A0A077Z513_TRITR Loading...

phospholipase A2

AlphaFold DB , UniProt , Accession A0A077Z513, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,627 aa.

						>A0A077Z513_TRITR|A0A077Z513
MYLARQYIDTDGCGPCHYFRHMNWIPMPAIVPLLVGIYTGILIAQNYKIPRVPVPMELYAKPHFLPFNMSDADDNPNSRRQLTKLLGNMVKVARERIMGRQNWLPRNNDTVVEVPEQFRDSVKTVAEFEPFQLFHSMTGSNIVSALYHIGLKCNKTLFSIVRWATEQEALEHLDSIRPFSALFLHIEQQMPGKYVRPTDTLLWAKCFAAPFRCSSMERLMYAIKKHPLWNPVHIAAEIGIKGYFEKLLEDETETKRYNCIFSTQNLILSRVLHSMCQPEGRYPLHIAVENSQTEIVKFMLEKLKVNPSQVDKLGQNSLHYAAQTSAEMIGVLTASDRLASCINALSKDGYTPLFMAVASARPSCAAALLKQGARLDVYCHGRSAVHEAMLQKGPKVFNLIRTLHAASPESFNIAEAETGNSALHVAGNKQTILALLACNPEFNLESRNFNGQTALHLHTYNSNLPCVVVLICKNANIDAHDEDGNTSLHIAISVSNRCAMPLVIFDWLLKNQNESITKLLLLFGADPNVHVKNKVKDGKKVSVVLALDGGGTRGVVIVQTLLMIEQRLKIPLYQIVDWVAGTSTGALLGTAIALGKSLKIAIIPLCKKSSSRSLRNVQKLYMLLKDDIFEGQKRPYSSSRMEESLKSIVGPSTTMADVTSKKLVITSVLIKNHPLRLHIFRNYQLPELLLWKVLRCTTAAPTYFSSVDNMYVDGGLMANNPSLDTLTEIHRYNCAVELANEGEKVEVGCFLSVGTGRTPERPLPVINFDSSNPLELLPAAMNYISVVMNQLTATEGAPVDRARSWCQDLNIPYFRFCTPLSKHFFLDTTSDEDMKVMGETWWLPSSPKEIVEIPPKALKTLQEIDRKDIFGIRHGSDEKTSDDTFHITMDWKNGKHILSLCRCSNLEDAYDHFNNLIYFLPLFSFIESRKRLDSLLQCIRRHSLWKPVHIAAMLGIRKYFENVARQEPSKISEQLNQICQPEGRYPLHIAVENCHVDLALYMINVLKVPISLPDLNGQNVFHYAAGASPSVVTALAECEGADKQINILSKDGYTPLFMSIISCKPTCTTALIKKGAVWDIMCNGRSAVHQAMLQDGSKVKECVLMQKLSLIIKTLVEASPDMIRDAEPQTGNSALHIAGNKQALSSLFLVCSNLDVELRNKAGQTALHMHVHHGNLGCTLVLLYNGANPDAQDSNGNTSLHLAVSSLNVDIAKALLVLGANPNILNNTGDSPRHLAARLGTNARELLSCLVIGGAVRCNMNHRGCVAGCMYRNSVEDEVTSECTSGKKLKFLLSLDGGGIRGLILVQMLIFIESFLDKPLISYVDWLAGTSTGAILAASLARGKSLRQCQVAYLRMKDLLFEDRKRPYDTDAMERHVKEHVGLEARMTDITKPKLIITSVLAQKHPVRLHIFRSYTLPGEDRIPCRDPDSCEEMPLWKVLRCSSAAPTYFTSVDNKFVDGGLIANNPSVDLLSEIQLYKMALEYTVGSLEYAGYVGLNVLQKSTEELEIGCLLNLGTGRIPDMPIESLNVGISSPIGMVGVLKNLGYMIMDQVTATEGRPADRAKAWCNEMGVPFFRFSPQMTKDYLLDTKTDREVVMMMWETVEYMQKRKEECYKLVNLIKALNQQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.7	Very low	29.8	Very low	210 Å²	210	172.6 Å²	172.6	100%	1.034	85%	0.846	S	S	*	*				0	-2.1	0	-70.4	170.3	76.5	0	0	114.2	L3	M1-L3 PolarHBondContact O-N 2.88Å
2	Y	25.9	Very low	29.5	Very low	210 Å²	210	164.2 Å²	164.2	82%	0.824	84%	0.836	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-26.8	-173.3	-154.4	-101	0	0	0	115
3	L	30.9	Very low	29.5	Very low	153 Å²	153	162.4 Å²	162.4	80%	0.801	85%	0.845	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-7.2	-179.4	-75.4	163.7	0	0	0	114.8	M1 R5	M1-L3 PolarHBondContact O-N 2.88Å; L3-R5 VanDerWaalsContact C-N 3.28Å; L3-R5 PolarHBondContact O-N 3.04Å
4	A	32.3	Very low	29.4	Very low	88 Å²	88	155.7 Å²	155.7	73%	0.727	84%	0.836	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	30.9	-175.6	0	0	0	0	0	113.1
5	R	28.8	Very low	29.2	Very low	224 Å²	224	153.8 Å²	153.8	85%	0.845	84%	0.835	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.4	15.5	-168.2	-134.9	179.2	-169.6	-170.4	0.3	115.8	L3	L3-R5 VanDerWaalsContact C-N 3.28Å; L3-R5 PolarHBondContact O-N 3.04Å
6	Q	32.2	Very low	28.9	Very low	164 Å²	164	150.4 Å²	150.4	77%	0.766	83%	0.825	S	S	*	*	S	Bend	trans	-118.7	13.3	177.7	-78.9	-175.6	-62.2	0	0	113.7
7	Y	31.6	Very low	28.7	Very low	226 Å²	226	152.5 Å²	152.5	89%	0.886	83%	0.827	S	S	*	*			trans	-127	39.6	-177.1	-91.4	-77.7	0	0	0	112.4
8	I	29.1	Very low	28.8	Very low	145 Å²	145	151.4 Å²	151.4	74%	0.744	81%	0.81	S	S	*	*			trans	-136.6	85.8	172.6	-54.5	178.1	0	0	0	107.4
9	D	27.8	Very low	28.6	Very low	158 Å²	158	153.6 Å²	153.6	85%	0.845	81%	0.812	S	S	*	*			trans	-171.3	92	160.6	-92	-29.8	0	0	0	108.6
10	T	31.5	Very low	28.5	Very low	146 Å²	146	157.9 Å²	157.9	90%	0.896	82%	0.816	S	S	*	*			trans	178.7	138.8	147.6	22.2	0	0	0	0	108.8
11	D	27.6	Very low	28.5	Very low	175 Å²	175	156 Å²	156	94%	0.936	80%	0.804	S	S	*	*			trans	-81.7	157.2	-168.4	-57.7	-88.8	0	0	0	115.3
12	G	26.5	Very low	28.3	Very low	71 Å²	71	153.1 Å²	153.1	73%	0.732	79%	0.79	S	S	*	*			trans	161.4	85.1	166.6	0	0	0	0	0	117.6
13	C	29.2	Very low	28.3	Very low	141 Å²	141	147.1 Å²	147.1	95%	0.953	77%	0.772	S	S	*	*			trans	57.3	127	156.1	-66.4	0	0	0	0	121.9
14	G	28	Very low	28.2	Very low	69 Å²	69	142.8 Å²	142.8	71%	0.711	75%	0.745	S	S	*	*			trans	98.2	111.8	145.1	0	0	0	0	0	117.6	C16	G14-C16 PolarHBondContact O-N 3.25Å
15	P	26.7	Very low	28.1	Very low	127 Å²	127	142.6 Å²	142.6	83%	0.825	73%	0.73	S	S	*	*			trans	-83.8	110.6	-176	32	-33.7	0	0	0	113.6
16	C	25	Very low	28.1	Very low	99 Å²	99	133.9 Å²	133.9	67%	0.669	70%	0.703	S	S	*	*			trans	-119.7	95.2	166.8	-167.3	0	0	0	0	111.5	G14 Y18	G14-C16 PolarHBondContact O-N 3.25Å; C16-Y18 VanDerWaalsContact C-N 3.31Å; C16-Y18 PolarHBondContact O-N 3.05Å
17	H	25.5	Very low	28.1	Very low	187 Å²	187	128 Å²	128	87%	0.866	68%	0.676	S	S	*	*			trans	-71.5	75.6	178.1	-88	-95.2	0	0	0	112.2
