F1990 HydrophobicContact CB-CD1 4.17Å; F1988-F1990 HydrophobicContact CB-CE1 3.86Å; F1988-F1990 HydrophobicContact CB-CZ 4.12Å; F1988-F1990 HydrophobicContact CD1-CD1 4.12Å; F1988-F1990 HydrophobicContact CD1-CE1 4.48Å; F1988-F1990 WeakPolarHBondContact O-CD2 3.14Å; F1988-F1990 WeakPolarHBondContact O-CE2 3.43Å; F1988-F1990 PolarHBondContact O-N 3.35Å; F1988-E2022 WeakPolarHBondContact CE1-OE2 3.39Å; F1988-E2022 VanDerWaalsContact CZ-OE1 3.24Å; F1988-E2022 WeakPolarHBondContact CZ-OE1 3.48Å; F1988-L2098 HydrophobicContact CD1-CD1 4.45Å
1989	N	53.3	Low	64.2	Low	55 Å²	55	61.7 Å²	61.7	29%	0.294	32%	0.32	S	S	.	.			trans	-83.3	61.3	-176	-156.5	77.8	0	0	0	110.6	E1991 K1992 N2141	N1989-E1991 PolarHBondContact O-N 3.38Å; N1989-K1992 VanDerWaalsContact O-CB 3.3Å; N1989-K1992 WeakPolarHBondContact O-CB 2.95Å; N1989-K1992 PolarHBondContact O-N 3.33Å; N1989-N2141 PolarHBondContact OD1-ND2 3.14Å
1990	F	53.6	Low	64.6	Low	52 Å²	52	57.4 Å²	57.4	23%	0.228	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-17.4	-162.4	-62.8	-66.8	0	0	0	117.7	P1987 F1988 L2098 L2208	P1987-F1990 HydrophobicContact CB-CE2 3.87Å; F1988-F1990 HydrophobicContact CB-CD1 4.17Å; F1988-F1990 HydrophobicContact CB-CE1 3.86Å; F1988-F1990 HydrophobicContact CB-CZ 4.12Å; F1988-F1990 HydrophobicContact CD1-CD1 4.12Å; F1988-F1990 HydrophobicContact CD1-CE1 4.48Å; F1988-F1990 WeakPolarHBondContact O-CD2 3.14Å; F1988-F1990 WeakPolarHBondContact O-CE2 3.43Å; F1988-F1990 PolarHBondContact O-N 3.35Å; F1990-L2098 HydrophobicContact CD1-CD1 4.07Å; F1990-L2098 HydrophobicContact CE1-CD1 3.81Å; F1990-L2208 HydrophobicContact CD1-CD2 4.34Å; F1990-L2208 HydrophobicContact CE1-CD2 3.62Å; F1990-L2208 HydrophobicContact CE1-CG 4.48Å; F1990-L2208 HydrophobicContact CZ-CD2 4.1Å
1991	E	53.1	Low	64.8	Low	91 Å²	91	58.8 Å²	58.8	43%	0.425	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	20.6	178.6	-59.5	154.2	-120.3	0	0	112.1	N1989 Y1993 R2143	N1989-E1991 PolarHBondContact O-N 3.38Å; E1991-Y1993 PolarHBondContact O-N 2.79Å; E1991-R2143 IonicContact OE1-CZ 3.67Å; E1991-R2143 IonicContact OE1-NE 2.99Å; E1991-R2143 PolarHBondContact OE1-NE 3.47Å; E1991-R2143 IonicContact OE1-NH1 3.12Å; E1991-R2143 PolarHBondContact OE1-NH1 2.8Å; E1991-R2143 IonicContact OE1-NH2 3.72Å; E1991-R2143 IonicContact OE2-CZ 3.35Å; E1991-R2143 IonicContact OE2-NE 3.41Å; E1991-R2143 PolarHBondContact OE2-NE 3.44Å; E1991-R2143 IonicContact OE2-NH1 3.61Å; E1991-R2143 PolarHBondContact OE2-NH1 2.81Å; E1991-R2143 IonicContact OE2-NH2 2.73Å; E1991-R2143 PolarHBondContact OE2-NH2 3.26Å
1992	K	51.3	Low	65	Low	116 Å²	116	60.7 Å²	60.7	50%	0.504	33%	0.331	S	S	.	.	S	Bend	trans	-72.3	-17.5	176.9	-169.5	170.2	170.6	-66	0	112.8	N1989	N1989-K1992 VanDerWaalsContact O-CB 3.3Å; N1989-K1992 WeakPolarHBondContact O-CB 2.95Å; N1989-K1992 PolarHBondContact O-N 3.33Å
1993	Y	50.3	Low	65	Low	122 Å²	122	68.3 Å²	68.3	48%	0.478	37%	0.367	S	S	.	.	S	Bend	trans	-134.5	73.8	-179.7	-60.1	-74	0	0	0	110.7	E1991 G1995 M1996	E1991-Y1993 PolarHBondContact O-N 2.79Å; Y1993-G1995 PolarHBondContact O-N 3.37Å; Y1993-M1996 PolarHBondContact O-N 3.37Å
1994	P	48.9	Very low	65.3	Low	121 Å²	121	72.6 Å²	72.6	79%	0.786	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	137.2	164	27.7	-34	0	0	0	109.2
1995	G	53.3	Low	65.8	Low	74 Å²	74	75.8 Å²	75.8	76%	0.763	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.5	0.6	-174.4	0	0	0	0	0	115.9	Y1993 R1997	Y1993-G1995 PolarHBondContact O-N 3.37Å; G1995-R1997 PolarHBondContact O-N 2.97Å
1996	M	62.5	Low	66.4	Low	50 Å²	50	77.1 Å²	77.1	25%	0.246	41%	0.412	C	S	.	.			trans	-77.3	30.6	178.1	-150.9	176.9	94.5	0	0	114.3	Y1993 Y2017 A2019 L2093	Y1993-M1996 PolarHBondContact O-N 3.37Å; M1996-Y2017 HydrophobicContact CE-CE1 4.45Å; M1996-Y2017 HydrophobicContact CG-CD1 3.73Å; M1996-Y2017 HydrophobicContact CG-CE1 3.46Å; M1996-Y2017 VanDerWaalsContact CG-CE1 3.46Å; M1996-Y2017 HydrophobicContact SD-CE1 4.14Å; M1996-A2019 HydrophobicContact CE-CB 4.07Å; M1996-L2093 WeakPolarHBondContact O-CD1 3.42Å
1997	R	70.5	Confident	67.6	Low	76 Å²	76	79.8 Å²	79.8	29%	0.287	42%	0.42	S	S	.	.	S	Bend	trans	-149.9	147.7	178.2	-73.2	178.7	177.9	-92.6	-3	108.6	G1995 T2091 G2092 L2093 Q2207 N2209	G1995-R1997 PolarHBondContact O-N 2.97Å; R1997-T2091 PolarHBondContact NH1-O 3.21Å; R1997-G2092 WeakPolarHBondContact CA-O 3.32Å; R1997-L2093 HydrophobicContact CG-CB 4.4Å; R1997-L2093 HydrophobicContact CG-CD1 4.13Å; R1997-Q2207 PolarHBondContact NH2-O 3.47Å; R1997-N2209 VanDerWaalsContact CZ-O 3.26Å; R1997-N2209 PolarHBondContact NH1-O 3.41Å; R1997-N2209 PolarHBondContact NH2-O 3.05Å
1998	M	78.5	Confident	69	Low	45 Å²	45	83 Å²	83	22%	0.222	44%	0.439	C	S	.	.			trans	-69.2	133.4	164.5	-168.6	-166.8	-176.1	0	0	109.9	V2000 Y2011 D2013 Y2014 F2015 G2092	M1998-V2000 PolarHBondContact O-N 2.86Å; M1998-Y2011 HydrophobicContact CE-CE1 4.24Å; M1998-Y2011 HydrophobicContact CE-CE2 4.43Å; M1998-Y2011 VanDerWaalsContact CE-OH 3.28Å; M1998-Y2011 WeakPolarHBondContact CE-OH 3.33Å; M1998-D2013 VanDerWaalsContact CE-O 3.29Å; M1998-D2013 WeakPolarHBondContact CE-O 3.48Å; M1998-Y2014 HydrophobicContact SD-CD2 3.47Å; M1998-Y2014 WeakPolarHBondContact SD-CD2 3.47Å; M1998-Y2014 HydrophobicContact SD-CE2 3.88Å; M1998-Y2014 HydrophobicContact SD-CG 4.34Å; M1998-F2015 PolarHBondContact SD-N 3.48Å; M1998-G2092 PolarHBondContact N-O 3.47Å; M1998-G2092 WeakPolarHBondContact O-CA 3.43Å
1999	N	76.3	Confident	70.5	Confident	146 Å²	146	83.4 Å²	83.4	78%	0.781	45%	0.446	S	S	*	.			trans	-66.8	125.6	168.8	-78.5	-1.4	0	0	0	109.6
2000	V	80	Confident	71.9	Confident	28 Å²	28	89.1 Å²	89.1	17%	0.17	47%	0.471	C	S	.	.			trans	-115.9	113.9	177.9	-174.4	0	0	0	0	108.6	M1998 R2004 M2005 Y2011 Y2014 R2090	M1998-V2000 PolarHBondContact O-N 2.86Å; V2000-R2004 HydrophobicContact CG1-CB 4.47Å; V2000-M2005 HydrophobicContact CG1-CB 4.38Å; V2000-Y2011 HydrophobicContact CG1-CD1 4.44Å; V2000-Y2011 HydrophobicContact CG1-CE1 4.24Å; V2000-Y2014 HydrophobicContact CG2-CD2 4.29Å; V2000-Y2014 HydrophobicContact CG2-CE2 3.6Å; V2000-R2090 HydrophobicContact CG1-CB 4.09Å; V2000-R2090 HydrophobicContact CG2-CB 4.31Å
2001	P	79.9	Confident	73.4	Confident	54 Å²	54	88.3 Å²	88.3	35%	0.351	47%	0.466	S	S	.	.			trans	-56.4	143.8	175.6	-26.6	35.1	0	0	0	111.5	E2003 R2004 M2005	P2001-E2003 PolarHBondContact O-N 2.95Å; P2001-E2003 VanDerWaalsContact O-N 3.13Å; P2001-R2004 HydrophobicContact CB-CG 4.47Å; P2001-R2004 CarbonylContact O-C 3.51Å; P2001-R2004 WeakPolarHBondContact O-CA 3.35Å; P2001-R2004 PolarHBondContact O-N 3.18Å; P2001-M2005 PolarHBondContact O-N 2.87Å; P2001-M2005 VanDerWaalsContact O-N 3.09Å
2002	P	79.9	Confident	74.7	Confident	112 Å²	112	89.4 Å²	89.4	73%	0.727	48%	0.482	S	S	*	.	H	α-helix	trans	-52.5	-39.8	-176.6	-28.5	35.5	0	0	0	113.6	R2004 M2005	P2002-R2004 VanDerWaalsContact C-N 3.33Å; P2002-R2004 PolarHBondContact O-N 3.42Å; P2002-M2005 VanDerWaalsContact O-CB 3.26Å; P2002-M2005 WeakPolarHBondContact O-CB 3.48Å; P2002-M2005 PolarHBondContact O-N 2.94Å
2003	E	81.5	Confident	76	Confident	162 Å²	162	89 Å²	89	76%	0.757	49%	0.485	S	S	*	.	H	α-helix	trans	-62.2	-36.9	176.8	-52.7	-172	151	0	0	113.1	P2001 V2009	P2001-E2003 PolarHBondContact O-N 2.95Å; P2001-E2003 VanDerWaalsContact O-N 3.13Å; E2003-V2009 WeakPolarHBondContact O-CG2 3.43Å
2004	R	83.2	Confident	77.5	Confident	94 Å²	94	85.3 Å²	85.3	36%	0.355	47%	0.47	S	S	.	.	H	α-helix	trans	-91.2	-0.1	-178.5	-57.4	-169.3	-173.5	-166.7	1.9	113	V2000 P2001 P2002 V2009 Y2011 D2013 R2090	V2000-R2004 HydrophobicContact CG1-CB 4.47Å; P2001-R2004 HydrophobicContact CB-CG 4.47Å; P2001-R2004 CarbonylContact O-C 3.51Å; P2001-R2004 WeakPolarHBondContact O-CA 3.35Å; P2001-R2004 PolarHBondContact O-N 3.18Å; P2002-R2004 VanDerWaalsContact C-N 3.33Å; P2002-R2004 PolarHBondContact O-N 3.42Å; R2004-V2009 HydrophobicContact CG-CG1 4.48Å; R2004-Y2011 HydrophobicContact CB-CD1 3.69Å; R2004-Y2011 HydrophobicContact CB-CE1 4.15Å; R2004-Y2011 HydrophobicContact CB-CG 4.09Å; R2004-Y2011 HydrophobicContact CG-CD1 4.42Å; R2004-Y2011 HydrophobicContact CG-CG 4.44Å; R2004-Y2011 VanDerWaalsContact NH1-CD2 3.27Å; R2004-D2013 IonicContact NH1-OD2 3.68Å; R2004-D2013 PolarHBondContact NH1-OD2 3.48Å; R2004-R2090 PolarHBondContact O-NH1 3.14Å
2005	M	83.9	Confident	78.8	Confident	84 Å²	84	87.8 Å²	87.8	41%	0.414	47%	0.469	S	S	.	.	H	α-helix	trans	-63.5	-44.2	178.2	-170.6	-174.5	-66.8	0	0	111.7	V2000 P2001 P2002 W2007 G2089 R2090	V2000-M2005 HydrophobicContact CG1-CB 4.38Å; P2001-M2005 PolarHBondContact O-N 2.87Å; P2001-M2005 VanDerWaalsContact O-N 3.09Å; P2002-M2005 VanDerWaalsContact O-CB 3.26Å; P2002-M2005 WeakPolarHBondContact O-CB 3.48Å; P2002-M2005 PolarHBondContact O-N 2.94Å; M2005-W2007 PolarHBondContact O-N 3.31Å; M2005-G2089 CarbonylContact O-C 3.55Å; M2005-G2089 WeakPolarHBondContact O-CA 3.39Å; M2005-R2090 PolarHBondContact O-N 3.35Å
2006	A	85.1	Confident	79.8	Confident	36 Å²	36	84.8 Å²	84.8	30%	0.298	44%	0.437	S	S	.	.	S	Bend	trans	-68.6	130.8	-176.9	0	0	0	0	0	112.3	T2008 V2009 R2090	A2006-T2008 PolarHBondContact O-N 2.82Å; A2006-V2009 PolarHBondContact O-N 3.4Å; A2006-R2090 PolarHBondContact O-NH1 3.35Å
2007	W	86.3	Confident	80.2	Confident	65 Å²	65	86.8 Å²	86.8	25%	0.246	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-8.1	175.5	-62.9	109.3	0	0	0	114.8	M2005 Y2014 L2085 N2086 G2089 R2090 D2211	M2005-W2007 PolarHBondContact O-N 3.31Å; W2007-Y2014 HydrophobicContact CH2-CE1 4.42Å; W2007-L2085 HydrophobicContact CH2-CD2 3.83Å; W2007-L2085 HydrophobicContact CZ2-CD2 3.87Å; W2007-L2085 HydrophobicContact CZ3-CD2 4.15Å; W2007-N2086 VanDerWaalsContact CD1-O 3.27Å; W2007-N2086 PolarHBondContact NE1-O 3.24Å; W2007-G2089 PolarHBondContact NE1-O 2.63Å; W2007-R2090 HydrophobicContact CD2-CG 4.1Å; W2007-R2090 HydrophobicContact CE3-CG 3.74Å; W2007-R2090 HydrophobicContact CH2-CB 4.44Å; W2007-R2090 HydrophobicContact CH2-CG 3.63Å; W2007-R2090 HydrophobicContact CZ2-CG 3.99Å; W2007-R2090 HydrophobicContact CZ3-CG 3.51Å; W2007-D2211 HydrophobicContact CH2-CB 4.2Å; W2007-D2211 HydrophobicContact CZ2-CB 4.19Å
2008	T	84.9	Confident	80.1	Confident	108 Å²	108	87.1 Å²	87.1	66%	0.663	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-14.9	172.5	45.4	0	0	0	0	113.6	A2006	A2006-T2008 PolarHBondContact O-N 2.82Å
2009	V	85	Confident	79.3	Confident	61 Å²	61	85.6 Å²	85.6	37%	0.37	44%	0.444	S	S	.	.	S	Bend	trans	-96.8	135	174.5	179.2	0	0	0	0	108.6	E2003 R2004 A2006 R2090	E2003-V2009 WeakPolarHBondContact O-CG2 3.43Å; R2004-V2009 HydrophobicContact CG-CG1 4.48Å; A2006-V2009 PolarHBondContact O-N 3.4Å; V2009-R2090 VanDerWaalsContact O-CZ 3.31Å; V2009-R2090 PolarHBondContact O-NH1 3.35Å; V2009-R2090 PolarHBondContact O-NH2 3.27Å
2010	E	82.8	Confident	78.3	Confident	175 Å²	175	81 Å²	81	82%	0.818	42%	0.423	S	S	*	.			trans	-74.2	134.9	176.1	-64	-170.8	164.6	0	0	110.3
2011	Y	84.2	Confident	77.1	Confident	34 Å²	34	87 Å²	87	13%	0.133	45%	0.449	C	S	.	.			trans	-138.9	88	175.1	-170.3	-178.4	0	0	0	107.8	M1998 V2000 R2004 D2013 Y2014	M1998-Y2011 HydrophobicContact CE-CE1 4.24Å; M1998-Y2011 HydrophobicContact CE-CE2 4.43Å; M1998-Y2011 VanDerWaalsContact CE-OH 3.28Å; M1998-Y2011 WeakPolarHBondContact CE-OH 3.33Å; V2000-Y2011 HydrophobicContact CG1-CD1 4.44Å; V2000-Y2011 HydrophobicContact CG1-CE1 4.24Å; R2004-Y2011 HydrophobicContact CB-CD1 3.69Å; R2004-Y2011 HydrophobicContact CB-CE1 4.15Å; R2004-Y2011 HydrophobicContact CB-CG 4.09Å; R2004-Y2011 HydrophobicContact CG-CD1 4.42Å; R2004-Y2011 HydrophobicContact CG-CG 4.44Å; R2004-Y2011 VanDerWaalsContact NH1-CD2 3.27Å; Y2011-D2013 VanDerWaalsContact C-N 3.26Å; Y2011-D2013 HydrophobicContact CD2-CB 4.27Å; Y2011-D2013 HydrophobicContact CE2-CB 3.89Å; Y2011-D2013 PolarHBondContact O-N 3.16Å; Y2011-Y2014 AromaticContact CD1-CD2 3.85Å; Y2011-Y2014 HydrophobicContact CD1-CD2 3.85Å; Y2011-Y2014 HydrophobicContact CD1-CG 4.23Å; Y2011-Y2014 AromaticContact CE1-CD2 3.94Å; Y2011-Y2014 HydrophobicContact CE1-CD2 3.94Å; Y2011-Y2014 WeakPolarHBondContact O-CB 3.32Å; Y2011-Y2014 PolarHBondContact O-N 3.29Å
2012	P	80.9	Confident	75.9	Confident	115 Å²	115	87.1 Å²	87.1	75%	0.747	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-33.6	-174.6	-24.9	35.9	0	0	0	113.4	Y2014	P2012-Y2014 PolarHBondContact O-N 3.44Å
2013	D	78.4	Confident	74.7	Confident	107 Å²	107	87 Å²	87	57%	0.572	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	8.8	-174.2	-26.8	-76.8	0	0	0	113.1	M1998 R2004 Y2011 F2015	M1998-D2013 VanDerWaalsContact CE-O 3.29Å; M1998-D2013 WeakPolarHBondContact CE-O 3.48Å; R2004-D2013 IonicContact NH1-OD2 3.68Å; R2004-D2013 PolarHBondContact NH1-OD2 3.48Å; Y2011-D2013 VanDerWaalsContact C-N 3.26Å; Y2011-D2013 HydrophobicContact CD2-CB 4.27Å; Y2011-D2013 HydrophobicContact CE2-CB 3.89Å; Y2011-D2013 PolarHBondContact O-N 3.16Å; D2013-F2015 PolarHBondContact O-N 3.22Å
2014	Y	81.4	Confident	73.7	Confident	44 Å²	44	80.5 Å²	80.5	17%	0.173	41%	0.407	C	S	.	.			trans	-71.7	99.7	-172.9	-174.7	-114.5	0	0	0	112.7	M1998 V2000 W2007 Y2011 P2012 A2016 R2090 T2091 G2092 D2211	M1998-Y2014 HydrophobicContact SD-CD2 3.47Å; M1998-Y2014 WeakPolarHBondContact SD-CD2 3.47Å; M1998-Y2014 HydrophobicContact SD-CE2 3.88Å; M1998-Y2014 HydrophobicContact SD-CG 4.34Å; V2000-Y2014 HydrophobicContact CG2-CD2 4.29Å; V2000-Y2014 HydrophobicContact CG2-CE2 3.6Å; W2007-Y2014 HydrophobicContact CH2-CE1 4.42Å; Y2011-Y2014 AromaticContact CD1-CD2 3.85Å; Y2011-Y2014 HydrophobicContact CD1-CD2 3.85Å; Y2011-Y2014 HydrophobicContact CD1-CG 4.23Å; Y2011-Y2014 AromaticContact CE1-CD2 3.94Å; Y2011-Y2014 HydrophobicContact CE1-CD2 3.94Å; Y2011-Y2014 WeakPolarHBondContact O-CB 3.32Å; Y2011-Y2014 PolarHBondContact O-N 3.29Å; P2012-Y2014 PolarHBondContact O-N 3.44Å; Y2014-A2016 HydrophobicContact CE1-CB 4.03Å; Y2014-A2016 HydrophobicContact CE2-CB 4.46Å; Y2014-R2090 HydrophobicContact CD1-CG 4.31Å; Y2014-R2090 HydrophobicContact CE1-CB 4.28Å; Y2014-R2090 HydrophobicContact CE1-CG 3.88Å; Y2014-R2090 HydrophobicContact CE2-CB 3.88Å; Y2014-R2090 HydrophobicContact CE2-CG 4.15Å; Y2014-T2091 PolarHBondContact OH-N 2.74Å; Y2014-G2092 WeakPolarHBondContact OH-CA 3.24Å; Y2014-G2092 PolarHBondContact OH-N 3.4Å; Y2014-D2211 VanDerWaalsContact CE1-OD2 3.28Å; Y2014-D2211 WeakPolarHBondContact CE1-OD2 3.35Å; Y2014-D2211 PolarHBondContact OH-OD1 3.39Å; Y2014-D2211 VanDerWaalsContact OH-OD1 3.1Å; Y2014-D2211 PolarHBondContact OH-OD2 2.91Å
2015	F	77	Confident	72.7	Confident	174 Å²	174	79.2 Å²	79.2	76%	0.763	41%	0.407	S	S	*	.			trans	-116.7	87.6	177.3	-171.5	-97.4	0	0	0	110.8	M1998 D2013	M1998-F2015 PolarHBondContact SD-N 3.48Å; D2013-F2015 PolarHBondContact O-N 3.22Å
2016	A	74	Confident	72	Confident	10 Å²	10	77.2 Å²	77.2	8%	0.083	40%	0.396	C	S	.	.			trans	-72.2	145.1	178.2	0	0	0	0	0	112.6	Y2014 L2094	Y2014-A2016 HydrophobicContact CE1-CB 4.03Å; Y2014-A2016 HydrophobicContact CE2-CB 4.46Å; A2016-L2094 HydrophobicContact CB-CB 4.05Å; A2016-L2094 HydrophobicContact CB-CD1 4.16Å
2017	Y	70.5	Confident	71	Confident	93 Å²	93	76.8 Å²	76.8	37%	0.365	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.7	178.9	-176.6	-99.8	0	0	0	111.1	M1996 A2019 G2092 L2093 L2094	M1996-Y2017 HydrophobicContact CE-CE1 4.45Å; M1996-Y2017 HydrophobicContact CG-CD1 3.73Å; M1996-Y2017 HydrophobicContact CG-CE1 3.46Å; M1996-Y2017 VanDerWaalsContact CG-CE1 3.46Å; M1996-Y2017 HydrophobicContact SD-CE1 4.14Å; Y2017-A2019 HydrophobicContact CD1-CB 4.25Å; Y2017-A2019 HydrophobicContact CE1-CB 4.4Å; Y2017-A2019 PolarHBondContact O-N 2.9Å; Y2017-G2092 PolarHBondContact N-O 3.03Å; Y2017-G2092 VanDerWaalsContact N-O 3.14Å; Y2017-L2093 HydrophobicContact CD1-CD1 4.23Å; Y2017-L2094 PolarHBondContact O-N 3.25Å
2018	D	67.6	Low	70	Confident	83 Å²	83	75.8 Å²	75.8	44%	0.444	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	94.5	179.9	-171	5.8	0	0	0	111.1	C2020 L2094	D2018-C2020 PolarHBondContact O-N 2.92Å; D2018-C2020 PolarHBondContact OD1-SG 3.09Å; D2018-L2094 HydrophobicContact CB-CB 4.31Å; D2018-L2094 HydrophobicContact CB-CD2 4.38Å
2019	A	61.6	Low	69	Low	12 Å²	12	77 Å²	77	10%	0.099	39%	0.392	C	S	.	.			trans	-79	45.6	-172.6	0	0	0	0	0	114.3	M1996 Y2017 L2093	M1996-A2019 HydrophobicContact CE-CB 4.07Å; Y2017-A2019 HydrophobicContact CD1-CB 4.25Å; Y2017-A2019 HydrophobicContact CE1-CB 4.4Å; Y2017-A2019 PolarHBondContact O-N 2.9Å; A2019-L2093 HydrophobicContact CB-CD1 3.68Å; A2019-L2093 HydrophobicContact CB-CD2 4.25Å; A2019-L2093 HydrophobicContact CB-CG 4.02Å
2020	C	55.7	Low	68.1	Low	49 Å²	49	80.7 Å²	80.7	33%	0.331	41%	0.405	S	S	.	.			trans	-84.9	-7.3	177.6	-75	0	0	0	0	114.5	D2018 F2037	D2018-C2020 PolarHBondContact O-N 2.92Å; D2018-C2020 PolarHBondContact OD1-SG 3.09Å; C2020-F2037 HydrophobicContact CB-CE2 4.3Å; C2020-F2037 HydrophobicContact CB-CZ 4.04Å
2021	E	54.4	Low	67.4	Low	155 Å²	155	72.3 Å²	72.3	72%	0.724	37%	0.366	S	S	*	.	S	Bend	trans	-81.1	-25.2	-174.9	-61.7	-167.7	143	0	0	114.7
2022	E	54.8	Low	66.8	Low	57 Å²	57	71.7 Å²	71.7	27%	0.266	36%	0.364	S	S	.	.	S	Bend	trans	-88.6	113.5	-178.4	-70.1	-157.2	136.6	0	0	113.3	F1988 L2098	F1988-E2022 WeakPolarHBondContact CE1-OE2 3.39Å; F1988-E2022 VanDerWaalsContact CZ-OE1 3.24Å; F1988-E2022 WeakPolarHBondContact CZ-OE1 3.48Å; E2022-L2098 HydrophobicContact CB-CD2 4.28Å
2023	I	54.6	Low	66.4	Low	109 Å²	109	67.2 Å²	67.2	56%	0.559	33%	0.334	S	S	*	.			trans	-89.4	110.8	-171.6	-54	175.3	0	0	0	112.3
2024	L	62.4	Low	65.7	Low	25 Å²	25	64.4 Å²	64.4	13%	0.131	33%	0.33	C	S	.	.			trans	-85.6	131.5	159.9	-83.1	172.4	0	0	0	111.1	V1972 M1985 F2026 L2098	V1972-L2024 HydrophobicContact CG2-CD2 4.5Å; M1985-L2024 HydrophobicContact CE-CD1 4.37Å; L2024-F2026 HydrophobicContact CB-CE2 3.98Å; L2024-F2026 HydrophobicContact CB-CZ 4.05Å; L2024-F2026 HydrophobicContact CD1-CZ 4.42Å; L2024-F2026 WeakPolarHBondContact O-CD2 3.42Å; L2024-F2026 PolarHBondContact O-N 3.46Å; L2024-L2098 HydrophobicContact CD1-CB 3.92Å; L2024-L2098 HydrophobicContact CD1-CD2 4.01Å; L2024-L2098 WeakPolarHBondContact CD1-O 3.33Å; L2024-L2098 HydrophobicContact CG-CD2 4.2Å
2025	L	60.9	Low	64.4	Low	68 Å²	68	67.9 Å²	67.9	36%	0.356	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-86.5	106	175.3	-71.2	168.6	0	0	0	110.7	V1964	V1964-L2025 HydrophobicContact CG1-CD1 4.23Å; V1964-L2025 HydrophobicContact CG2-CD1 3.66Å
2026	F	69	Low	62.9	Low	41 Å²	41	63.6 Å²	63.6	18%	0.18	34%	0.34	C	S	.	.			trans	-87.4	150.6	174.4	-61.4	-80.8	0	0	0	111.7	V1972 L2024 S2028 S2031 H2032 P2100	V1972-F2026 HydrophobicContact CB-CD1 4.48Å; V1972-F2026 HydrophobicContact CG2-CD1 3.94Å; V1972-F2026 HydrophobicContact CG2-CE1 4Å; L2024-F2026 HydrophobicContact CB-CE2 3.98Å; L2024-F2026 HydrophobicContact CB-CZ 4.05Å; L2024-F2026 HydrophobicContact CD1-CZ 4.42Å; L2024-F2026 WeakPolarHBondContact O-CD2 3.42Å; L2024-F2026 PolarHBondContact O-N 3.46Å; F2026-S2028 PolarHBondContact O-N 3.27Å; F2026-S2031 WeakPolarHBondContact CB-OG 3.13Å; F2026-H2032 HydrophobicContact CD1-CB 4.34Å; F2026-H2032 HydrophobicContact CD2-CB 3.96Å; F2026-H2032 AromaticContact CD2-CG 3.95Å; F2026-H2032 HydrophobicContact CE2-CB 4.18Å; F2026-H2032 HydrophobicContact CG-CB 4.06Å; F2026-H2032 HydrophobicContact CZ-CB 4.47Å; F2026-P2100 HydrophobicContact CE1-CB 3.98Å
2027	P	65.6	Low	61.3	Low	28 Å²	28	69.7 Å²	69.7	18%	0.182	37%	0.365	C	S	.	.	S	Bend	trans	-71.6	-20.7	-174.2	-22.6	35.9	0	0	0	116.3	E1974 W1983	E1974-P2027 HydrophobicContact CB-CG 4.11Å; W1983-P2027 HydrophobicContact CZ3-CG 4.43Å
2028	S	65	Low	59.7	Low	43 Å²	43	71.3 Å²	71.3	30%	0.301	39%	0.385	S	S	.	.			trans	-157.3	159.9	-177.9	59.4	0	0	0	0	112.6	F2026 E2030 S2031 H2032	F2026-S2028 PolarHBondContact O-N 3.27Å; S2028-E2030 VanDerWaalsContact C-N 3.31Å; S2028-E2030 PolarHBondContact O-N 3.02Å; S2028-S2031 PolarHBondContact N-OG 3.49Å; S2028-S2031 WeakPolarHBondContact O-CB 3.26Å; S2028-S2031 PolarHBondContact O-N 2.84Å; S2028-S2031 VanDerWaalsContact O-N 3.11Å; S2028-S2031 PolarHBondContact O-OG 2.89Å; S2028-S2031 WeakPolarHBondContact OG-CB 3.48Å; S2028-S2031 PolarHBondContact OG-N 3.3Å; S2028-S2031 PolarHBondContact OG-OG 2.92Å; S2028-H2032 PolarHBondContact O-ND1 2.83Å
2029	E	63.7	Low	58	Low	134 Å²	134	75.5 Å²	75.5	63%	0.626	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-65.1	-34.3	176.5	-62.7	-166.3	138.1	0	0	112.2	S2031 H2032 N2036	E2029-S2031 PolarHBondContact O-N 3.08Å; E2029-H2032 PolarHBondContact O-N 3.11Å; E2029-N2036 PolarHBondContact OE1-ND2 2.72Å
2030	E	65.3	Low	56.7	Low	138 Å²	138	78 Å²	78	65%	0.645	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-60.4	-25.4	172.6	-63.8	-173	177	0	0	114.1	R1981 S2028 H2032 R2101	R1981-E2030 IonicContact CZ-OE2 2.82Å; R1981-E2030 IonicContact NH2-OE2 3.44Å; R1981-E2030 PolarHBondContact NH2-OE2 3.19Å; S2028-E2030 VanDerWaalsContact C-N 3.31Å; S2028-E2030 PolarHBondContact O-N 3.02Å; E2030-H2032 VanDerWaalsContact C-N 3.28Å; E2030-H2032 PolarHBondContact O-N 3.29Å; E2030-R2101 PolarHBondContact O-NH1 2.87Å; E2030-R2101 PolarHBondContact O-NH2 2.91Å
2031	S	68.3	Low	55.4	Low	0 Å²	0	84 Å²	84	0%	0	46%	0.457	C	S	.	.	G	3₁₀ helix	trans	-77.1	-8.2	-173	64.5	0	0	0	0	114.8	F2026 S2028 E2029 R2101	F2026-S2031 WeakPolarHBondContact CB-OG 3.13Å; S2028-S2031 PolarHBondContact N-OG 3.49Å; S2028-S2031 WeakPolarHBondContact O-CB 3.26Å; S2028-S2031 PolarHBondContact O-N 2.84Å; S2028-S2031 VanDerWaalsContact O-N 3.11Å; S2028-S2031 PolarHBondContact O-OG 2.89Å; S2028-S2031 WeakPolarHBondContact OG-CB 3.48Å; S2028-S2031 PolarHBondContact OG-N 3.3Å; S2028-S2031 PolarHBondContact OG-OG 2.92Å; E2029-S2031 PolarHBondContact O-N 3.08Å; S2031-R2101 PolarHBondContact O-NH2 3.46Å
2032	H	72.1	Confident	54.5	Low	20 Å²	20	82.7 Å²	82.7	9%	0.093	45%	0.453	C	S	.	.	S	Bend	trans	-140.7	159.4	177.3	70.1	-70.7	0	0	0	112.1	F2026 S2028 E2029 E2030 G2034 P2100	F2026-H2032 HydrophobicContact CD1-CB 4.34Å; F2026-H2032 HydrophobicContact CD2-CB 3.96Å; F2026-H2032 AromaticContact CD2-CG 3.95Å; F2026-H2032 HydrophobicContact CE2-CB 4.18Å; F2026-H2032 HydrophobicContact CG-CB 4.06Å; F2026-H2032 HydrophobicContact CZ-CB 4.47Å; S2028-H2032 PolarHBondContact O-ND1 2.83Å; E2029-H2032 PolarHBondContact O-N 3.11Å; E2030-H2032 VanDerWaalsContact C-N 3.28Å; E2030-H2032 PolarHBondContact O-N 3.29Å; H2032-G2034 PolarHBondContact O-N 3.03Å; H2032-P2100 WeakPolarHBondContact CA-O 3.18Å
2033	D	72.7	Confident	53.4	Low	22 Å²	22	86 Å²	86	12%	0.118	48%	0.477	C	S	.	.	S	Bend	trans	-97.2	80.4	174.9	-54.2	-27.3	0	0	0	110.7	R2068 P2100 R2101 W2102	D2033-R2068 VanDerWaalsContact CG-NH2 3.32Å; D2033-R2068 IonicContact OD1-CZ 3.23Å; D2033-R2068 IonicContact OD1-NH1 3.46Å; D2033-R2068 IonicContact OD1-NH2 3.05Å; D2033-R2068 PolarHBondContact OD1-NH2 2.85Å; D2033-R2068 IonicContact OD2-CZ 2.8Å; D2033-R2068 IonicContact OD2-NH1 2.59Å; D2033-R2068 PolarHBondContact OD2-NH1 3.37Å; D2033-R2068 IonicContact OD2-NH2 2.71Å; D2033-R2068 PolarHBondContact OD2-NH2 2.98Å; D2033-R2068 VanDerWaalsContact OD2-NH2 3.16Å; D2033-P2100 PolarHBondContact N-O 3.35Å; D2033-P2100 VanDerWaalsContact N-O 3.15Å; D2033-R2101 VanDerWaalsContact OD1-CD 3.22Å; D2033-R2101 WeakPolarHBondContact OD1-CD 3.45Å; D2033-R2101 IonicContact OD1-CZ 3.85Å; D2033-R2101 IonicContact OD1-NE 2.7Å; D2033-R2101 IonicContact OD1-NH1 3.37Å; D2033-R2101 PolarHBondContact OD1-NH1 3.38Å; D2033-R2101 WeakPolarHBondContact OD2-CA 3.38Å; D2033-R2101 WeakPolarHBondContact OD2-CB 3.32Å; D2033-R2101 WeakPolarHBondContact OD2-CD 3.37Å; D2033-W2102 PolarHBondContact O-NE1 3.03Å; D2033-W2102 VanDerWaalsContact O-NE1 3.14Å; D2033-W2102 PolarHBondContact OD2-N 3.28Å
2034	G	62.7	Low	52.4	Low	47 Å²	47	87.1 Å²	87.1	49%	0.485	48%	0.478	S	S	.	.	S	Bend	trans	-177.6	-173.1	-178.8	0	0	0	0	0	113.4	H2032	H2032-G2034 PolarHBondContact O-N 3.03Å
2035	V	54.1	Low	51.3	Low	117 Å²	117	90.4 Å²	90.4	71%	0.709	50%	0.5	S	S	*	.			trans	-122	139.1	171.5	-175	0	0	0	0	108.4	F2037	V2035-F2037 PolarHBondContact O-N 3.43Å
2036	N	46	Very low	50.3	Low	84 Å²	84	95.8 Å²	95.8	45%	0.449	52%	0.521	S	S	.	.			trans	-60.9	126.5	-178.1	-69.2	-69	0	0	0	112.3	E2029 T2038	E2029-N2036 PolarHBondContact OE1-ND2 2.72Å; N2036-T2038 PolarHBondContact O-N 2.89Å
2037	F	39.8	Very low	49.1	Very low	139 Å²	139	100 Å²	100	61%	0.61	54%	0.541	S	S	*	.			trans	-67.8	116.6	173.2	-84.7	-88.6	0	0	0	111.4	C2020 V2035	C2020-F2037 HydrophobicContact CB-CE2 4.3Å; C2020-F2037 HydrophobicContact CB-CZ 4.04Å; V2035-F2037 PolarHBondContact O-N 3.43Å
2038	T	38.1	Very low	48.4	Very low	126 Å²	126	103.4 Å²	103.4	77%	0.773	55%	0.554	S	S	*	*			trans	-121.6	129.5	170.1	57.7	0	0	0	0	110.2	N2036 G2040	N2036-T2038 PolarHBondContact O-N 2.89Å; T2038-G2040 PolarHBondContact O-N 2.89Å
2039	H	30.8	Very low	47.9	Very low	172 Å²	172	103 Å²	103	80%	0.796	55%	0.551	S	S	*	*			trans	-50.2	130.8	-176.6	-69.5	-48.6	0	0	0	113.8
2040	G	34	Very low	47.5	Very low	63 Å²	63	104 Å²	104	65%	0.649	56%	0.556	S	S	*	*			trans	158.6	79.5	164.1	0	0	0	0	0	117.3	T2038 I2042	T2038-G2040 PolarHBondContact O-N 2.89Å; G2040-I2042 PolarHBondContact O-N 3.01Å; G2040-I2042 VanDerWaalsContact O-N 3.15Å
2041	N	29.8	Very low	47.4	Very low	175 Å²	175	102.4 Å²	102.4	94%	0.936	55%	0.552	S	S	*	*			trans	33.3	61.8	155	-64.6	7.5	0	0	0	118.9
2042	I	34	Very low	47.4	Very low	128 Å²	128	102.8 Å²	102.8	66%	0.656	55%	0.554	S	S	*	*			trans	-132.7	137.4	160.4	-62.7	-177.5	0	0	0	109.1	G2040 F2044	G2040-I2042 PolarHBondContact O-N 3.01Å; G2040-I2042 VanDerWaalsContact O-N 3.15Å; I2042-F2044 HydrophobicContact CB-CD2 4.21Å; I2042-F2044 HydrophobicContact CB-CE2 3.95Å; I2042-F2044 HydrophobicContact CG2-CD2 4.06Å; I2042-F2044 HydrophobicContact CG2-CE2 3.86Å; I2042-F2044 PolarHBondContact O-N 3.14Å
2043	V	31.8	Very low	47.3	Very low	127 Å²	127	109.7 Å²	109.7	77%	0.77	58%	0.579	S	S	*	*			trans	-76.3	108.9	176.2	177.5	0	0	0	0	109.4	T2045	V2043-T2045 PolarHBondContact O-N 2.71Å
2044	F	35	Very low	47.2	Very low	132 Å²	132	112.1 Å²	112.1	58%	0.579	60%	0.595	S	S	*	*			trans	-97.7	74.3	179.4	-90.6	-89.6	0	0	0	112.4	I2042 Q2047	I2042-F2044 HydrophobicContact CB-CD2 4.21Å; I2042-F2044 HydrophobicContact CB-CE2 3.95Å; I2042-F2044 HydrophobicContact CG2-CD2 4.06Å; I2042-F2044 HydrophobicContact CG2-CE2 3.86Å; I2042-F2044 PolarHBondContact O-N 3.14Å; F2044-Q2047 HydrophobicContact CD1-CB 4.33Å; F2044-Q2047 HydrophobicContact CE1-CB 4.48Å
2045	T	37.8	Very low	47.9	Very low	95 Å²	95	111.4 Å²	111.4	58%	0.583	58%	0.58	S	S	*	*	S	Bend	trans	-103.7	152.1	160	51.8	0	0	0	0	110.4	V2043 Q2047	V2043-T2045 PolarHBondContact O-N 2.71Å; T2045-Q2047 VanDerWaalsContact C-N 3.28Å; T2045-Q2047 PolarHBondContact O-N 3.03Å
2046	F	40.4	Very low	49.3	Very low	181 Å²	181	109.2 Å²	109.2	79%	0.794	56%	0.564	S	S	*	*	S	Bend	trans	63.7	-27.3	177.7	-65.6	-81.9	0	0	0	120.2	H2048 S2049	F2046-H2048 PolarHBondContact O-N 3.47Å; F2046-S2049 WeakPolarHBondContact O-CB 3.16Å; F2046-S2049 PolarHBondContact O-N 3.5Å; F2046-S2049 PolarHBondContact O-OG 2.86Å
2047	Q	43.4	Very low	51.1	Low	129 Å²	129	106.1 Å²	106.1	60%	0.603	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-21.1	-175.1	-84.3	-163.3	-6.3	0	0	115.7	F2044 T2045 S2049	F2044-Q2047 HydrophobicContact CD1-CB 4.33Å; F2044-Q2047 HydrophobicContact CE1-CB 4.48Å; T2045-Q2047 VanDerWaalsContact C-N 3.28Å; T2045-Q2047 PolarHBondContact O-N 3.03Å; Q2047-S2049 PolarHBondContact O-N 2.94Å
2048	H	52.5	Low	53.3	Low	100 Å²	100	101.1 Å²	101.1	46%	0.463	53%	0.526	S	S	.	.	H	α-helix	trans	-61.7	-27.5	173.1	-84.2	100.9	0	0	0	113.8	F2046 E2050 N2051 L2052	F2046-H2048 PolarHBondContact O-N 3.47Å; H2048-E2050 PolarHBondContact O-N 3.29Å; H2048-N2051 PolarHBondContact O-N 2.97Å; H2048-L2052 WeakPolarHBondContact O-CG 3.21Å; H2048-L2052 PolarHBondContact O-N 3.09Å
2049	S	52.9	Low	55.5	Low	34 Å²	34	100 Å²	100	24%	0.238	51%	0.512	C	S	.	.	H	α-helix	trans	-68.4	-29.9	-172.6	63.6	0	0	0	0	114.7	F2046 Q2047 R2053	F2046-S2049 WeakPolarHBondContact O-CB 3.16Å; F2046-S2049 PolarHBondContact O-N 3.5Å; F2046-S2049 PolarHBondContact O-OG 2.86Å; Q2047-S2049 PolarHBondContact O-N 2.94Å; S2049-R2053 VanDerWaalsContact O-CD 3.28Å; S2049-R2053 WeakPolarHBondContact O-CD 3.48Å; S2049-R2053 VanDerWaalsContact O-CG 3.25Å; S2049-R2053 WeakPolarHBondContact O-CG 3.49Å
2050	E	56.8	Low	58	Low	154 Å²	154	95.4 Å²	95.4	72%	0.72	49%	0.488	S	S	*	.	H	α-helix	trans	-75.3	-45.5	177.2	-64.4	-163.8	144.6	0	0	111.3	H2048 R2053	H2048-E2050 PolarHBondContact O-N 3.29Å; E2050-R2053 PolarHBondContact O-N 3.31Å
2051	N	62.8	Low	60.2	Low	105 Å²	105	92.6 Å²	92.6	56%	0.561	46%	0.458	S	S	*	.	H	α-helix	trans	-63.8	-44.2	-178.8	-77.5	-30	0	0	0	112.4	H2048 R2053 T2054	H2048-N2051 PolarHBondContact O-N 2.97Å; N2051-R2053 VanDerWaalsContact C-N 3.27Å; N2051-R2053 PolarHBondContact O-N 3.18Å; N2051-T2054 PolarHBondContact O-N 3.17Å; N2051-T2054 PolarHBondContact O-OG1 3.32Å
2052	L	68.3	Low	62.4	Low	9 Å²	9	87.8 Å²	87.8	5%	0.047	44%	0.443	C	S	.	.	H	α-helix	trans	-55.4	-41.9	177.1	-78.2	166.9	0	0	0	112.1	H2048 T2054 I2055 F2057 A2083 W2102	H2048-L2052 WeakPolarHBondContact O-CG 3.21Å; H2048-L2052 PolarHBondContact O-N 3.09Å; L2052-T2054 PolarHBondContact O-N 2.73Å; L2052-T2054 VanDerWaalsContact O-N 3.12Å; L2052-I2055 PolarHBondContact O-N 2.96Å; L2052-I2055 VanDerWaalsContact O-N 3.17Å; L2052-F2057 HydrophobicContact CD2-CZ 4.24Å; L2052-F2057 WeakPolarHBondContact O-CE2 3.29Å; L2052-A2083 HydrophobicContact CD1-CB 4.12Å; L2052-W2102 HydrophobicContact CD2-CD2 3.71Å; L2052-W2102 HydrophobicContact CD2-CE3 4.02Å; L2052-W2102 HydrophobicContact CD2-CG 4.07Å; L2052-W2102 HydrophobicContact CD2-CH2 4.42Å; L2052-W2102 HydrophobicContact CD2-CZ2 4.17Å; L2052-W2102 HydrophobicContact CD2-CZ3 4.34Å
2053	R	69	Low	64.4	Low	165 Å²	165	88.9 Å²	88.9	62%	0.623	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-7.7	179.5	-68.5	172	-179.1	-149.6	-1.3	114.1	S2049 E2050 N2051 T2080	S2049-R2053 VanDerWaalsContact O-CD 3.28Å; S2049-R2053 WeakPolarHBondContact O-CD 3.48Å; S2049-R2053 VanDerWaalsContact O-CG 3.25Å; S2049-R2053 WeakPolarHBondContact O-CG 3.49Å; E2050-R2053 PolarHBondContact O-N 3.31Å; N2051-R2053 VanDerWaalsContact C-N 3.27Å; N2051-R2053 PolarHBondContact O-N 3.18Å; R2053-T2080 PolarHBondContact NH2-O 2.84Å
2054	T	72.1	Confident	66.2	Low	72 Å²	72	84.8 Å²	84.8	44%	0.442	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-3.1	174.8	77.1	0	0	0	0	114.4	N2051 L2052 K2063	N2051-T2054 PolarHBondContact O-N 3.17Å; N2051-T2054 PolarHBondContact O-OG1 3.32Å; L2052-T2054 PolarHBondContact O-N 2.73Å; L2052-T2054 VanDerWaalsContact O-N 3.12Å; T2054-K2063 PolarHBondContact O-NZ 3.43Å
2055	I	77.1	Confident	68.1	Low	33 Å²	33	85.9 Å²	85.9	17%	0.169	43%	0.427	C	S	.	.	S	Bend	trans	-95.9	133	-175.4	-59.6	178.1	0	0	0	110.7	L2052 F2057 R2068	L2052-I2055 PolarHBondContact O-N 2.96Å; L2052-I2055 VanDerWaalsContact O-N 3.17Å; I2055-F2057 HydrophobicContact CB-CD2 4.49Å; I2055-F2057 HydrophobicContact CB-CE1 4.27Å; I2055-F2057 HydrophobicContact CB-CE2 3.97Å; I2055-F2057 HydrophobicContact CB-CZ 3.84Å; I2055-F2057 HydrophobicContact CD1-CZ 4.28Å; I2055-F2057 HydrophobicContact CG2-CD1 4.04Å; I2055-F2057 HydrophobicContact CG2-CE1 3.69Å; I2055-F2057 HydrophobicContact CG2-CE2 4.24Å; I2055-F2057 HydrophobicContact CG2-CG 4.45Å; I2055-F2057 HydrophobicContact CG2-CZ 3.79Å; I2055-F2057 PolarHBondContact O-N 3.39Å; I2055-R2068 VanDerWaalsContact CG2-NE 3.3Å
2056	N	82.8	Confident	70	Confident	71 Å²	71	81.9 Å²	81.9	38%	0.38	40%	0.402	S	S	.	.			trans	-82.3	75.5	-178.7	-85.9	-7.1	0	0	0	112.1	Q2059	N2056-Q2059 HydrophobicContact CB-CG 3.9Å; N2056-Q2059 PolarHBondContact OD1-NE2 3.21Å
2057	F	84.9	Confident	72	Confident	18 Å²	18	75.5 Å²	75.5	8%	0.079	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	158.9	174.2	-62.5	-60.7	0	0	0	113.7	L2052 I2055 Q2059 Y2075 L2077 G2082 P2084 W2102	L2052-F2057 HydrophobicContact CD2-CZ 4.24Å; L2052-F2057 WeakPolarHBondContact O-CE2 3.29Å; I2055-F2057 HydrophobicContact CB-CD2 4.49Å; I2055-F2057 HydrophobicContact CB-CE1 4.27Å; I2055-F2057 HydrophobicContact CB-CE2 3.97Å; I2055-F2057 HydrophobicContact CB-CZ 3.84Å; I2055-F2057 HydrophobicContact CD1-CZ 4.28Å; I2055-F2057 HydrophobicContact CG2-CD1 4.04Å; I2055-F2057 HydrophobicContact CG2-CE1 3.69Å; I2055-F2057 HydrophobicContact CG2-CE2 4.24Å; I2055-F2057 HydrophobicContact CG2-CG 4.45Å; I2055-F2057 HydrophobicContact CG2-CZ 3.79Å; I2055-F2057 PolarHBondContact O-N 3.39Å; F2057-Q2059 PolarHBondContact O-N 3.38Å; F2057-Y2075 HydrophobicContact CB-CE2 4.02Å; F2057-Y2075 HydrophobicContact CD1-CE2 4.44Å; F2057-Y2075 HydrophobicContact CG-CE2 4.49Å; F2057-L2077 HydrophobicContact CB-CD1 4.38Å; F2057-L2077 HydrophobicContact CB-CD2 3.85Å; F2057-L2077 HydrophobicContact CD2-CD1 4.37Å; F2057-L2077 HydrophobicContact CD2-CD2 3.96Å; F2057-L2077 HydrophobicContact CG-CD2 3.99Å; F2057-G2082 WeakPolarHBondContact CE2-O 3.29Å; F2057-P2084 HydrophobicContact CD1-CG 4.47Å; F2057-P2084 HydrophobicContact CE1-CG 4.08Å; F2057-P2084 HydrophobicContact CZ-CG 4.45Å; F2057-W2102 HydrophobicContact CE1-CB 3.91Å; F2057-W2102 HydrophobicContact CZ-CB 4.24Å
2058	N	86	Confident	73.9	Confident	35 Å²	35	69.7 Å²	69.7	19%	0.187	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	9.9	-177.4	-78.1	-59.8	0	0	0	116.1	R2074 Y2075	N2058-R2074 VanDerWaalsContact OD1-CA 3.23Å; N2058-R2074 WeakPolarHBondContact OD1-CA 3.4Å; N2058-Y2075 PolarHBondContact N-OH 2.94Å; N2058-Y2075 PolarHBondContact ND2-O 2.95Å; N2058-Y2075 WeakPolarHBondContact OD1-CD1 3.42Å; N2058-Y2075 WeakPolarHBondContact OD1-CE1 3.27Å; N2058-Y2075 PolarHBondContact OD1-N 3.41Å
2059	Q	84	Confident	75.4	Confident	103 Å²	103	68.5 Å²	68.5	48%	0.481	34%	0.34	S	S	.	.	S	Bend	trans	-146	-169.9	-178.8	65.6	-171.1	-22.4	0	0	111.7	N2056 F2057 R2068	N2056-Q2059 HydrophobicContact CB-CG 3.9Å; N2056-Q2059 PolarHBondContact OD1-NE2 3.21Å; F2057-Q2059 PolarHBondContact O-N 3.38Å; Q2059-R2068 PolarHBondContact O-N 2.85Å; Q2059-R2068 VanDerWaalsContact O-N 3.16Å
2060	Y	83	Confident	77	Confident	74 Å²	74	67.3 Å²	67.3	29%	0.29	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.3	172.9	-175.1	-110.6	0	0	0	110.5	A2062 K2065 L2066 R2067	Y2060-A2062 PolarHBondContact O-N 3.03Å; Y2060-K2065 VanDerWaalsContact CE2-C 3.49Å; Y2060-K2065 WeakPolarHBondContact CE2-O 3.24Å; Y2060-K2065 VanDerWaalsContact CZ-C 3.46Å; Y2060-K2065 VanDerWaalsContact CZ-O 3.3Å; Y2060-K2065 VanDerWaalsContact OH-CA 3.24Å; Y2060-K2065 WeakPolarHBondContact OH-CA 3.21Å; Y2060-K2065 PolarHBondContact OH-O 2.84Å; Y2060-L2066 WeakPolarHBondContact CD2-O 3.21Å; Y2060-R2067 HydrophobicContact CD2-CB 4.24Å
2061	D	79.9	Confident	78.3	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.027	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	95.6	176.6	-175.8	-10.5	0	0	0	109.7	K2063 A2064 K2065 L2066 R2068	D2061-K2063 PolarHBondContact O-N 3.31Å; D2061-K2063 WeakPolarHBondContact OD1-CB 3.29Å; D2061-K2063 PolarHBondContact OD1-N 3.09Å; D2061-A2064 HydrophobicContact CB-CB 4.28Å; D2061-A2064 PolarHBondContact O-N 3.04Å; D2061-A2064 PolarHBondContact OD1-N 3.46Å; D2061-A2064 WeakPolarHBondContact OD2-CB 3.49Å; D2061-K2065 CarbonylContact O-C 3.59Å; D2061-K2065 VanDerWaalsContact O-CA 3.27Å; D2061-K2065 WeakPolarHBondContact O-CA 3.19Å; D2061-K2065 PolarHBondContact O-N 2.86Å; D2061-L2066 WeakPolarHBondContact CB-O 3.39Å; D2061-L2066 PolarHBondContact N-O 2.85Å; D2061-L2066 PolarHBondContact O-N 3.3Å; D2061-L2066 VanDerWaalsContact O-N 3.15Å; D2061-R2068 HydrophobicContact CB-CG 4.09Å; D2061-R2068 IonicContact OD2-CZ 3.93Å; D2061-R2068 IonicContact OD2-NE 3.06Å; D2061-R2068 PolarHBondContact OD2-NE 2.91Å; D2061-R2068 IonicContact OD2-NH2 2.75Å; D2061-R2068 PolarHBondContact OD2-NH2 3.27Å
2062	A	76.8	Confident	79.2	Confident	73 Å²	73	61.4 Å²	61.4	60%	0.603	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-17.8	179.7	0	0	0	0	0	114.1	Y2060	Y2060-A2062 PolarHBondContact O-N 3.03Å
2063	K	74.7	Confident	79.8	Confident	152 Å²	152	62.4 Å²	62.4	66%	0.661	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-52.5	173.7	-62.3	173.9	-179.2	169	0	110.1	T2054 D2061 K2065	T2054-K2063 PolarHBondContact O-NZ 3.43Å; D2061-K2063 PolarHBondContact O-N 3.31Å; D2061-K2063 WeakPolarHBondContact OD1-CB 3.29Å; D2061-K2063 PolarHBondContact OD1-N 3.09Å; K2063-K2065 VanDerWaalsContact C-N 3.29Å; K2063-K2065 PolarHBondContact O-N 2.94Å
2064	A	70	Confident	80.6	Confident	41 Å²	41	65.1 Å²	65.1	34%	0.339	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-5.9	-179.5	0	0	0	0	0	114.1	D2061 L2066	D2061-A2064 HydrophobicContact CB-CB 4.28Å; D2061-A2064 PolarHBondContact O-N 3.04Å; D2061-A2064 PolarHBondContact OD1-N 3.46Å; D2061-A2064 WeakPolarHBondContact OD2-CB 3.49Å; A2064-L2066 HydrophobicContact CB-CB 3.99Å; A2064-L2066 PolarHBondContact O-N 3.12Å
2065	K	75.5	Confident	81.4	Confident	154 Å²	154	62.2 Å²	62.2	67%	0.67	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	22.6	-169.6	-59.7	177.5	-178.6	171.3	0	114.1	Y2060 D2061 K2063	Y2060-K2065 VanDerWaalsContact CE2-C 3.49Å; Y2060-K2065 WeakPolarHBondContact CE2-O 3.24Å; Y2060-K2065 VanDerWaalsContact CZ-C 3.46Å; Y2060-K2065 VanDerWaalsContact CZ-O 3.3Å; Y2060-K2065 VanDerWaalsContact OH-CA 3.24Å; Y2060-K2065 WeakPolarHBondContact OH-CA 3.21Å; Y2060-K2065 PolarHBondContact OH-O 2.84Å; D2061-K2065 CarbonylContact O-C 3.59Å; D2061-K2065 VanDerWaalsContact O-CA 3.27Å; D2061-K2065 WeakPolarHBondContact O-CA 3.19Å; D2061-K2065 PolarHBondContact O-N 2.86Å; K2063-K2065 VanDerWaalsContact C-N 3.29Å; K2063-K2065 PolarHBondContact O-N 2.94Å
2066	L	77.4	Confident	81.9	Confident	12 Å²	12	68.1 Å²	68.1	6%	0.063	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	135.5	-166.8	-173.7	71.8	0	0	0	112.5	Y2060 D2061 A2064 R2068 R2101 D2152	Y2060-L2066 WeakPolarHBondContact CD2-O 3.21Å; D2061-L2066 WeakPolarHBondContact CB-O 3.39Å; D2061-L2066 PolarHBondContact N-O 2.85Å; D2061-L2066 PolarHBondContact O-N 3.3Å; D2061-L2066 VanDerWaalsContact O-N 3.15Å; A2064-L2066 HydrophobicContact CB-CB 3.99Å; A2064-L2066 PolarHBondContact O-N 3.12Å; L2066-R2068 HydrophobicContact CD2-CG 4.12Å; L2066-R2068 HydrophobicContact CG-CG 4.42Å; L2066-R2068 PolarHBondContact O-N 3.01Å; L2066-R2101 HydrophobicContact CD2-CB 4.36Å; L2066-R2101 HydrophobicContact CD2-CG 3.78Å; L2066-D2152 HydrophobicContact CD1-CB 3.82Å
2067	R	81.3	Confident	82.1	Confident	47 Å²	47	68.6 Å²	68.6	18%	0.177	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	97	170.6	-169.1	171.5	-172.7	166	5.4	110.9	Y2060 Q2069 H2106 H2153 C2157 D2158 F2159	Y2060-R2067 HydrophobicContact CD2-CB 4.24Å; R2067-Q2069 VanDerWaalsContact C-N 3.26Å; R2067-Q2069 HydrophobicContact CG-CB 4.16Å; R2067-Q2069 PolarHBondContact O-N 3.49Å; R2067-H2106 PolarHBondContact O-CE1 3.24Å; R2067-H2153 WeakPolarHBondContact CB-O 3.49Å; R2067-H2153 PolarHBondContact N-O 3.46Å; R2067-H2153 VanDerWaalsContact N-O 3.12Å; R2067-C2157 PolarHBondContact NH1-O 2.92Å; R2067-D2158 IonicContact NH1-OD1 3.97Å; R2067-F2159 HydrophobicContact CG-CZ 4.47Å
2068	R	83.9	Confident	81.9	Confident	6 Å²	6	69.6 Å²	69.6	2%	0.023	34%	0.336	C	S	.	.			trans	-87.8	23	176.2	-60.7	-173.9	-176.6	-86.6	1.4	113.8	D2033 I2055 Q2059 D2061 L2066 Y2075 W2102	D2033-R2068 VanDerWaalsContact CG-NH2 3.32Å; D2033-R2068 IonicContact OD1-CZ 3.23Å; D2033-R2068 IonicContact OD1-NH1 3.46Å; D2033-R2068 IonicContact OD1-NH2 3.05Å; D2033-R2068 PolarHBondContact OD1-NH2 2.85Å; D2033-R2068 IonicContact OD2-CZ 2.8Å; D2033-R2068 IonicContact OD2-NH1 2.59Å; D2033-R2068 PolarHBondContact OD2-NH1 3.37Å; D2033-R2068 IonicContact OD2-NH2 2.71Å; D2033-R2068 PolarHBondContact OD2-NH2 2.98Å; D2033-R2068 VanDerWaalsContact OD2-NH2 3.16Å; I2055-R2068 VanDerWaalsContact CG2-NE 3.3Å; Q2059-R2068 PolarHBondContact O-N 2.85Å; Q2059-R2068 VanDerWaalsContact O-N 3.16Å; D2061-R2068 HydrophobicContact CB-CG 4.09Å; D2061-R2068 IonicContact OD2-CZ 3.93Å; D2061-R2068 IonicContact OD2-NE 3.06Å; D2061-R2068 PolarHBondContact OD2-NE 2.91Å; D2061-R2068 IonicContact OD2-NH2 2.75Å; D2061-R2068 PolarHBondContact OD2-NH2 3.27Å; L2066-R2068 HydrophobicContact CD2-CG 4.12Å; L2066-R2068 HydrophobicContact CG-CG 4.42Å; L2066-R2068 PolarHBondContact O-N 3.01Å; R2068-Y2075 WeakPolarHBondContact O-CE1 3.44Å; R2068-Y2075 PolarHBondContact O-OH 3.05Å; R2068-W2102 PolarHBondContact NH1-O 3.39Å
2069	Q	85.1	Confident	81.5	Confident	76 Å²	76	73.1 Å²	73.1	36%	0.355	36%	0.364	S	S	.	.			trans	-92.5	134.3	176.7	-176.5	-173.3	18.2	0	0	109.2	R2067 H2106	R2067-Q2069 VanDerWaalsContact C-N 3.26Å; R2067-Q2069 HydrophobicContact CG-CB 4.16Å; R2067-Q2069 PolarHBondContact O-N 3.49Å; Q2069-H2106 PolarHBondContact O-CE1 3.38Å; Q2069-H2106 PolarHBondContact O-NE2 3.5Å
2070	S	86.1	Confident	81	Confident	8 Å²	8	72.8 Å²	72.8	6%	0.056	37%	0.369	C	S	.	.	B	Isolated β-bridge	trans	-80.2	146.8	178	166.2	0	0	0	0	112	L2072 G2073 E2216	S2070-L2072 PolarHBondContact O-N 3.48Å; S2070-L2072 WeakPolarHBondContact OG-CB 3.31Å; S2070-L2072 PolarHBondContact OG-N 3.09Å; S2070-G2073 PolarHBondContact O-N 2.95Å; S2070-G2073 VanDerWaalsContact O-N 3.13Å; S2070-E2216 WeakPolarHBondContact CA-OE2 3.45Å; S2070-E2216 VanDerWaalsContact CB-OE1 3.24Å; S2070-E2216 WeakPolarHBondContact CB-OE1 3.35Å; S2070-E2216 VanDerWaalsContact OG-CD 3.28Å; S2070-E2216 PolarHBondContact OG-OE1 3.4Å; S2070-E2216 PolarHBondContact OG-OE2 3.45Å
2071	L	83	Confident	80.6	Confident	45 Å²	45	71.8 Å²	71.8	24%	0.236	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.8	168.6	-61.6	-179.4	0	0	0	112.7	F2159 K2201 E2216	L2071-F2159 HydrophobicContact CD2-CD1 4.14Å; L2071-F2159 HydrophobicContact CD2-CD2 3.61Å; L2071-F2159 HydrophobicContact CD2-CE1 4.11Å; L2071-F2159 HydrophobicContact CD2-CE2 3.58Å; L2071-F2159 HydrophobicContact CD2-CG 3.88Å; L2071-F2159 HydrophobicContact CD2-CZ 3.83Å; L2071-K2201 HydrophobicContact CD1-CG 4.04Å; L2071-E2216 WeakPolarHBondContact CB-OE2 3.31Å; L2071-E2216 HydrophobicContact CD1-CB 4.15Å; L2071-E2216 HydrophobicContact CG-CB 4.49Å; L2071-E2216 PolarHBondContact N-OE2 3.13Å
2072	L	82.5	Confident	80.6	Confident	91 Å²	91	72.2 Å²	72.2	48%	0.476	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-8.9	173.3	-62.5	-179.6	0	0	0	113.2	S2070 P2087 M2088	S2070-L2072 PolarHBondContact O-N 3.48Å; S2070-L2072 WeakPolarHBondContact OG-CB 3.31Å; S2070-L2072 PolarHBondContact OG-N 3.09Å; L2072-P2087 HydrophobicContact CD1-CB 4.3Å; L2072-P2087 HydrophobicContact CD1-CG 3.89Å; L2072-M2088 HydrophobicContact CD1-CE 3.74Å
2073	G	81.3	Confident	80.7	Confident	30 Å²	30	69 Å²	69	31%	0.309	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	119.2	-124.9	178.2	0	0	0	0	0	113.5	S2070	S2070-G2073 PolarHBondContact O-N 2.95Å; S2070-G2073 VanDerWaalsContact O-N 3.13Å
2074	R	85.2	Confident	81.4	Confident	222 Å²	222	61.7 Å²	61.7	84%	0.838	32%	0.317	S	S	*	.			trans	-105.4	121.9	177.5	-72.3	-174.1	176.3	-170.2	-0.5	110.8	N2058	N2058-R2074 VanDerWaalsContact OD1-CA 3.23Å; N2058-R2074 WeakPolarHBondContact OD1-CA 3.4Å
2075	Y	88.7	Confident	82.3	Confident	11 Å²	11	61.3 Å²	61.3	4%	0.043	31%	0.309	C	S	.	.			trans	-87.1	159.3	173.8	50.7	-96.3	0	0	0	111.4	F2057 N2058 R2068 L2077 P2084 P2104 W2214	F2057-Y2075 HydrophobicContact CB-CE2 4.02Å; F2057-Y2075 HydrophobicContact CD1-CE2 4.44Å; F2057-Y2075 HydrophobicContact CG-CE2 4.49Å; N2058-Y2075 PolarHBondContact N-OH 2.94Å; N2058-Y2075 PolarHBondContact ND2-O 2.95Å; N2058-Y2075 WeakPolarHBondContact OD1-CD1 3.42Å; N2058-Y2075 WeakPolarHBondContact OD1-CE1 3.27Å; N2058-Y2075 PolarHBondContact OD1-N 3.41Å; R2068-Y2075 WeakPolarHBondContact O-CE1 3.44Å; R2068-Y2075 PolarHBondContact O-OH 3.05Å; Y2075-L2077 HydrophobicContact CD2-CD2 4.12Å; Y2075-L2077 HydrophobicContact CE2-CD2 3.83Å; Y2075-P2084 HydrophobicContact CD2-CB 3.74Å; Y2075-P2084 HydrophobicContact CE2-CB 3.54Å; Y2075-P2104 HydrophobicContact CE1-CG 3.93Å; Y2075-W2214 AromaticContact CD1-CH2 3.93Å; Y2075-W2214 HydrophobicContact CD1-CH2 3.93Å; Y2075-W2214 AromaticContact CD1-CZ2 3.74Å; Y2075-W2214 HydrophobicContact CD1-CZ2 3.74Å; Y2075-W2214 AromaticContact CD2-CH2 3.97Å; Y2075-W2214 HydrophobicContact CD2-CH2 3.97Å; Y2075-W2214 HydrophobicContact CE1-CH2 4.45Å; Y2075-W2214 HydrophobicContact CE1-CZ2 4.33Å; Y2075-W2214 AromaticContact CG-CH2 3.65Å; Y2075-W2214 HydrophobicContact CG-CH2 3.65Å; Y2075-W2214 AromaticContact CG-CZ2 3.88Å; Y2075-W2214 HydrophobicContact CG-CZ2 3.88Å
2076	R	87.7	Confident	83	Confident	156 Å²	156	54 Å²	54	59%	0.589	28%	0.278	S	S	*	.			trans	-77.5	154.4	176.1	-62.8	-179.4	-175.7	171.5	3	110.3	L2085	R2076-L2085 HydrophobicContact CB-CB 4.39Å; R2076-L2085 HydrophobicContact CB-CD1 4.26Å; R2076-L2085 PolarHBondContact O-N 3.35Å