18	Y	29.9	Very low	27.9	Very low	133 Å²	133	122.2 Å²	122.2	52%	0.522	67%	0.666	S	S	.	*			trans	-136.3	2.2	178.6	-105.5	-53.1	0	0	0	118.4	C16 K835	C16-Y18 VanDerWaalsContact C-N 3.31Å; C16-Y18 PolarHBondContact O-N 3.05Å; Y18-K835 HydrophobicContact CE1-CD 4.27Å
19	F	25.7	Very low	28.2	Very low	192 Å²	192	117.5 Å²	117.5	84%	0.842	65%	0.649	S	S	*	*			trans	-99.9	17.8	-169.1	-94.2	-80.1	0	0	0	117.4
20	R	26.1	Very low	28.8	Very low	239 Å²	239	112.5 Å²	112.5	90%	0.902	62%	0.622	S	S	*	*	S	Bend	trans	-111.3	1	-175.5	-105	-175.2	-174.3	178.9	5.1	118.5
21	H	28	Very low	28.9	Very low	119 Å²	119	108.7 Å²	108.7	55%	0.551	60%	0.598	S	S	*	*			trans	-128.5	6.1	-177.2	-79.3	-85.1	0	0	0	115.7	N23 K835 V836	H21-N23 PolarHBondContact O-N 2.99Å; H21-K835 HydrophobicContact CB-CB 4.45Å; H21-V836 PolarHBondContact ND1-O 3.48Å
22	M	25.1	Very low	29.2	Very low	150 Å²	150	101.6 Å²	101.6	74%	0.739	56%	0.561	S	S	*	*			trans	-80.5	60.5	178.4	-70.2	-151.1	-169.8	0	0	113.7
23	N	26.5	Very low	29.7	Very low	84 Å²	84	99 Å²	99	45%	0.449	53%	0.531	S	S	.	.			trans	-88.1	165.7	145.5	-93.1	-40.5	0	0	0	108.1	H21 V836 M837 G838	H21-N23 PolarHBondContact O-N 2.99Å; N23-V836 WeakPolarHBondContact O-CG1 3.36Å; N23-M837 VanDerWaalsContact CB-C 3.48Å; N23-M837 HydrophobicContact CB-CB 3.96Å; N23-M837 WeakPolarHBondContact CB-O 3.09Å; N23-M837 PolarHBondContact ND2-O 2.65Å; N23-G838 WeakPolarHBondContact ND2-CA 3.26Å
24	W	29.3	Very low	30.3	Very low	62 Å²	62	93.1 Å²	93.1	24%	0.235	49%	0.49	C	S	.	.			trans	96.3	58.2	135.7	48.3	-55.9	0	0	0	118.3	M27 M837 E839	W24-M27 HydrophobicContact CB-CG 4.35Å; W24-M27 HydrophobicContact CD2-CB 4.49Å; W24-M27 HydrophobicContact CD2-CG 4.32Å; W24-M27 HydrophobicContact CE3-CB 4.13Å; W24-M27 HydrophobicContact CE3-CG 4.45Å; W24-M27 HydrophobicContact CG-CG 4.42Å; W24-M27 HydrophobicContact CH2-CB 4.44Å; W24-M27 HydrophobicContact CZ3-CB 4.12Å; W24-M837 HydrophobicContact CB-CB 4.12Å; W24-M837 HydrophobicContact CB-SD 3.74Å; W24-M837 HydrophobicContact CD2-CB 4.26Å; W24-M837 HydrophobicContact CD2-SD 4.42Å; W24-M837 HydrophobicContact CE3-SD 4.09Å; W24-M837 HydrophobicContact CG-CB 3.93Å; W24-M837 HydrophobicContact CG-SD 4.26Å; W24-M837 VanDerWaalsContact O-CE 3.22Å; W24-M837 WeakPolarHBondContact O-CE 3.21Å; W24-E839 HydrophobicContact CH2-CB 3.77Å; W24-E839 HydrophobicContact CH2-CG 3.47Å; W24-E839 VanDerWaalsContact CH2-CG 3.47Å; W24-E839 WeakPolarHBondContact CH2-OE1 3.38Å; W24-E839 HydrophobicContact CZ2-CB 3.59Å; W24-E839 HydrophobicContact CZ2-CG 3.71Å; W24-E839 HydrophobicContact CZ3-CG 4.35Å
25	I	30	Very low	30.8	Very low	83 Å²	83	91.6 Å²	91.6	43%	0.426	47%	0.466	S	S	.	.	S	Bend	trans	-58.3	126	138.4	-63.8	174	0	0	0	106.1	M27 I30 M781	I25-M27 WeakPolarHBondContact O-CA 3.48Å; I25-M27 WeakPolarHBondContact O-CG 3.35Å; I25-M27 PolarHBondContact O-N 3.15Å; I25-I30 HydrophobicContact CG2-CB 4.06Å; I25-I30 HydrophobicContact CG2-CD1 3.87Å; I25-I30 HydrophobicContact CG2-CG1 3.67Å; I25-I30 HydrophobicContact CG2-CG2 4.22Å; I25-M781 HydrophobicContact CD1-CE 4.35Å
26	P	29.3	Very low	31.4	Very low	42 Å²	42	85.5 Å²	85.5	27%	0.273	43%	0.427	S	S	.	.			trans	-54	93	-175.7	-27.2	33.2	0	0	0	113.2	A29 M837	P26-A29 PolarHBondContact O-N 3.36Å; P26-M837 HydrophobicContact CG-CE 4.14Å
27	M	31.6	Very low	32.3	Very low	40 Å²	40	82.4 Å²	82.4	20%	0.197	40%	0.404	C	S	.	.	H	α-helix	trans	-66.2	-26.9	-160.8	-85.5	-52.7	-143.9	0	0	115.7	W24 I25 A29 I30 V31 L34 M781	W24-M27 HydrophobicContact CB-CG 4.35Å; W24-M27 HydrophobicContact CD2-CB 4.49Å; W24-M27 HydrophobicContact CD2-CG 4.32Å; W24-M27 HydrophobicContact CE3-CB 4.13Å; W24-M27 HydrophobicContact CE3-CG 4.45Å; W24-M27 HydrophobicContact CG-CG 4.42Å; W24-M27 HydrophobicContact CH2-CB 4.44Å; W24-M27 HydrophobicContact CZ3-CB 4.12Å; I25-M27 WeakPolarHBondContact O-CA 3.48Å; I25-M27 WeakPolarHBondContact O-CG 3.35Å; I25-M27 PolarHBondContact O-N 3.15Å; M27-A29 PolarHBondContact O-N 2.89Å; M27-I30 PolarHBondContact O-N 2.96Å; M27-I30 HydrophobicContact SD-CB 4.39Å; M27-I30 HydrophobicContact SD-CG2 4.35Å; M27-V31 HydrophobicContact CB-CG2 3.8Å; M27-V31 HydrophobicContact CE-CG2 4.2Å; M27-V31 HydrophobicContact CG-CG2 4.03Å; M27-V31 WeakPolarHBondContact O-CB 3.36Å; M27-V31 WeakPolarHBondContact O-CG2 3.24Å; M27-V31 PolarHBondContact O-N 2.82Å; M27-V31 HydrophobicContact SD-CG2 3.68Å; M27-L34 HydrophobicContact CE-CD1 4.26Å; M27-M781 HydrophobicContact CE-CE 4.31Å; M27-M781 HydrophobicContact CE-SD 4.37Å
28	P	28.2	Very low	33.2	Very low	104 Å²	104	75.8 Å²	75.8	68%	0.675	37%	0.371	S	S	*	.	H	α-helix	trans	-54.4	-27.8	178.8	-31	37.7	0	0	0	115.6	P32	P28-P32 VanDerWaalsContact O-CD 3.26Å; P28-P32 WeakPolarHBondContact O-CD 3.44Å; P28-P32 WeakPolarHBondContact O-CG 3.48Å