2077	L	86.5	Confident	83.5	Confident	82 Å²	82	55.7 Å²	55.7	43%	0.429	29%	0.289	S	S	.	.	B	Isolated β-bridge	trans	-110	143.8	167.1	-56.8	-178.6	0	0	0	108.2	F2057 Y2075 A2083 P2084	F2057-L2077 HydrophobicContact CB-CD1 4.38Å; F2057-L2077 HydrophobicContact CB-CD2 3.85Å; F2057-L2077 HydrophobicContact CD2-CD1 4.37Å; F2057-L2077 HydrophobicContact CD2-CD2 3.96Å; F2057-L2077 HydrophobicContact CG-CD2 3.99Å; Y2075-L2077 HydrophobicContact CD2-CD2 4.12Å; Y2075-L2077 HydrophobicContact CE2-CD2 3.83Å; L2077-A2083 CarbonylContact C-O 3.35Å; L2077-A2083 WeakPolarHBondContact CA-O 3.16Å; L2077-P2084 HydrophobicContact CD2-CB 4.16Å
2078	D	81.1	Confident	83.8	Confident	38 Å²	38	58 Å²	58	20%	0.203	30%	0.303	C	S	.	.			trans	-67.4	133.4	167.7	166.5	33.5	0	0	0	110.1	T2080 T2081 G2082 A2083 L2085	D2078-T2080 VanDerWaalsContact C-N 3.28Å; D2078-T2080 PolarHBondContact O-N 3.34Å; D2078-T2080 PolarHBondContact OD1-N 2.98Å; D2078-T2080 PolarHBondContact OD1-OG1 3.39Å; D2078-T2080 PolarHBondContact OD2-OG1 3.14Å; D2078-T2081 VanDerWaalsContact OD2-CB 3.29Å; D2078-T2081 WeakPolarHBondContact OD2-CB 3.35Å; D2078-T2081 WeakPolarHBondContact OD2-CG2 3.31Å; D2078-T2081 PolarHBondContact OD2-N 3.18Å; D2078-T2081 PolarHBondContact OD2-OG1 2.97Å; D2078-G2082 VanDerWaalsContact O-CA 3.26Å; D2078-G2082 WeakPolarHBondContact O-CA 3.46Å; D2078-G2082 PolarHBondContact O-N 3.47Å; D2078-G2082 VanDerWaalsContact O-N 3.08Å; D2078-A2083 PolarHBondContact N-O 2.9Å; D2078-L2085 HydrophobicContact CB-CD1 4.33Å; D2078-L2085 HydrophobicContact CB-CD2 4.19Å; D2078-L2085 HydrophobicContact CB-CG 4.24Å
2079	S	78	Confident	84	Confident	110 Å²	110	57.8 Å²	57.8	77%	0.769	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-23.5	178.9	59.7	0	0	0	0	113.2
2080	T	74.4	Confident	84.2	Confident	95 Å²	95	55.5 Å²	55.5	58%	0.583	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-60.6	-176.4	74.8	0	0	0	0	112.1	R2053 D2078	R2053-T2080 PolarHBondContact NH2-O 2.84Å; D2078-T2080 VanDerWaalsContact C-N 3.28Å; D2078-T2080 PolarHBondContact O-N 3.34Å; D2078-T2080 PolarHBondContact OD1-N 2.98Å; D2078-T2080 PolarHBondContact OD1-OG1 3.39Å; D2078-T2080 PolarHBondContact OD2-OG1 3.14Å
2081	T	73.2	Confident	84.2	Confident	54 Å²	54	56.3 Å²	56.3	33%	0.331	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-28.9	-179	62.2	0	0	0	0	113.3	D2078 A2083	D2078-T2081 VanDerWaalsContact OD2-CB 3.29Å; D2078-T2081 WeakPolarHBondContact OD2-CB 3.35Å; D2078-T2081 WeakPolarHBondContact OD2-CG2 3.31Å; D2078-T2081 PolarHBondContact OD2-N 3.18Å; D2078-T2081 PolarHBondContact OD2-OG1 2.97Å; T2081-A2083 VanDerWaalsContact OG1-CB 3.24Å; T2081-A2083 WeakPolarHBondContact OG1-CB 3.26Å; T2081-A2083 PolarHBondContact OG1-N 3.38Å
2082	G	79.7	Confident	84.2	Confident	13 Å²	13	54.1 Å²	54.1	13%	0.134	28%	0.284	C	S	.	.			trans	77.7	5.1	-166.1	0	0	0	0	0	114.1	F2057 D2078	F2057-G2082 WeakPolarHBondContact CE2-O 3.29Å; D2078-G2082 VanDerWaalsContact O-CA 3.26Å; D2078-G2082 WeakPolarHBondContact O-CA 3.46Å; D2078-G2082 PolarHBondContact O-N 3.47Å; D2078-G2082 VanDerWaalsContact O-N 3.08Å
2083	A	80.5	Confident	84.1	Confident	5 Å²	5	50.3 Å²	50.3	4%	0.041	27%	0.265	C	S	.	.			trans	-68.1	152.2	175.4	0	0	0	0	0	111.4	L2052 L2077 D2078 T2081 S2212	L2052-A2083 HydrophobicContact CD1-CB 4.12Å; L2077-A2083 CarbonylContact C-O 3.35Å; L2077-A2083 WeakPolarHBondContact CA-O 3.16Å; D2078-A2083 PolarHBondContact N-O 2.9Å; T2081-A2083 VanDerWaalsContact OG1-CB 3.24Å; T2081-A2083 WeakPolarHBondContact OG1-CB 3.26Å; T2081-A2083 PolarHBondContact OG1-N 3.38Å; A2083-S2212 WeakPolarHBondContact CB-OG 3.28Å
2084	P	88.9	Confident	83.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-67.4	150.3	168.4	31.3	-35.6	0	0	0	110.9	F2057 Y2075 L2077 W2102 S2212 W2214	F2057-P2084 HydrophobicContact CD1-CG 4.47Å; F2057-P2084 HydrophobicContact CE1-CG 4.08Å; F2057-P2084 HydrophobicContact CZ-CG 4.45Å; Y2075-P2084 HydrophobicContact CD2-CB 3.74Å; Y2075-P2084 HydrophobicContact CE2-CB 3.54Å; L2077-P2084 HydrophobicContact CD2-CB 4.16Å; P2084-W2102 HydrophobicContact CG-CB 4.31Å; P2084-S2212 WeakPolarHBondContact CG-O 3.49Å; P2084-S2212 WeakPolarHBondContact O-CA 3.18Å; P2084-S2212 WeakPolarHBondContact O-CB 3.37Å; P2084-S2212 PolarHBondContact O-OG 3.45Å; P2084-W2214 HydrophobicContact CB-CH2 4.05Å; P2084-W2214 HydrophobicContact CB-CZ3 4.05Å; P2084-W2214 HydrophobicContact CG-CZ3 4.47Å
2085	L	89.1	Confident	83.4	Confident	32 Å²	32	42.7 Å²	42.7	17%	0.168	24%	0.235	C	C	.	.			trans	-109.7	131.7	173.7	-66.9	172.4	0	0	0	109.9	W2007 R2076 D2078 D2211	W2007-L2085 HydrophobicContact CH2-CD2 3.83Å; W2007-L2085 HydrophobicContact CZ2-CD2 3.87Å; W2007-L2085 HydrophobicContact CZ3-CD2 4.15Å; R2076-L2085 HydrophobicContact CB-CB 4.39Å; R2076-L2085 HydrophobicContact CB-CD1 4.26Å; R2076-L2085 PolarHBondContact O-N 3.35Å; D2078-L2085 HydrophobicContact CB-CD1 4.33Å; D2078-L2085 HydrophobicContact CB-CD2 4.19Å; D2078-L2085 HydrophobicContact CB-CG 4.24Å; L2085-D2211 CarbonylContact C-O 3.58Å; L2085-D2211 WeakPolarHBondContact CA-O 3.32Å
2086	N	89.9	Confident	82.7	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	24%	0.238	C	C	.	.			trans	-54.4	124.4	177.2	176.6	-22.4	0	0	0	110.3	W2007 M2088 G2089 T2091 Y2203 A2210 D2211 W2214	W2007-N2086 VanDerWaalsContact CD1-O 3.27Å; W2007-N2086 PolarHBondContact NE1-O 3.24Å; N2086-M2088 PolarHBondContact O-N 2.99Å; N2086-M2088 PolarHBondContact OD1-N 3.42Å; N2086-G2089 WeakPolarHBondContact CB-O 3.48Å; N2086-G2089 PolarHBondContact O-N 3.38Å; N2086-T2091 VanDerWaalsContact ND2-CG2 3.25Å; N2086-T2091 WeakPolarHBondContact ND2-CG2 3.5Å; N2086-Y2203 PolarHBondContact ND2-OH 3.33Å; N2086-Y2203 VanDerWaalsContact OD1-CE2 3.25Å; N2086-Y2203 WeakPolarHBondContact OD1-CE2 3.28Å; N2086-A2210 PolarHBondContact ND2-O 2.92Å; N2086-D2211 PolarHBondContact N-O 2.99Å; N2086-W2214 HydrophobicContact CB-CE3 3.97Å; N2086-W2214 HydrophobicContact CB-CZ3 4.44Å
2087	P	88.4	Confident	82.1	Confident	47 Å²	47	36.9 Å²	36.9	31%	0.305	22%	0.22	S	C	.	.	S	Bend	trans	-65.8	-19.7	-173.5	26.4	-35.4	0	0	0	114.4	L2072 Y2203 W2214	L2072-P2087 HydrophobicContact CD1-CB 4.3Å; L2072-P2087 HydrophobicContact CD1-CG 3.89Å; P2087-Y2203 HydrophobicContact CG-CD2 4.49Å; P2087-W2214 VanDerWaalsContact CD-CE2 3.44Å; P2087-W2214 HydrophobicContact CG-CZ2 4.26Å
2088	M	87.4	Confident	81.5	Confident	96 Å²	96	34.4 Å²	34.4	47%	0.473	21%	0.207	S	C	.	.	S	Bend	trans	-85.6	-32.9	179	-59.5	-63.4	86.9	0	0	113	L2072 N2086 Y2203	L2072-M2088 HydrophobicContact CD1-CE 3.74Å; N2086-M2088 PolarHBondContact O-N 2.99Å; N2086-M2088 PolarHBondContact OD1-N 3.42Å; M2088-Y2203 HydrophobicContact CB-CE1 4.31Å; M2088-Y2203 HydrophobicContact CB-CE2 4.38Å; M2088-Y2203 HydrophobicContact CG-CD1 3.55Å; M2088-Y2203 HydrophobicContact CG-CD2 3.8Å; M2088-Y2203 HydrophobicContact CG-CE1 3.55Å; M2088-Y2203 HydrophobicContact CG-CE2 3.8Å; M2088-Y2203 HydrophobicContact CG-CG 3.68Å; M2088-Y2203 HydrophobicContact SD-CD1 4.3Å; M2088-Y2203 HydrophobicContact SD-CG 4.44Å
2089	G	87.9	Confident	81.4	Confident	2 Å²	2	32.6 Å²	32.6	2%	0.021	20%	0.197	C	C	.	.			trans	154.3	-168.8	-178.2	0	0	0	0	0	114.7	M2005 W2007 N2086	M2005-G2089 CarbonylContact O-C 3.55Å; M2005-G2089 WeakPolarHBondContact O-CA 3.39Å; W2007-G2089 PolarHBondContact NE1-O 2.63Å; N2086-G2089 WeakPolarHBondContact CB-O 3.48Å; N2086-G2089 PolarHBondContact O-N 3.38Å
2090	R	89.3	Confident	81.4	Confident	27 Å²	27	27.6 Å²	27.6	10%	0.102	16%	0.162	C	C	.	.			trans	-68.1	139.4	167.9	-68.3	174.6	-173.2	99	1.3	110.1	V2000 R2004 M2005 A2006 W2007 V2009 Y2014	V2000-R2090 HydrophobicContact CG1-CB 4.09Å; V2000-R2090 HydrophobicContact CG2-CB 4.31Å; R2004-R2090 PolarHBondContact O-NH1 3.14Å; M2005-R2090 PolarHBondContact O-N 3.35Å; A2006-R2090 PolarHBondContact O-NH1 3.35Å; W2007-R2090 HydrophobicContact CD2-CG 4.1Å; W2007-R2090 HydrophobicContact CE3-CG 3.74Å; W2007-R2090 HydrophobicContact CH2-CB 4.44Å; W2007-R2090 HydrophobicContact CH2-CG 3.63Å; W2007-R2090 HydrophobicContact CZ2-CG 3.99Å; W2007-R2090 HydrophobicContact CZ3-CG 3.51Å; V2009-R2090 VanDerWaalsContact O-CZ 3.31Å; V2009-R2090 PolarHBondContact O-NH1 3.35Å; V2009-R2090 PolarHBondContact O-NH2 3.27Å; Y2014-R2090 HydrophobicContact CD1-CG 4.31Å; Y2014-R2090 HydrophobicContact CE1-CB 4.28Å; Y2014-R2090 HydrophobicContact CE1-CG 3.88Å; Y2014-R2090 HydrophobicContact CE2-CB 3.88Å; Y2014-R2090 HydrophobicContact CE2-CG 4.15Å
2091	T	85.6	Confident	81.7	Confident	25 Å²	25	23.7 Å²	23.7	15%	0.153	14%	0.137	C	C	.	.			trans	-119.9	-3.3	-175.3	71.7	0	0	0	0	113.8	R1997 Y2014 N2086 L2093 A2210 D2211	R1997-T2091 PolarHBondContact NH1-O 3.21Å; Y2014-T2091 PolarHBondContact OH-N 2.74Å; N2086-T2091 VanDerWaalsContact ND2-CG2 3.25Å; N2086-T2091 WeakPolarHBondContact ND2-CG2 3.5Å; T2091-L2093 VanDerWaalsContact C-N 3.25Å; T2091-L2093 PolarHBondContact O-N 2.73Å; T2091-L2093 PolarHBondContact OG1-N 2.92Å; T2091-A2210 WeakPolarHBondContact OG1-CA 3.3Å; T2091-D2211 WeakPolarHBondContact CA-OD1 3.49Å; T2091-D2211 WeakPolarHBondContact CB-OD1 3.37Å; T2091-D2211 PolarHBondContact N-OD1 2.72Å; T2091-D2211 PolarHBondContact OG1-N 3.05Å; T2091-D2211 VanDerWaalsContact OG1-N 3.13Å; T2091-D2211 PolarHBondContact OG1-OD1 3.46Å
2092	G	82.7	Confident	82.3	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	76.6	4.9	-176	0	0	0	0	0	115	R1997 M1998 Y2014 Y2017	R1997-G2092 WeakPolarHBondContact CA-O 3.32Å; M1998-G2092 PolarHBondContact N-O 3.47Å; M1998-G2092 WeakPolarHBondContact O-CA 3.43Å; Y2014-G2092 WeakPolarHBondContact OH-CA 3.24Å; Y2014-G2092 PolarHBondContact OH-N 3.4Å; Y2017-G2092 PolarHBondContact N-O 3.03Å; Y2017-G2092 VanDerWaalsContact N-O 3.14Å
2093	L	80.4	Confident	82.7	Confident	11 Å²	11	21.9 Å²	21.9	6%	0.058	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	115.5	-175.7	-157.4	72	0	0	0	110.5	M1996 R1997 Y2017 A2019 T2091 A2210 D2211	M1996-L2093 WeakPolarHBondContact O-CD1 3.42Å; R1997-L2093 HydrophobicContact CG-CB 4.4Å; R1997-L2093 HydrophobicContact CG-CD1 4.13Å; Y2017-L2093 HydrophobicContact CD1-CD1 4.23Å; A2019-L2093 HydrophobicContact CB-CD1 3.68Å; A2019-L2093 HydrophobicContact CB-CD2 4.25Å; A2019-L2093 HydrophobicContact CB-CG 4.02Å; T2091-L2093 VanDerWaalsContact C-N 3.25Å; T2091-L2093 PolarHBondContact O-N 2.73Å; T2091-L2093 PolarHBondContact OG1-N 2.92Å; L2093-A2210 HydrophobicContact CB-CB 4.29Å; L2093-A2210 HydrophobicContact CD2-CB 4.13Å; L2093-A2210 HydrophobicContact CG-CB 4.44Å; L2093-D2211 WeakPolarHBondContact O-CB 3.29Å; L2093-D2211 VanDerWaalsContact O-CG 3.32Å; L2093-D2211 PolarHBondContact O-N 3.4Å
2094	L	78.1	Confident	83.1	Confident	82 Å²	82	22 Å²	22	43%	0.429	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	154.7	-179.1	-154.8	80.2	0	0	0	110.9	A2016 Y2017 D2018	A2016-L2094 HydrophobicContact CB-CB 4.05Å; A2016-L2094 HydrophobicContact CB-CD1 4.16Å; Y2017-L2094 PolarHBondContact O-N 3.25Å; D2018-L2094 HydrophobicContact CB-CB 4.31Å; D2018-L2094 HydrophobicContact CB-CD2 4.38Å
2095	G	74.7	Confident	83.1	Confident	9 Å²	9	22.2 Å²	22.2	9%	0.093	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	-139.8	171.4	0	0	0	0	0	113.3	A2210 S2212	G2095-A2210 WeakPolarHBondContact O-CB 3.22Å; G2095-S2212 CarbonylContact O-C 3.57Å; G2095-S2212 WeakPolarHBondContact O-CA 3.18Å; G2095-S2212 WeakPolarHBondContact O-CB 3.32Å; G2095-S2212 PolarHBondContact O-N 2.9Å
2096	K	74.3	Confident	83.1	Confident	25 Å²	25	21.3 Å²	21.3	11%	0.109	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-14.8	-166.6	176.8	167.3	163.1	-64.9	0	113.8	L2099 P2100 W2102 A2213	K2096-L2099 VanDerWaalsContact CE-O 3.27Å; K2096-L2099 WeakPolarHBondContact CE-O 3.4Å; K2096-L2099 WeakPolarHBondContact CG-O 3.4Å; K2096-L2099 PolarHBondContact NZ-O 3.03Å; K2096-L2099 PolarHBondContact O-N 3.42Å; K2096-P2100 WeakPolarHBondContact CE-O 3.43Å; K2096-P2100 PolarHBondContact NZ-O 3.27Å; K2096-P2100 VanDerWaalsContact NZ-O 3.12Å; K2096-W2102 HydrophobicContact CB-CD2 4.05Å; K2096-W2102 HydrophobicContact CB-CE3 4.04Å; K2096-W2102 HydrophobicContact CB-CH2 3.92Å; K2096-W2102 HydrophobicContact CB-CZ2 3.9Å; K2096-W2102 HydrophobicContact CB-CZ3 4Å; K2096-W2102 HydrophobicContact CD-CD2 3.84Å; K2096-W2102 HydrophobicContact CD-CG 3.93Å; K2096-W2102 HydrophobicContact CD-CZ2 4.14Å; K2096-W2102 HydrophobicContact CG-CD2 4.39Å; K2096-A2213 HydrophobicContact CB-CB 4.42Å; K2096-A2213 HydrophobicContact CG-CB 4.15Å
2097	G	74.1	Confident	83	Confident	20 Å²	20	21.4 Å²	21.4	21%	0.206	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	-142	-173.7	0	0	0	0	0	112.6	L2099	G2097-L2099 VanDerWaalsContact C-N 3.28Å; G2097-L2099 PolarHBondContact O-N 3.16Å
2098	L	73.4	Confident	83.1	Confident	31 Å²	31	19.2 Å²	19.2	16%	0.162	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	3.3	-176.2	-61.8	175.6	0	0	0	114.5	M1985 F1988 F1990 E2022 L2024 L2208	M1985-L2098 WeakPolarHBondContact CE-O 3.48Å; F1988-L2098 HydrophobicContact CD1-CD1 4.45Å; F1990-L2098 HydrophobicContact CD1-CD1 4.07Å; F1990-L2098 HydrophobicContact CE1-CD1 3.81Å; E2022-L2098 HydrophobicContact CB-CD2 4.28Å; L2024-L2098 HydrophobicContact CD1-CB 3.92Å; L2024-L2098 HydrophobicContact CD1-CD2 4.01Å; L2024-L2098 WeakPolarHBondContact CD1-O 3.33Å; L2024-L2098 HydrophobicContact CG-CD2 4.2Å; L2098-L2208 HydrophobicContact CB-CD2 3.88Å; L2098-L2208 HydrophobicContact CD1-CD2 4.25Å
2099	L	79.5	Confident	83.2	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.08	C	C	.	.			trans	-83	149.1	-177.1	-70.2	172.7	0	0	0	112.6	K2096 G2097 N2105 L2208 A2213 M2215	K2096-L2099 VanDerWaalsContact CE-O 3.27Å; K2096-L2099 WeakPolarHBondContact CE-O 3.4Å; K2096-L2099 WeakPolarHBondContact CG-O 3.4Å; K2096-L2099 PolarHBondContact NZ-O 3.03Å; K2096-L2099 PolarHBondContact O-N 3.42Å; G2097-L2099 VanDerWaalsContact C-N 3.28Å; G2097-L2099 PolarHBondContact O-N 3.16Å; L2099-N2105 HydrophobicContact CD2-CB 4.35Å; L2099-L2208 HydrophobicContact CD2-CB 4.18Å; L2099-L2208 HydrophobicContact CD2-CD1 4.4Å; L2099-L2208 HydrophobicContact CG-CB 4.41Å; L2099-A2213 HydrophobicContact CB-CB 4.05Å; L2099-A2213 HydrophobicContact CD1-CB 3.83Å; L2099-A2213 WeakPolarHBondContact CD1-O 3.33Å; L2099-M2215 HydrophobicContact CD1-CG 4.26Å; L2099-M2215 HydrophobicContact CD2-CG 3.68Å; L2099-M2215 HydrophobicContact CD2-SD 4.12Å
2100	P	77	Confident	83.2	Confident	4 Å²	4	14.8 Å²	14.8	3%	0.026	8%	0.08	C	C	.	.	S	Bend	trans	-73.3	-30.7	-174.1	26.8	-33.8	0	0	0	114.2	F2026 H2032 D2033 K2096 N2105 L2150	F2026-P2100 HydrophobicContact CE1-CB 3.98Å; H2032-P2100 WeakPolarHBondContact CA-O 3.18Å; D2033-P2100 PolarHBondContact N-O 3.35Å; D2033-P2100 VanDerWaalsContact N-O 3.15Å; K2096-P2100 WeakPolarHBondContact CE-O 3.43Å; K2096-P2100 PolarHBondContact NZ-O 3.27Å; K2096-P2100 VanDerWaalsContact NZ-O 3.12Å; P2100-N2105 WeakPolarHBondContact CD-OD1 3.37Å; P2100-N2105 WeakPolarHBondContact CG-OD1 2.97Å; P2100-L2150 HydrophobicContact CG-CD1 4.15Å
2101	R	82.1	Confident	83.2	Confident	14 Å²	14	13.6 Å²	13.6	5%	0.053	8%	0.076	C	C	.	.	S	Bend	trans	-123.8	153.9	-174.7	-54.7	-64.2	-177.3	-170.6	-4.5	113	E2030 S2031 D2033 L2066 N2105 D2152	E2030-R2101 PolarHBondContact O-NH1 2.87Å; E2030-R2101 PolarHBondContact O-NH2 2.91Å; S2031-R2101 PolarHBondContact O-NH2 3.46Å; D2033-R2101 VanDerWaalsContact OD1-CD 3.22Å; D2033-R2101 WeakPolarHBondContact OD1-CD 3.45Å; D2033-R2101 IonicContact OD1-CZ 3.85Å; D2033-R2101 IonicContact OD1-NE 2.7Å; D2033-R2101 IonicContact OD1-NH1 3.37Å; D2033-R2101 PolarHBondContact OD1-NH1 3.38Å; D2033-R2101 WeakPolarHBondContact OD2-CA 3.38Å; D2033-R2101 WeakPolarHBondContact OD2-CB 3.32Å; D2033-R2101 WeakPolarHBondContact OD2-CD 3.37Å; L2066-R2101 HydrophobicContact CD2-CB 4.36Å; L2066-R2101 HydrophobicContact CD2-CG 3.78Å; R2101-N2105 WeakPolarHBondContact CB-OD1 3.43Å; R2101-N2105 PolarHBondContact N-OD1 3.1Å; R2101-N2105 PolarHBondContact O-ND2 2.85Å; R2101-N2105 PolarHBondContact O-OD1 2.99Å; R2101-D2152 IonicContact NH2-OD2 3.16Å
2102	W	84.8	Confident	83.4	Confident	28 Å²	28	12.6 Å²	12.6	11%	0.106	7%	0.07	C	C	.	.	S	Bend	trans	-75.7	136.9	168.3	-66.2	93.7	0	0	0	111.2	D2033 L2052 F2057 R2068 P2084 K2096	D2033-W2102 PolarHBondContact O-NE1 3.03Å; D2033-W2102 VanDerWaalsContact O-NE1 3.14Å; D2033-W2102 PolarHBondContact OD2-N 3.28Å; L2052-W2102 HydrophobicContact CD2-CD2 3.71Å; L2052-W2102 HydrophobicContact CD2-CE3 4.02Å; L2052-W2102 HydrophobicContact CD2-CG 4.07Å; L2052-W2102 HydrophobicContact CD2-CH2 4.42Å; L2052-W2102 HydrophobicContact CD2-CZ2 4.17Å; L2052-W2102 HydrophobicContact CD2-CZ3 4.34Å; F2057-W2102 HydrophobicContact CE1-CB 3.91Å; F2057-W2102 HydrophobicContact CZ-CB 4.24Å; R2068-W2102 PolarHBondContact NH1-O 3.39Å; P2084-W2102 HydrophobicContact CG-CB 4.31Å; K2096-W2102 HydrophobicContact CB-CD2 4.05Å; K2096-W2102 HydrophobicContact CB-CE3 4.04Å; K2096-W2102 HydrophobicContact CB-CH2 3.92Å; K2096-W2102 HydrophobicContact CB-CZ2 3.9Å; K2096-W2102 HydrophobicContact CB-CZ3 4Å; K2096-W2102 HydrophobicContact CD-CD2 3.84Å; K2096-W2102 HydrophobicContact CD-CG 3.93Å; K2096-W2102 HydrophobicContact CD-CZ2 4.14Å; K2096-W2102 HydrophobicContact CG-CD2 4.39Å
2103	G	87.7	Confident	83.8	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	84.9	-141.3	-178.5	0	0	0	0	0	113.4	N2105 S2212 A2213 W2214	G2103-N2105 PolarHBondContact O-N 2.87Å; G2103-N2105 PolarHBondContact O-ND2 2.86Å; G2103-S2212 PolarHBondContact N-O 3.06Å; G2103-A2213 WeakPolarHBondContact O-CA 3.3Å; G2103-W2214 PolarHBondContact O-N 3.37Å; G2103-W2214 VanDerWaalsContact O-N 3.08Å
2104	P	89.3	Confident	84.2	Confident	7 Å²	7	14.1 Å²	14.1	5%	0.045	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	119.5	-176.7	29.6	-34.5	0	0	0	111.9	Y2075 W2214 E2216	Y2075-P2104 HydrophobicContact CE1-CG 3.93Å; P2104-W2214 HydrophobicContact CB-CZ2 4.23Å; P2104-W2214 HydrophobicContact CG-CZ2 4.44Å; P2104-E2216 HydrophobicContact CB-CG 4.05Å
2105	N	89	Confident	84.6	Confident	6 Å²	6	11.8 Å²	11.8	3%	0.032	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	103.1	174.3	-71.4	-102.4	0	0	0	108.5	L2099 P2100 R2101 G2103 L2150 W2214 M2215 E2216	L2099-N2105 HydrophobicContact CD2-CB 4.35Å; P2100-N2105 WeakPolarHBondContact CD-OD1 3.37Å; P2100-N2105 WeakPolarHBondContact CG-OD1 2.97Å; R2101-N2105 WeakPolarHBondContact CB-OD1 3.43Å; R2101-N2105 PolarHBondContact N-OD1 3.1Å; R2101-N2105 PolarHBondContact O-ND2 2.85Å; R2101-N2105 PolarHBondContact O-OD1 2.99Å; G2103-N2105 PolarHBondContact O-N 2.87Å; G2103-N2105 PolarHBondContact O-ND2 2.86Å; N2105-L2150 HydrophobicContact CB-CD2 4.19Å; N2105-W2214 WeakPolarHBondContact CB-O 3.32Å; N2105-W2214 PolarHBondContact N-O 3Å; N2105-M2215 WeakPolarHBondContact O-CA 3.5Å; N2105-E2216 PolarHBondContact O-N 2.93Å
2106	H	89.3	Confident	85.1	Confident	12 Å²	12	11.7 Å²	11.7	6%	0.056	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	140.1	-175.5	-61.7	99.9	0	0	0	112.1	R2067 Q2069 L2150 T2151 H2153 F2159 E2216	R2067-H2106 PolarHBondContact O-CE1 3.24Å; Q2069-H2106 PolarHBondContact O-CE1 3.38Å; Q2069-H2106 PolarHBondContact O-NE2 3.5Å; H2106-L2150 CarbonylContact O-C 3.59Å; H2106-L2150 WeakPolarHBondContact O-CA 3.48Å; H2106-T2151 PolarHBondContact O-N 2.9Å; H2106-H2153 AromaticContact CG-CD2 3.88Å; H2106-F2159 AromaticContact CD2-CE1 3.41Å; H2106-F2159 VanDerWaalsContact CD2-CE1 3.41Å; H2106-F2159 WeakPolarHBondContact CD2-CE1 3.39Å; H2106-F2159 AromaticContact CD2-CZ 3.9Å; H2106-F2159 AromaticContact CG-CE1 3.84Å; H2106-F2159 AromaticContact NE2-CE1 3.54Å; H2106-F2159 AromaticContact NE2-CZ 3.51Å; H2106-E2216 CarbonylContact C-O 3.55Å; H2106-E2216 VanDerWaalsContact CA-O 3.31Å; H2106-E2216 WeakPolarHBondContact CA-O 3.32Å
2107	S	88.9	Confident	85.4	Confident	3 Å²	3	15.1 Å²	15.1	2%	0.021	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	165.7	-178.9	116	0	0	0	0	112.9	Y2149 E2216 T2217 V2218	S2107-Y2149 CarbonylContact C-O 3.58Å; S2107-Y2149 WeakPolarHBondContact CA-O 3.42Å; S2107-Y2149 VanDerWaalsContact CB-O 3.3Å; S2107-Y2149 WeakPolarHBondContact CB-O 3.45Å; S2107-E2216 PolarHBondContact N-O 3.45Å; S2107-T2217 WeakPolarHBondContact O-CA 3.44Å; S2107-T2217 WeakPolarHBondContact OG-CG2 3.36Å; S2107-T2217 PolarHBondContact OG-OG1 3.47Å; S2107-V2218 PolarHBondContact O-N 2.8Å
2108	F	89.4	Confident	85.5	Confident	1 Å²	1	16.3 Å²	16.3	0%	0.004	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	145.3	163.2	70.6	-91.8	0	0	0	112.6	L1982 W2148 Y2149 T2151 V2163 I2166 I2167 L2170 V2218	L1982-F2108 HydrophobicContact CD2-CE1 4.19Å; L1982-F2108 HydrophobicContact CD2-CZ 4.24Å; F2108-W2148 VanDerWaalsContact O-CA 3.31Å; F2108-W2148 WeakPolarHBondContact O-CA 3.48Å; F2108-Y2149 HydrophobicContact CD2-CD2 4.3Å; F2108-Y2149 HydrophobicContact CE1-CD2 4.29Å; F2108-Y2149 HydrophobicContact CE1-CG 4.26Å; F2108-Y2149 AromaticContact CE2-CD2 3.48Å; F2108-Y2149 HydrophobicContact CE2-CD2 3.48Å; F2108-Y2149 VanDerWaalsContact CE2-CD2 3.48Å; F2108-Y2149 HydrophobicContact CE2-CE2 4.17Å; F2108-Y2149 HydrophobicContact CE2-CG 4.25Å; F2108-Y2149 AromaticContact CZ-CD2 3.48Å; F2108-Y2149 HydrophobicContact CZ-CD2 3.48Å; F2108-Y2149 VanDerWaalsContact CZ-CD2 3.48Å; F2108-Y2149 HydrophobicContact CZ-CE2 4.3Å; F2108-Y2149 AromaticContact CZ-CG 3.81Å; F2108-Y2149 HydrophobicContact CZ-CG 3.81Å; F2108-Y2149 PolarHBondContact N-O 2.89Å; F2108-Y2149 PolarHBondContact O-N 2.92Å; F2108-T2151 HydrophobicContact CD1-CG2 3.74Å; F2108-T2151 HydrophobicContact CE1-CG2 3.69Å; F2108-V2163 HydrophobicContact CB-CG1 3.79Å; F2108-V2163 HydrophobicContact CD1-CG1 4.39Å; F2108-V2163 HydrophobicContact CG-CG1 4.07Å; F2108-I2166 HydrophobicContact CE1-CG2 3.87Å; F2108-I2166 HydrophobicContact CZ-CG2 4.18Å; F2108-I2167 HydrophobicContact CD2-CD1 3.76Å; F2108-I2167 HydrophobicContact CD2-CG1 3.82Å; F2108-I2167 HydrophobicContact CE2-CD1 4.03Å; F2108-I2167 HydrophobicContact CE2-CG1 3.56Å; F2108-I2167 HydrophobicContact CG-CD1 4.4Å; F2108-I2167 HydrophobicContact CZ-CG1 4.07Å; F2108-L2170 HydrophobicContact CZ-CD2 4.23Å; F2108-V2218 CarbonylContact C-O 3.57Å; F2108-V2218 WeakPolarHBondContact CA-O 3.25Å; F2108-V2218 HydrophobicContact CB-CB 4.48Å; F2108-V2218 WeakPolarHBondContact CB-O 3.46Å
2109	V	88.8	Confident	85.4	Confident	1 Å²	1	22 Å²	22	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.1	176.3	172.1	0	0	0	0	109.1	M2146 W2148 T2217 V2218 V2219 I2220 I2267	V2109-M2146 HydrophobicContact CG1-CB 4.22Å; V2109-W2148 HydrophobicContact CG2-CB 3.8Å; V2109-T2217 HydrophobicContact CB-CG2 4.16Å; V2109-T2217 HydrophobicContact CG2-CG2 3.58Å; V2109-V2218 PolarHBondContact N-O 3.36Å; V2109-V2219 HydrophobicContact CB-CG1 4.48Å; V2109-V2219 HydrophobicContact CB-CG2 4.32Å; V2109-V2219 HydrophobicContact CG1-CG1 4.49Å; V2109-I2220 PolarHBondContact O-N 2.95Å; V2109-I2267 HydrophobicContact CG1-CD1 4.41Å
2110	L	88.7	Confident	85	Confident	5 Å²	5	31.9 Å²	31.9	3%	0.026	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	94.7	-178.4	-173.9	67.6	0	0	0	110.5	I2112 P2147 I2167 L2222 L2240	L2110-I2112 HydrophobicContact CD2-CD1 4.08Å; L2110-I2112 HydrophobicContact CD2-CG1 4.44Å; L2110-I2112 HydrophobicContact CG-CD1 4.29Å; L2110-I2112 HydrophobicContact CG-CG1 4.1Å; L2110-P2147 PolarHBondContact N-O 2.88Å; L2110-I2167 HydrophobicContact CD1-CD1 4.5Å; L2110-I2167 HydrophobicContact CD1-CG2 4.25Å; L2110-L2222 HydrophobicContact CD1-CD1 3.86Å; L2110-L2222 HydrophobicContact CD1-CG 3.97Å; L2110-L2240 HydrophobicContact CD2-CD2 4.48Å
2111	C	90	Very high	84.5	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.007	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.3	171.4	-167.4	0	0	0	0	109.3	M2146 I2220 N2221 L2222	C2111-M2146 HydrophobicContact CB-SD 3.96Å; C2111-M2146 VanDerWaalsContact SG-SD 3.64Å; C2111-I2220 PolarHBondContact N-O 2.66Å; C2111-N2221 HydrophobicContact CB-CB 4.07Å; C2111-N2221 CarbonylContact O-C 3.55Å; C2111-N2221 VanDerWaalsContact O-CA 3.3Å; C2111-N2221 WeakPolarHBondContact O-CA 3.44Å; C2111-L2222 PolarHBondContact O-N 3.23Å
2112	I	89.8	Confident	83.8	Confident	5 Å²	5	37 Å²	37	3%	0.026	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.5	177.4	-57.5	-180	0	0	0	107.7	L2110 Y2135 L2136 L2222 L2232 I2236 L2240 W2251	L2110-I2112 HydrophobicContact CD2-CD1 4.08Å; L2110-I2112 HydrophobicContact CD2-CG1 4.44Å; L2110-I2112 HydrophobicContact CG-CD1 4.29Å; L2110-I2112 HydrophobicContact CG-CG1 4.1Å; I2112-Y2135 WeakPolarHBondContact O-CA 3.49Å; I2112-L2136 HydrophobicContact CB-CB 4.13Å; I2112-L2136 HydrophobicContact CD1-CD1 4.33Å; I2112-L2136 PolarHBondContact O-N 3.44Å; I2112-L2136 VanDerWaalsContact O-N 3.08Å; I2112-L2222 WeakPolarHBondContact CA-O 3.39Å; I2112-L2222 HydrophobicContact CG1-CB 4.44Å; I2112-L2222 HydrophobicContact CG1-CD1 4.48Å; I2112-L2232 HydrophobicContact CG2-CD1 3.79Å; I2112-I2236 HydrophobicContact CD1-CD1 4.15Å; I2112-I2236 HydrophobicContact CG2-CD1 4.27Å; I2112-L2240 HydrophobicContact CD1-CD1 3.96Å; I2112-W2251 HydrophobicContact CG2-CH2 4Å; I2112-W2251 HydrophobicContact CG2-CZ3 4.41Å
2113	T	90.4	Very high	83.2	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	143.4	-170.8	60.8	0	0	0	0	113.7	L2133 Q2134 N2221 L2222 H2223 E2224 V2271	T2113-L2133 HydrophobicContact CG2-CD2 4.16Å; T2113-Q2134 VanDerWaalsContact CA-O 3.29Å; T2113-Q2134 WeakPolarHBondContact CA-O 3.43Å; T2113-N2221 PolarHBondContact OG1-OD1 2.84Å; T2113-L2222 PolarHBondContact N-O 3.47Å; T2113-H2223 WeakPolarHBondContact O-CA 3.45Å; T2113-H2223 PolarHBondContact OG1-ND1 3.17Å; T2113-E2224 PolarHBondContact O-N 3.19Å; T2113-V2271 HydrophobicContact CG2-CG1 4.16Å
2114	R	88	Confident	82.6	Confident	43 Å²	43	41.9 Å²	41.9	16%	0.162	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	161.8	175.4	71.6	178.3	-170.5	-167.9	-2.6	111.2	L2133 Q2134 E2224 D2234 W2251	R2114-L2133 WeakPolarHBondContact O-CD1 3.47Å; R2114-Q2134 HydrophobicContact CG-CB 4.06Å; R2114-Q2134 PolarHBondContact N-O 3.31Å; R2114-Q2134 PolarHBondContact O-N 3.25Å; R2114-E2224 HydrophobicContact CB-CB 3.87Å; R2114-D2234 IonicContact CZ-OD1 3.98Å; R2114-D2234 IonicContact NH1-OD1 3.16Å; R2114-D2234 PolarHBondContact NH1-OD1 3.1Å; R2114-D2234 IonicContact NH2-OD1 3.86Å; R2114-W2251 HydrophobicContact CG-CE3 4.13Å; R2114-W2251 HydrophobicContact CG-CH2 4.08Å; R2114-W2251 HydrophobicContact CG-CZ3 3.8Å; R2114-W2251 VanDerWaalsContact NH1-CE2 3.34Å; R2114-W2251 VanDerWaalsContact NH1-NE1 3.19Å; R2114-W2251 VanDerWaalsContact NH2-CG 3.33Å
2115	W	87.6	Confident	82.2	Confident	33 Å²	33	44.3 Å²	44.3	13%	0.125	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	136.8	177.4	-65.1	109.8	0	0	0	112.5	R2117 Q2124 L2133 H2223 R2275 A2277	W2115-R2117 PolarHBondContact O-N 2.98Å; W2115-Q2124 HydrophobicContact CB-CG 4.29Å; W2115-Q2124 HydrophobicContact CE3-CG 4.41Å; W2115-L2133 HydrophobicContact CD2-CD1 4.12Å; W2115-L2133 HydrophobicContact CE3-CB 4.46Å; W2115-L2133 HydrophobicContact CE3-CD1 3.82Å; W2115-L2133 HydrophobicContact CH2-CD1 4.32Å; W2115-L2133 HydrophobicContact CZ3-CB 4.3Å; W2115-L2133 HydrophobicContact CZ3-CD1 3.93Å; W2115-H2223 AromaticContact CE2-CE1 3.78Å; W2115-H2223 AromaticContact CE2-NE2 3.71Å; W2115-H2223 AromaticContact CZ2-NE2 3.97Å; W2115-H2223 AromaticContact NE1-CE1 3.55Å; W2115-H2223 AromaticContact NE1-NE2 3.18Å; W2115-H2223 PolarHBondContact NE1-NE2 3.29Å; W2115-H2223 VanDerWaalsContact NE1-NE2 3.18Å; W2115-R2275 HydrophobicContact CH2-CB 4.36Å; W2115-A2277 HydrophobicContact CZ3-CB 4.31Å
2116	T	85.6	Confident	81.7	Confident	7 Å²	7	49 Å²	49	4%	0.043	26%	0.255	C	S	.	.			trans	-65.3	127.3	168.8	-57.7	0	0	0	0	109.2	Q2124 I2125 V2132 Q2134 E2253	T2116-Q2124 CarbonylContact O-C 3.6Å; T2116-Q2124 WeakPolarHBondContact O-CA 3.22Å; T2116-I2125 HydrophobicContact CG2-CB 4.22Å; T2116-I2125 HydrophobicContact CG2-CD1 3.65Å; T2116-I2125 HydrophobicContact CG2-CG1 3.95Å; T2116-I2125 PolarHBondContact O-N 3.22Å; T2116-V2132 PolarHBondContact N-O 3.29Å; T2116-V2132 WeakPolarHBondContact OG1-CG1 3.19Å; T2116-V2132 PolarHBondContact OG1-O 3.21Å; T2116-Q2134 WeakPolarHBondContact OG1-CG 3.12Å; T2116-Q2134 PolarHBondContact OG1-NE2 3.2Å; T2116-E2253 WeakPolarHBondContact CG2-OE1 3.47Å
2117	R	80.4	Confident	81	Confident	96 Å²	96	52.8 Å²	52.8	36%	0.362	27%	0.269	S	S	.	.	B	Isolated β-bridge	trans	-117.4	137.3	178.8	-61.6	172.1	-175.9	-88.6	3.3	111	W2115 T2119 G2122 A2123 E2224	W2115-R2117 PolarHBondContact O-N 2.98Å; R2117-T2119 PolarHBondContact O-N 3.03Å; R2117-G2122 PolarHBondContact NH1-O 2.91Å; R2117-A2123 CarbonylContact C-O 3.56Å; R2117-A2123 VanDerWaalsContact CA-O 3.24Å; R2117-A2123 WeakPolarHBondContact CA-O 3.39Å; R2117-E2224 IonicContact CZ-OE1 2.79Å; R2117-E2224 IonicContact NE-OE1 2.75Å; R2117-E2224 PolarHBondContact NE-OE1 3.27Å; R2117-E2224 IonicContact NH2-OE1 3.55Å; R2117-E2224 PolarHBondContact NH2-OE1 2.69Å
2118	D	75.9	Confident	80.2	Confident	45 Å²	45	57.1 Å²	57.1	24%	0.241	30%	0.299	C	S	.	.			trans	-65.9	122.2	172.8	161.1	33	0	0	0	110.6	R2120 T2121 G2122 A2123 I2125	D2118-R2120 PolarHBondContact O-N 3.48Å; D2118-R2120 PolarHBondContact OD1-N 2.66Å; D2118-T2121 WeakPolarHBondContact CB-OG1 3.3Å; D2118-T2121 PolarHBondContact O-N 3.22Å; D2118-T2121 VanDerWaalsContact O-N 3.12Å; D2118-T2121 WeakPolarHBondContact OD2-CB 3.23Å; D2118-T2121 VanDerWaalsContact OD2-CG2 3.26Å; D2118-T2121 WeakPolarHBondContact OD2-CG2 3.47Å; D2118-T2121 PolarHBondContact OD2-N 3.36Å; D2118-T2121 VanDerWaalsContact OD2-N 3.15Å; D2118-T2121 PolarHBondContact OD2-OG1 3.16Å; D2118-G2122 PolarHBondContact O-N 3.35Å; D2118-A2123 PolarHBondContact N-O 3.42Å; D2118-I2125 HydrophobicContact CB-CG1 4.36Å
2119	T	70.6	Confident	79.3	Confident	151 Å²	151	65 Å²	65	93%	0.926	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-27	176.7	62.1	0	0	0	0	115.1	R2117	R2117-T2119 PolarHBondContact O-N 3.03Å
2120	R	71.1	Confident	79	Confident	207 Å²	207	71.1 Å²	71.1	78%	0.781	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-26.3	-177.5	-170.9	-177.1	62.4	135.4	2.1	113.9	D2118	D2118-R2120 PolarHBondContact O-N 3.48Å; D2118-R2120 PolarHBondContact OD1-N 2.66Å
2121	T	67.5	Low	78.7	Confident	86 Å²	86	71.3 Å²	71.3	53%	0.528	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-16.9	-174.3	58.8	0	0	0	0	114.7	D2118 A2123	D2118-T2121 WeakPolarHBondContact CB-OG1 3.3Å; D2118-T2121 PolarHBondContact O-N 3.22Å; D2118-T2121 VanDerWaalsContact O-N 3.12Å; D2118-T2121 WeakPolarHBondContact OD2-CB 3.23Å; D2118-T2121 VanDerWaalsContact OD2-CG2 3.26Å; D2118-T2121 WeakPolarHBondContact OD2-CG2 3.47Å; D2118-T2121 PolarHBondContact OD2-N 3.36Å; D2118-T2121 VanDerWaalsContact OD2-N 3.15Å; D2118-T2121 PolarHBondContact OD2-OG1 3.16Å; T2121-A2123 PolarHBondContact O-N 3.14Å; T2121-A2123 VanDerWaalsContact O-N 3.14Å
2122	G	67.2	Low	78.4	Confident	41 Å²	41	71.3 Å²	71.3	42%	0.423	37%	0.367	S	S	.	.			trans	69.7	-2.6	-175	0	0	0	0	0	114.8	R2117 D2118	R2117-G2122 PolarHBondContact NH1-O 2.91Å; D2118-G2122 PolarHBondContact O-N 3.35Å
2123	A	71.3	Confident	78.3	Confident	52 Å²	52	71 Å²	71	43%	0.43	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-77.7	150.7	177.4	0	0	0	0	0	111.2	R2117 D2118 T2121	R2117-A2123 CarbonylContact C-O 3.56Å; R2117-A2123 VanDerWaalsContact CA-O 3.24Å; R2117-A2123 WeakPolarHBondContact CA-O 3.39Å; D2118-A2123 PolarHBondContact N-O 3.42Å; T2121-A2123 PolarHBondContact O-N 3.14Å; T2121-A2123 VanDerWaalsContact O-N 3.14Å
2124	Q	76.6	Confident	78.3	Confident	78 Å²	78	72.5 Å²	72.5	36%	0.364	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-58.9	135.6	174.3	-175.9	179.6	18.5	0	0	110.8	W2115 T2116	W2115-Q2124 HydrophobicContact CB-CG 4.29Å; W2115-Q2124 HydrophobicContact CE3-CG 4.41Å; T2116-Q2124 CarbonylContact O-C 3.6Å; T2116-Q2124 WeakPolarHBondContact O-CA 3.22Å
2125	I	80.4	Confident	78.3	Confident	57 Å²	57	70.4 Å²	70.4	29%	0.292	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-78.1	129.4	170.4	-58.1	-168.3	0	0	0	108.3	T2116 D2118 V2132	T2116-I2125 HydrophobicContact CG2-CB 4.22Å; T2116-I2125 HydrophobicContact CG2-CD1 3.65Å; T2116-I2125 HydrophobicContact CG2-CG1 3.95Å; T2116-I2125 PolarHBondContact O-N 3.22Å; D2118-I2125 HydrophobicContact CB-CG1 4.36Å; I2125-V2132 HydrophobicContact CB-CG2 4.39Å; I2125-V2132 HydrophobicContact CG2-CG2 4.01Å; I2125-V2132 PolarHBondContact O-N 3.24Å
2126	I	78.7	Confident	78.4	Confident	105 Å²	105	69 Å²	69	54%	0.538	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.1	-178.6	-59	175.3	0	0	0	108.1	R2130	I2126-R2130 CarbonylContact C-O 3.21Å; I2126-R2130 VanDerWaalsContact CA-O 3.28Å; I2126-R2130 WeakPolarHBondContact CA-O 3.41Å; I2126-R2130 WeakPolarHBondContact CG2-O 3.45Å
2127	R	74.1	Confident	78.5	Confident	91 Å²	91	68.7 Å²	68.7	34%	0.343	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.2	171.2	-69.7	179.8	-172.4	138.2	9.4	107.8	N2129 R2130 V2132 E2253 F2278	R2127-N2129 VanDerWaalsContact C-N 3.3Å; R2127-N2129 PolarHBondContact O-N 2.77Å; R2127-R2130 PolarHBondContact N-O 2.6Å; R2127-R2130 PolarHBondContact O-N 2.94Å; R2127-V2132 HydrophobicContact CB-CG2 4.09Å; R2127-V2132 HydrophobicContact CG-CG2 3.61Å; R2127-E2253 IonicContact CZ-OE2 3.62Å; R2127-E2253 VanDerWaalsContact CZ-OE2 3.23Å; R2127-E2253 IonicContact NH1-OE2 3.54Å; R2127-E2253 PolarHBondContact NH1-OE2 3.2Å; R2127-E2253 IonicContact NH2-OE1 2.78Å; R2127-E2253 IonicContact NH2-OE2 3.91Å; R2127-E2253 PolarHBondContact NH2-OE2 3.27Å; R2127-F2278 HydrophobicContact CB-CB 4.48Å; R2127-F2278 HydrophobicContact CB-CD2 3.51Å; R2127-F2278 HydrophobicContact CB-CE2 3.83Å; R2127-F2278 HydrophobicContact CB-CG 3.96Å
2128	S	71.3	Confident	78.6	Confident	94 Å²	94	64.4 Å²	64.4	66%	0.657	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	45.1	178.1	-55.5	0	0	0	0	114.7	R2130	S2128-R2130 PolarHBondContact O-N 3.48Å; S2128-R2130 VanDerWaalsContact O-N 3.12Å
2129	N	72.3	Confident	78.7	Confident	166 Å²	166	62.8 Å²	62.8	89%	0.888	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	9.2	-173.4	-78.4	-7.4	0	0	0	116.7	R2127	R2127-N2129 VanDerWaalsContact C-N 3.3Å; R2127-N2129 PolarHBondContact O-N 2.77Å
2130	R	81.1	Confident	78.3	Confident	131 Å²	131	56.6 Å²	56.6	49%	0.494	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	151.2	173.7	-59.1	-165.4	-172.8	-174.9	2.5	111.6	I2126 R2127 S2128 A2277 F2278	I2126-R2130 CarbonylContact C-O 3.21Å; I2126-R2130 VanDerWaalsContact CA-O 3.28Å; I2126-R2130 WeakPolarHBondContact CA-O 3.41Å; I2126-R2130 WeakPolarHBondContact CG2-O 3.45Å; R2127-R2130 PolarHBondContact N-O 2.6Å; R2127-R2130 PolarHBondContact O-N 2.94Å; S2128-R2130 PolarHBondContact O-N 3.48Å; S2128-R2130 VanDerWaalsContact O-N 3.12Å; R2130-A2277 WeakPolarHBondContact CD-O 3.15Å; R2130-A2277 PolarHBondContact NH1-O 3Å; R2130-A2277 VanDerWaalsContact NH1-O 3.11Å; R2130-F2278 HydrophobicContact CB-CB 4.3Å
2131	G	82.4	Confident	77.9	Confident	8 Å²	8	49.8 Å²	49.8	8%	0.082	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	139.6	175.2	0	0	0	0	0	111.7	A2277 F2278	G2131-A2277 WeakPolarHBondContact O-CA 3.42Å; G2131-F2278 PolarHBondContact O-N 3.18Å
2132	V	85.1	Confident	77.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-80	121.5	170.2	-175.1	0	0	0	0	109	T2116 I2125 R2127 E2253	T2116-V2132 PolarHBondContact N-O 3.29Å; T2116-V2132 WeakPolarHBondContact OG1-CG1 3.19Å; T2116-V2132 PolarHBondContact OG1-O 3.21Å; I2125-V2132 HydrophobicContact CB-CG2 4.39Å; I2125-V2132 HydrophobicContact CG2-CG2 4.01Å; I2125-V2132 PolarHBondContact O-N 3.24Å; R2127-V2132 HydrophobicContact CB-CG2 4.09Å; R2127-V2132 HydrophobicContact CG-CG2 3.61Å; V2132-E2253 HydrophobicContact CG1-CB 4.34Å; V2132-E2253 HydrophobicContact CG1-CG 4.2Å
2133	L	87.8	Confident	77.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	147.1	179.6	-165.5	70	0	0	0	110.2	T2113 R2114 W2115 V2254 A2277	T2113-L2133 HydrophobicContact CG2-CD2 4.16Å; R2114-L2133 WeakPolarHBondContact O-CD1 3.47Å; W2115-L2133 HydrophobicContact CD2-CD1 4.12Å; W2115-L2133 HydrophobicContact CE3-CB 4.46Å; W2115-L2133 HydrophobicContact CE3-CD1 3.82Å; W2115-L2133 HydrophobicContact CH2-CD1 4.32Å; W2115-L2133 HydrophobicContact CZ3-CB 4.3Å; W2115-L2133 HydrophobicContact CZ3-CD1 3.93Å; L2133-V2254 HydrophobicContact CB-CG2 3.97Å; L2133-V2254 HydrophobicContact CD2-CG2 4.3Å; L2133-V2254 HydrophobicContact CG-CG2 4.35Å; L2133-V2254 PolarHBondContact O-N 2.71Å; L2133-A2277 HydrophobicContact CB-CB 3.83Å; L2133-A2277 HydrophobicContact CD2-CB 4.31Å
2134	Q	88.7	Confident	78	Confident	30 Å²	30	52.6 Å²	52.6	14%	0.14	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	143.5	167	-55.1	-167.4	-28.9	0	0	109.9	T2113 R2114 T2116 W2251 I2252	T2113-Q2134 VanDerWaalsContact CA-O 3.29Å; T2113-Q2134 WeakPolarHBondContact CA-O 3.43Å; R2114-Q2134 HydrophobicContact CG-CB 4.06Å; R2114-Q2134 PolarHBondContact N-O 3.31Å; R2114-Q2134 PolarHBondContact O-N 3.25Å; T2116-Q2134 WeakPolarHBondContact OG1-CG 3.12Å; T2116-Q2134 PolarHBondContact OG1-NE2 3.2Å; Q2134-W2251 HydrophobicContact CB-CE3 4.31Å; Q2134-I2252 CarbonylContact C-O 3.17Å; Q2134-I2252 WeakPolarHBondContact CA-O 3.28Å
2135	Y	89.5	Confident	78.2	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	159.2	170.8	73.3	-76.7	0	0	0	111.1	I2112 A2137 M2146 W2251 I2252 V2254 L2260 L2268	I2112-Y2135 WeakPolarHBondContact O-CA 3.49Å; Y2135-A2137 HydrophobicContact CD2-CB 4.32Å; Y2135-A2137 HydrophobicContact CE2-CB 3.76Å; Y2135-M2146 HydrophobicContact CD2-CG 4.48Å; Y2135-W2251 WeakPolarHBondContact O-CA 3.4Å; Y2135-I2252 HydrophobicContact CD1-CB 4.4Å; Y2135-I2252 WeakPolarHBondContact CD1-O 3.33Å; Y2135-I2252 HydrophobicContact CE1-CB 3.9Å; Y2135-I2252 HydrophobicContact CE1-CG2 3.94Å; Y2135-I2252 PolarHBondContact N-O 3.38Å; Y2135-I2252 PolarHBondContact O-N 3.16Å; Y2135-V2254 HydrophobicContact CD1-CG2 3.89Å; Y2135-L2260 HydrophobicContact CE2-CD1 4.17Å; Y2135-L2260 HydrophobicContact CE2-CD2 4.27Å; Y2135-L2268 HydrophobicContact CD1-CD1 4.12Å; Y2135-L2268 HydrophobicContact CD1-CD2 3.82Å; Y2135-L2268 HydrophobicContact CD2-CD1 4.45Å; Y2135-L2268 HydrophobicContact CD2-CD2 4.45Å; Y2135-L2268 HydrophobicContact CE1-CD2 3.58Å; Y2135-L2268 HydrophobicContact CE2-CD2 4.24Å; Y2135-L2268 HydrophobicContact CG-CD1 3.98Å; Y2135-L2268 HydrophobicContact CG-CD2 4.25Å
2136	L	89.2	Confident	78.4	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	119.4	173	-169.9	159.5	0	0	0	109.5	I2112 P2147 I2236 L2237 L2240 W2251	I2112-L2136 HydrophobicContact CB-CB 4.13Å; I2112-L2136 HydrophobicContact CD1-CD1 4.33Å; I2112-L2136 PolarHBondContact O-N 3.44Å; I2112-L2136 VanDerWaalsContact O-N 3.08Å; L2136-P2147 HydrophobicContact CD2-CG 4.24Å; L2136-I2236 HydrophobicContact CD1-CG2 4.23Å; L2136-L2237 HydrophobicContact CD1-CD2 3.78Å; L2136-L2237 HydrophobicContact CG-CD2 3.99Å; L2136-L2240 HydrophobicContact CD1-CD1 3.8Å; L2136-L2240 HydrophobicContact CD2-CD1 3.66Å; L2136-L2240 HydrophobicContact CG-CD1 4.42Å; L2136-W2251 HydrophobicContact CB-CE3 4.22Å; L2136-W2251 HydrophobicContact CB-CZ3 4.08Å
2137	A	86.8	Confident	78.8	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	155.6	174.2	0	0	0	0	0	111.1	Y2135 L2144 S2249 K2250 I2252	Y2135-A2137 HydrophobicContact CD2-CB 4.32Å; Y2135-A2137 HydrophobicContact CE2-CB 3.76Å; A2137-L2144 HydrophobicContact CB-CB 4.37Å; A2137-L2144 HydrophobicContact CB-CD2 4.3Å; A2137-S2249 CarbonylContact O-C 3.6Å; A2137-S2249 WeakPolarHBondContact O-CA 3.47Å; A2137-K2250 PolarHBondContact N-O 3.23Å; A2137-K2250 PolarHBondContact O-N 3.1Å; A2137-I2252 HydrophobicContact CB-CD1 3.7Å; A2137-I2252 HydrophobicContact CB-CG1 4.29Å
2138	L	82.9	Confident	79.4	Confident	6 Å²	6	39 Å²	39	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.1	164.2	-60.5	172	0	0	0	109	C2145 P2147	L2138-C2145 PolarHBondContact N-O 2.91Å; L2138-C2145 PolarHBondContact O-N 3.17Å; L2138-P2147 HydrophobicContact CD1-CB 4.44Å; L2138-P2147 HydrophobicContact CD1-CG 4.29Å; L2138-P2147 HydrophobicContact CG-CG 4.43Å
2139	E	77.5	Confident	80.1	Confident	11 Å²	11	34.8 Å²	34.8	5%	0.051	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	113	175.1	-175.6	140	-169.1	0	0	108.6	V359 S360 E361 Q2248 K2250	V359-E2139 VanDerWaalsContact C-CG 3.48Å; V359-E2139 HydrophobicContact CB-CG 4.19Å; V359-E2139 HydrophobicContact CG1-CB 3.51Å; V359-E2139 VanDerWaalsContact CG1-CD 3.42Å; V359-E2139 HydrophobicContact CG1-CG 3.41Å; V359-E2139 VanDerWaalsContact CG1-CG 3.41Å; V359-E2139 WeakPolarHBondContact CG1-OE2 3.45Å; S360-E2139 WeakPolarHBondContact CB-OE1 3.42Å; S360-E2139 VanDerWaalsContact N-CG 3.26Å; S360-E2139 PolarHBondContact N-OE1 3.03Å; S360-E2139 CarbonylContact O-C 3.53Å; S360-E2139 WeakPolarHBondContact O-CG 3.36Å; S360-E2139 PolarHBondContact OG-OE1 2.72Å; E361-E2139 HydrophobicContact CG-CG 4.31Å; E2139-Q2248 HydrophobicContact CB-CB 3.87Å; E2139-Q2248 WeakPolarHBondContact CB-O 3.36Å; E2139-Q2248 HydrophobicContact CG-CB 4.3Å; E2139-Q2248 PolarHBondContact N-O 3.48Å; E2139-K2250 IonicContact OE2-NZ 3.07Å
2140	R	62.3	Low	80.7	Confident	21 Å²	21	27.1 Å²	27.1	8%	0.079	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	121.4	161.3	-83.5	-142.4	121.3	142	-6.1	115.3	S360 E361 P362 P1987 K2142 R2143 E2246 E2247	S360-R2140 CarbonylContact O-C 3.57Å; S360-R2140 WeakPolarHBondContact O-CA 3.38Å; S360-R2140 PolarHBondContact O-N 2.77Å; E361-R2140 HydrophobicContact CB-CG 4.48Å; E361-R2140 CarbonylContact O-C 3.54Å; E361-R2140 WeakPolarHBondContact O-CA 3.25Å; E361-R2140 VanDerWaalsContact O-CB 3.24Å; E361-R2140 WeakPolarHBondContact O-CB 3.41Å; E361-R2140 WeakPolarHBondContact O-CD 3.28Å; E361-R2140 WeakPolarHBondContact O-CG 3.32Å; E361-R2140 PolarHBondContact O-NE 3.09Å; E361-R2140 VanDerWaalsContact O-NE 3.09Å; P362-R2140 PolarHBondContact O-NE 3.1Å; P362-R2140 PolarHBondContact O-NH2 3.07Å; P1987-R2140 HydrophobicContact CG-CG 4.41Å; R2140-K2142 PolarHBondContact O-N 2.92Å; R2140-R2143 CarbonylContact C-O 3.57Å; R2140-R2143 PolarHBondContact N-O 2.92Å; R2140-R2143 CarbonylContact O-C 3.58Å; R2140-R2143 VanDerWaalsContact O-CA 3.31Å; R2140-R2143 WeakPolarHBondContact O-CA 3.39Å; R2140-R2143 VanDerWaalsContact O-CB 3.27Å; R2140-R2143 WeakPolarHBondContact O-CB 3.36Å; R2140-R2143 PolarHBondContact O-N 3.46Å; R2140-E2246 PolarHBondContact NE-O 3.39Å; R2140-E2246 VanDerWaalsContact NE-O 3.08Å; R2140-E2246 PolarHBondContact NH2-O 3.13Å; R2140-E2246 VanDerWaalsContact NH2-O 3.13Å; R2140-E2247 HydrophobicContact CG-CG 3.52Å; R2140-E2247 IonicContact CZ-OE1 2.76Å; R2140-E2247 IonicContact NE-OE1 2.7Å; R2140-E2247 IonicContact NH1-OE1 3.77Å; R2140-E2247 PolarHBondContact NH1-OE1 2.83Å
2141	N	62.7	Low	80.9	Confident	64 Å²	64	21 Å²	21	34%	0.342	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.8	46.3	175	-154	19.5	0	0	0	116.9	S360 E361 P362 N1989 R2143	S360-N2141 PolarHBondContact O-N 2.74Å; E361-N2141 PolarHBondContact O-N 2.84Å; P362-N2141 HydrophobicContact CB-CB 3.95Å; P362-N2141 WeakPolarHBondContact CD-OD1 3.31Å; P362-N2141 HydrophobicContact CG-CB 4.44Å; P362-N2141 WeakPolarHBondContact CG-OD1 3.21Å; N1989-N2141 PolarHBondContact OD1-ND2 3.14Å; N2141-R2143 PolarHBondContact O-N 3.39Å
2142	K	63.1	Low	80.8	Confident	149 Å²	149	21.6 Å²	21.6	65%	0.648	10%	0.099	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	8.1	-170.3	-64.2	-171.2	177.2	-176.4	0	114.3	G358 V359 R2140 N2259	G358-K2142 VanDerWaalsContact CA-O 3.29Å; G358-K2142 WeakPolarHBondContact CA-O 3.38Å; V359-K2142 VanDerWaalsContact C-CA 3.41Å; V359-K2142 PolarHBondContact N-O 2.95Å; V359-K2142 CarbonylContact O-C 3.59Å; V359-K2142 WeakPolarHBondContact O-CA 3.47Å; V359-K2142 PolarHBondContact O-N 2.96Å; R2140-K2142 PolarHBondContact O-N 2.92Å; K2142-N2259 PolarHBondContact O-ND2 3.12Å
2143	R	67.1	Low	80.5	Confident	83 Å²	83	21.7 Å²	21.7	31%	0.313	10%	0.099	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	162.8	176.9	-51.9	-178	177.7	152.3	0.9	111.8	V359 E1991 R2140 N2141 N2259	V359-R2143 PolarHBondContact O-N 2.95Å; V359-R2143 VanDerWaalsContact O-N 3.09Å; E1991-R2143 IonicContact OE1-CZ 3.67Å; E1991-R2143 IonicContact OE1-NE 2.99Å; E1991-R2143 PolarHBondContact OE1-NE 3.47Å; E1991-R2143 IonicContact OE1-NH1 3.12Å; E1991-R2143 PolarHBondContact OE1-NH1 2.8Å; E1991-R2143 IonicContact OE1-NH2 3.72Å; E1991-R2143 IonicContact OE2-CZ 3.35Å; E1991-R2143 IonicContact OE2-NE 3.41Å; E1991-R2143 PolarHBondContact OE2-NE 3.44Å; E1991-R2143 IonicContact OE2-NH1 3.61Å; E1991-R2143 PolarHBondContact OE2-NH1 2.81Å; E1991-R2143 IonicContact OE2-NH2 2.73Å; E1991-R2143 PolarHBondContact OE2-NH2 3.26Å; R2140-R2143 CarbonylContact C-O 3.57Å; R2140-R2143 PolarHBondContact N-O 2.92Å; R2140-R2143 CarbonylContact O-C 3.58Å; R2140-R2143 VanDerWaalsContact O-CA 3.31Å; R2140-R2143 WeakPolarHBondContact O-CA 3.39Å; R2140-R2143 VanDerWaalsContact O-CB 3.27Å; R2140-R2143 WeakPolarHBondContact O-CB 3.36Å; R2140-R2143 PolarHBondContact O-N 3.46Å; N2141-R2143 PolarHBondContact O-N 3.39Å; R2143-N2259 CarbonylContact C-O 3.57Å; R2143-N2259 WeakPolarHBondContact CA-O 3.28Å