29	A	35.1	Very low	33.6	Very low	47 Å²	47	71 Å²	71	39%	0.388	36%	0.356	S	S	.	.	H	α-helix	trans	-95.7	-23.6	176.7	0	0	0	0	0	113.9	P26 M27	P26-A29 PolarHBondContact O-N 3.36Å; M27-A29 PolarHBondContact O-N 2.89Å
30	I	39.2	Very low	34.1	Very low	52 Å²	52	62.1 Å²	62.1	27%	0.267	32%	0.319	S	S	.	.	H	α-helix	trans	-100.3	-26.6	-173.4	-62.3	-112.4	0	0	0	111.8	I25 M27 L33 L34	I25-I30 HydrophobicContact CG2-CB 4.06Å; I25-I30 HydrophobicContact CG2-CD1 3.87Å; I25-I30 HydrophobicContact CG2-CG1 3.67Å; I25-I30 HydrophobicContact CG2-CG2 4.22Å; M27-I30 PolarHBondContact O-N 2.96Å; M27-I30 HydrophobicContact SD-CB 4.39Å; M27-I30 HydrophobicContact SD-CG2 4.35Å; I30-L33 CarbonylContact O-C 3.38Å; I30-L33 WeakPolarHBondContact O-CB 3.38Å; I30-L33 PolarHBondContact O-N 3.5Å; I30-L33 VanDerWaalsContact O-N 3.14Å; I30-L34 HydrophobicContact CG2-CD1 3.91Å; I30-L34 HydrophobicContact CG2-CG 4.09Å; I30-L34 WeakPolarHBondContact O-CB 3.3Å; I30-L34 WeakPolarHBondContact O-CG 3.48Å; I30-L34 PolarHBondContact O-N 3.19Å
31	V	34.2	Very low	34.8	Very low	67 Å²	67	53.4 Å²	53.4	41%	0.406	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-46.1	171.7	169.8	0	0	0	0	111.7	M27 L33 L34 V35	M27-V31 HydrophobicContact CB-CG2 3.8Å; M27-V31 HydrophobicContact CE-CG2 4.2Å; M27-V31 HydrophobicContact CG-CG2 4.03Å; M27-V31 WeakPolarHBondContact O-CB 3.36Å; M27-V31 WeakPolarHBondContact O-CG2 3.24Å; M27-V31 PolarHBondContact O-N 2.82Å; M27-V31 HydrophobicContact SD-CG2 3.68Å; V31-L33 PolarHBondContact O-N 2.97Å; V31-L34 PolarHBondContact O-N 2.97Å; V31-V35 HydrophobicContact CG1-CG2 4.35Å; V31-V35 WeakPolarHBondContact O-CB 3.49Å; V31-V35 VanDerWaalsContact O-CG2 3.31Å; V31-V35 WeakPolarHBondContact O-CG2 3.48Å; V31-V35 PolarHBondContact O-N 3.19Å
32	P	34	Very low	35.1	Very low	25 Å²	25	51.2 Å²	51.2	16%	0.162	28%	0.281	C	S	.	.	H	α-helix	trans	-62.8	-25.8	172.9	-24.3	36.8	0	0	0	113.3	P28 G36 M1538 L1542	P28-P32 VanDerWaalsContact O-CD 3.26Å; P28-P32 WeakPolarHBondContact O-CD 3.44Å; P28-P32 WeakPolarHBondContact O-CG 3.48Å; P32-G36 PolarHBondContact O-N 3.42Å; P32-M1538 HydrophobicContact CB-CB 4.18Å; P32-M1538 HydrophobicContact CB-CE 4.45Å; P32-M1538 HydrophobicContact CB-SD 3.85Å; P32-M1538 HydrophobicContact CG-CE 4.08Å; P32-M1538 HydrophobicContact CG-SD 3.85Å; P32-L1542 HydrophobicContact CB-CD1 3.64Å
33	L	38.3	Very low	35.6	Very low	17 Å²	17	47.1 Å²	47.1	9%	0.089	26%	0.262	C	S	.	.	H	α-helix	trans	-77.5	-43.2	177.8	-157.2	165.4	0	0	0	110.9	I30 V31 G36 I37 L1542	I30-L33 CarbonylContact O-C 3.38Å; I30-L33 WeakPolarHBondContact O-CB 3.38Å; I30-L33 PolarHBondContact O-N 3.5Å; I30-L33 VanDerWaalsContact O-N 3.14Å; V31-L33 PolarHBondContact O-N 2.97Å; L33-G36 PolarHBondContact O-N 2.68Å; L33-I37 HydrophobicContact CD2-CD1 3.48Å; L33-I37 VanDerWaalsContact CD2-CD1 3.48Å; L33-I37 HydrophobicContact CD2-CG1 4.11Å; L33-I37 WeakPolarHBondContact O-CB 3.43Å; L33-I37 WeakPolarHBondContact O-CG1 3.44Å; L33-I37 PolarHBondContact O-N 3.4Å; L33-L1542 HydrophobicContact CB-CB 4.42Å; L33-L1542 HydrophobicContact CB-CD1 4.07Å; L33-L1542 HydrophobicContact CB-CD2 4.27Å; L33-L1542 HydrophobicContact CB-CG 4.48Å; L33-L1542 HydrophobicContact CD1-CD2 4.01Å; L33-L1542 HydrophobicContact CG-CB 4.26Å; L33-L1542 HydrophobicContact CG-CD2 3.94Å; L33-L1542 HydrophobicContact CG-CG 4.47Å
34	L	41.6	Very low	36.1	Very low	17 Å²	17	45.6 Å²	45.6	9%	0.089	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-43	170.7	-71.2	166.3	0	0	0	111.1	M27 I30 V31 Y38 M781 I784	M27-L34 HydrophobicContact CE-CD1 4.26Å; I30-L34 HydrophobicContact CG2-CD1 3.91Å; I30-L34 HydrophobicContact CG2-CG 4.09Å; I30-L34 WeakPolarHBondContact O-CB 3.3Å; I30-L34 WeakPolarHBondContact O-CG 3.48Å; I30-L34 PolarHBondContact O-N 3.19Å; V31-L34 PolarHBondContact O-N 2.97Å; L34-Y38 WeakPolarHBondContact O-CB 3.41Å; L34-Y38 PolarHBondContact O-N 3.24Å; L34-M781 HydrophobicContact CD1-CG 3.93Å; L34-M781 HydrophobicContact CD1-SD 4.11Å; L34-M781 HydrophobicContact CD2-CG 3.67Å; L34-M781 HydrophobicContact CG-CG 4.49Å; L34-I784 HydrophobicContact CD2-CD1 3.6Å
35	V	38.4	Very low	36.5	Very low	37 Å²	37	46.5 Å²	46.5	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-66	-41	174.1	170.4	0	0	0	0	111	V31 Y38 T39 Y59	V31-V35 HydrophobicContact CG1-CG2 4.35Å; V31-V35 WeakPolarHBondContact O-CB 3.49Å; V31-V35 VanDerWaalsContact O-CG2 3.31Å; V31-V35 WeakPolarHBondContact O-CG2 3.48Å; V31-V35 PolarHBondContact O-N 3.19Å; V35-Y38 PolarHBondContact O-N 3.17Å; V35-T39 HydrophobicContact CG1-CG2 4.23Å; V35-T39 VanDerWaalsContact O-CB 3.29Å; V35-T39 WeakPolarHBondContact O-CB 3.16Å; V35-T39 WeakPolarHBondContact O-CG2 3.45Å; V35-T39 PolarHBondContact O-N 3.27Å; V35-T39 PolarHBondContact O-OG1 2.83Å; V35-Y59 HydrophobicContact CG2-CE2 4.39Å