2144	L	78.6	Confident	79.8	Confident	6 Å²	6	23 Å²	23	3%	0.031	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	144.2	-174.7	-50	172.4	0	0	0	110.2	V359 A2137 I2252 N2259 L2260 R2261	V359-L2144 HydrophobicContact CB-CD2 3.74Å; V359-L2144 HydrophobicContact CG1-CD2 3.17Å; A2137-L2144 HydrophobicContact CB-CB 4.37Å; A2137-L2144 HydrophobicContact CB-CD2 4.3Å; L2144-I2252 HydrophobicContact CD1-CD1 3.7Å; L2144-I2252 HydrophobicContact CD2-CD1 3.44Å; L2144-I2252 VanDerWaalsContact CD2-CD1 3.44Å; L2144-I2252 HydrophobicContact CG-CD1 4.19Å; L2144-N2259 WeakPolarHBondContact CB-O 3.33Å; L2144-N2259 WeakPolarHBondContact CG-O 3.47Å; L2144-N2259 PolarHBondContact N-O 3.06Å; L2144-L2260 HydrophobicContact CB-CB 4.27Å; L2144-L2260 HydrophobicContact CB-CD1 3.76Å; L2144-R2261 PolarHBondContact O-N 2.9Å; L2144-R2261 VanDerWaalsContact O-N 3.13Å
2145	C	80	Confident	79.1	Confident	20 Å²	20	25.2 Å²	25.2	14%	0.135	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	155.4	166.1	65.6	0	0	0	0	112.7	L2138	L2138-C2145 PolarHBondContact N-O 2.91Å; L2138-C2145 PolarHBondContact O-N 3.17Å
2146	M	86.2	Confident	78.2	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.163	C	C	.	.			trans	-84.3	152.2	167.8	-76.3	-170.7	-84.3	0	0	110.3	V2109 C2111 Y2135 W2148 H2264 I2267 L2268	V2109-M2146 HydrophobicContact CG1-CB 4.22Å; C2111-M2146 HydrophobicContact CB-SD 3.96Å; C2111-M2146 VanDerWaalsContact SG-SD 3.64Å; Y2135-M2146 HydrophobicContact CD2-CG 4.48Å; M2146-W2148 PolarHBondContact O-N 3.36Å; M2146-H2264 HydrophobicContact CE-CB 3.71Å; M2146-H2264 WeakPolarHBondContact CE-O 3.47Å; M2146-H2264 PolarHBondContact N-ND1 3.33Å; M2146-H2264 PolarHBondContact O-CE1 3.2Å; M2146-I2267 HydrophobicContact CE-CB 3.96Å; M2146-I2267 HydrophobicContact CE-CG2 3.78Å; M2146-L2268 HydrophobicContact CE-CB 4.48Å
2147	P	85.3	Confident	77.4	Confident	3 Å²	3	34 Å²	34	2%	0.019	17%	0.165	C	C	.	.			trans	-62.2	126.5	175.4	-19.1	30	0	0	0	112.2	L2110 L2136 L2138 L2240	L2110-P2147 PolarHBondContact N-O 2.88Å; L2136-P2147 HydrophobicContact CD2-CG 4.24Å; L2138-P2147 HydrophobicContact CD1-CB 4.44Å; L2138-P2147 HydrophobicContact CD1-CG 4.29Å; L2138-P2147 HydrophobicContact CG-CG 4.43Å; P2147-L2240 HydrophobicContact CB-CD2 4.21Å; P2147-L2240 HydrophobicContact CG-CD1 3.9Å; P2147-L2240 HydrophobicContact CG-CD2 4.29Å
2148	W	86.7	Confident	76.6	Confident	22 Å²	22	39.3 Å²	39.3	8%	0.083	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	153.6	-178.2	72.5	-75.3	0	0	0	111.6	M1985 F2108 V2109 M2146 L2150 L2208 M2215	M1985-W2148 HydrophobicContact CB-CH2 4.25Å; M1985-W2148 HydrophobicContact CB-CZ2 4.22Å; M1985-W2148 HydrophobicContact CG-CH2 4.42Å; M1985-W2148 HydrophobicContact SD-CH2 3.89Å; F2108-W2148 VanDerWaalsContact O-CA 3.31Å; F2108-W2148 WeakPolarHBondContact O-CA 3.48Å; V2109-W2148 HydrophobicContact CG2-CB 3.8Å; M2146-W2148 PolarHBondContact O-N 3.36Å; W2148-L2150 HydrophobicContact CZ3-CD1 4.2Å; W2148-L2150 HydrophobicContact CZ3-CD2 4.33Å; W2148-L2150 HydrophobicContact CZ3-CG 3.92Å; W2148-L2208 HydrophobicContact CH2-CD1 3.87Å; W2148-M2215 HydrophobicContact CH2-SD 4.42Å; W2148-M2215 HydrophobicContact CZ3-SD 3.83Å
2149	Y	86.4	Confident	76.2	Confident	6 Å²	6	39.8 Å²	39.8	2%	0.024	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	140	-178.1	-57.7	-95.8	0	0	0	110.4	R1984 S2107 F2108 L2170	R1984-Y2149 HydrophobicContact CB-CD1 4.04Å; R1984-Y2149 HydrophobicContact CB-CE1 4.19Å; R1984-Y2149 HydrophobicContact CG-CE1 4.46Å; S2107-Y2149 CarbonylContact C-O 3.58Å; S2107-Y2149 WeakPolarHBondContact CA-O 3.42Å; S2107-Y2149 VanDerWaalsContact CB-O 3.3Å; S2107-Y2149 WeakPolarHBondContact CB-O 3.45Å; F2108-Y2149 HydrophobicContact CD2-CD2 4.3Å; F2108-Y2149 HydrophobicContact CE1-CD2 4.29Å; F2108-Y2149 HydrophobicContact CE1-CG 4.26Å; F2108-Y2149 AromaticContact CE2-CD2 3.48Å; F2108-Y2149 HydrophobicContact CE2-CD2 3.48Å; F2108-Y2149 VanDerWaalsContact CE2-CD2 3.48Å; F2108-Y2149 HydrophobicContact CE2-CE2 4.17Å; F2108-Y2149 HydrophobicContact CE2-CG 4.25Å; F2108-Y2149 AromaticContact CZ-CD2 3.48Å; F2108-Y2149 HydrophobicContact CZ-CD2 3.48Å; F2108-Y2149 VanDerWaalsContact CZ-CD2 3.48Å; F2108-Y2149 HydrophobicContact CZ-CE2 4.3Å; F2108-Y2149 AromaticContact CZ-CG 3.81Å; F2108-Y2149 HydrophobicContact CZ-CG 3.81Å; F2108-Y2149 PolarHBondContact N-O 2.89Å; F2108-Y2149 PolarHBondContact O-N 2.92Å; Y2149-L2170 HydrophobicContact CE1-CD2 4.4Å; Y2149-L2170 HydrophobicContact CE2-CD2 3.99Å
2150	L	85.5	Confident	76	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	149.3	167.7	-66.6	158.2	0	0	0	110	L1982 W1983 M1985 P2100 N2105 H2106 W2148 M2215	L1982-L2150 CarbonylContact C-O 3.56Å; L1982-L2150 VanDerWaalsContact CA-O 3.32Å; L1982-L2150 WeakPolarHBondContact CA-O 3.38Å; W1983-L2150 HydrophobicContact CB-CB 4.1Å; W1983-L2150 HydrophobicContact CG-CB 4.45Å; W1983-L2150 PolarHBondContact N-O 2.86Å; W1983-L2150 PolarHBondContact O-N 3.35Å; M1985-L2150 HydrophobicContact CE-CD1 3.79Å; M1985-L2150 HydrophobicContact CG-CD1 4.46Å; M1985-L2150 HydrophobicContact SD-CD1 4.13Å; P2100-L2150 HydrophobicContact CG-CD1 4.15Å; N2105-L2150 HydrophobicContact CB-CD2 4.19Å; H2106-L2150 CarbonylContact O-C 3.59Å; H2106-L2150 WeakPolarHBondContact O-CA 3.48Å; W2148-L2150 HydrophobicContact CZ3-CD1 4.2Å; W2148-L2150 HydrophobicContact CZ3-CD2 4.33Å; W2148-L2150 HydrophobicContact CZ3-CG 3.92Å; L2150-M2215 HydrophobicContact CD2-SD 4.34Å
2151	T	84.7	Confident	76.7	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	121.9	-174.2	37.7	0	0	0	0	113.8	R1981 L1982 H2106 F2108 H2153 I2166	R1981-T2151 WeakPolarHBondContact O-CA 3.5Å; L1982-T2151 HydrophobicContact CD1-CG2 4.46Å; L1982-T2151 HydrophobicContact CG-CG2 4.01Å; H2106-T2151 PolarHBondContact O-N 2.9Å; F2108-T2151 HydrophobicContact CD1-CG2 3.74Å; F2108-T2151 HydrophobicContact CE1-CG2 3.69Å; T2151-H2153 WeakPolarHBondContact CB-NE2 3.28Å; T2151-H2153 PolarHBondContact O-CD2 3.03Å; T2151-H2153 PolarHBondContact OG1-CE1 3.5Å; T2151-H2153 PolarHBondContact OG1-NE2 3.07Å; T2151-I2166 HydrophobicContact CG2-CD1 4.31Å
2152	D	80.3	Confident	77.6	Confident	21 Å²	21	44.8 Å²	44.8	11%	0.112	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.6	169.6	-70.3	-3.3	0	0	0	109.6	H1980 R1981 W1983 L2066 R2101	H1980-D2152 PolarHBondContact ND1-O 3.19Å; R1981-D2152 HydrophobicContact CB-CB 4.13Å; R1981-D2152 PolarHBondContact O-N 3.26Å; W1983-D2152 WeakPolarHBondContact CZ2-OD2 3.24Å; W1983-D2152 PolarHBondContact NE1-OD1 3.48Å; W1983-D2152 VanDerWaalsContact NE1-OD1 3.16Å; W1983-D2152 PolarHBondContact NE1-OD2 2.98Å; L2066-D2152 HydrophobicContact CD1-CB 3.82Å; R2101-D2152 IonicContact NH2-OD2 3.16Å
2153	H	78.9	Confident	78.5	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.019	19%	0.19	C	C	.	.			trans	-105	132.1	-177.7	-61.4	-76.4	0	0	0	112.3	R2067 H2106 T2151 C2157 F2159	R2067-H2153 WeakPolarHBondContact CB-O 3.49Å; R2067-H2153 PolarHBondContact N-O 3.46Å; R2067-H2153 VanDerWaalsContact N-O 3.12Å; H2106-H2153 AromaticContact CG-CD2 3.88Å; T2151-H2153 WeakPolarHBondContact CB-NE2 3.28Å; T2151-H2153 PolarHBondContact O-CD2 3.03Å; T2151-H2153 PolarHBondContact OG1-CE1 3.5Å; T2151-H2153 PolarHBondContact OG1-NE2 3.07Å; H2153-C2157 HydrophobicContact CB-CB 4.33Å; H2153-C2157 PolarHBondContact ND1-SG 2.9Å; H2153-F2159 HydrophobicContact CB-CE1 4.26Å; H2153-F2159 AromaticContact CD2-CD1 3.74Å; H2153-F2159 AromaticContact CD2-CE1 3.49Å; H2153-F2159 VanDerWaalsContact CD2-CE1 3.49Å; H2153-F2159 WeakPolarHBondContact CD2-CE1 3.4Å; H2153-F2159 AromaticContact CG-CE1 3.89Å; H2153-F2159 AromaticContact NE2-CD1 3.76Å; H2153-F2159 AromaticContact NE2-CE1 3.97Å
2154	T	74.4	Confident	79.2	Confident	28 Å²	28	37.8 Å²	37.8	17%	0.172	20%	0.196	C	C	.	.			trans	-82	169.1	176.6	57.9	0	0	0	0	112.3	D1979 K2156 C2157	D1979-T2154 HydrophobicContact CB-CG2 4.04Å; D1979-T2154 WeakPolarHBondContact O-CG2 3.33Å; T2154-K2156 PolarHBondContact O-N 3.42Å; T2154-K2156 VanDerWaalsContact O-N 3.14Å; T2154-C2157 WeakPolarHBondContact O-CB 3.33Å; T2154-C2157 PolarHBondContact O-N 3.14Å; T2154-C2157 VanDerWaalsContact O-N 3.15Å
2155	S	72.5	Confident	79.3	Confident	76 Å²	76	43.7 Å²	43.7	53%	0.531	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.9	-177.6	51.5	0	0	0	0	115.6
2156	K	70.6	Confident	79.4	Confident	180 Å²	180	43 Å²	43	78%	0.783	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-4	177.5	-63.2	-177.9	179.8	177.6	0	114	T2154	T2154-K2156 PolarHBondContact O-N 3.42Å; T2154-K2156 VanDerWaalsContact O-N 3.14Å
2157	C	72.4	Confident	79.2	Confident	5 Å²	5	43.4 Å²	43.4	3%	0.034	22%	0.218	C	C	.	.			trans	-93	107.1	-172.7	164.5	0	0	0	0	110.7	R2067 H2153 T2154 C2162	R2067-C2157 PolarHBondContact NH1-O 2.92Å; H2153-C2157 HydrophobicContact CB-CB 4.33Å; H2153-C2157 PolarHBondContact ND1-SG 2.9Å; T2154-C2157 WeakPolarHBondContact O-CB 3.33Å; T2154-C2157 PolarHBondContact O-N 3.14Å; T2154-C2157 VanDerWaalsContact O-N 3.15Å; C2157-C2162 HydrophobicContact CB-CB 4.09Å; C2157-C2162 WeakPolarHBondContact CB-SG 3.42Å; C2157-C2162 WeakPolarHBondContact SG-CB 3.49Å; C2157-C2162 CovalentContact SG-SG 2.04Å; C2157-C2162 PolarHBondContact SG-SG 2.71Å
2158	D	69.8	Low	79.1	Confident	114 Å²	114	46.7 Å²	46.7	61%	0.61	24%	0.241	S	C	*	.			trans	-84.7	115.4	161.2	-70.9	-38.4	0	0	0	108.9	R2067 D2160 E2161 C2162	R2067-D2158 IonicContact NH1-OD1 3.97Å; D2158-D2160 PolarHBondContact O-N 2.89Å; D2158-E2161 PolarHBondContact O-N 3.33Å; D2158-C2162 WeakPolarHBondContact O-CB 3.49Å; D2158-C2162 PolarHBondContact O-N 3.39Å; D2158-C2162 VanDerWaalsContact O-N 3.11Å
2159	F	74.9	Confident	78.9	Confident	15 Å²	15	47.7 Å²	47.7	7%	0.066	25%	0.251	C	S	.	.	H	α-helix	trans	-50.5	-37.4	-161.9	-61.3	-92.3	0	0	0	114.3	R2067 L2071 H2106 H2153 C2162 V2163	R2067-F2159 HydrophobicContact CG-CZ 4.47Å; L2071-F2159 HydrophobicContact CD2-CD1 4.14Å; L2071-F2159 HydrophobicContact CD2-CD2 3.61Å; L2071-F2159 HydrophobicContact CD2-CE1 4.11Å; L2071-F2159 HydrophobicContact CD2-CE2 3.58Å; L2071-F2159 HydrophobicContact CD2-CG 3.88Å; L2071-F2159 HydrophobicContact CD2-CZ 3.83Å; H2106-F2159 AromaticContact CD2-CE1 3.41Å; H2106-F2159 VanDerWaalsContact CD2-CE1 3.41Å; H2106-F2159 WeakPolarHBondContact CD2-CE1 3.39Å; H2106-F2159 AromaticContact CD2-CZ 3.9Å; H2106-F2159 AromaticContact CG-CE1 3.84Å; H2106-F2159 AromaticContact NE2-CE1 3.54Å; H2106-F2159 AromaticContact NE2-CZ 3.51Å; H2153-F2159 HydrophobicContact CB-CE1 4.26Å; H2153-F2159 AromaticContact CD2-CD1 3.74Å; H2153-F2159 AromaticContact CD2-CE1 3.49Å; H2153-F2159 VanDerWaalsContact CD2-CE1 3.49Å; H2153-F2159 WeakPolarHBondContact CD2-CE1 3.4Å; H2153-F2159 AromaticContact CG-CE1 3.89Å; H2153-F2159 AromaticContact NE2-CD1 3.76Å; H2153-F2159 AromaticContact NE2-CE1 3.97Å; F2159-C2162 PolarHBondContact O-N 2.95Å; F2159-V2163 WeakPolarHBondContact O-CB 3.45Å; F2159-V2163 VanDerWaalsContact O-CG2 3.31Å; F2159-V2163 WeakPolarHBondContact O-CG2 3.48Å; F2159-V2163 PolarHBondContact O-N 2.94Å
2160	D	74.4	Confident	78.7	Confident	66 Å²	66	48.1 Å²	48.1	35%	0.353	25%	0.254	S	S	.	.	H	α-helix	trans	-69.5	-46.9	-171.6	-52.4	-75	0	0	0	112.8	D2158 L2164 K2201	D2158-D2160 PolarHBondContact O-N 2.89Å; D2160-L2164 WeakPolarHBondContact O-CD1 3.37Å; D2160-L2164 WeakPolarHBondContact O-CG 3.19Å; D2160-K2201 WeakPolarHBondContact OD1-CD 3.26Å; D2160-K2201 WeakPolarHBondContact OD1-CE 3.48Å; D2160-K2201 IonicContact OD1-NZ 3.95Å; D2160-K2201 PolarHBondContact OD1-NZ 3.07Å; D2160-K2201 IonicContact OD2-NZ 3.92Å; D2160-K2201 PolarHBondContact OD2-NZ 3.36Å
2161	E	76.7	Confident	78.6	Confident	124 Å²	124	49 Å²	49	58%	0.579	26%	0.259	S	S	*	.	H	α-helix	trans	-70.1	-39.5	169.9	-71.7	-160.2	171.9	0	0	111.8	D2158 L2164 K2165	D2158-E2161 PolarHBondContact O-N 3.33Å; E2161-L2164 PolarHBondContact O-N 3.15Å; E2161-K2165 HydrophobicContact CB-CD 4.49Å; E2161-K2165 WeakPolarHBondContact O-CG 3.41Å; E2161-K2165 PolarHBondContact O-N 3.22Å; E2161-K2165 IonicContact OE2-NZ 3.9Å; E2161-K2165 PolarHBondContact OE2-NZ 2.98Å
2162	C	81.8	Confident	78.5	Confident	11 Å²	11	51 Å²	51	7%	0.074	27%	0.271	C	S	.	.	H	α-helix	trans	-65	-45.5	-169.3	-176.1	0	0	0	0	111.5	H1980 C2157 D2158 F2159 K2165 I2166	H1980-C2162 PolarHBondContact CE1-SG 3.38Å; H1980-C2162 PolarHBondContact NE2-SG 3.31Å; H1980-C2162 VanDerWaalsContact NE2-SG 3.35Å; C2157-C2162 HydrophobicContact CB-CB 4.09Å; C2157-C2162 WeakPolarHBondContact CB-SG 3.42Å; C2157-C2162 WeakPolarHBondContact SG-CB 3.49Å; C2157-C2162 CovalentContact SG-SG 2.04Å; C2157-C2162 PolarHBondContact SG-SG 2.71Å; D2158-C2162 WeakPolarHBondContact O-CB 3.49Å; D2158-C2162 PolarHBondContact O-N 3.39Å; D2158-C2162 VanDerWaalsContact O-N 3.11Å; F2159-C2162 PolarHBondContact O-N 2.95Å; C2162-K2165 PolarHBondContact O-N 3.05Å; C2162-I2166 WeakPolarHBondContact O-CD1 3.5Å; C2162-I2166 VanDerWaalsContact O-CG1 3.25Å; C2162-I2166 WeakPolarHBondContact O-CG1 3.42Å; C2162-I2166 PolarHBondContact O-N 2.94Å
2163	V	80.8	Confident	78.3	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.006	29%	0.289	C	S	.	.	H	α-helix	trans	-66.4	-38.3	176.2	172.5	0	0	0	0	111.8	F2108 F2159 I2166 I2167 V2218 I2220	F2108-V2163 HydrophobicContact CB-CG1 3.79Å; F2108-V2163 HydrophobicContact CD1-CG1 4.39Å; F2108-V2163 HydrophobicContact CG-CG1 4.07Å; F2159-V2163 WeakPolarHBondContact O-CB 3.45Å; F2159-V2163 VanDerWaalsContact O-CG2 3.31Å; F2159-V2163 WeakPolarHBondContact O-CG2 3.48Å; F2159-V2163 PolarHBondContact O-N 2.94Å; V2163-I2166 PolarHBondContact O-N 3.49Å; V2163-I2167 HydrophobicContact CG1-CD1 3.73Å; V2163-I2167 HydrophobicContact CG1-CG1 4.35Å; V2163-I2167 WeakPolarHBondContact O-CG1 3.49Å; V2163-I2167 PolarHBondContact O-N 2.89Å; V2163-V2218 HydrophobicContact CG1-CB 4.47Å; V2163-V2218 HydrophobicContact CG1-CG1 4.32Å; V2163-V2218 HydrophobicContact CG2-CG2 4.37Å; V2163-I2220 HydrophobicContact CG1-CD1 3.79Å
2164	L	81.5	Confident	78.3	Confident	84 Å²	84	57.2 Å²	57.2	44%	0.44	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-41.7	175.3	-71.3	171.5	0	0	0	112.1	D2160 E2161 I2167 S2168 V2196 I2220	D2160-L2164 WeakPolarHBondContact O-CD1 3.37Å; D2160-L2164 WeakPolarHBondContact O-CG 3.19Å; E2161-L2164 PolarHBondContact O-N 3.15Å; L2164-I2167 PolarHBondContact O-N 3.4Å; L2164-S2168 WeakPolarHBondContact O-CB 3.24Å; L2164-S2168 PolarHBondContact O-N 3.25Å; L2164-V2196 HydrophobicContact CD2-CG1 4.31Å; L2164-I2220 HydrophobicContact CD2-CD1 3.96Å
2165	K	81.1	Confident	78.5	Confident	131 Å²	131	56 Å²	56	57%	0.57	29%	0.286	S	S	*	.	H	α-helix	trans	-63.6	-41.7	174.3	-72.7	165	177.5	172.2	0	111.6	E2161 C2162 S2169	E2161-K2165 HydrophobicContact CB-CD 4.49Å; E2161-K2165 WeakPolarHBondContact O-CG 3.41Å; E2161-K2165 PolarHBondContact O-N 3.22Å; E2161-K2165 IonicContact OE2-NZ 3.9Å; E2161-K2165 PolarHBondContact OE2-NZ 2.98Å; C2162-K2165 PolarHBondContact O-N 3.05Å; K2165-S2169 VanDerWaalsContact O-CB 3.29Å; K2165-S2169 WeakPolarHBondContact O-CB 3.41Å; K2165-S2169 PolarHBondContact O-N 2.93Å
2166	I	82.5	Confident	78.9	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-50.2	174.3	-70.5	163	0	0	0	111.3	H1980 L1982 F2108 T2151 C2162 V2163 S2169 L2170	H1980-I2166 HydrophobicContact CB-CD1 4.11Å; H1980-I2166 HydrophobicContact CB-CG1 4.46Å; L1982-I2166 HydrophobicContact CD1-CG2 4.04Å; L1982-I2166 HydrophobicContact CD2-CG2 3.83Å; L1982-I2166 HydrophobicContact CG-CG2 4.22Å; F2108-I2166 HydrophobicContact CE1-CG2 3.87Å; F2108-I2166 HydrophobicContact CZ-CG2 4.18Å; T2151-I2166 HydrophobicContact CG2-CD1 4.31Å; C2162-I2166 WeakPolarHBondContact O-CD1 3.5Å; C2162-I2166 VanDerWaalsContact O-CG1 3.25Å; C2162-I2166 WeakPolarHBondContact O-CG1 3.42Å; C2162-I2166 PolarHBondContact O-N 2.94Å; V2163-I2166 PolarHBondContact O-N 3.49Å; I2166-S2169 PolarHBondContact O-N 2.95Å; I2166-L2170 VanDerWaalsContact O-CB 3.3Å; I2166-L2170 WeakPolarHBondContact O-CB 3.41Å; I2166-L2170 PolarHBondContact O-N 3.18Å
2167	I	82.9	Confident	79.2	Confident	10 Å²	10	52.3 Å²	52.3	5%	0.051	28%	0.275	C	S	.	.	H	α-helix	trans	-63.3	-44.6	-179.2	-70.3	167.8	0	0	0	111.3	F2108 L2110 V2163 L2164 S2169 L2170 I2171 I2220	F2108-I2167 HydrophobicContact CD2-CD1 3.76Å; F2108-I2167 HydrophobicContact CD2-CG1 3.82Å; F2108-I2167 HydrophobicContact CE2-CD1 4.03Å; F2108-I2167 HydrophobicContact CE2-CG1 3.56Å; F2108-I2167 HydrophobicContact CG-CD1 4.4Å; F2108-I2167 HydrophobicContact CZ-CG1 4.07Å; L2110-I2167 HydrophobicContact CD1-CD1 4.5Å; L2110-I2167 HydrophobicContact CD1-CG2 4.25Å; V2163-I2167 HydrophobicContact CG1-CD1 3.73Å; V2163-I2167 HydrophobicContact CG1-CG1 4.35Å; V2163-I2167 WeakPolarHBondContact O-CG1 3.49Å; V2163-I2167 PolarHBondContact O-N 2.89Å; L2164-I2167 PolarHBondContact O-N 3.4Å; I2167-S2169 PolarHBondContact O-N 3.09Å; I2167-L2170 PolarHBondContact O-N 3.46Å; I2167-I2171 HydrophobicContact CG2-CD1 3.74Å; I2167-I2171 HydrophobicContact CG2-CG1 4.41Å; I2167-I2171 WeakPolarHBondContact O-CB 3.33Å; I2167-I2171 WeakPolarHBondContact O-CG1 3.27Å; I2167-I2171 PolarHBondContact O-N 3.18Å; I2167-I2220 HydrophobicContact CD1-CB 4.48Å; I2167-I2220 HydrophobicContact CD1-CD1 3.57Å
2168	S	83	Confident	79.3	Confident	72 Å²	72	56.4 Å²	56.4	50%	0.503	29%	0.294	S	S	.	.	H	α-helix	trans	-61.2	-44.8	177.5	-175.7	0	0	0	0	111.9	L2164 T2172	L2164-S2168 WeakPolarHBondContact O-CB 3.24Å; L2164-S2168 PolarHBondContact O-N 3.25Å; S2168-T2172 VanDerWaalsContact O-CB 3.28Å; S2168-T2172 WeakPolarHBondContact O-CB 3.21Å; S2168-T2172 PolarHBondContact O-N 3.34Å; S2168-T2172 PolarHBondContact O-OG1 3.46Å
2169	S	82.2	Confident	79.7	Confident	42 Å²	42	51.6 Å²	51.6	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-65.6	-40.1	176.3	-173.1	0	0	0	0	112.2	K2165 I2166 I2167 T2172 R2173	K2165-S2169 VanDerWaalsContact O-CB 3.29Å; K2165-S2169 WeakPolarHBondContact O-CB 3.41Å; K2165-S2169 PolarHBondContact O-N 2.93Å; I2166-S2169 PolarHBondContact O-N 2.95Å; I2167-S2169 PolarHBondContact O-N 3.09Å; S2169-T2172 PolarHBondContact O-N 3.01Å; S2169-R2173 VanDerWaalsContact O-CB 3.26Å; S2169-R2173 WeakPolarHBondContact O-CB 3.4Å; S2169-R2173 VanDerWaalsContact O-CG 3.29Å; S2169-R2173 WeakPolarHBondContact O-CG 3.37Å; S2169-R2173 PolarHBondContact O-N 3.34Å
2170	L	81.8	Confident	79.9	Confident	15 Å²	15	54.9 Å²	54.9	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-62.5	-49.3	175.5	-178.6	66.1	0	0	0	111.8	L1977 L1982 F2108 Y2149 I2166 I2167 R2174	L1977-L2170 HydrophobicContact CD2-CB 4.09Å; L1982-L2170 HydrophobicContact CD2-CD2 4.44Å; F2108-L2170 HydrophobicContact CZ-CD2 4.23Å; Y2149-L2170 HydrophobicContact CE1-CD2 4.4Å; Y2149-L2170 HydrophobicContact CE2-CD2 3.99Å; I2166-L2170 VanDerWaalsContact O-CB 3.3Å; I2166-L2170 WeakPolarHBondContact O-CB 3.41Å; I2166-L2170 PolarHBondContact O-N 3.18Å; I2167-L2170 PolarHBondContact O-N 3.46Å; L2170-R2174 HydrophobicContact CD1-CG 4.16Å; L2170-R2174 VanDerWaalsContact O-CB 3.23Å; L2170-R2174 WeakPolarHBondContact O-CB 3.42Å; L2170-R2174 WeakPolarHBondContact O-CG 3.39Å; L2170-R2174 PolarHBondContact O-N 2.89Å
2171	I	82.5	Confident	80.1	Confident	24 Å²	24	58.1 Å²	58.1	12%	0.123	30%	0.304	C	S	.	.	H	α-helix	trans	-62	-44.6	177.8	-71	172.2	0	0	0	110.5	I2167 G2175 L2188 I2191 L2222 L2239	I2167-I2171 HydrophobicContact CG2-CD1 3.74Å; I2167-I2171 HydrophobicContact CG2-CG1 4.41Å; I2167-I2171 WeakPolarHBondContact O-CB 3.33Å; I2167-I2171 WeakPolarHBondContact O-CG1 3.27Å; I2167-I2171 PolarHBondContact O-N 3.18Å; I2171-G2175 PolarHBondContact O-N 3.25Å; I2171-L2188 HydrophobicContact CG2-CD2 4.31Å; I2171-I2191 HydrophobicContact CG2-CD1 3.82Å; I2171-L2222 HydrophobicContact CD1-CD1 4.24Å; I2171-L2239 HydrophobicContact CG2-CD1 4.32Å
2172	T	82.7	Confident	80.2	Confident	42 Å²	42	59.6 Å²	59.6	26%	0.258	31%	0.309	S	S	.	.	H	α-helix	trans	-65.4	-52.8	-179.2	-56.9	0	0	0	0	111.2	S2168 S2169 R2174 G2175 H2176	S2168-T2172 VanDerWaalsContact O-CB 3.28Å; S2168-T2172 WeakPolarHBondContact O-CB 3.21Å; S2168-T2172 PolarHBondContact O-N 3.34Å; S2168-T2172 PolarHBondContact O-OG1 3.46Å; S2169-T2172 PolarHBondContact O-N 3.01Å; T2172-R2174 PolarHBondContact O-N 3.49Å; T2172-G2175 PolarHBondContact O-N 2.72Å; T2172-G2175 VanDerWaalsContact O-N 3.14Å; T2172-H2176 PolarHBondContact O-CD2 3.47Å; T2172-H2176 PolarHBondContact O-N 2.82Å; T2172-H2176 VanDerWaalsContact O-N 3.1Å
2173	R	76.1	Confident	80.1	Confident	132 Å²	132	64.6 Å²	64.6	50%	0.498	33%	0.326	S	S	.	.	H	α-helix	trans	-58.6	-43.2	177.8	-72.6	177.3	170.9	-151.9	-6.7	111.8	S2169 A2177	S2169-R2173 VanDerWaalsContact O-CB 3.26Å; S2169-R2173 WeakPolarHBondContact O-CB 3.4Å; S2169-R2173 VanDerWaalsContact O-CG 3.29Å; S2169-R2173 WeakPolarHBondContact O-CG 3.37Å; S2169-R2173 PolarHBondContact O-N 3.34Å; R2173-A2177 WeakPolarHBondContact O-CB 3.45Å; R2173-A2177 PolarHBondContact O-N 3.46Å
2174	R	79.5	Confident	80.1	Confident	24 Å²	24	64.7 Å²	64.7	9%	0.091	33%	0.327	C	S	.	.	H	α-helix	trans	-69.7	-33.1	176.7	-69.4	-78.8	-75.8	-159.5	-9.8	112.8	L2170 T2172 A2177 M2178 L2239 N2241 E2242	L2170-R2174 HydrophobicContact CD1-CG 4.16Å; L2170-R2174 VanDerWaalsContact O-CB 3.23Å; L2170-R2174 WeakPolarHBondContact O-CB 3.42Å; L2170-R2174 WeakPolarHBondContact O-CG 3.39Å; L2170-R2174 PolarHBondContact O-N 2.89Å; T2172-R2174 PolarHBondContact O-N 3.49Å; R2174-A2177 PolarHBondContact O-N 3.12Å; R2174-M2178 WeakPolarHBondContact O-CB 3.48Å; R2174-M2178 PolarHBondContact O-N 3Å; R2174-L2239 HydrophobicContact CB-CD2 4.38Å; R2174-L2239 VanDerWaalsContact CZ-O 3.29Å; R2174-L2239 PolarHBondContact NE-O 3.35Å; R2174-L2239 PolarHBondContact NH2-O 3.39Å; R2174-N2241 PolarHBondContact NH2-O 3.34Å; R2174-E2242 IonicContact CZ-OE2 3.17Å; R2174-E2242 IonicContact NH1-OE1 3.9Å; R2174-E2242 IonicContact NH1-OE2 3Å; R2174-E2242 PolarHBondContact NH1-OE2 3.48Å; R2174-E2242 IonicContact NH2-OE1 2.72Å; R2174-E2242 IonicContact NH2-OE2 2.71Å; R2174-E2242 PolarHBondContact NH2-OE2 3.09Å
2175	G	79.6	Confident	80.1	Confident	3 Å²	3	63.9 Å²	63.9	3%	0.031	32%	0.323	C	S	.	.	H	α-helix	trans	-57	-58.7	172.6	0	0	0	0	0	111.6	I2171 T2172 A2177 M2178 L2179 V2184	I2171-G2175 PolarHBondContact O-N 3.25Å; T2172-G2175 PolarHBondContact O-N 2.72Å; T2172-G2175 VanDerWaalsContact O-N 3.14Å; G2175-A2177 PolarHBondContact O-N 3.49Å; G2175-M2178 PolarHBondContact O-N 3.2Å; G2175-L2179 PolarHBondContact O-N 3Å; G2175-V2184 VanDerWaalsContact C-CG2 3.48Å; G2175-V2184 VanDerWaalsContact O-CG2 3.25Å; G2175-V2184 WeakPolarHBondContact O-CG2 3.32Å