36	G	39.2	Very low	36.4	Very low	0 Å²	0	48 Å²	48	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.8	-40.8	177.4	0	0	0	0	0	113.6	P32 L33 T39 G40	P32-G36 PolarHBondContact O-N 3.42Å; L33-G36 PolarHBondContact O-N 2.68Å; G36-T39 PolarHBondContact O-OG1 3.09Å; G36-G40 WeakPolarHBondContact O-CA 3.5Å; G36-G40 PolarHBondContact O-N 3.26Å
37	I	42.6	Very low	36.5	Very low	34 Å²	34	54.5 Å²	54.5	17%	0.174	30%	0.297	C	S	.	.	H	α-helix	trans	-72.3	-43.2	174.2	-70.8	179.2	0	0	0	110.7	L33 G40 I41 I784	L33-I37 HydrophobicContact CD2-CD1 3.48Å; L33-I37 VanDerWaalsContact CD2-CD1 3.48Å; L33-I37 HydrophobicContact CD2-CG1 4.11Å; L33-I37 WeakPolarHBondContact O-CB 3.43Å; L33-I37 WeakPolarHBondContact O-CG1 3.44Å; L33-I37 PolarHBondContact O-N 3.4Å; I37-G40 CarbonylContact O-C 3.49Å; I37-G40 WeakPolarHBondContact O-CA 3.39Å; I37-G40 PolarHBondContact O-N 3.11Å; I37-I41 HydrophobicContact CG2-CD1 3.74Å; I37-I41 HydrophobicContact CG2-CG1 4.41Å; I37-I41 WeakPolarHBondContact O-CB 3.34Å; I37-I41 VanDerWaalsContact O-CG1 3.28Å; I37-I41 WeakPolarHBondContact O-CG1 3.29Å; I37-I41 PolarHBondContact O-N 3Å; I37-I784 HydrophobicContact CB-CD1 4.45Å; I37-I784 HydrophobicContact CD1-CD1 3.89Å; I37-I784 HydrophobicContact CD1-CG1 4.1Å; I37-I784 HydrophobicContact CG2-CD1 4.14Å
38	Y	44.6	Very low	36.3	Very low	47 Å²	47	62.5 Å²	62.5	18%	0.184	33%	0.331	C	S	.	.	H	α-helix	trans	-69.3	-40.3	-178.8	-167.5	-105.6	0	0	0	112.5	L34 V35 I41 L42 P773 L776	L34-Y38 WeakPolarHBondContact O-CB 3.41Å; L34-Y38 PolarHBondContact O-N 3.24Å; V35-Y38 PolarHBondContact O-N 3.17Å; Y38-I41 PolarHBondContact O-N 3.3Å; Y38-L42 HydrophobicContact CD1-CD1 3.87Å; Y38-L42 HydrophobicContact CE1-CD1 3.42Å; Y38-L42 VanDerWaalsContact CE1-CD1 3.42Å; Y38-L42 HydrophobicContact CE1-CG 4.12Å; Y38-L42 WeakPolarHBondContact O-CG 3.32Å; Y38-L42 PolarHBondContact O-N 3.24Å; Y38-P773 HydrophobicContact CE1-CB 3.99Å; Y38-P773 WeakPolarHBondContact OH-CA 3.45Å; Y38-P773 WeakPolarHBondContact OH-CB 3.45Å; Y38-P773 WeakPolarHBondContact OH-CG 3.24Å; Y38-L776 HydrophobicContact CE2-CD1 4.35Å
39	T	38.6	Very low	36.3	Very low	32 Å²	32	65.2 Å²	65.2	20%	0.196	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-38.8	168.8	55.4	0	0	0	0	111.2	V35 G36 I41 L42 I43	V35-T39 HydrophobicContact CG1-CG2 4.23Å; V35-T39 VanDerWaalsContact O-CB 3.29Å; V35-T39 WeakPolarHBondContact O-CB 3.16Å; V35-T39 WeakPolarHBondContact O-CG2 3.45Å; V35-T39 PolarHBondContact O-N 3.27Å; V35-T39 PolarHBondContact O-OG1 2.83Å; G36-T39 PolarHBondContact O-OG1 3.09Å; T39-I41 VanDerWaalsContact C-N 3.33Å; T39-I41 PolarHBondContact O-N 2.9Å; T39-L42 PolarHBondContact O-N 3.33Å; T39-I43 WeakPolarHBondContact O-CB 3.37Å; T39-I43 WeakPolarHBondContact O-CD1 3.39Å; T39-I43 WeakPolarHBondContact O-CG1 3.47Å; T39-I43 PolarHBondContact O-N 3.26Å
40	G	37	Very low	35.8	Very low	6 Å²	6	68.8 Å²	68.8	6%	0.062	36%	0.357	C	S	.	.	H	α-helix	trans	-54.1	-45.7	171	0	0	0	0	0	113.3	G36 I37 A44	G36-G40 WeakPolarHBondContact O-CA 3.5Å; G36-G40 PolarHBondContact O-N 3.26Å; I37-G40 CarbonylContact O-C 3.49Å; I37-G40 WeakPolarHBondContact O-CA 3.39Å; I37-G40 PolarHBondContact O-N 3.11Å; G40-A44 VanDerWaalsContact O-CB 3.23Å; G40-A44 WeakPolarHBondContact O-CB 3.49Å; G40-A44 PolarHBondContact O-N 3.14Å
41	I	39.8	Very low	35	Very low	56 Å²	56	78.2 Å²	78.2	29%	0.287	39%	0.389	S	S	.	.	H	α-helix	trans	-66	-46.3	177.1	-70.5	164.8	0	0	0	111.3	I37 Y38 T39 A44 Q45	I37-I41 HydrophobicContact CG2-CD1 3.74Å; I37-I41 HydrophobicContact CG2-CG1 4.41Å; I37-I41 WeakPolarHBondContact O-CB 3.34Å; I37-I41 VanDerWaalsContact O-CG1 3.28Å; I37-I41 WeakPolarHBondContact O-CG1 3.29Å; I37-I41 PolarHBondContact O-N 3Å; Y38-I41 PolarHBondContact O-N 3.3Å; T39-I41 VanDerWaalsContact C-N 3.33Å; T39-I41 PolarHBondContact O-N 2.9Å; I41-A44 PolarHBondContact O-N 3.42Å; I41-Q45 WeakPolarHBondContact O-CG 3.18Å; I41-Q45 PolarHBondContact O-N 2.94Å
42	L	35.4	Very low	34.7	Very low	73 Å²	73	81.1 Å²	81.1	38%	0.382	41%	0.407	S	S	.	.	H	α-helix	trans	-67.3	-35.6	178.2	-75.3	174.7	0	0	0	113.3	Y38 T39 Q45	Y38-L42 HydrophobicContact CD1-CD1 3.87Å; Y38-L42 HydrophobicContact CE1-CD1 3.42Å; Y38-L42 VanDerWaalsContact CE1-CD1 3.42Å; Y38-L42 HydrophobicContact CE1-CG 4.12Å; Y38-L42 WeakPolarHBondContact O-CG 3.32Å; Y38-L42 PolarHBondContact O-N 3.24Å; T39-L42 PolarHBondContact O-N 3.33Å; L42-Q45 WeakPolarHBondContact O-CB 3.38Å; L42-Q45 PolarHBondContact O-N 2.63Å