2176	H	80.9	Confident	80.1	Confident	108 Å²	108	65.8 Å²	65.8	50%	0.5	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-25.1	178.8	-68.8	-76.8	0	0	0	113.8	T2172	T2172-H2176 PolarHBondContact O-CD2 3.47Å; T2172-H2176 PolarHBondContact O-N 2.82Å; T2172-H2176 VanDerWaalsContact O-N 3.1Å
2177	A	75.4	Confident	80.1	Confident	71 Å²	71	66 Å²	66	59%	0.587	33%	0.328	S	S	*	.	H	α-helix	trans	-80.1	-32.4	177.3	0	0	0	0	0	114.6	R2173 R2174 G2175	R2173-A2177 WeakPolarHBondContact O-CB 3.45Å; R2173-A2177 PolarHBondContact O-N 3.46Å; R2174-A2177 PolarHBondContact O-N 3.12Å; G2175-A2177 PolarHBondContact O-N 3.49Å
2178	M	74.9	Confident	80	Confident	90 Å²	90	67.3 Å²	67.3	44%	0.443	34%	0.335	S	S	.	.	H	α-helix	trans	-115.6	-14.7	-168.9	-66.6	-64.9	168.5	0	0	115	R2174 G2175	R2174-M2178 WeakPolarHBondContact O-CB 3.48Å; R2174-M2178 PolarHBondContact O-N 3Å; G2175-M2178 PolarHBondContact O-N 3.2Å
2179	L	78.2	Confident	80	Confident	13 Å²	13	69.3 Å²	69.3	7%	0.068	33%	0.334	C	S	.	.	S	Bend	trans	-128.6	143	-177.2	-74.7	162	0	0	0	110.5	G2175 E2181 R2183 V2184 L2187 D2235 L2239	G2175-L2179 PolarHBondContact O-N 3Å; L2179-E2181 PolarHBondContact O-N 3.29Å; L2179-R2183 HydrophobicContact CB-CB 4.4Å; L2179-R2183 HydrophobicContact CD2-CB 4.42Å; L2179-V2184 HydrophobicContact CB-CG2 3.83Å; L2179-V2184 VanDerWaalsContact O-CG2 3.32Å; L2179-V2184 WeakPolarHBondContact O-CG2 3.33Å; L2179-L2187 HydrophobicContact CD1-CD2 3.56Å; L2179-D2235 HydrophobicContact CD2-CB 4.2Å; L2179-L2239 HydrophobicContact CD1-CD2 3.98Å
2180	P	79.6	Confident	79.9	Confident	85 Å²	85	71.4 Å²	71.4	55%	0.552	34%	0.336	S	S	*	.			trans	-64	134.2	173.4	27.5	-33.9	0	0	0	109.5	K2182 R2183 V2184	P2180-K2182 VanDerWaalsContact C-N 3.3Å; P2180-K2182 PolarHBondContact O-N 3.25Å; P2180-R2183 HydrophobicContact CG-CB 4.41Å; P2180-R2183 HydrophobicContact CG-CG 4.08Å; P2180-R2183 WeakPolarHBondContact O-CA 3.42Å; P2180-R2183 WeakPolarHBondContact O-CB 3.31Å; P2180-R2183 PolarHBondContact O-N 2.89Å; P2180-V2184 PolarHBondContact O-N 2.91Å
2181	E	77.7	Confident	79.8	Confident	133 Å²	133	71.9 Å²	71.9	62%	0.621	34%	0.338	S	S	*	.	H	α-helix	trans	-30.9	-53.7	-176.2	-170.4	178.9	-124.2	0	0	115.2	L2179 R2183 V2184 D2185	L2179-E2181 PolarHBondContact O-N 3.29Å; E2181-R2183 PolarHBondContact O-N 3.12Å; E2181-V2184 WeakPolarHBondContact O-CA 3.49Å; E2181-V2184 VanDerWaalsContact O-CB 3.29Å; E2181-V2184 WeakPolarHBondContact O-CB 3.48Å; E2181-V2184 PolarHBondContact O-N 3Å; E2181-D2185 PolarHBondContact O-N 3.19Å
2182	K	79.5	Confident	79.7	Confident	156 Å²	156	77.3 Å²	77.3	68%	0.678	36%	0.363	S	S	*	.	H	α-helix	trans	-62	-13.5	178.8	-64.3	178.9	-179	174.6	0	115.7	P2180 R2186	P2180-K2182 VanDerWaalsContact C-N 3.3Å; P2180-K2182 PolarHBondContact O-N 3.25Å; K2182-R2186 WeakPolarHBondContact O-CD 3.37Å; K2182-R2186 VanDerWaalsContact O-CG 3.26Å; K2182-R2186 WeakPolarHBondContact O-CG 3.41Å; K2182-R2186 PolarHBondContact O-NE 2.99Å
2183	R	80.2	Confident	79.6	Confident	116 Å²	116	80.3 Å²	80.3	44%	0.438	37%	0.373	S	S	.	.	H	α-helix	trans	-93.2	-36.3	167.2	-68.8	-168.8	-171.1	-148	8.9	111.4	L2179 P2180 E2181 R2186 L2187 D2235	L2179-R2183 HydrophobicContact CB-CB 4.4Å; L2179-R2183 HydrophobicContact CD2-CB 4.42Å; P2180-R2183 HydrophobicContact CG-CB 4.41Å; P2180-R2183 HydrophobicContact CG-CG 4.08Å; P2180-R2183 WeakPolarHBondContact O-CA 3.42Å; P2180-R2183 WeakPolarHBondContact O-CB 3.31Å; P2180-R2183 PolarHBondContact O-N 2.89Å; E2181-R2183 PolarHBondContact O-N 3.12Å; R2183-R2186 PolarHBondContact O-N 3.31Å; R2183-R2186 VanDerWaalsContact O-N 3.14Å; R2183-L2187 WeakPolarHBondContact O-CB 3.44Å; R2183-L2187 PolarHBondContact O-N 3.16Å; R2183-D2235 WeakPolarHBondContact CD-OD2 3.17Å; R2183-D2235 IonicContact CZ-OD2 3.06Å; R2183-D2235 IonicContact NE-OD2 2.84Å; R2183-D2235 VanDerWaalsContact NH1-CG 3.28Å; R2183-D2235 IonicContact NH1-OD1 3.65Å; R2183-D2235 PolarHBondContact NH1-OD1 2.88Å; R2183-D2235 VanDerWaalsContact NH1-OD1 3.07Å; R2183-D2235 IonicContact NH1-OD2 3.04Å; R2183-D2235 PolarHBondContact NH1-OD2 3.2Å
2184	V	79.5	Confident	79.8	Confident	3 Å²	3	74.6 Å²	74.6	2%	0.018	35%	0.353	C	S	.	.	H	α-helix	trans	-56.6	-51.2	173.7	-171.5	0	0	0	0	109.7	G2175 L2179 P2180 E2181 R2186 L2187 L2188	G2175-V2184 VanDerWaalsContact C-CG2 3.48Å; G2175-V2184 VanDerWaalsContact O-CG2 3.25Å; G2175-V2184 WeakPolarHBondContact O-CG2 3.32Å; L2179-V2184 HydrophobicContact CB-CG2 3.83Å; L2179-V2184 VanDerWaalsContact O-CG2 3.32Å; L2179-V2184 WeakPolarHBondContact O-CG2 3.33Å; P2180-V2184 PolarHBondContact O-N 2.91Å; E2181-V2184 WeakPolarHBondContact O-CA 3.49Å; E2181-V2184 VanDerWaalsContact O-CB 3.29Å; E2181-V2184 WeakPolarHBondContact O-CB 3.48Å; E2181-V2184 PolarHBondContact O-N 3Å; V2184-R2186 PolarHBondContact O-N 2.83Å; V2184-R2186 VanDerWaalsContact O-N 3.15Å; V2184-L2187 PolarHBondContact O-N 3.33Å; V2184-L2188 HydrophobicContact CG1-CD1 3.87Å; V2184-L2188 HydrophobicContact CG1-CG 4.22Å; V2184-L2188 WeakPolarHBondContact O-CB 3.27Å; V2184-L2188 WeakPolarHBondContact O-CG 3.33Å; V2184-L2188 PolarHBondContact O-N 3.07Å
2185	D	82.8	Confident	80	Confident	67 Å²	67	77.2 Å²	77.2	36%	0.358	37%	0.366	S	S	.	.	H	α-helix	trans	-52	-40.5	174.9	-63	-27.2	0	0	0	113	E2181 K2189	E2181-D2185 PolarHBondContact O-N 3.19Å; D2185-K2189 WeakPolarHBondContact O-CB 3.31Å; D2185-K2189 WeakPolarHBondContact O-CD 3.47Å; D2185-K2189 WeakPolarHBondContact O-CG 3.48Å; D2185-K2189 PolarHBondContact O-N 2.98Å
2186	R	81.2	Confident	80.2	Confident	171 Å²	171	80.7 Å²	80.7	65%	0.645	39%	0.387	S	S	*	.	H	α-helix	trans	-78.3	-26.6	-177.3	-66.9	174.1	-173.5	-164.3	-1.3	112.3	K2182 R2183 V2184 R2190	K2182-R2186 WeakPolarHBondContact O-CD 3.37Å; K2182-R2186 VanDerWaalsContact O-CG 3.26Å; K2182-R2186 WeakPolarHBondContact O-CG 3.41Å; K2182-R2186 PolarHBondContact O-NE 2.99Å; R2183-R2186 PolarHBondContact O-N 3.31Å; R2183-R2186 VanDerWaalsContact O-N 3.14Å; V2184-R2186 PolarHBondContact O-N 2.83Å; V2184-R2186 VanDerWaalsContact O-N 3.15Å; R2186-R2190 WeakPolarHBondContact O-CD 3.26Å; R2186-R2190 WeakPolarHBondContact O-CG 3.42Å; R2186-R2190 PolarHBondContact O-N 2.68Å
2187	L	81.5	Confident	80.5	Confident	8 Å²	8	76.9 Å²	76.9	4%	0.042	37%	0.372	C	S	.	.	H	α-helix	trans	-82.2	-46	178.8	-175.2	53.9	0	0	0	109.7	L2179 R2183 V2184 R2190 I2191 P2233 I2236 L2239	L2179-L2187 HydrophobicContact CD1-CD2 3.56Å; R2183-L2187 WeakPolarHBondContact O-CB 3.44Å; R2183-L2187 PolarHBondContact O-N 3.16Å; V2184-L2187 PolarHBondContact O-N 3.33Å; L2187-R2190 WeakPolarHBondContact O-CB 3.15Å; L2187-R2190 PolarHBondContact O-N 3.03Å; L2187-R2190 VanDerWaalsContact O-N 3.08Å; L2187-I2191 HydrophobicContact CD1-CD1 4.08Å; L2187-I2191 HydrophobicContact CD1-CG1 4.44Å; L2187-I2191 HydrophobicContact CG-CD1 3.97Å; L2187-I2191 WeakPolarHBondContact O-CG1 3.47Å; L2187-I2191 PolarHBondContact O-N 2.87Å; L2187-P2233 HydrophobicContact CD1-CG 3.91Å; L2187-I2236 HydrophobicContact CD1-CB 4.36Å; L2187-L2239 HydrophobicContact CD2-CD1 3.78Å; L2187-L2239 HydrophobicContact CD2-CD2 4.42Å; L2187-L2239 HydrophobicContact CD2-CG 4.2Å
2188	L	81.4	Confident	81.1	Confident	38 Å²	38	77.8 Å²	77.8	20%	0.199	36%	0.364	C	S	.	.	H	α-helix	trans	-54.5	-52.6	168.8	-67.5	173.7	0	0	0	110.5	I2171 V2184 R2190 I2191 E2192	I2171-L2188 HydrophobicContact CG2-CD2 4.31Å; V2184-L2188 HydrophobicContact CG1-CD1 3.87Å; V2184-L2188 HydrophobicContact CG1-CG 4.22Å; V2184-L2188 WeakPolarHBondContact O-CB 3.27Å; V2184-L2188 WeakPolarHBondContact O-CG 3.33Å; V2184-L2188 PolarHBondContact O-N 3.07Å; L2188-R2190 PolarHBondContact O-N 3.21Å; L2188-I2191 PolarHBondContact O-N 2.88Å; L2188-E2192 WeakPolarHBondContact O-CB 3.4Å; L2188-E2192 VanDerWaalsContact O-CG 3.27Å; L2188-E2192 WeakPolarHBondContact O-CG 3.27Å; L2188-E2192 PolarHBondContact O-N 3.49Å
2189	K	82.4	Confident	81.5	Confident	115 Å²	115	75.4 Å²	75.4	50%	0.5	35%	0.352	S	S	.	.	H	α-helix	trans	-66.7	1.8	176.9	-70.8	167.8	-179.1	158.9	0	116.4	D2185 E2192 K2193	D2185-K2189 WeakPolarHBondContact O-CB 3.31Å; D2185-K2189 WeakPolarHBondContact O-CD 3.47Å; D2185-K2189 WeakPolarHBondContact O-CG 3.48Å; D2185-K2189 PolarHBondContact O-N 2.98Å; K2189-E2192 WeakPolarHBondContact CA-OE2 3.31Å; K2189-E2192 WeakPolarHBondContact CG-OE2 3.38Å; K2189-K2193 VanDerWaalsContact O-CD 3.32Å; K2189-K2193 WeakPolarHBondContact O-CD 3.32Å; K2189-K2193 WeakPolarHBondContact O-CE 3.48Å; K2189-K2193 PolarHBondContact O-NZ 2.89Å
2190	R	81.3	Confident	81.9	Confident	85 Å²	85	78 Å²	78	32%	0.321	36%	0.363	S	S	.	.	H	α-helix	trans	-106.5	-39.1	167.7	-74.1	167.1	-176.8	-133.3	4.3	111.3	R2186 L2187 L2188 K2193 A2194 G2229 Q2231	R2186-R2190 WeakPolarHBondContact O-CD 3.26Å; R2186-R2190 WeakPolarHBondContact O-CG 3.42Å; R2186-R2190 PolarHBondContact O-N 2.68Å; L2187-R2190 WeakPolarHBondContact O-CB 3.15Å; L2187-R2190 PolarHBondContact O-N 3.03Å; L2187-R2190 VanDerWaalsContact O-N 3.08Å; L2188-R2190 PolarHBondContact O-N 3.21Å; R2190-K2193 CarbonylContact O-C 3.53Å; R2190-K2193 WeakPolarHBondContact O-CA 3.49Å; R2190-K2193 PolarHBondContact O-N 3.33Å; R2190-A2194 PolarHBondContact O-N 2.98Å; R2190-G2229 WeakPolarHBondContact CG-O 3.4Å; R2190-Q2231 WeakPolarHBondContact CD-O 3.36Å; R2190-Q2231 PolarHBondContact NH1-O 3.39Å
2191	I	78.8	Confident	82.3	Confident	25 Å²	25	77.8 Å²	77.8	13%	0.128	35%	0.353	C	S	.	.	H	α-helix	trans	-67.8	-38.5	174.9	-66.2	169.3	0	0	0	110.7	I2171 L2187 L2188 K2193 A2194 I2236	I2171-I2191 HydrophobicContact CG2-CD1 3.82Å; L2187-I2191 HydrophobicContact CD1-CD1 4.08Å; L2187-I2191 HydrophobicContact CD1-CG1 4.44Å; L2187-I2191 HydrophobicContact CG-CD1 3.97Å; L2187-I2191 WeakPolarHBondContact O-CG1 3.47Å; L2187-I2191 PolarHBondContact O-N 2.87Å; L2188-I2191 PolarHBondContact O-N 2.88Å; I2191-K2193 PolarHBondContact O-N 3.32Å; I2191-A2194 WeakPolarHBondContact O-CB 3.49Å; I2191-A2194 PolarHBondContact O-N 3.43Å; I2191-I2236 HydrophobicContact CD1-CD1 4.45Å
2192	E	80.2	Confident	82.8	Confident	139 Å²	139	71.5 Å²	71.5	65%	0.65	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-13.1	166.5	-71.5	167.3	-175.5	0	0	114	L2188 K2189	L2188-E2192 WeakPolarHBondContact O-CB 3.4Å; L2188-E2192 VanDerWaalsContact O-CG 3.27Å; L2188-E2192 WeakPolarHBondContact O-CG 3.27Å; L2188-E2192 PolarHBondContact O-N 3.49Å; K2189-E2192 WeakPolarHBondContact CA-OE2 3.31Å; K2189-E2192 WeakPolarHBondContact CG-OE2 3.38Å
2193	K	81.5	Confident	83.3	Confident	105 Å²	105	65.2 Å²	65.2	46%	0.457	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-1.7	178.5	-61.7	176.7	-172.4	154.2	0	112.7	K2189 R2190 I2191 S2225 A2230	K2189-K2193 VanDerWaalsContact O-CD 3.32Å; K2189-K2193 WeakPolarHBondContact O-CD 3.32Å; K2189-K2193 WeakPolarHBondContact O-CE 3.48Å; K2189-K2193 PolarHBondContact O-NZ 2.89Å; R2190-K2193 CarbonylContact O-C 3.53Å; R2190-K2193 WeakPolarHBondContact O-CA 3.49Å; R2190-K2193 PolarHBondContact O-N 3.33Å; I2191-K2193 PolarHBondContact O-N 3.32Å; K2193-S2225 VanDerWaalsContact O-CB 3.31Å; K2193-S2225 WeakPolarHBondContact O-CB 3.42Å; K2193-A2230 HydrophobicContact CB-CB 4.07Å; K2193-A2230 WeakPolarHBondContact O-CB 3.5Å
2194	A	79.6	Confident	83.7	Confident	11 Å²	11	60.1 Å²	60.1	9%	0.091	28%	0.278	C	S	.	.	S	Bend	trans	-72.4	149.1	169.4	0	0	0	0	0	108.3	R2190 I2191 V2196 H2223	R2190-A2194 PolarHBondContact O-N 2.98Å; I2191-A2194 WeakPolarHBondContact O-CB 3.49Å; I2191-A2194 PolarHBondContact O-N 3.43Å; A2194-V2196 PolarHBondContact O-N 3.24Å; A2194-H2223 CarbonylContact C-O 3.57Å; A2194-H2223 WeakPolarHBondContact CA-O 3.36Å; A2194-H2223 WeakPolarHBondContact CB-O 3.11Å
2195	E	83.9	Confident	84	Confident	79 Å²	79	65.3 Å²	65.3	37%	0.369	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	119	176.6	-161.5	-163.9	128.2	0	0	108.5	T2197 H2223 R2275	E2195-T2197 HydrophobicContact CG-CG2 4.41Å; E2195-T2197 WeakPolarHBondContact OE1-CG2 3.18Å; E2195-H2223 HydrophobicContact CB-CB 4.3Å; E2195-H2223 PolarHBondContact N-O 2.89Å; E2195-H2223 PolarHBondContact O-N 3.43Å; E2195-R2275 VanDerWaalsContact CD-NH2 3.31Å; E2195-R2275 IonicContact OE1-CZ 2.69Å; E2195-R2275 VanDerWaalsContact OE1-CZ 3.27Å; E2195-R2275 IonicContact OE1-NH1 2.79Å; E2195-R2275 PolarHBondContact OE1-NH1 3.5Å; E2195-R2275 IonicContact OE1-NH2 2.68Å; E2195-R2275 PolarHBondContact OE1-NH2 3.39Å; E2195-R2275 IonicContact OE2-CZ 3.67Å; E2195-R2275 IonicContact OE2-NH1 2.68Å; E2195-R2275 PolarHBondContact OE2-NH1 2.97Å; E2195-R2275 IonicContact OE2-NH2 2.93Å
2196	V	84.7	Confident	84	Confident	76 Å²	76	62.6 Å²	62.6	46%	0.461	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	112.6	-177.3	-171.5	0	0	0	0	108.8	L2164 A2194 I2220 L2222	L2164-V2196 HydrophobicContact CD2-CG1 4.31Å; A2194-V2196 PolarHBondContact O-N 3.24Å; V2196-I2220 HydrophobicContact CG1-CG2 3.86Å; V2196-L2222 HydrophobicContact CB-CD2 4.33Å; V2196-L2222 HydrophobicContact CG1-CD2 4.04Å; V2196-L2222 HydrophobicContact CG2-CD2 3.74Å
2197	T	86.7	Confident	83.8	Confident	29 Å²	29	58.2 Å²	58.2	18%	0.178	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	121.1	-179.9	55.3	0	0	0	0	111.3	E2195 N2221 R2275	E2195-T2197 HydrophobicContact CG-CG2 4.41Å; E2195-T2197 WeakPolarHBondContact OE1-CG2 3.18Å; T2197-N2221 PolarHBondContact N-O 3.46Å; T2197-N2221 PolarHBondContact O-N 2.89Å; T2197-N2221 PolarHBondContact OG1-ND2 2.88Å; T2197-N2221 VanDerWaalsContact OG1-ND2 3.16Å; T2197-R2275 PolarHBondContact OG1-NH2 2.79Å
2198	Q	87.5	Confident	83.7	Confident	90 Å²	90	58 Å²	58	42%	0.421	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	125.7	167.7	-179.6	171.8	-24.3	0	0	109.1	V2219	Q2198-V2219 WeakPolarHBondContact CA-O 3.39Å
2199	I	84	Confident	83.9	Confident	40 Å²	40	56.2 Å²	56.2	21%	0.205	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-42	-175.4	-64.7	151.4	0	0	0	111	V2219 N2221 N2270 V2271 L2274	I2199-V2219 HydrophobicContact CB-CB 4.37Å; I2199-V2219 HydrophobicContact CB-CG1 4.14Å; I2199-V2219 HydrophobicContact CD1-CG1 3.94Å; I2199-V2219 PolarHBondContact N-O 3.2Å; I2199-N2221 HydrophobicContact CD1-CB 3.41Å; I2199-N2221 VanDerWaalsContact CD1-CB 3.41Å; I2199-N2221 HydrophobicContact CG1-CB 4.21Å; I2199-N2270 HydrophobicContact CG2-CB 4.24Å; I2199-V2271 HydrophobicContact CD1-CG2 3.44Å; I2199-V2271 VanDerWaalsContact CD1-CG2 3.44Å; I2199-V2271 HydrophobicContact CG1-CG2 4.49Å; I2199-L2274 HydrophobicContact CG1-CD2 4.27Å
2200	F	86.2	Confident	84.1	Confident	67 Å²	67	50.8 Å²	50.8	29%	0.294	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	148.8	-170.5	-177.5	-101	0	0	0	111	Y2203 V2219	F2200-Y2203 VanDerWaalsContact CE1-O 3.3Å; F2200-Y2203 WeakPolarHBondContact CE1-O 3.41Å; F2200-Y2203 WeakPolarHBondContact CZ-O 3.43Å; F2200-V2219 HydrophobicContact CB-CB 4.06Å; F2200-V2219 HydrophobicContact CB-CG2 3.89Å; F2200-V2219 HydrophobicContact CD1-CG2 4.19Å; F2200-V2219 PolarHBondContact O-N 3.24Å
2201	K	87.6	Confident	84.3	Confident	80 Å²	80	47 Å²	47	35%	0.348	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	112.6	175.8	175.7	179.1	177	-175.6	0	108.5	L2071 D2160 T2217 V2218	L2071-K2201 HydrophobicContact CD1-CG 4.04Å; D2160-K2201 WeakPolarHBondContact OD1-CD 3.26Å; D2160-K2201 WeakPolarHBondContact OD1-CE 3.48Å; D2160-K2201 IonicContact OD1-NZ 3.95Å; D2160-K2201 PolarHBondContact OD1-NZ 3.07Å; D2160-K2201 IonicContact OD2-NZ 3.92Å; D2160-K2201 PolarHBondContact OD2-NZ 3.36Å; K2201-T2217 WeakPolarHBondContact CA-O 3.46Å; K2201-V2218 HydrophobicContact CG-CG2 4.34Å
2202	G	87.8	Confident	84.7	Confident	2 Å²	2	46.3 Å²	46.3	2%	0.021	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.3	-164.9	-178.4	0	0	0	0	0	112.4	L2204 E2216 T2217	G2202-L2204 PolarHBondContact O-N 3.39Å; G2202-E2216 CarbonylContact O-C 3.48Å; G2202-E2216 VanDerWaalsContact O-CA 3.3Å; G2202-E2216 WeakPolarHBondContact O-CA 3.04Å; G2202-T2217 PolarHBondContact N-O 2.84Å; G2202-T2217 PolarHBondContact O-N 2.91Å
2203	Y	90.6	Very high	85	Confident	24 Å²	24	39.7 Å²	39.7	9%	0.094	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	126.6	171.6	175.5	-83	0	0	0	110.7	N2086 P2087 M2088 F2200 D2205 N2209 W2214	N2086-Y2203 PolarHBondContact ND2-OH 3.33Å; N2086-Y2203 VanDerWaalsContact OD1-CE2 3.25Å; N2086-Y2203 WeakPolarHBondContact OD1-CE2 3.28Å; P2087-Y2203 HydrophobicContact CG-CD2 4.49Å; M2088-Y2203 HydrophobicContact CB-CE1 4.31Å; M2088-Y2203 HydrophobicContact CB-CE2 4.38Å; M2088-Y2203 HydrophobicContact CG-CD1 3.55Å; M2088-Y2203 HydrophobicContact CG-CD2 3.8Å; M2088-Y2203 HydrophobicContact CG-CE1 3.55Å; M2088-Y2203 HydrophobicContact CG-CE2 3.8Å; M2088-Y2203 HydrophobicContact CG-CG 3.68Å; M2088-Y2203 HydrophobicContact SD-CD1 4.3Å; M2088-Y2203 HydrophobicContact SD-CG 4.44Å; F2200-Y2203 VanDerWaalsContact CE1-O 3.3Å; F2200-Y2203 WeakPolarHBondContact CE1-O 3.41Å; F2200-Y2203 WeakPolarHBondContact CZ-O 3.43Å; Y2203-D2205 HydrophobicContact CD1-CB 4.43Å; Y2203-D2205 HydrophobicContact CE1-CB 3.71Å; Y2203-D2205 WeakPolarHBondContact CE1-OD1 3.41Å; Y2203-D2205 PolarHBondContact OH-OD1 2.61Å; Y2203-N2209 VanDerWaalsContact CZ-ND2 3.26Å; Y2203-N2209 PolarHBondContact OH-ND2 3.35Å; Y2203-W2214 HydrophobicContact CD2-CB 4.09Å; Y2203-W2214 AromaticContact CD2-CD1 3.6Å; Y2203-W2214 AromaticContact CD2-CG 3.99Å; Y2203-W2214 HydrophobicContact CD2-CG 3.99Å; Y2203-W2214 HydrophobicContact CE2-CB 3.68Å; Y2203-W2214 HydrophobicContact CE2-CG 4.01Å
2204	L	88.5	Confident	85.5	Confident	9 Å²	9	34.7 Å²	34.7	5%	0.047	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-101.7	118.5	171.8	176.9	63.7	0	0	0	108.3	G2202 D2206 N2209 M2215 T2217 I2267	G2202-L2204 PolarHBondContact O-N 3.39Å; L2204-D2206 PolarHBondContact O-N 3.14Å; L2204-N2209 PolarHBondContact O-ND2 3.42Å; L2204-M2215 HydrophobicContact CD2-CE 4.47Å; L2204-M2215 PolarHBondContact N-O 3.02Å; L2204-T2217 HydrophobicContact CD2-CG2 4.22Å; L2204-I2267 HydrophobicContact CD1-CD1 4.07Å
2205	D	86.2	Confident	86	Confident	112 Å²	112	34.2 Å²	34.2	60%	0.599	17%	0.171	S	C	*	.	P	Polyproline II helix	trans	-73.7	125.9	174.8	-158.2	49.8	0	0	0	111	Y2203 S2263	Y2203-D2205 HydrophobicContact CD1-CB 4.43Å; Y2203-D2205 HydrophobicContact CE1-CB 3.71Å; Y2203-D2205 WeakPolarHBondContact CE1-OD1 3.41Å; Y2203-D2205 PolarHBondContact OH-OD1 2.61Å; D2205-S2263 WeakPolarHBondContact O-CB 3.39Å
2206	D	81.6	Confident	86.3	Confident	9 Å²	9	30.4 Å²	30.4	5%	0.048	15%	0.153	C	C	.	.			trans	-161.4	150.3	-167.7	-169.2	-83.3	0	0	0	111.3	L2204 L2208 N2209 M2215 R2261 S2263	L2204-D2206 PolarHBondContact O-N 3.14Å; D2206-L2208 PolarHBondContact O-N 3.15Å; D2206-L2208 WeakPolarHBondContact OD1-CB 3.29Å; D2206-L2208 PolarHBondContact OD1-N 3.44Å; D2206-N2209 PolarHBondContact N-ND2 2.76Å; D2206-N2209 WeakPolarHBondContact O-CB 3.39Å; D2206-N2209 PolarHBondContact O-N 3.09Å; D2206-M2215 HydrophobicContact CB-CE 3.49Å; D2206-M2215 VanDerWaalsContact CB-CE 3.49Å; D2206-R2261 VanDerWaalsContact CG-NH2 3.29Å; D2206-R2261 IonicContact OD1-CZ 2.68Å; D2206-R2261 IonicContact OD1-NE 2.74Å; D2206-R2261 IonicContact OD1-NH2 3.7Å; D2206-R2261 PolarHBondContact OD1-NH2 3.29Å; D2206-R2261 IonicContact OD2-CZ 2.96Å; D2206-R2261 IonicContact OD2-NE 3.51Å; D2206-R2261 PolarHBondContact OD2-NE 2.9Å; D2206-R2261 IonicContact OD2-NH1 2.7Å; D2206-R2261 IonicContact OD2-NH2 2.75Å; D2206-R2261 PolarHBondContact OD2-NH2 3.44Å; D2206-S2263 VanDerWaalsContact OD2-CB 3.28Å; D2206-S2263 WeakPolarHBondContact OD2-CB 3.41Å; D2206-S2263 PolarHBondContact OD2-OG 3.01Å
2207	Q	77.3	Confident	86.5	Confident	79 Å²	79	26.8 Å²	26.8	37%	0.369	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-12.4	177.4	-67.6	172	-23.1	0	0	114.8	R1997	R1997-Q2207 PolarHBondContact NH2-O 3.47Å
2208	L	79.2	Confident	86.6	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.016	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-15.3	172.6	-71.5	172	0	0	0	115.1	F1990 L2098 L2099 W2148 D2206 M2215	F1990-L2208 HydrophobicContact CD1-CD2 4.34Å; F1990-L2208 HydrophobicContact CE1-CD2 3.62Å; F1990-L2208 HydrophobicContact CE1-CG 4.48Å; F1990-L2208 HydrophobicContact CZ-CD2 4.1Å; L2098-L2208 HydrophobicContact CB-CD2 3.88Å; L2098-L2208 HydrophobicContact CD1-CD2 4.25Å; L2099-L2208 HydrophobicContact CD2-CB 4.18Å; L2099-L2208 HydrophobicContact CD2-CD1 4.4Å; L2099-L2208 HydrophobicContact CG-CB 4.41Å; W2148-L2208 HydrophobicContact CH2-CD1 3.87Å; D2206-L2208 PolarHBondContact O-N 3.15Å; D2206-L2208 WeakPolarHBondContact OD1-CB 3.29Å; D2206-L2208 PolarHBondContact OD1-N 3.44Å; L2208-M2215 HydrophobicContact CB-CE 4.21Å; L2208-M2215 HydrophobicContact CB-SD 4.49Å; L2208-M2215 HydrophobicContact CD1-CE 3.88Å; L2208-M2215 HydrophobicContact CD1-SD 3.8Å
2209	N	87.2	Confident	86.7	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.011	10%	0.104	C	C	.	.			trans	-75	128.1	-173.1	-65.6	-23.6	0	0	0	112	R1997 Y2203 L2204 D2206 W2214 M2215	R1997-N2209 VanDerWaalsContact CZ-O 3.26Å; R1997-N2209 PolarHBondContact NH1-O 3.41Å; R1997-N2209 PolarHBondContact NH2-O 3.05Å; Y2203-N2209 VanDerWaalsContact CZ-ND2 3.26Å; Y2203-N2209 PolarHBondContact OH-ND2 3.35Å; L2204-N2209 PolarHBondContact O-ND2 3.42Å; D2206-N2209 PolarHBondContact N-ND2 2.76Å; D2206-N2209 WeakPolarHBondContact O-CB 3.39Å; D2206-N2209 PolarHBondContact O-N 3.09Å; N2209-W2214 HydrophobicContact CB-CB 4.36Å; N2209-W2214 WeakPolarHBondContact OD1-CA 3.5Å; N2209-M2215 PolarHBondContact OD1-N 3.37Å
2210	A	84.9	Confident	87	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.096	C	C	.	.			trans	-110.8	175.6	173.4	0	0	0	0	0	110.9	N2086 T2091 L2093 G2095 S2212 A2213	N2086-A2210 PolarHBondContact ND2-O 2.92Å; T2091-A2210 WeakPolarHBondContact OG1-CA 3.3Å; L2093-A2210 HydrophobicContact CB-CB 4.29Å; L2093-A2210 HydrophobicContact CD2-CB 4.13Å; L2093-A2210 HydrophobicContact CG-CB 4.44Å; G2095-A2210 WeakPolarHBondContact O-CB 3.22Å; A2210-S2212 PolarHBondContact O-N 2.9Å; A2210-A2213 PolarHBondContact N-O 3.23Å
2211	D	86.8	Confident	87.2	Confident	5 Å²	5	16.5 Å²	16.5	3%	0.027	8%	0.082	C	C	.	.	S	Bend	trans	-63.8	-27.3	178.1	-72.5	3.4	0	0	0	112.5	W2007 Y2014 L2085 N2086 T2091 L2093	W2007-D2211 HydrophobicContact CH2-CB 4.2Å; W2007-D2211 HydrophobicContact CZ2-CB 4.19Å; Y2014-D2211 VanDerWaalsContact CE1-OD2 3.28Å; Y2014-D2211 WeakPolarHBondContact CE1-OD2 3.35Å; Y2014-D2211 PolarHBondContact OH-OD1 3.39Å; Y2014-D2211 VanDerWaalsContact OH-OD1 3.1Å; Y2014-D2211 PolarHBondContact OH-OD2 2.91Å; L2085-D2211 CarbonylContact C-O 3.58Å; L2085-D2211 WeakPolarHBondContact CA-O 3.32Å; N2086-D2211 PolarHBondContact N-O 2.99Å; T2091-D2211 WeakPolarHBondContact CA-OD1 3.49Å; T2091-D2211 WeakPolarHBondContact CB-OD1 3.37Å; T2091-D2211 PolarHBondContact N-OD1 2.72Å; T2091-D2211 PolarHBondContact OG1-N 3.05Å; T2091-D2211 VanDerWaalsContact OG1-N 3.13Å; T2091-D2211 PolarHBondContact OG1-OD1 3.46Å; L2093-D2211 WeakPolarHBondContact O-CB 3.29Å; L2093-D2211 VanDerWaalsContact O-CG 3.32Å; L2093-D2211 PolarHBondContact O-N 3.4Å
2212	S	86.2	Confident	87.2	Confident	11 Å²	11	13.1 Å²	13.1	8%	0.077	7%	0.067	C	C	.	.	S	Bend	trans	-126.1	12.7	-178	-57.6	0	0	0	0	115.3	A2083 P2084 G2095 G2103 A2210	A2083-S2212 WeakPolarHBondContact CB-OG 3.28Å; P2084-S2212 WeakPolarHBondContact CG-O 3.49Å; P2084-S2212 WeakPolarHBondContact O-CA 3.18Å; P2084-S2212 WeakPolarHBondContact O-CB 3.37Å; P2084-S2212 PolarHBondContact O-OG 3.45Å; G2095-S2212 CarbonylContact O-C 3.57Å; G2095-S2212 WeakPolarHBondContact O-CA 3.18Å; G2095-S2212 WeakPolarHBondContact O-CB 3.32Å; G2095-S2212 PolarHBondContact O-N 2.9Å; G2103-S2212 PolarHBondContact N-O 3.06Å; A2210-S2212 PolarHBondContact O-N 2.9Å
2213	A	88	Confident	87.2	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	131.5	166	0	0	0	0	0	110.3	K2096 L2099 G2103 A2210	K2096-A2213 HydrophobicContact CB-CB 4.42Å; K2096-A2213 HydrophobicContact CG-CB 4.15Å; L2099-A2213 HydrophobicContact CB-CB 4.05Å; L2099-A2213 HydrophobicContact CD1-CB 3.83Å; L2099-A2213 WeakPolarHBondContact CD1-O 3.33Å; G2103-A2213 WeakPolarHBondContact O-CA 3.3Å; A2210-A2213 PolarHBondContact N-O 3.23Å
2214	W	90.6	Very high	86.9	Confident	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	159.1	-178.4	60.7	90.8	0	0	0	111.3	Y2075 P2084 N2086 P2087 G2103 P2104 N2105 Y2203 N2209 E2216	Y2075-W2214 AromaticContact CD1-CH2 3.93Å; Y2075-W2214 HydrophobicContact CD1-CH2 3.93Å; Y2075-W2214 AromaticContact CD1-CZ2 3.74Å; Y2075-W2214 HydrophobicContact CD1-CZ2 3.74Å; Y2075-W2214 AromaticContact CD2-CH2 3.97Å; Y2075-W2214 HydrophobicContact CD2-CH2 3.97Å; Y2075-W2214 HydrophobicContact CE1-CH2 4.45Å; Y2075-W2214 HydrophobicContact CE1-CZ2 4.33Å; Y2075-W2214 AromaticContact CG-CH2 3.65Å; Y2075-W2214 HydrophobicContact CG-CH2 3.65Å; Y2075-W2214 AromaticContact CG-CZ2 3.88Å; Y2075-W2214 HydrophobicContact CG-CZ2 3.88Å; P2084-W2214 HydrophobicContact CB-CH2 4.05Å; P2084-W2214 HydrophobicContact CB-CZ3 4.05Å; P2084-W2214 HydrophobicContact CG-CZ3 4.47Å; N2086-W2214 HydrophobicContact CB-CE3 3.97Å; N2086-W2214 HydrophobicContact CB-CZ3 4.44Å; P2087-W2214 VanDerWaalsContact CD-CE2 3.44Å; P2087-W2214 HydrophobicContact CG-CZ2 4.26Å; G2103-W2214 PolarHBondContact O-N 3.37Å; G2103-W2214 VanDerWaalsContact O-N 3.08Å; P2104-W2214 HydrophobicContact CB-CZ2 4.23Å; P2104-W2214 HydrophobicContact CG-CZ2 4.44Å; N2105-W2214 WeakPolarHBondContact CB-O 3.32Å; N2105-W2214 PolarHBondContact N-O 3Å; Y2203-W2214 HydrophobicContact CD2-CB 4.09Å; Y2203-W2214 AromaticContact CD2-CD1 3.6Å; Y2203-W2214 AromaticContact CD2-CG 3.99Å; Y2203-W2214 HydrophobicContact CD2-CG 3.99Å; Y2203-W2214 HydrophobicContact CE2-CB 3.68Å; Y2203-W2214 HydrophobicContact CE2-CG 4.01Å; N2209-W2214 HydrophobicContact CB-CB 4.36Å; N2209-W2214 WeakPolarHBondContact OD1-CA 3.5Å; W2214-E2216 PolarHBondContact NE1-OE1 2.86Å
2215	M	90.1	Very high	86.3	Confident	1 Å²	1	13.5 Å²	13.5	1%	0.005	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	137.2	177.3	-65.4	-161.8	-61.4	0	0	112.6	L2099 N2105 W2148 L2150 L2204 D2206 L2208 N2209	L2099-M2215 HydrophobicContact CD1-CG 4.26Å; L2099-M2215 HydrophobicContact CD2-CG 3.68Å; L2099-M2215 HydrophobicContact CD2-SD 4.12Å; N2105-M2215 WeakPolarHBondContact O-CA 3.5Å; W2148-M2215 HydrophobicContact CH2-SD 4.42Å; W2148-M2215 HydrophobicContact CZ3-SD 3.83Å; L2150-M2215 HydrophobicContact CD2-SD 4.34Å; L2204-M2215 HydrophobicContact CD2-CE 4.47Å; L2204-M2215 PolarHBondContact N-O 3.02Å; D2206-M2215 HydrophobicContact CB-CE 3.49Å; D2206-M2215 VanDerWaalsContact CB-CE 3.49Å; L2208-M2215 HydrophobicContact CB-CE 4.21Å; L2208-M2215 HydrophobicContact CB-SD 4.49Å; L2208-M2215 HydrophobicContact CD1-CE 3.88Å; L2208-M2215 HydrophobicContact CD1-SD 3.8Å; N2209-M2215 PolarHBondContact OD1-N 3.37Å
2216	E	90.4	Very high	85.4	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	120.3	172	-60.7	-168.2	175.9	0	0	109.5	S2070 L2071 P2104 N2105 H2106 S2107 G2202 W2214	S2070-E2216 WeakPolarHBondContact CA-OE2 3.45Å; S2070-E2216 VanDerWaalsContact CB-OE1 3.24Å; S2070-E2216 WeakPolarHBondContact CB-OE1 3.35Å; S2070-E2216 VanDerWaalsContact OG-CD 3.28Å; S2070-E2216 PolarHBondContact OG-OE1 3.4Å; S2070-E2216 PolarHBondContact OG-OE2 3.45Å; L2071-E2216 WeakPolarHBondContact CB-OE2 3.31Å; L2071-E2216 HydrophobicContact CD1-CB 4.15Å; L2071-E2216 HydrophobicContact CG-CB 4.49Å; L2071-E2216 PolarHBondContact N-OE2 3.13Å; P2104-E2216 HydrophobicContact CB-CG 4.05Å; N2105-E2216 PolarHBondContact O-N 2.93Å; H2106-E2216 CarbonylContact C-O 3.55Å; H2106-E2216 VanDerWaalsContact CA-O 3.31Å; H2106-E2216 WeakPolarHBondContact CA-O 3.32Å; S2107-E2216 PolarHBondContact N-O 3.45Å; G2202-E2216 CarbonylContact O-C 3.48Å; G2202-E2216 VanDerWaalsContact O-CA 3.3Å; G2202-E2216 WeakPolarHBondContact O-CA 3.04Å; W2214-E2216 PolarHBondContact NE1-OE1 2.86Å
2217	T	88.7	Confident	84.7	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.9	-159.9	-62.3	0	0	0	0	112.9	S2107 V2109 K2201 G2202 L2204 V2219	S2107-T2217 WeakPolarHBondContact O-CA 3.44Å; S2107-T2217 WeakPolarHBondContact OG-CG2 3.36Å; S2107-T2217 PolarHBondContact OG-OG1 3.47Å; V2109-T2217 HydrophobicContact CB-CG2 4.16Å; V2109-T2217 HydrophobicContact CG2-CG2 3.58Å; K2201-T2217 WeakPolarHBondContact CA-O 3.46Å; G2202-T2217 PolarHBondContact N-O 2.84Å; G2202-T2217 PolarHBondContact O-N 2.91Å; L2204-T2217 HydrophobicContact CD2-CG2 4.22Å; T2217-V2219 HydrophobicContact CG2-CG2 3.91Å
2218	V	89.1	Confident	83.8	Confident	5 Å²	5	24.7 Å²	24.7	3%	0.03	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	116.4	166.6	-176.4	0	0	0	0	109.3	S2107 F2108 V2109 V2163 K2201 I2220	S2107-V2218 PolarHBondContact O-N 2.8Å; F2108-V2218 CarbonylContact C-O 3.57Å; F2108-V2218 WeakPolarHBondContact CA-O 3.25Å; F2108-V2218 HydrophobicContact CB-CB 4.48Å; F2108-V2218 WeakPolarHBondContact CB-O 3.46Å; V2109-V2218 PolarHBondContact N-O 3.36Å; V2163-V2218 HydrophobicContact CG1-CB 4.47Å; V2163-V2218 HydrophobicContact CG1-CG1 4.32Å; V2163-V2218 HydrophobicContact CG2-CG2 4.37Å; K2201-V2218 HydrophobicContact CG-CG2 4.34Å; V2218-I2220 HydrophobicContact CG1-CD1 4.13Å; V2218-I2220 HydrophobicContact CG1-CG1 4.25Å
2219	V	89.6	Confident	82.9	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	117.9	-178	-175.7	0	0	0	0	110.1	V2109 Q2198 I2199 F2200 T2217 I2267	V2109-V2219 HydrophobicContact CB-CG1 4.48Å; V2109-V2219 HydrophobicContact CB-CG2 4.32Å; V2109-V2219 HydrophobicContact CG1-CG1 4.49Å; Q2198-V2219 WeakPolarHBondContact CA-O 3.39Å; I2199-V2219 HydrophobicContact CB-CB 4.37Å; I2199-V2219 HydrophobicContact CB-CG1 4.14Å; I2199-V2219 HydrophobicContact CD1-CG1 3.94Å; I2199-V2219 PolarHBondContact N-O 3.2Å; F2200-V2219 HydrophobicContact CB-CB 4.06Å; F2200-V2219 HydrophobicContact CB-CG2 3.89Å; F2200-V2219 HydrophobicContact CD1-CG2 4.19Å; F2200-V2219 PolarHBondContact O-N 3.24Å; T2217-V2219 HydrophobicContact CG2-CG2 3.91Å; V2219-I2267 HydrophobicContact CG1-CD1 4.46Å; V2219-I2267 HydrophobicContact CG1-CG2 3.66Å; V2219-I2267 HydrophobicContact CG2-CD1 3.85Å; V2219-I2267 HydrophobicContact CG2-CG1 4.34Å
2220	I	89.5	Confident	81.7	Confident	4 Å²	4	26.1 Å²	26.1	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.2	179.9	-70.3	160.9	0	0	0	109.5	V2109 C2111 V2163 L2164 I2167 V2196 V2218 L2222	V2109-I2220 PolarHBondContact O-N 2.95Å; C2111-I2220 PolarHBondContact N-O 2.66Å; V2163-I2220 HydrophobicContact CG1-CD1 3.79Å; L2164-I2220 HydrophobicContact CD2-CD1 3.96Å; I2167-I2220 HydrophobicContact CD1-CB 4.48Å; I2167-I2220 HydrophobicContact CD1-CD1 3.57Å; V2196-I2220 HydrophobicContact CG1-CG2 3.86Å; V2218-I2220 HydrophobicContact CG1-CD1 4.13Å; V2218-I2220 HydrophobicContact CG1-CG1 4.25Å; I2220-L2222 HydrophobicContact CG2-CD2 4.48Å
2221	N	90.7	Very high	81	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.2	173.7	163.9	54.5	0	0	0	111	C2111 T2113 T2197 I2199	C2111-N2221 HydrophobicContact CB-CB 4.07Å; C2111-N2221 CarbonylContact O-C 3.55Å; C2111-N2221 VanDerWaalsContact O-CA 3.3Å; C2111-N2221 WeakPolarHBondContact O-CA 3.44Å; T2113-N2221 PolarHBondContact OG1-OD1 2.84Å; T2197-N2221 PolarHBondContact N-O 3.46Å; T2197-N2221 PolarHBondContact O-N 2.89Å; T2197-N2221 PolarHBondContact OG1-ND2 2.88Å; T2197-N2221 VanDerWaalsContact OG1-ND2 3.16Å; I2199-N2221 HydrophobicContact CD1-CB 3.41Å; I2199-N2221 VanDerWaalsContact CD1-CB 3.41Å; I2199-N2221 HydrophobicContact CG1-CB 4.21Å
2222	L	88.2	Confident	80.5	Confident	10 Å²	10	30.3 Å²	30.3	5%	0.052	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	105.1	168.1	-59.3	-178.4	0	0	0	108.8	L2110 C2111 I2112 T2113 I2171 V2196 I2220	L2110-L2222 HydrophobicContact CD1-CD1 3.86Å; L2110-L2222 HydrophobicContact CD1-CG 3.97Å; C2111-L2222 PolarHBondContact O-N 3.23Å; I2112-L2222 WeakPolarHBondContact CA-O 3.39Å; I2112-L2222 HydrophobicContact CG1-CB 4.44Å; I2112-L2222 HydrophobicContact CG1-CD1 4.48Å; T2113-L2222 PolarHBondContact N-O 3.47Å; I2171-L2222 HydrophobicContact CD1-CD1 4.24Å; V2196-L2222 HydrophobicContact CB-CD2 4.33Å; V2196-L2222 HydrophobicContact CG1-CD2 4.04Å; V2196-L2222 HydrophobicContact CG2-CD2 3.74Å; I2220-L2222 HydrophobicContact CG2-CD2 4.48Å
2223	H	87.9	Confident	79.9	Confident	5 Å²	5	31.3 Å²	31.3	2%	0.023	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	140.5	-177.3	-171.3	67.4	0	0	0	112.5	T2113 W2115 A2194 E2195 S2225 R2275	T2113-H2223 WeakPolarHBondContact O-CA 3.45Å; T2113-H2223 PolarHBondContact OG1-ND1 3.17Å; W2115-H2223 AromaticContact CE2-CE1 3.78Å; W2115-H2223 AromaticContact CE2-NE2 3.71Å; W2115-H2223 AromaticContact CZ2-NE2 3.97Å; W2115-H2223 AromaticContact NE1-CE1 3.55Å; W2115-H2223 AromaticContact NE1-NE2 3.18Å; W2115-H2223 PolarHBondContact NE1-NE2 3.29Å; W2115-H2223 VanDerWaalsContact NE1-NE2 3.18Å; A2194-H2223 CarbonylContact C-O 3.57Å; A2194-H2223 WeakPolarHBondContact CA-O 3.36Å; A2194-H2223 WeakPolarHBondContact CB-O 3.11Å; E2195-H2223 HydrophobicContact CB-CB 4.3Å; E2195-H2223 PolarHBondContact N-O 2.89Å; E2195-H2223 PolarHBondContact O-N 3.43Å; H2223-S2225 PolarHBondContact O-N 3.01Å; H2223-R2275 PolarHBondContact CD2-NH1 2.96Å; H2223-R2275 VanDerWaalsContact CD2-NH1 3.34Å
2224	E	84.9	Confident	79.5	Confident	8 Å²	8	35.5 Å²	35.5	4%	0.037	19%	0.188	C	C	.	.			trans	-64.7	96.5	168.4	-178.7	172.5	127.7	0	0	110.6	T2113 R2114 R2117 Q2231 L2232	T2113-E2224 PolarHBondContact O-N 3.19Å; R2114-E2224 HydrophobicContact CB-CB 3.87Å; R2117-E2224 IonicContact CZ-OE1 2.79Å; R2117-E2224 IonicContact NE-OE1 2.75Å; R2117-E2224 PolarHBondContact NE-OE1 3.27Å; R2117-E2224 IonicContact NH2-OE1 3.55Å; R2117-E2224 PolarHBondContact NH2-OE1 2.69Å; E2224-Q2231 WeakPolarHBondContact OE2-CA 3.29Å; E2224-L2232 HydrophobicContact CB-CD1 4.42Å; E2224-L2232 HydrophobicContact CB-CG 4.38Å; E2224-L2232 PolarHBondContact OE2-N 3.28Å
2225	S	75.1	Confident	78.9	Confident	29 Å²	29	37.1 Å²	37.1	20%	0.203	20%	0.196	C	C	.	.			trans	-51.8	145.4	171.6	171.3	0	0	0	0	111.3	K2193 H2223 S2227	K2193-S2225 VanDerWaalsContact O-CB 3.31Å; K2193-S2225 WeakPolarHBondContact O-CB 3.42Å; H2223-S2225 PolarHBondContact O-N 3.01Å; S2225-S2227 PolarHBondContact O-N 3.08Å; S2225-S2227 PolarHBondContact OG-N 2.91Å; S2225-S2227 PolarHBondContact OG-OG 3.47Å
2226	E	68.3	Low	78.4	Confident	178 Å²	178	37.2 Å²	37.2	83%	0.832	20%	0.197	S	C	*	.	S	Bend	trans	-57.8	-18.5	175.7	-59.4	-169.3	160.3	0	0	113.5	K2228	E2226-K2228 PolarHBondContact O-N 3.34Å
2227	S	65.3	Low	78	Confident	56 Å²	56	38.7 Å²	38.7	39%	0.392	20%	0.204	S	C	.	.	S	Bend	trans	-62.2	132.5	177.4	78.2	0	0	0	0	111.6	S2225 G2229 A2230	S2225-S2227 PolarHBondContact O-N 3.08Å; S2225-S2227 PolarHBondContact OG-N 2.91Å; S2225-S2227 PolarHBondContact OG-OG 3.47Å; S2227-G2229 PolarHBondContact O-N 3.17Å; S2227-A2230 PolarHBondContact O-N 3.33Å
2228	K	60.3	Low	77.6	Confident	202 Å²	202	43.9 Å²	43.9	88%	0.878	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-10	-178.6	-67.7	-179.2	179.3	174.9	0	114.8	E2226	E2226-K2228 PolarHBondContact O-N 3.34Å
2229	G	58.9	Low	77	Confident	34 Å²	34	44.1 Å²	44.1	35%	0.351	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-11.3	177.6	0	0	0	0	0	115.5	R2190 S2227	R2190-G2229 WeakPolarHBondContact CG-O 3.4Å; S2227-G2229 PolarHBondContact O-N 3.17Å
2230	A	61.4	Low	76.5	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.231	C	C	.	.			trans	-96.9	-4.2	-170.5	0	0	0	0	0	115.2	K2193 S2227 L2232	K2193-A2230 HydrophobicContact CB-CB 4.07Å; K2193-A2230 WeakPolarHBondContact O-CB 3.5Å; S2227-A2230 PolarHBondContact O-N 3.33Å; A2230-L2232 PolarHBondContact O-N 3.27Å; A2230-L2232 VanDerWaalsContact O-N 3.15Å
2231	Q	71.3	Confident	75.9	Confident	87 Å²	87	46.5 Å²	46.5	41%	0.407	24%	0.241	S	C	.	.			trans	-53.2	118	-172.3	-66.2	-172.3	-32.5	0	0	112.8	R2190 E2224 P2233	R2190-Q2231 WeakPolarHBondContact CD-O 3.36Å; R2190-Q2231 PolarHBondContact NH1-O 3.39Å; E2224-Q2231 WeakPolarHBondContact OE2-CA 3.29Å; Q2231-P2233 WeakPolarHBondContact O-CD 3.21Å
2232	L	75.5	Confident	74.9	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.037	24%	0.244	C	C	.	.			trans	-79.7	113.5	-173.8	-66.6	177.3	0	0	0	110.2	I2112 E2224 A2230 I2236	I2112-L2232 HydrophobicContact CG2-CD1 3.79Å; E2224-L2232 HydrophobicContact CB-CD1 4.42Å; E2224-L2232 HydrophobicContact CB-CG 4.38Å; E2224-L2232 PolarHBondContact OE2-N 3.28Å; A2230-L2232 PolarHBondContact O-N 3.27Å; A2230-L2232 VanDerWaalsContact O-N 3.15Å; L2232-I2236 HydrophobicContact CD2-CD1 4.27Å
2233	P	74.5	Confident	73.8	Confident	32 Å²	32	50.8 Å²	50.8	21%	0.208	27%	0.268	C	S	.	.			trans	-80.1	152.5	-176.8	34	-32.4	0	0	0	110.6	L2187 Q2231 D2235 I2236	L2187-P2233 HydrophobicContact CD1-CG 3.91Å; Q2231-P2233 WeakPolarHBondContact O-CD 3.21Å; P2233-D2235 PolarHBondContact O-N 3.06Å; P2233-I2236 WeakPolarHBondContact O-CB 3.11Å; P2233-I2236 VanDerWaalsContact O-CG2 3.27Å; P2233-I2236 WeakPolarHBondContact O-CG2 3.41Å; P2233-I2236 PolarHBondContact O-N 3.08Å
2234	D	78.5	Confident	72.6	Confident	88 Å²	88	56.4 Å²	56.4	47%	0.471	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-65	-3.7	177.4	-54.8	-45.6	0	0	0	114	R2114 I2236 L2237 W2251	R2114-D2234 IonicContact CZ-OD1 3.98Å; R2114-D2234 IonicContact NH1-OD1 3.16Å; R2114-D2234 PolarHBondContact NH1-OD1 3.1Å; R2114-D2234 IonicContact NH2-OD1 3.86Å; D2234-I2236 PolarHBondContact O-N 3.11Å; D2234-L2237 HydrophobicContact CB-CD1 4.01Å; D2234-L2237 WeakPolarHBondContact O-CB 3.19Å; D2234-L2237 WeakPolarHBondContact O-CG 3.29Å; D2234-L2237 PolarHBondContact O-N 3.28Å; D2234-W2251 PolarHBondContact OD1-NE1 3.35Å
2235	D	78	Confident	71.6	Confident	33 Å²	33	57.6 Å²	57.6	18%	0.176	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-64.5	-21.5	164.6	-83.4	-31.6	0	0	0	112.8	L2179 R2183 P2233 L2237 K2238	L2179-D2235 HydrophobicContact CD2-CB 4.2Å; R2183-D2235 WeakPolarHBondContact CD-OD2 3.17Å; R2183-D2235 IonicContact CZ-OD2 3.06Å; R2183-D2235 IonicContact NE-OD2 2.84Å; R2183-D2235 VanDerWaalsContact NH1-CG 3.28Å; R2183-D2235 IonicContact NH1-OD1 3.65Å; R2183-D2235 PolarHBondContact NH1-OD1 2.88Å; R2183-D2235 VanDerWaalsContact NH1-OD1 3.07Å; R2183-D2235 IonicContact NH1-OD2 3.04Å; R2183-D2235 PolarHBondContact NH1-OD2 3.2Å; P2233-D2235 PolarHBondContact O-N 3.06Å; D2235-L2237 VanDerWaalsContact C-N 3.25Å; D2235-L2237 PolarHBondContact O-N 3.45Å; D2235-K2238 PolarHBondContact O-N 3.1Å; D2235-K2238 IonicContact OD1-NZ 3.24Å; D2235-K2238 PolarHBondContact OD1-NZ 3.31Å
2236	I	81.2	Confident	71.2	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-64.1	-30.7	177.9	-160.4	167.9	0	0	0	112.7	I2112 L2136 L2187 I2191 L2232 P2233 D2234 K2238 L2239 W2251	I2112-I2236 HydrophobicContact CD1-CD1 4.15Å; I2112-I2236 HydrophobicContact CG2-CD1 4.27Å; L2136-I2236 HydrophobicContact CD1-CG2 4.23Å; L2187-I2236 HydrophobicContact CD1-CB 4.36Å; I2191-I2236 HydrophobicContact CD1-CD1 4.45Å; L2232-I2236 HydrophobicContact CD2-CD1 4.27Å; P2233-I2236 WeakPolarHBondContact O-CB 3.11Å; P2233-I2236 VanDerWaalsContact O-CG2 3.27Å; P2233-I2236 WeakPolarHBondContact O-CG2 3.41Å; P2233-I2236 PolarHBondContact O-N 3.08Å; D2234-I2236 PolarHBondContact O-N 3.11Å; I2236-K2238 PolarHBondContact O-N 3.34Å; I2236-L2239 HydrophobicContact CG1-CD1 4.26Å; I2236-L2239 WeakPolarHBondContact O-CB 3.28Å; I2236-L2239 PolarHBondContact O-N 2.95Å; I2236-L2239 VanDerWaalsContact O-N 3.07Å; I2236-W2251 HydrophobicContact CG2-CH2 4.47Å; I2236-W2251 HydrophobicContact CG2-CZ2 3.85Å
2237	L	81.5	Confident	71.3	Confident	30 Å²	30	51.6 Å²	51.6	16%	0.157	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-52.1	-39	175.9	-67.2	174.2	0	0	0	111.4	L2136 D2234 D2235 L2239 L2240 S2249	L2136-L2237 HydrophobicContact CD1-CD2 3.78Å; L2136-L2237 HydrophobicContact CG-CD2 3.99Å; D2234-L2237 HydrophobicContact CB-CD1 4.01Å; D2234-L2237 WeakPolarHBondContact O-CB 3.19Å; D2234-L2237 WeakPolarHBondContact O-CG 3.29Å; D2234-L2237 PolarHBondContact O-N 3.28Å; D2235-L2237 VanDerWaalsContact C-N 3.25Å; D2235-L2237 PolarHBondContact O-N 3.45Å; L2237-L2239 VanDerWaalsContact C-N 3.29Å; L2237-L2239 PolarHBondContact O-N 3.25Å; L2237-L2240 PolarHBondContact O-N 3.13Å; L2237-S2249 VanDerWaalsContact CB-OG 3.31Å; L2237-S2249 WeakPolarHBondContact CB-OG 3.39Å; L2237-S2249 PolarHBondContact O-OG 3.32Å
2238	K	79.8	Confident	71.8	Confident	109 Å²	109	53.8 Å²	53.8	47%	0.474	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-74.3	-12.1	-176.7	-60.7	172.2	-172.4	157.4	0	114.5	D2235 I2236	D2235-K2238 PolarHBondContact O-N 3.1Å; D2235-K2238 IonicContact OD1-NZ 3.24Å; D2235-K2238 PolarHBondContact OD1-NZ 3.31Å; I2236-K2238 PolarHBondContact O-N 3.34Å
2239	L	77.8	Confident	72.9	Confident	11 Å²	11	45 Å²	45	6%	0.058	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-75	-26.6	177.4	-66.1	-175.7	0	0	0	112.7	I2171 R2174 L2179 L2187 I2236 L2237	I2171-L2239 HydrophobicContact CG2-CD1 4.32Å; R2174-L2239 HydrophobicContact CB-CD2 4.38Å; R2174-L2239 VanDerWaalsContact CZ-O 3.29Å; R2174-L2239 PolarHBondContact NE-O 3.35Å; R2174-L2239 PolarHBondContact NH2-O 3.39Å; L2179-L2239 HydrophobicContact CD1-CD2 3.98Å; L2187-L2239 HydrophobicContact CD2-CD1 3.78Å; L2187-L2239 HydrophobicContact CD2-CD2 4.42Å; L2187-L2239 HydrophobicContact CD2-CG 4.2Å; I2236-L2239 HydrophobicContact CG1-CD1 4.26Å; I2236-L2239 WeakPolarHBondContact O-CB 3.28Å; I2236-L2239 PolarHBondContact O-N 2.95Å; I2236-L2239 VanDerWaalsContact O-N 3.07Å; L2237-L2239 VanDerWaalsContact C-N 3.29Å; L2237-L2239 PolarHBondContact O-N 3.25Å
2240	L	78	Confident	74.2	Confident	11 Å²	11	47.3 Å²	47.3	6%	0.058	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-24.4	-163.3	-66.5	167.3	0	0	0	114.2	R1984 L2110 I2112 L2136 P2147 L2237	R1984-L2240 PolarHBondContact NH1-O 2.9Å; R1984-L2240 PolarHBondContact NH2-O 2.87Å; L2110-L2240 HydrophobicContact CD2-CD2 4.48Å; I2112-L2240 HydrophobicContact CD1-CD1 3.96Å; L2136-L2240 HydrophobicContact CD1-CD1 3.8Å; L2136-L2240 HydrophobicContact CD2-CD1 3.66Å; L2136-L2240 HydrophobicContact CG-CD1 4.42Å; P2147-L2240 HydrophobicContact CB-CD2 4.21Å; P2147-L2240 HydrophobicContact CG-CD1 3.9Å; P2147-L2240 HydrophobicContact CG-CD2 4.29Å; L2237-L2240 PolarHBondContact O-N 3.13Å
2241	N	77.9	Confident	75.4	Confident	43 Å²	43	49 Å²	49	23%	0.23	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-70.6	143.5	176.9	-55.1	-17.9	0	0	0	110.4	R2174 S2249	R2174-N2241 PolarHBondContact NH2-O 3.34Å; N2241-S2249 PolarHBondContact ND2-OG 2.91Å; N2241-S2249 WeakPolarHBondContact OD1-CB 3.32Å; N2241-S2249 PolarHBondContact OD1-N 3.18Å; N2241-S2249 PolarHBondContact OD1-OG 3.5Å
2242	E	69.8	Low	76.1	Confident	15 Å²	15	46.4 Å²	46.4	7%	0.07	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-96.2	146.5	175.2	-58.2	-62	177.5	0	0	111.5	R1975 R1984 R2174 T2245	R1975-E2242 IonicContact CZ-OE1 3.64Å; R1975-E2242 IonicContact CZ-OE2 3.59Å; R1975-E2242 IonicContact NH1-OE1 3.37Å; R1975-E2242 PolarHBondContact NH1-OE1 3.03Å; R1975-E2242 IonicContact NH1-OE2 3.89Å; R1975-E2242 VanDerWaalsContact NH2-CD 3.25Å; R1975-E2242 IonicContact NH2-OE1 2.69Å; R1975-E2242 PolarHBondContact NH2-OE1 3.47Å; R1975-E2242 VanDerWaalsContact NH2-OE1 3.17Å; R1975-E2242 IonicContact NH2-OE2 3.9Å; R1975-E2242 PolarHBondContact NH2-OE2 2.8Å; R1984-E2242 IonicContact CZ-OE1 3.17Å; R1984-E2242 IonicContact NE-OE1 3.83Å; R1984-E2242 IonicContact NH1-OE1 2.83Å; R1984-E2242 PolarHBondContact NH1-OE1 2.99Å; R2174-E2242 IonicContact CZ-OE2 3.17Å; R2174-E2242 IonicContact NH1-OE1 3.9Å; R2174-E2242 IonicContact NH1-OE2 3Å; R2174-E2242 PolarHBondContact NH1-OE2 3.48Å; R2174-E2242 IonicContact NH2-OE1 2.72Å; R2174-E2242 IonicContact NH2-OE2 2.71Å; R2174-E2242 PolarHBondContact NH2-OE2 3.09Å; E2242-T2245 PolarHBondContact O-OG1 2.93Å; E2242-T2245 VanDerWaalsContact O-OG1 3.09Å
2243	P	64.5	Low	76.6	Confident	84 Å²	84	48.2 Å²	48.2	55%	0.545	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	143.1	168.1	29.6	-33.1	0	0	0	110.3
2244	N	63	Low	77	Confident	124 Å²	124	46.8 Å²	46.8	66%	0.663	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.8	22.3	178.9	-46.8	-32.5	0	0	0	116.3
2245	T	62.5	Low	76.8	Confident	32 Å²	32	43 Å²	43	20%	0.196	22%	0.217	C	C	.	.	S	Bend	trans	-124	140	168.4	47.3	0	0	0	0	110.9	V364 E2242 E2247	V364-T2245 HydrophobicContact CG2-CG2 4.46Å; E2242-T2245 PolarHBondContact O-OG1 2.93Å; E2242-T2245 VanDerWaalsContact O-OG1 3.09Å; T2245-E2247 VanDerWaalsContact C-N 3.33Å; T2245-E2247 PolarHBondContact O-N 3.42Å; T2245-E2247 VanDerWaalsContact O-N 3.09Å
2246	E	67	Low	76.3	Confident	71 Å²	71	47.3 Å²	47.3	33%	0.332	24%	0.236	S	C	.	.			trans	-63.6	97.4	148.8	-70.2	178.7	-157.6	0	0	107.2	E361 P362 V363 R2140	E361-E2246 HydrophobicContact CB-CB 3.76Å; E361-E2246 VanDerWaalsContact CD-C 3.44Å; E361-E2246 HydrophobicContact CG-CB 3.77Å; E361-E2246 HydrophobicContact CG-CG 4.5Å; E361-E2246 VanDerWaalsContact OE1-CA 3.3Å; E361-E2246 WeakPolarHBondContact OE1-CA 3.33Å; P362-E2246 WeakPolarHBondContact O-CB 3.29Å; V363-E2246 WeakPolarHBondContact CG1-OE1 3.23Å; V363-E2246 WeakPolarHBondContact O-CB 3.48Å; V363-E2246 VanDerWaalsContact O-CD 3.23Å; V363-E2246 WeakPolarHBondContact O-CG 3.38Å; R2140-E2246 PolarHBondContact NE-O 3.39Å; R2140-E2246 VanDerWaalsContact NE-O 3.08Å; R2140-E2246 PolarHBondContact NH2-O 3.13Å; R2140-E2246 VanDerWaalsContact NH2-O 3.13Å