43	I	35.9	Very low	34.3	Very low	65 Å²	65	85.6 Å²	85.6	33%	0.333	44%	0.436	S	S	.	.	H	α-helix	trans	-73.5	-40	178.5	-71.1	166.9	0	0	0	110.2	T39 Q45 N46 Y47	T39-I43 WeakPolarHBondContact O-CB 3.37Å; T39-I43 WeakPolarHBondContact O-CD1 3.39Å; T39-I43 WeakPolarHBondContact O-CG1 3.47Å; T39-I43 PolarHBondContact O-N 3.26Å; I43-Q45 PolarHBondContact O-N 2.99Å; I43-Q45 VanDerWaalsContact O-N 3.17Å; I43-N46 CarbonylContact O-C 3.57Å; I43-N46 PolarHBondContact O-N 3.21Å; I43-N46 VanDerWaalsContact O-N 3.11Å; I43-Y47 HydrophobicContact CG2-CD2 4.28Å; I43-Y47 HydrophobicContact CG2-CE1 4.45Å; I43-Y47 HydrophobicContact CG2-CE2 3.37Å; I43-Y47 VanDerWaalsContact CG2-CZ 3.46Å; I43-Y47 VanDerWaalsContact CG2-OH 3.29Å; I43-Y47 WeakPolarHBondContact CG2-OH 3.48Å; I43-Y47 WeakPolarHBondContact O-CD2 3.44Å
44	A	35.5	Very low	33.8	Very low	52 Å²	52	91.2 Å²	91.2	43%	0.43	47%	0.471	S	S	.	.	H	α-helix	trans	-61.6	-19.7	171.2	0	0	0	0	0	113.3	G40 I41	G40-A44 VanDerWaalsContact O-CB 3.23Å; G40-A44 WeakPolarHBondContact O-CB 3.49Å; G40-A44 PolarHBondContact O-N 3.14Å; I41-A44 PolarHBondContact O-N 3.42Å
45	Q	37.8	Very low	33.1	Very low	80 Å²	80	96.1 Å²	96.1	37%	0.374	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-12.5	175.6	-72.4	173.5	7.2	0	0	114.4	I41 L42 I43	I41-Q45 WeakPolarHBondContact O-CG 3.18Å; I41-Q45 PolarHBondContact O-N 2.94Å; L42-Q45 WeakPolarHBondContact O-CB 3.38Å; L42-Q45 PolarHBondContact O-N 2.63Å; I43-Q45 PolarHBondContact O-N 2.99Å; I43-Q45 VanDerWaalsContact O-N 3.17Å
46	N	29.1	Very low	32.4	Very low	115 Å²	115	100.8 Å²	100.8	62%	0.615	53%	0.525	S	S	*	.			trans	-149	93.4	-178.2	-61.5	-85.8	0	0	0	113.7	I43	I43-N46 CarbonylContact O-C 3.57Å; I43-N46 PolarHBondContact O-N 3.21Å; I43-N46 VanDerWaalsContact O-N 3.11Å
47	Y	31.1	Very low	31.8	Very low	178 Å²	178	109.3 Å²	109.3	70%	0.698	57%	0.565	S	S	*	*			trans	-121	88	169.2	-95.2	-65.1	0	0	0	113	I43	I43-Y47 HydrophobicContact CG2-CD2 4.28Å; I43-Y47 HydrophobicContact CG2-CE1 4.45Å; I43-Y47 HydrophobicContact CG2-CE2 3.37Å; I43-Y47 VanDerWaalsContact CG2-CZ 3.46Å; I43-Y47 VanDerWaalsContact CG2-OH 3.29Å; I43-Y47 WeakPolarHBondContact CG2-OH 3.48Å; I43-Y47 WeakPolarHBondContact O-CD2 3.44Å
48	K	26.4	Very low	31.1	Very low	208 Å²	208	111.8 Å²	111.8	90%	0.904	58%	0.578	S	S	*	*			trans	-170.7	58.6	154.8	-114.6	-178.3	-175.3	-176.8	0	113.3
49	I	27.7	Very low	30.2	Very low	162 Å²	162	116.1 Å²	116.1	83%	0.831	60%	0.595	S	S	*	*			trans	-133.2	136.6	167.3	-57.5	-177.7	0	0	0	109.5
50	P	24.6	Very low	29.9	Very low	122 Å²	122	116 Å²	116	79%	0.792	60%	0.597	S	S	*	*			trans	-74.7	175.7	-179.4	-18.2	33.6	0	0	0	116
51	R	24.1	Very low	29.4	Very low	249 Å²	249	120.3 Å²	120.3	94%	0.94	61%	0.614	S	S	*	*			trans	-64.9	128.1	-174.5	-58.4	170.2	176.9	169.7	-3.7	114.4
52	V	26.1	Very low	28.8	Very low	128 Å²	128	121.6 Å²	121.6	78%	0.776	63%	0.626	S	S	*	*			trans	-146.5	138.5	151.5	-176.7	0	0	0	0	107.1
53	P	26.6	Very low	28.6	Very low	120 Å²	120	125.8 Å²	125.8	78%	0.779	64%	0.643	S	S	*	*			trans	-79.9	154.3	-176.3	32.3	-36.2	0	0	0	113.7
54	V	26.8	Very low	28.3	Very low	135 Å²	135	130.1 Å²	130.1	82%	0.818	66%	0.66	S	S	*	*			trans	-137.5	115.5	178.2	-179.3	0	0	0	0	109.8
55	P	27.5	Very low	28.1	Very low	120 Å²	120	134.4 Å²	134.4	78%	0.779	68%	0.675	S	S	*	*			trans	-69.1	163.6	168.7	-19.7	34.1	0	0	0	112.8
56	M	23.7	Very low	27.7	Very low	134 Å²	134	135.2 Å²	135.2	66%	0.66	69%	0.687	S	S	*	*			trans	-76.3	136.5	-178.3	-60.7	-166.9	-57.8	0	0	112.3	I1536	M56-I1536 HydrophobicContact SD-CD1 4.21Å; M56-I1536 HydrophobicContact SD-CG1 4.15Å
57	E	26.7	Very low	27.6	Very low	180 Å²	180	137.4 Å²	137.4	84%	0.841	69%	0.691	S	S	*	*				179.7	152.7	114.9	-95.6	170.3	-151.4	0	0	110.8
58	L	27.7	Very low	27.7	Very low	86 Å²	86	135.3 Å²	135.3	45%	0.45	69%	0.692	S	S	.	*			trans	104.4	93	175.8	-59.1	172.3	0	0	0	119.5
59	Y	26.8	Very low	27.7	Very low	137 Å²	137	130.6 Å²	130.6	54%	0.537	68%	0.675	S	S	.	*				-100.7	-164.2	112.6	-54.8	-97.8	0	0	0	106.4	V35 W842	V35-Y59 HydrophobicContact CG2-CE2 4.39Å; Y59-W842 WeakPolarHBondContact O-CZ2 3.25Å; Y59-W842 PolarHBondContact O-NE1 2.88Å
60	A	30.5	Very low	28.2	Very low	29 Å²	29	126.3 Å²	126.3	24%	0.24	66%	0.659	C	S	.	*			cis	-158.6	137.6	-10.6	0	0	0	0	0	107	W841 W842	A60-W841 HydrophobicContact CB-CB 4.07Å; A60-W841 HydrophobicContact CB-CD2 3.92Å; A60-W841 HydrophobicContact CB-CE3 3.71Å; A60-W841 HydrophobicContact CB-CG 4.09Å; A60-W841 HydrophobicContact CB-CZ3 4.45Å; A60-W841 WeakPolarHBondContact O-CB 3.43Å; A60-W842 PolarHBondContact O-N 3.23Å
61	K	27.4	Very low	28.6	Very low	97 Å²	97	124 Å²	124	42%	0.422	64%	0.64	S	S	.	*			trans	176.3	160.6	139.7	-137	-167.3	-169.3	123.1	0	111.2	T840 W841 W842	K61-T840 PolarHBondContact NZ-OG1 3.27Å; K61-W841 HydrophobicContact CB-CB 4.37Å; K61-W841 VanDerWaalsContact CD-O 3.25Å; K61-W841 WeakPolarHBondContact CD-O 3.35Å; K61-W841 WeakPolarHBondContact CE-O 3.46Å; K61-W841 HydrophobicContact CG-CB 4.09Å; K61-W841 HydrophobicContact CG-CE3 4.38Å; K61-W841 VanDerWaalsContact NZ-N 3.19Å; K61-W841 PolarHBondContact NZ-O 2.79Å; K61-W842 WeakPolarHBondContact CB-O 3.27Å
62	P	28.3	Very low	29	Very low	83 Å²	83	113.7 Å²	113.7	54%	0.539	61%	0.608	S	S	.	*			trans	-108.4	164.5	150.3	35.8	-32.7	0	0	0	113.7
63	H	29.6	Very low	29.5	Very low	162 Å²	162	111 Å²	111	75%	0.75	59%	0.59	S	S	*	*			trans	-64.1	169.7	168.8	-59.4	-96.2	0	0	0	111.1
64	F	30.4	Very low	30.2	Very low	156 Å²	156	113.1 Å²	113.1	68%	0.684	59%	0.594	S	S	*	*			cis	-150.7	136.1	34.2	-86.3	-99.3	0	0	0	114.1
65	L	30.7	Very low	30.9	Very low	141 Å²	141	110 Å²	110	74%	0.738	57%	0.573	S	S	*	*			trans	56.3	155.2	136.1	-61.4	-179.5	0	0	0	122.2
66	P	30.6	Very low	31.5	Very low	97 Å²	97	109.3 Å²	109.3	63%	0.63	57%	0.568	S	S	*	*			cis	-141.2	128.2	-32.5	34.2	-16	0	0	0	115.3
67	F	27.1	Very low	32.5	Very low	161 Å²	161	108 Å²	108	71%	0.706	56%	0.564	S	S	*	*			trans	-173.3	120.9	138.4	-105.2	-69.7	0	0	0	107	L85	F67-L85 HydrophobicContact CE1-CD2 3.71Å; F67-L85 HydrophobicContact CE2-CD2 3.76Å; F67-L85 HydrophobicContact CZ-CD1 4.38Å; F67-L85 HydrophobicContact CZ-CD2 3.3Å; F67-L85 HydrophobicContact CZ-CG 4.48Å
68	N	32.1	Very low	33.1	Very low	134 Å²	134	101.8 Å²	101.8	72%	0.717	54%	0.54	S	S	*	.			trans	-138.2	114.6	-179.6	-161.9	1.4	0	0	0	111	S70 K856	N68-S70 VanDerWaalsContact C-N 3.27Å; N68-S70 PolarHBondContact O-N 3.44Å; N68-K856 PolarHBondContact O-NZ 2.8Å
69	M	27.5	Very low	33.7	Very low	110 Å²	110	101 Å²	101	54%	0.542	53%	0.532	S	S	.	.			trans	-85.5	34.8	-154.7	-59.6	-168	-65.6	0	0	115.2	F128	M69-F128 HydrophobicContact CE-CD1 4.13Å; M69-F128 HydrophobicContact CE-CE1 3.49Å; M69-F128 VanDerWaalsContact CE-CE1 3.49Å; M69-F128 HydrophobicContact CE-CZ 3.72Å
70	S	36.5	Very low	34.8	Very low	72 Å²	72	103.7 Å²	103.7	50%	0.503	54%	0.541	S	S	.	.			trans	-109.6	58.2	-175.9	51.7	0	0	0	0	113.3	N68 K856	N68-S70 VanDerWaalsContact C-N 3.27Å; N68-S70 PolarHBondContact O-N 3.44Å; S70-K856 WeakPolarHBondContact O-CD 3.13Å; S70-K856 WeakPolarHBondContact O-CE 3.31Å; S70-K856 PolarHBondContact O-NZ 2.82Å; S70-K856 PolarHBondContact OG-NZ 3Å
71	D	33.3	Very low	35.6	Very low	73 Å²	73	109.4 Å²	109.4	39%	0.39	56%	0.562	S	S	.	*			trans	-160.1	26.2	175.4	-129.8	-21.2	0	0	0	111.6	K856 K859	D71-K856 WeakPolarHBondContact OD2-CE 3.31Å; D71-K856 WeakPolarHBondContact OD2-CG 3.45Å; D71-K859 IonicContact OD1-NZ 3.17Å; D71-K859 PolarHBondContact OD1-NZ 3.17Å
72	A	33.4	Very low	36.2	Very low	33 Å²	33	107.8 Å²	107.8	27%	0.273	56%	0.558	S	S	.	*			trans	-96.7	-4.2	-158.7	0	0	0	0	0	115.2	R79	A72-R79 WeakPolarHBondContact O-CG 3.33Å; A72-R79 PolarHBondContact O-NE 2.91Å
73	D	37	Very low	37	Very low	72 Å²	72	108.3 Å²	108.3	39%	0.385	56%	0.56	S	S	.	*	S	Bend	trans	-100.2	-33.9	-164.6	-69.4	-43.5	0	0	0	116.9	R79	D73-R79 PolarHBondContact O-NH2 3.1Å; D73-R79 IonicContact OD1-CZ 2.78Å; D73-R79 IonicContact OD1-NH2 2.69Å; D73-R79 PolarHBondContact OD1-NH2 3.24Å
74	D	41.6	Very low	38.2	Very low	163 Å²	163	108.1 Å²	108.1	87%	0.872	56%	0.557	S	S	*	*	S	Bend	trans	-112	30.5	-175.2	-79.7	-50.4	0	0	0	115.3
75	N	41.1	Very low	38.8	Very low	71 Å²	71	103.8 Å²	103.8	38%	0.38	54%	0.541	S	S	.	.			trans	-146.4	114	169.2	-169.8	-34.9	0	0	0	113.4	N77 S78 R79	N75-N77 VanDerWaalsContact C-N 3.32Å; N75-N77 PolarHBondContact O-N 2.94Å; N75-N77 WeakPolarHBondContact OD1-CB 3.21Å; N75-N77 PolarHBondContact OD1-N 2.89Å; N75-S78 WeakPolarHBondContact CB-OG 3.36Å; N75-S78 WeakPolarHBondContact O-CB 3.3Å; N75-S78 PolarHBondContact O-N 3.34Å; N75-S78 PolarHBondContact OD1-N 3.44Å; N75-R79 PolarHBondContact O-N 3.07Å
76	P	40.2	Very low	39.2	Very low	104 Å²	104	101.4 Å²	101.4	68%	0.675	53%	0.528	S	S	*	.	H	α-helix	trans	-67.9	-26.9	-178.1	26.8	-34.1	0	0	0	113.6	R80	P76-R80 PolarHBondContact O-N 3.15Å; P76-R80 VanDerWaalsContact O-N 3.16Å
77	N	44.4	Very low	40	Very low	107 Å²	107	98.7 Å²	98.7	57%	0.572	52%	0.518	S	S	*	.	H	α-helix	trans	-73.8	-34.7	173.7	-79	-38.3	0	0	0	111.9	N75 R80 Q81	N75-N77 VanDerWaalsContact C-N 3.32Å; N75-N77 PolarHBondContact O-N 2.94Å; N75-N77 WeakPolarHBondContact OD1-CB 3.21Å; N75-N77 PolarHBondContact OD1-N 2.89Å; N77-R80 WeakPolarHBondContact O-CB 3.37Å; N77-R80 PolarHBondContact O-N 3.04Å; N77-Q81 PolarHBondContact O-N 3.31Å
78	S	40	Very low	41.2	Very low	49 Å²	49	95.3 Å²	95.3	34%	0.343	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-45.9	172.8	-59.7	0	0	0	0	111.4	N75 R80 Q81 L82	N75-S78 WeakPolarHBondContact CB-OG 3.36Å; N75-S78 WeakPolarHBondContact O-CB 3.3Å; N75-S78 PolarHBondContact O-N 3.34Å; N75-S78 PolarHBondContact OD1-N 3.44Å; S78-R80 VanDerWaalsContact C-N 3.32Å; S78-R80 PolarHBondContact O-N 3.38Å; S78-Q81 PolarHBondContact O-N 2.96Å; S78-L82 PolarHBondContact O-N 2.64Å