2247	E	71.8	Confident	75.5	Confident	11 Å²	11	48.7 Å²	48.7	5%	0.051	25%	0.247	C	C	.	.			trans	-159.7	101.5	174.7	-110.1	174.6	-126.1	0	0	110	E361 R1984 R2140 T2245	E361-E2247 PolarHBondContact OE1-N 3.34Å; E361-E2247 VanDerWaalsContact OE2-C 3.3Å; E361-E2247 VanDerWaalsContact OE2-CA 3.27Å; E361-E2247 WeakPolarHBondContact OE2-CA 3.28Å; E361-E2247 PolarHBondContact OE2-N 3.44Å; R1984-E2247 IonicContact CZ-OE2 3.69Å; R1984-E2247 IonicContact NE-OE2 3.82Å; R1984-E2247 IonicContact NH2-OE2 3.93Å; R1984-E2247 PolarHBondContact NH2-OE2 3.31Å; R2140-E2247 HydrophobicContact CG-CG 3.52Å; R2140-E2247 IonicContact CZ-OE1 2.76Å; R2140-E2247 IonicContact NE-OE1 2.7Å; R2140-E2247 IonicContact NH1-OE1 3.77Å; R2140-E2247 PolarHBondContact NH1-OE1 2.83Å; T2245-E2247 VanDerWaalsContact C-N 3.33Å; T2245-E2247 PolarHBondContact O-N 3.42Å; T2245-E2247 VanDerWaalsContact O-N 3.09Å
2248	Q	75.3	Confident	74.7	Confident	101 Å²	101	47.9 Å²	47.9	47%	0.472	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	121.3	-174.7	-72.4	171.1	66.5	0	0	113	E361 E2139	E361-Q2248 PolarHBondContact OE1-NE2 3.39Å; E361-Q2248 VanDerWaalsContact OE2-CB 3.27Å; E361-Q2248 WeakPolarHBondContact OE2-CB 3.29Å; E361-Q2248 VanDerWaalsContact OE2-CG 3.28Å; E361-Q2248 WeakPolarHBondContact OE2-CG 3.45Å; E361-Q2248 PolarHBondContact OE2-N 2.96Å; E361-Q2248 PolarHBondContact OE2-NE2 3.28Å; E2139-Q2248 HydrophobicContact CB-CB 3.87Å; E2139-Q2248 WeakPolarHBondContact CB-O 3.36Å; E2139-Q2248 HydrophobicContact CG-CB 4.3Å; E2139-Q2248 PolarHBondContact N-O 3.48Å
2249	S	83.7	Confident	74.2	Confident	18 Å²	18	46.8 Å²	46.8	13%	0.126	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	132.7	169.1	55.7	0	0	0	0	113.2	A2137 L2237 N2241	A2137-S2249 CarbonylContact O-C 3.6Å; A2137-S2249 WeakPolarHBondContact O-CA 3.47Å; L2237-S2249 VanDerWaalsContact CB-OG 3.31Å; L2237-S2249 WeakPolarHBondContact CB-OG 3.39Å; L2237-S2249 PolarHBondContact O-OG 3.32Å; N2241-S2249 PolarHBondContact ND2-OG 2.91Å; N2241-S2249 WeakPolarHBondContact OD1-CB 3.32Å; N2241-S2249 PolarHBondContact OD1-N 3.18Å; N2241-S2249 PolarHBondContact OD1-OG 3.5Å
2250	K	84.8	Confident	74.1	Confident	83 Å²	83	46.9 Å²	46.9	36%	0.361	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	148.5	179.7	-162.7	176.9	-164.5	158	0	112.5	V359 A2137 E2139 I2252	V359-K2250 HydrophobicContact CG1-CD 4.5Å; V359-K2250 HydrophobicContact CG2-CD 3.86Å; A2137-K2250 PolarHBondContact N-O 3.23Å; A2137-K2250 PolarHBondContact O-N 3.1Å; E2139-K2250 IonicContact OE2-NZ 3.07Å; K2250-I2252 HydrophobicContact CG-CG1 4.43Å
2251	W	86.2	Confident	74	Confident	36 Å²	36	47.9 Å²	47.9	14%	0.136	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.3	168	-66.2	108.1	0	0	0	110.5	I2112 R2114 Q2134 Y2135 L2136 D2234 I2236	I2112-W2251 HydrophobicContact CG2-CH2 4Å; I2112-W2251 HydrophobicContact CG2-CZ3 4.41Å; R2114-W2251 HydrophobicContact CG-CE3 4.13Å; R2114-W2251 HydrophobicContact CG-CH2 4.08Å; R2114-W2251 HydrophobicContact CG-CZ3 3.8Å; R2114-W2251 VanDerWaalsContact NH1-CE2 3.34Å; R2114-W2251 VanDerWaalsContact NH1-NE1 3.19Å; R2114-W2251 VanDerWaalsContact NH2-CG 3.33Å; Q2134-W2251 HydrophobicContact CB-CE3 4.31Å; Y2135-W2251 WeakPolarHBondContact O-CA 3.4Å; L2136-W2251 HydrophobicContact CB-CE3 4.22Å; L2136-W2251 HydrophobicContact CB-CZ3 4.08Å; D2234-W2251 PolarHBondContact OD1-NE1 3.35Å; I2236-W2251 HydrophobicContact CG2-CH2 4.47Å; I2236-W2251 HydrophobicContact CG2-CZ2 3.85Å
2252	I	86.3	Confident	74	Confident	32 Å²	32	50.1 Å²	50.1	16%	0.164	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.9	-177.3	-57.4	-175	0	0	0	108.8	Q2134 Y2135 A2137 L2144 K2250	Q2134-I2252 CarbonylContact C-O 3.17Å; Q2134-I2252 WeakPolarHBondContact CA-O 3.28Å; Y2135-I2252 HydrophobicContact CD1-CB 4.4Å; Y2135-I2252 WeakPolarHBondContact CD1-O 3.33Å; Y2135-I2252 HydrophobicContact CE1-CB 3.9Å; Y2135-I2252 HydrophobicContact CE1-CG2 3.94Å; Y2135-I2252 PolarHBondContact N-O 3.38Å; Y2135-I2252 PolarHBondContact O-N 3.16Å; A2137-I2252 HydrophobicContact CB-CD1 3.7Å; A2137-I2252 HydrophobicContact CB-CG1 4.29Å; L2144-I2252 HydrophobicContact CD1-CD1 3.7Å; L2144-I2252 HydrophobicContact CD2-CD1 3.44Å; L2144-I2252 VanDerWaalsContact CD2-CD1 3.44Å; L2144-I2252 HydrophobicContact CG-CD1 4.19Å; K2250-I2252 HydrophobicContact CG-CG1 4.43Å
2253	E	85.9	Confident	74.6	Confident	45 Å²	45	49.7 Å²	49.7	21%	0.21	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	141.8	171.4	-64.5	-163.4	157.2	0	0	109.9	T2116 R2127 V2132 S2255	T2116-E2253 WeakPolarHBondContact CG2-OE1 3.47Å; R2127-E2253 IonicContact CZ-OE2 3.62Å; R2127-E2253 VanDerWaalsContact CZ-OE2 3.23Å; R2127-E2253 IonicContact NH1-OE2 3.54Å; R2127-E2253 PolarHBondContact NH1-OE2 3.2Å; R2127-E2253 IonicContact NH2-OE1 2.78Å; R2127-E2253 IonicContact NH2-OE2 3.91Å; R2127-E2253 PolarHBondContact NH2-OE2 3.27Å; V2132-E2253 HydrophobicContact CG1-CB 4.34Å; V2132-E2253 HydrophobicContact CG1-CG 4.2Å; E2253-S2255 PolarHBondContact O-N 3.4Å
2254	V	82.8	Confident	75.6	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.006	23%	0.234	C	C	.	.			trans	-67.5	125.3	174.9	179.4	0	0	0	0	110	L2133 Y2135 L2268 A2272 Y2279	L2133-V2254 HydrophobicContact CB-CG2 3.97Å; L2133-V2254 HydrophobicContact CD2-CG2 4.3Å; L2133-V2254 HydrophobicContact CG-CG2 4.35Å; L2133-V2254 PolarHBondContact O-N 2.71Å; Y2135-V2254 HydrophobicContact CD1-CG2 3.89Å; V2254-L2268 HydrophobicContact CG1-CD2 4.24Å; V2254-L2268 HydrophobicContact CG1-CG 4.25Å; V2254-L2268 HydrophobicContact CG2-CD1 4.04Å; V2254-L2268 HydrophobicContact CG2-CD2 4.29Å; V2254-L2268 HydrophobicContact CG2-CG 4.32Å; V2254-A2272 HydrophobicContact CG1-CB 4.36Å; V2254-Y2279 HydrophobicContact CG1-CD2 3.51Å; V2254-Y2279 HydrophobicContact CG1-CE2 4.29Å; V2254-Y2279 HydrophobicContact CG1-CG 4.29Å
2255	S	74.1	Confident	76.6	Confident	8 Å²	8	41.4 Å²	41.4	6%	0.056	21%	0.211	C	C	.	.			trans	-151.6	148	171.5	68.4	0	0	0	0	111.8	E2253 S2257 S2258 Y2279	E2253-S2255 PolarHBondContact O-N 3.4Å; S2255-S2257 PolarHBondContact O-N 3.23Å; S2255-S2257 VanDerWaalsContact O-N 3.11Å; S2255-S2257 PolarHBondContact OG-OG 3.02Å; S2255-S2258 PolarHBondContact O-N 3.32Å; S2255-S2258 PolarHBondContact O-OG 3.04Å; S2255-Y2279 WeakPolarHBondContact CA-OXT 3.06Å
2256	H	68.3	Low	77.7	Confident	124 Å²	124	46.6 Å²	46.6	57%	0.574	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49	-34	173.1	-165.7	-68.8	0	0	0	114.4	Y2279	H2256-Y2279 HydrophobicContact CB-CD1 4.44Å; H2256-Y2279 HydrophobicContact CB-CE1 3.99Å; H2256-Y2279 AromaticContact CD2-CE1 3.68Å; H2256-Y2279 PolarHBondContact N-OXT 3.39Å
2257	S	64.3	Low	78.7	Confident	34 Å²	34	43.3 Å²	43.3	24%	0.238	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-3.8	-173.2	62.6	0	0	0	0	116.4	A354 L355 S2255 N2259	A354-S2257 WeakPolarHBondContact CB-OG 3.34Å; A354-S2257 WeakPolarHBondContact O-CB 3.47Å; A354-S2257 PolarHBondContact O-OG 3.27Å; L355-S2257 PolarHBondContact O-OG 3.14Å; S2255-S2257 PolarHBondContact O-N 3.23Å; S2255-S2257 VanDerWaalsContact O-N 3.11Å; S2255-S2257 PolarHBondContact OG-OG 3.02Å; S2257-N2259 PolarHBondContact O-N 3.23Å
2258	S	65.9	Low	79.5	Confident	13 Å²	13	42.8 Å²	42.8	9%	0.091	21%	0.211	C	C	.	.			trans	-69.5	136.1	-170.6	67.8	0	0	0	0	111.9	S2255 L2260	S2255-S2258 PolarHBondContact O-N 3.32Å; S2255-S2258 PolarHBondContact O-OG 3.04Å; S2258-L2260 PolarHBondContact O-N 3.24Å
2259	N	68.9	Low	80	Confident	85 Å²	85	42.4 Å²	42.4	46%	0.455	21%	0.207	S	C	.	.			trans	-69.6	54.1	-179.4	-79.1	3.9	0	0	0	113	K2142 R2143 L2144 S2257	K2142-N2259 PolarHBondContact O-ND2 3.12Å; R2143-N2259 CarbonylContact C-O 3.57Å; R2143-N2259 WeakPolarHBondContact CA-O 3.28Å; L2144-N2259 WeakPolarHBondContact CB-O 3.33Å; L2144-N2259 WeakPolarHBondContact CG-O 3.47Å; L2144-N2259 PolarHBondContact N-O 3.06Å; S2257-N2259 PolarHBondContact O-N 3.23Å
2260	L	75.8	Confident	80.1	Confident	14 Å²	14	43.4 Å²	43.4	7%	0.073	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-98.9	139.2	-174.5	-175.4	66	0	0	0	110.6	Y2135 L2144 S2258 T2262 H2264 N2265 L2268	Y2135-L2260 HydrophobicContact CE2-CD1 4.17Å; Y2135-L2260 HydrophobicContact CE2-CD2 4.27Å; L2144-L2260 HydrophobicContact CB-CB 4.27Å; L2144-L2260 HydrophobicContact CB-CD1 3.76Å; S2258-L2260 PolarHBondContact O-N 3.24Å; L2260-T2262 PolarHBondContact O-N 2.87Å; L2260-H2264 HydrophobicContact CD1-CB 3.97Å; L2260-H2264 HydrophobicContact CD2-CB 4.22Å; L2260-H2264 HydrophobicContact CG-CB 3.88Å; L2260-N2265 HydrophobicContact CD2-CB 4.18Å; L2260-N2265 HydrophobicContact CG-CB 4.44Å; L2260-L2268 HydrophobicContact CD2-CB 4.17Å; L2260-L2268 HydrophobicContact CD2-CD2 3.67Å
2261	R	75.1	Confident	80.2	Confident	31 Å²	31	39.4 Å²	39.4	12%	0.117	19%	0.194	C	C	.	.			trans	-45.2	131.8	173.1	-170.4	-172.4	-166.1	178.1	5.2	110.2	L2144 D2206 S2263 H2264 N2265	L2144-R2261 PolarHBondContact O-N 2.9Å; L2144-R2261 VanDerWaalsContact O-N 3.13Å; D2206-R2261 VanDerWaalsContact CG-NH2 3.29Å; D2206-R2261 IonicContact OD1-CZ 2.68Å; D2206-R2261 IonicContact OD1-NE 2.74Å; D2206-R2261 IonicContact OD1-NH2 3.7Å; D2206-R2261 PolarHBondContact OD1-NH2 3.29Å; D2206-R2261 IonicContact OD2-CZ 2.96Å; D2206-R2261 IonicContact OD2-NE 3.51Å; D2206-R2261 PolarHBondContact OD2-NE 2.9Å; D2206-R2261 IonicContact OD2-NH1 2.7Å; D2206-R2261 IonicContact OD2-NH2 2.75Å; D2206-R2261 PolarHBondContact OD2-NH2 3.44Å; R2261-S2263 WeakPolarHBondContact CD-OG 3.5Å; R2261-S2263 PolarHBondContact O-N 3.37Å; R2261-H2264 HydrophobicContact CB-CB 4.26Å; R2261-H2264 CarbonylContact O-C 3.52Å; R2261-H2264 WeakPolarHBondContact O-CA 3.45Å; R2261-H2264 WeakPolarHBondContact O-CB 3.36Å; R2261-H2264 PolarHBondContact O-N 3.14Å; R2261-N2265 PolarHBondContact O-N 3.01Å
2262	T	78.1	Confident	80.3	Confident	91 Å²	91	37.8 Å²	37.8	56%	0.558	19%	0.188	S	C	*	.	H	α-helix	trans	-51.4	-48.8	-171.6	49.5	0	0	0	0	113.4	L2260 H2264 N2265 Y2266	L2260-T2262 PolarHBondContact O-N 2.87Å; T2262-H2264 VanDerWaalsContact C-N 3.29Å; T2262-H2264 PolarHBondContact O-N 3.33Å; T2262-N2265 PolarHBondContact O-N 3.38Å; T2262-Y2266 PolarHBondContact O-N 2.63Å; T2262-Y2266 VanDerWaalsContact O-N 3.09Å
2263	S	82	Confident	80.2	Confident	5 Å²	5	41.5 Å²	41.5	4%	0.035	21%	0.205	C	C	.	.	H	α-helix	trans	-57.8	-36.7	175.5	58.1	0	0	0	0	113.4	D2205 D2206 R2261 I2267	D2205-S2263 WeakPolarHBondContact O-CB 3.39Å; D2206-S2263 VanDerWaalsContact OD2-CB 3.28Å; D2206-S2263 WeakPolarHBondContact OD2-CB 3.41Å; D2206-S2263 PolarHBondContact OD2-OG 3.01Å; R2261-S2263 WeakPolarHBondContact CD-OG 3.5Å; R2261-S2263 PolarHBondContact O-N 3.37Å; S2263-I2267 WeakPolarHBondContact O-CG1 3.4Å; S2263-I2267 PolarHBondContact O-N 3.2Å
2264	H	86.4	Confident	80.2	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-75.4	-30.8	174.3	-65.6	158.7	0	0	0	112.8	M2146 L2260 R2261 T2262 I2267 L2268	M2146-H2264 HydrophobicContact CE-CB 3.71Å; M2146-H2264 WeakPolarHBondContact CE-O 3.47Å; M2146-H2264 PolarHBondContact N-ND1 3.33Å; M2146-H2264 PolarHBondContact O-CE1 3.2Å; L2260-H2264 HydrophobicContact CD1-CB 3.97Å; L2260-H2264 HydrophobicContact CD2-CB 4.22Å; L2260-H2264 HydrophobicContact CG-CB 3.88Å; R2261-H2264 HydrophobicContact CB-CB 4.26Å; R2261-H2264 CarbonylContact O-C 3.52Å; R2261-H2264 WeakPolarHBondContact O-CA 3.45Å; R2261-H2264 WeakPolarHBondContact O-CB 3.36Å; R2261-H2264 PolarHBondContact O-N 3.14Å; T2262-H2264 VanDerWaalsContact C-N 3.29Å; T2262-H2264 PolarHBondContact O-N 3.33Å; H2264-I2267 PolarHBondContact O-N 3.46Å; H2264-L2268 WeakPolarHBondContact O-CB 3.37Å; H2264-L2268 PolarHBondContact O-N 3.36Å
2265	N	84.3	Confident	80.2	Confident	32 Å²	32	45.8 Å²	45.8	17%	0.171	23%	0.226	C	C	.	.	H	α-helix	trans	-70.1	-39.5	177.4	-155.9	16.4	0	0	0	111.6	L2260 R2261 T2262 I2267 L2268 K2269 Y2279	L2260-N2265 HydrophobicContact CD2-CB 4.18Å; L2260-N2265 HydrophobicContact CG-CB 4.44Å; R2261-N2265 PolarHBondContact O-N 3.01Å; T2262-N2265 PolarHBondContact O-N 3.38Å; N2265-I2267 PolarHBondContact O-N 2.95Å; N2265-L2268 PolarHBondContact O-N 3.08Å; N2265-L2268 VanDerWaalsContact O-N 3.16Å; N2265-K2269 PolarHBondContact O-N 2.84Å; N2265-Y2279 PolarHBondContact OD1-OH 3.02Å
2266	Y	85.3	Confident	80.6	Confident	141 Å²	141	55.1 Å²	55.1	55%	0.553	26%	0.26	S	S	*	.	H	α-helix	trans	-57.6	-45.8	170.3	179.9	-99	0	0	0	112.1	T2262 L2268 K2269 N2270	T2262-Y2266 PolarHBondContact O-N 2.63Å; T2262-Y2266 VanDerWaalsContact O-N 3.09Å; Y2266-L2268 PolarHBondContact O-N 3.21Å; Y2266-K2269 PolarHBondContact O-N 3.05Å; Y2266-N2270 VanDerWaalsContact CE1-ND2 3.31Å; Y2266-N2270 WeakPolarHBondContact CE1-ND2 3.16Å; Y2266-N2270 PolarHBondContact O-N 3.16Å
2267	I	87.2	Confident	81.3	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-59.6	-46.5	173.7	-68.1	167.5	0	0	0	110.9	V2109 M2146 L2204 V2219 S2263 H2264 N2265 K2269 N2270 V2271	V2109-I2267 HydrophobicContact CG1-CD1 4.41Å; M2146-I2267 HydrophobicContact CE-CB 3.96Å; M2146-I2267 HydrophobicContact CE-CG2 3.78Å; L2204-I2267 HydrophobicContact CD1-CD1 4.07Å; V2219-I2267 HydrophobicContact CG1-CD1 4.46Å; V2219-I2267 HydrophobicContact CG1-CG2 3.66Å; V2219-I2267 HydrophobicContact CG2-CD1 3.85Å; V2219-I2267 HydrophobicContact CG2-CG1 4.34Å; S2263-I2267 WeakPolarHBondContact O-CG1 3.4Å; S2263-I2267 PolarHBondContact O-N 3.2Å; H2264-I2267 PolarHBondContact O-N 3.46Å; N2265-I2267 PolarHBondContact O-N 2.95Å; I2267-K2269 PolarHBondContact O-N 3.05Å; I2267-N2270 WeakPolarHBondContact O-CB 3.37Å; I2267-N2270 PolarHBondContact O-N 2.96Å; I2267-N2270 VanDerWaalsContact O-N 3.17Å; I2267-V2271 HydrophobicContact CG2-CG2 4.29Å; I2267-V2271 WeakPolarHBondContact O-CG2 3.39Å; I2267-V2271 PolarHBondContact O-N 2.58Å
2268	L	87.8	Confident	82.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.1	-38.9	-176.9	-171.6	63.1	0	0	0	112.5	Y2135 M2146 V2254 L2260 H2264 N2265 Y2266 V2271 A2272	Y2135-L2268 HydrophobicContact CD1-CD1 4.12Å; Y2135-L2268 HydrophobicContact CD1-CD2 3.82Å; Y2135-L2268 HydrophobicContact CD2-CD1 4.45Å; Y2135-L2268 HydrophobicContact CD2-CD2 4.45Å; Y2135-L2268 HydrophobicContact CE1-CD2 3.58Å; Y2135-L2268 HydrophobicContact CE2-CD2 4.24Å; Y2135-L2268 HydrophobicContact CG-CD1 3.98Å; Y2135-L2268 HydrophobicContact CG-CD2 4.25Å; M2146-L2268 HydrophobicContact CE-CB 4.48Å; V2254-L2268 HydrophobicContact CG1-CD2 4.24Å; V2254-L2268 HydrophobicContact CG1-CG 4.25Å; V2254-L2268 HydrophobicContact CG2-CD1 4.04Å; V2254-L2268 HydrophobicContact CG2-CD2 4.29Å; V2254-L2268 HydrophobicContact CG2-CG 4.32Å; L2260-L2268 HydrophobicContact CD2-CB 4.17Å; L2260-L2268 HydrophobicContact CD2-CD2 3.67Å; H2264-L2268 WeakPolarHBondContact O-CB 3.37Å; H2264-L2268 PolarHBondContact O-N 3.36Å; N2265-L2268 PolarHBondContact O-N 3.08Å; N2265-L2268 VanDerWaalsContact O-N 3.16Å; Y2266-L2268 PolarHBondContact O-N 3.21Å; L2268-V2271 PolarHBondContact O-N 3.02Å; L2268-A2272 PolarHBondContact O-N 2.96Å
2269	K	86.6	Confident	82.5	Confident	92 Å²	92	50.8 Å²	50.8	40%	0.4	23%	0.232	S	C	.	.	H	α-helix	trans	-55.9	-50.2	170.4	179.2	-179.6	173.1	-178.9	0	111	N2265 Y2266 I2267 V2271 A2272 E2273 Y2279	N2265-K2269 PolarHBondContact O-N 2.84Å; Y2266-K2269 PolarHBondContact O-N 3.05Å; I2267-K2269 PolarHBondContact O-N 3.05Å; K2269-V2271 VanDerWaalsContact C-N 3.28Å; K2269-V2271 PolarHBondContact O-N 3.22Å; K2269-A2272 WeakPolarHBondContact O-CB 3.45Å; K2269-A2272 PolarHBondContact O-N 3.08Å; K2269-A2272 VanDerWaalsContact O-N 3.09Å; K2269-E2273 WeakPolarHBondContact CE-OE1 3.42Å; K2269-E2273 WeakPolarHBondContact CG-OE1 3.37Å; K2269-E2273 WeakPolarHBondContact O-CG 3.47Å; K2269-E2273 PolarHBondContact O-N 2.8Å; K2269-Y2279 HydrophobicContact CB-CE2 4.08Å
2270	N	86.4	Confident	83.2	Confident	39 Å²	39	49.1 Å²	49.1	21%	0.209	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-34.7	177.7	-65.6	-10	0	0	0	112.3	I2199 Y2266 I2267 L2274	I2199-N2270 HydrophobicContact CG2-CB 4.24Å; Y2266-N2270 VanDerWaalsContact CE1-ND2 3.31Å; Y2266-N2270 WeakPolarHBondContact CE1-ND2 3.16Å; Y2266-N2270 PolarHBondContact O-N 3.16Å; I2267-N2270 WeakPolarHBondContact O-CB 3.37Å; I2267-N2270 PolarHBondContact O-N 2.96Å; I2267-N2270 VanDerWaalsContact O-N 3.17Å; N2270-L2274 VanDerWaalsContact O-CB 3.25Å; N2270-L2274 WeakPolarHBondContact O-CB 3.43Å; N2270-L2274 PolarHBondContact O-N 2.92Å
2271	V	87.4	Confident	83.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68.5	-41.7	173.3	-167	0	0	0	0	111.7	T2113 I2199 I2267 L2268 K2269 L2274 R2275	T2113-V2271 HydrophobicContact CG2-CG1 4.16Å; I2199-V2271 HydrophobicContact CD1-CG2 3.44Å; I2199-V2271 VanDerWaalsContact CD1-CG2 3.44Å; I2199-V2271 HydrophobicContact CG1-CG2 4.49Å; I2267-V2271 HydrophobicContact CG2-CG2 4.29Å; I2267-V2271 WeakPolarHBondContact O-CG2 3.39Å; I2267-V2271 PolarHBondContact O-N 2.58Å; L2268-V2271 PolarHBondContact O-N 3.02Å; K2269-V2271 VanDerWaalsContact C-N 3.28Å; K2269-V2271 PolarHBondContact O-N 3.22Å; V2271-L2274 PolarHBondContact O-N 2.84Å; V2271-R2275 HydrophobicContact CG1-CG 4.33Å; V2271-R2275 WeakPolarHBondContact O-CB 3.42Å; V2271-R2275 WeakPolarHBondContact O-CG 3.16Å; V2271-R2275 PolarHBondContact O-N 3.2Å
2272	A	86.6	Confident	84	Confident	2 Å²	2	52 Å²	52	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-64.9	-40.2	178.7	0	0	0	0	0	111.7	V2254 L2268 K2269 R2275 R2276 A2277 Y2279	V2254-A2272 HydrophobicContact CG1-CB 4.36Å; L2268-A2272 PolarHBondContact O-N 2.96Å; K2269-A2272 WeakPolarHBondContact O-CB 3.45Å; K2269-A2272 PolarHBondContact O-N 3.08Å; K2269-A2272 VanDerWaalsContact O-N 3.09Å; A2272-R2275 CarbonylContact O-C 3.53Å; A2272-R2276 CarbonylContact O-C 3.53Å; A2272-R2276 WeakPolarHBondContact O-CA 3.16Å; A2272-R2276 PolarHBondContact O-N 2.77Å; A2272-A2277 HydrophobicContact CB-CB 4.22Å; A2272-A2277 PolarHBondContact O-N 3.1Å; A2272-Y2279 HydrophobicContact CB-CD2 4.21Å
2273	E	85.6	Confident	84.4	Confident	109 Å²	109	49.7 Å²	49.7	51%	0.509	22%	0.216	S	C	.	.	H	α-helix	trans	-65.5	-49.5	174	-70.8	178.3	-165.6	0	0	111.5	K2269 R2275 R2276	K2269-E2273 WeakPolarHBondContact CE-OE1 3.42Å; K2269-E2273 WeakPolarHBondContact CG-OE1 3.37Å; K2269-E2273 WeakPolarHBondContact O-CG 3.47Å; K2269-E2273 PolarHBondContact O-N 2.8Å; E2273-R2275 VanDerWaalsContact C-N 3.26Å; E2273-R2275 PolarHBondContact O-N 3.11Å; E2273-R2276 PolarHBondContact O-N 3.11Å
2274	L	85.6	Confident	84.5	Confident	100 Å²	100	52.5 Å²	52.5	52%	0.524	23%	0.227	S	C	.	.	H	α-helix	trans	-55.8	-38.6	176.1	-178.8	66.1	0	0	0	112.6	I2199 N2270 V2271	I2199-L2274 HydrophobicContact CG1-CD2 4.27Å; N2270-L2274 VanDerWaalsContact O-CB 3.25Å; N2270-L2274 WeakPolarHBondContact O-CB 3.43Å; N2270-L2274 PolarHBondContact O-N 2.92Å; V2271-L2274 PolarHBondContact O-N 2.84Å
2275	R	82.7	Confident	84.4	Confident	37 Å²	37	55.9 Å²	55.9	14%	0.14	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	1.1	179.6	-63.1	-70.8	167.6	-174.9	-9.1	114.1	W2115 E2195 T2197 H2223 V2271 A2272 E2273 A2277	W2115-R2275 HydrophobicContact CH2-CB 4.36Å; E2195-R2275 VanDerWaalsContact CD-NH2 3.31Å; E2195-R2275 IonicContact OE1-CZ 2.69Å; E2195-R2275 VanDerWaalsContact OE1-CZ 3.27Å; E2195-R2275 IonicContact OE1-NH1 2.79Å; E2195-R2275 PolarHBondContact OE1-NH1 3.5Å; E2195-R2275 IonicContact OE1-NH2 2.68Å; E2195-R2275 PolarHBondContact OE1-NH2 3.39Å; E2195-R2275 IonicContact OE2-CZ 3.67Å; E2195-R2275 IonicContact OE2-NH1 2.68Å; E2195-R2275 PolarHBondContact OE2-NH1 2.97Å; E2195-R2275 IonicContact OE2-NH2 2.93Å; T2197-R2275 PolarHBondContact OG1-NH2 2.79Å; H2223-R2275 PolarHBondContact CD2-NH1 2.96Å; H2223-R2275 VanDerWaalsContact CD2-NH1 3.34Å; V2271-R2275 HydrophobicContact CG1-CG 4.33Å; V2271-R2275 WeakPolarHBondContact O-CB 3.42Å; V2271-R2275 WeakPolarHBondContact O-CG 3.16Å; V2271-R2275 PolarHBondContact O-N 3.2Å; A2272-R2275 CarbonylContact O-C 3.53Å; E2273-R2275 VanDerWaalsContact C-N 3.26Å; E2273-R2275 PolarHBondContact O-N 3.11Å; R2275-A2277 PolarHBondContact O-N 2.04Å
2276	R	82.8	Confident	84.4	Confident	203 Å²	203	57.6 Å²	57.6	77%	0.766	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	38.1	-175.4	-58	179.4	177.4	172.5	-1.2	113.4	A2272 E2273	A2272-R2276 CarbonylContact O-C 3.53Å; A2272-R2276 WeakPolarHBondContact O-CA 3.16Å; A2272-R2276 PolarHBondContact O-N 2.77Å; E2273-R2276 PolarHBondContact O-N 3.11Å
2277	A	82.6	Confident	84.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-80.3	167.8	179.8	0	0	0	0	0	112.8	W2115 R2130 G2131 L2133 A2272 R2275	W2115-A2277 HydrophobicContact CZ3-CB 4.31Å; R2130-A2277 WeakPolarHBondContact CD-O 3.15Å; R2130-A2277 PolarHBondContact NH1-O 3Å; R2130-A2277 VanDerWaalsContact NH1-O 3.11Å; G2131-A2277 WeakPolarHBondContact O-CA 3.42Å; L2133-A2277 HydrophobicContact CB-CB 3.83Å; L2133-A2277 HydrophobicContact CD2-CB 4.31Å; A2272-A2277 HydrophobicContact CB-CB 4.22Å; A2272-A2277 PolarHBondContact O-N 3.1Å; R2275-A2277 PolarHBondContact O-N 2.04Å
2278	F	81.1	Confident	84.1	Confident	28 Å²	28	55.2 Å²	55.2	12%	0.123	24%	0.241	C	C	.	.			trans	-73.4	140.8	162.3	-171.9	-85.1	0	0	0	109.9	R2127 R2130 G2131	R2127-F2278 HydrophobicContact CB-CB 4.48Å; R2127-F2278 HydrophobicContact CB-CD2 3.51Å; R2127-F2278 HydrophobicContact CB-CE2 3.83Å; R2127-F2278 HydrophobicContact CB-CG 3.96Å; R2130-F2278 HydrophobicContact CB-CB 4.3Å; G2131-F2278 PolarHBondContact O-N 3.18Å
2279	Y	74.1	Confident	83.8	Confident	52 Å²	52	60.2 Å²	60.2	20%	0.204	26%	0.263	C	S	.	.			trans	-145.3	0	179	177.4	-83.3	0	0	0	108.6	V2254 S2255 H2256 N2265 K2269 A2272	V2254-Y2279 HydrophobicContact CG1-CD2 3.51Å; V2254-Y2279 HydrophobicContact CG1-CE2 4.29Å; V2254-Y2279 HydrophobicContact CG1-CG 4.29Å; S2255-Y2279 WeakPolarHBondContact CA-OXT 3.06Å; H2256-Y2279 HydrophobicContact CB-CD1 4.44Å; H2256-Y2279 HydrophobicContact CB-CE1 3.99Å; H2256-Y2279 AromaticContact CD2-CE1 3.68Å; H2256-Y2279 PolarHBondContact N-OXT 3.39Å; N2265-Y2279 PolarHBondContact OD1-OH 3.02Å; K2269-Y2279 HydrophobicContact CB-CE2 4.08Å; A2272-Y2279 HydrophobicContact CB-CD2 4.21Å

Retrieved 2,279 of 2,279 residues in 1315.5 ms (Link to these results)

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