79	R	39.6	Very low	41.5	Very low	71 Å²	71	94.6 Å²	94.6	27%	0.268	50%	0.501	S	S	.	.	H	α-helix	trans	-57.2	-44.4	173.2	-74.7	-174.6	175.1	159.7	1.3	111.2	A72 D73 N75 Q81 L82 T83 S136	A72-R79 WeakPolarHBondContact O-CG 3.33Å; A72-R79 PolarHBondContact O-NE 2.91Å; D73-R79 PolarHBondContact O-NH2 3.1Å; D73-R79 IonicContact OD1-CZ 2.78Å; D73-R79 IonicContact OD1-NH2 2.69Å; D73-R79 PolarHBondContact OD1-NH2 3.24Å; N75-R79 PolarHBondContact O-N 3.07Å; R79-Q81 PolarHBondContact O-N 3.5Å; R79-L82 PolarHBondContact O-N 2.99Å; R79-T83 PolarHBondContact O-N 2.91Å; R79-T83 PolarHBondContact O-OG1 3.3Å; R79-S136 VanDerWaalsContact NH1-CB 3.33Å; R79-S136 PolarHBondContact NH1-OG 2.83Å
80	R	48.8	Very low	42.1	Very low	192 Å²	192	93.8 Å²	93.8	73%	0.725	50%	0.502	S	S	*	.	H	α-helix	trans	-59.7	-39.8	177.1	-129.5	175.9	-173.8	177.5	1.9	113.5	P76 N77 S78 K84	P76-R80 PolarHBondContact O-N 3.15Å; P76-R80 VanDerWaalsContact O-N 3.16Å; N77-R80 WeakPolarHBondContact O-CB 3.37Å; N77-R80 PolarHBondContact O-N 3.04Å; S78-R80 VanDerWaalsContact C-N 3.32Å; S78-R80 PolarHBondContact O-N 3.38Å; R80-K84 PolarHBondContact O-N 2.78Å
81	Q	49.1	Very low	42.6	Very low	149 Å²	149	95.7 Å²	95.7	70%	0.696	50%	0.501	S	S	*	.	H	α-helix	trans	-70.2	-42.1	173.8	-73.3	-170	-5.8	0	0	112.1	N77 S78 R79 T83 K84 L85	N77-Q81 PolarHBondContact O-N 3.31Å; S78-Q81 PolarHBondContact O-N 2.96Å; R79-Q81 PolarHBondContact O-N 3.5Å; Q81-T83 PolarHBondContact O-N 3.06Å; Q81-K84 PolarHBondContact O-N 3.47Å; Q81-L85 WeakPolarHBondContact O-CB 3.38Å; Q81-L85 PolarHBondContact O-N 3.32Å
82	L	38.2	Very low	43	Very low	63 Å²	63	95.6 Å²	95.6	33%	0.33	50%	0.503	S	S	.	.	H	α-helix	trans	-61.6	-44.2	179.2	-147.9	86.2	0	0	0	111.6	S78 R79 K84 L85 L86	S78-L82 PolarHBondContact O-N 2.64Å; R79-L82 PolarHBondContact O-N 2.99Å; L82-K84 VanDerWaalsContact C-N 3.32Å; L82-K84 PolarHBondContact O-N 3.23Å; L82-L85 PolarHBondContact O-N 3.49Å; L82-L86 HydrophobicContact CD2-CD1 4.33Å; L82-L86 HydrophobicContact CG-CD1 4.39Å; L82-L86 WeakPolarHBondContact O-CB 3.43Å; L82-L86 WeakPolarHBondContact O-CG 3.28Å; L82-L86 PolarHBondContact O-N 2.98Å
83	T	44.9	Very low	43.1	Very low	94 Å²	94	96.2 Å²	96.2	58%	0.577	51%	0.508	S	S	*	.	H	α-helix	trans	-60.5	-40.2	174.6	-50	0	0	0	0	111.9	R79 Q81 G87	R79-T83 PolarHBondContact O-N 2.91Å; R79-T83 PolarHBondContact O-OG1 3.3Å; Q81-T83 PolarHBondContact O-N 3.06Å; T83-G87 PolarHBondContact O-N 3.05Å
84	K	55.5	Low	43	Very low	158 Å²	158	100.7 Å²	100.7	69%	0.687	52%	0.52	S	S	*	.	H	α-helix	trans	-70.3	-36.2	178.6	-157.6	176.1	-172.7	-179.6	0	112	R80 Q81 L82 N88	R80-K84 PolarHBondContact O-N 2.78Å; Q81-K84 PolarHBondContact O-N 3.47Å; L82-K84 VanDerWaalsContact C-N 3.32Å; L82-K84 PolarHBondContact O-N 3.23Å; K84-N88 WeakPolarHBondContact O-CB 3.41Å; K84-N88 PolarHBondContact O-N 3.33Å
85	L	42.3	Very low	43.1	Very low	66 Å²	66	98.2 Å²	98.2	35%	0.346	50%	0.503	S	S	.	.	H	α-helix	trans	-69.7	-47.3	175.6	-163.4	89.4	0	0	0	111.6	F67 Q81 L82 G87 N88 M89	F67-L85 HydrophobicContact CE1-CD2 3.71Å; F67-L85 HydrophobicContact CE2-CD2 3.76Å; F67-L85 HydrophobicContact CZ-CD1 4.38Å; F67-L85 HydrophobicContact CZ-CD2 3.3Å; F67-L85 HydrophobicContact CZ-CG 4.48Å; Q81-L85 WeakPolarHBondContact O-CB 3.38Å; Q81-L85 PolarHBondContact O-N 3.32Å; L82-L85 PolarHBondContact O-N 3.49Å; L85-G87 VanDerWaalsContact C-N 3.34Å; L85-G87 PolarHBondContact O-N 2.85Å; L85-N88 CarbonylContact O-C 3.59Å; L85-N88 PolarHBondContact O-N 3.43Å; L85-N88 VanDerWaalsContact O-N 3.15Å; L85-M89 HydrophobicContact CD2-SD 4.31Å; L85-M89 HydrophobicContact CG-SD 4.5Å; L85-M89 WeakPolarHBondContact O-CG 3.27Å; L85-M89 PolarHBondContact O-N 3.48Å
86	L	39.4	Very low	43	Very low	90 Å²	90	105.2 Å²	105.2	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-60.3	-43.4	174.3	-77.2	165.6	0	0	0	111.2	L82 N88 M89 V90	L82-L86 HydrophobicContact CD2-CD1 4.33Å; L82-L86 HydrophobicContact CG-CD1 4.39Å; L82-L86 WeakPolarHBondContact O-CB 3.43Å; L82-L86 WeakPolarHBondContact O-CG 3.28Å; L82-L86 PolarHBondContact O-N 2.98Å; L86-N88 VanDerWaalsContact C-N 3.32Å; L86-N88 PolarHBondContact O-N 3.36Å; L86-M89 PolarHBondContact O-N 2.68Å; L86-V90 WeakPolarHBondContact O-CB 3.34Å; L86-V90 WeakPolarHBondContact O-CG2 3.24Å; L86-V90 PolarHBondContact O-N 2.94Å
87	G	48.5	Very low	42.8	Very low	40 Å²	40	106.6 Å²	106.6	41%	0.412	52%	0.524	S	S	.	.	H	α-helix	trans	-56.4	-44.1	172.6	0	0	0	0	0	112.5	T83 L85 K91	T83-G87 PolarHBondContact O-N 3.05Å; L85-G87 VanDerWaalsContact C-N 3.34Å; L85-G87 PolarHBondContact O-N 2.85Å; G87-K91 VanDerWaalsContact O-CB 3.28Å; G87-K91 WeakPolarHBondContact O-CB 3.46Å; G87-K91 PolarHBondContact O-N 3.47Å
88	N	51.7	Low	42.2	Very low	91 Å²	91	108.2 Å²	108.2	49%	0.487	53%	0.53	S	S	.	.	H	α-helix	trans	-69	-37.6	175.5	-75.8	-10.1	0	0	0	113.2	K84 L85 L86 K91 V92	K84-N88 WeakPolarHBondContact O-CB 3.41Å; K84-N88 PolarHBondContact O-N 3.33Å; L85-N88 CarbonylContact O-C 3.59Å; L85-N88 PolarHBondContact O-N 3.43Å; L85-N88 VanDerWaalsContact O-N 3.15Å; L86-N88 VanDerWaalsContact C-N 3.32Å; L86-N88 PolarHBondContact O-N 3.36Å; N88-K91 WeakPolarHBondContact O-CB 3.5Å; N88-K91 PolarHBondContact O-N 2.97Å; N88-V92 WeakPolarHBondContact O-CG2 3.3Å; N88-V92 PolarHBondContact O-N 2.93Å
89	M	38	Very low	41.7	Very low	118 Å²	118	108.7 Å²	108.7	58%	0.581	54%	0.543	S	S	*	.	H	α-helix	trans	-68.6	-41.3	176.5	-72.1	-179.4	69.7	0	0	111.7	L85 L86 K91 V92 A93	L85-M89 HydrophobicContact CD2-SD 4.31Å; L85-M89 HydrophobicContact CG-SD 4.5Å; L85-M89 WeakPolarHBondContact O-CG 3.27Å; L85-M89 PolarHBondContact O-N 3.48Å; L86-M89 PolarHBondContact O-N 2.68Å; M89-K91 VanDerWaalsContact C-N 3.32Å; M89-V92 PolarHBondContact O-N 3.41Å; M89-A93 WeakPolarHBondContact O-CB 3.21Å; M89-A93 PolarHBondContact O-N 3.1Å
90	V	40.9	Very low	41.2	Very low	94 Å²	94	116.3 Å²	116.3	57%	0.57	57%	0.571	S	S	*	*	H	α-helix	trans	-61.9	-40.5	170.2	170.9	0	0	0	0	110.5	L86 A93 R94	L86-V90 WeakPolarHBondContact O-CB 3.34Å; L86-V90 WeakPolarHBondContact O-CG2 3.24Å; L86-V90 PolarHBondContact O-N 2.94Å; V90-A93 PolarHBondContact O-N 3.34Å; V90-R94 WeakPolarHBondContact O-CB 3.49Å; V90-R94 PolarHBondContact O-N 2.93Å
91	K	46.3	Very low	40.3	Very low	111 Å²	111	114.4 Å²	114.4	48%	0.483	57%	0.571	S	S	.	*	H	α-helix	trans	-62.3	-48.1	175.6	-167.7	175.1	-172.5	-82.1	0	112	G87 N88 M89 A93 R94 E95	G87-K91 VanDerWaalsContact O-CB 3.28Å; G87-K91 WeakPolarHBondContact O-CB 3.46Å; G87-K91 PolarHBondContact O-N 3.47Å; N88-K91 WeakPolarHBondContact O-CB 3.5Å; N88-K91 PolarHBondContact O-N 2.97Å; M89-K91 VanDerWaalsContact C-N 3.32Å; K91-A93 PolarHBondContact O-N 2.8Å; K91-R94 PolarHBondContact O-N 2.94Å; K91-E95 WeakPolarHBondContact CE-OE1 3.37Å; K91-E95 HydrophobicContact CG-CG 4.47Å; K91-E95 WeakPolarHBondContact CG-OE1 3.17Å; K91-E95 IonicContact NZ-OE1 3.39Å; K91-E95 PolarHBondContact NZ-OE1 2.9Å; K91-E95 IonicContact NZ-OE2 2.81Å; K91-E95 WeakPolarHBondContact O-CB 3.39Å; K91-E95 VanDerWaalsContact O-CG 3.27Å; K91-E95 WeakPolarHBondContact O-CG 3.5Å; K91-E95 PolarHBondContact O-N 3.37Å
92	V	42.8	Very low	39.3	Very low	71 Å²	71	115.4 Å²	115.4	43%	0.43	58%	0.581	S	S	.	*	H	α-helix	trans	-66.6	-35.6	178	171	0	0	0	0	112.2	N88 M89 R96	N88-V92 WeakPolarHBondContact O-CG2 3.3Å; N88-V92 PolarHBondContact O-N 2.93Å; M89-V92 PolarHBondContact O-N 3.41Å; V92-R96 WeakPolarHBondContact O-CB 3.33Å; V92-R96 WeakPolarHBondContact O-CG 3.33Å; V92-R96 PolarHBondContact O-N 3.18Å
93	A	34.7	Very low	38.9	Very low	46 Å²	46	123.1 Å²	123.1	38%	0.38	61%	0.606	S	S	.	*	H	α-helix	trans	-64.5	-47	171.8	0	0	0	0	0	111.1	M89 V90 K91 E95 R96 I97	M89-A93 WeakPolarHBondContact O-CB 3.21Å; M89-A93 PolarHBondContact O-N 3.1Å; V90-A93 PolarHBondContact O-N 3.34Å; K91-A93 PolarHBondContact O-N 2.8Å; A93-E95 PolarHBondContact O-N 3.43Å; A93-R96 PolarHBondContact O-N 3.46Å; A93-I97 VanDerWaalsContact O-CB 3.3Å; A93-I97 WeakPolarHBondContact O-CB 3.34Å; A93-I97 WeakPolarHBondContact O-CD1 3.43Å; A93-I97 WeakPolarHBondContact O-CG1 3.28Å; A93-I97 PolarHBondContact O-N 3.26Å
94	R	35.8	Very low	38	Very low	166 Å²	166	126.2 Å²	126.2	63%	0.626	62%	0.618	S	S	*	*	H	α-helix	trans	-61.5	-42.5	177.4	-165.2	175.5	-169.9	171.9	3.2	112	V90 K91 I97 M98	V90-R94 WeakPolarHBondContact O-CB 3.49Å; V90-R94 PolarHBondContact O-N 2.93Å; K91-R94 PolarHBondContact O-N 2.94Å; R94-I97 PolarHBondContact O-N 2.97Å; R94-M98 HydrophobicContact CG-CE 4.32Å; R94-M98 HydrophobicContact CG-SD 3.75Å; R94-M98 VanDerWaalsContact O-CB 3.32Å; R94-M98 WeakPolarHBondContact O-CB 3.4Å; R94-M98 WeakPolarHBondContact O-CG 3.44Å; R94-M98 PolarHBondContact O-N 3.17Å
95	E	43.2	Very low	36.9	Very low	111 Å²	111	123.9 Å²	123.9	52%	0.519	62%	0.619	S	S	.	*	H	α-helix	trans	-68.5	-33.5	177.1	-74.3	169.2	172.5	0	0	112.9	K91 A93	K91-E95 WeakPolarHBondContact CE-OE1 3.37Å; K91-E95 HydrophobicContact CG-CG 4.47Å; K91-E95 WeakPolarHBondContact CG-OE1 3.17Å; K91-E95 IonicContact NZ-OE1 3.39Å; K91-E95 PolarHBondContact NZ-OE1 2.9Å; K91-E95 IonicContact NZ-OE2 2.81Å; K91-E95 WeakPolarHBondContact O-CB 3.39Å; K91-E95 VanDerWaalsContact O-CG 3.27Å; K91-E95 WeakPolarHBondContact O-CG 3.5Å; K91-E95 PolarHBondContact O-N 3.37Å; A93-E95 PolarHBondContact O-N 3.43Å
96	R	38	Very low	36.5	Very low	218 Å²	218	131.6 Å²	131.6	82%	0.823	64%	0.644	S	S	*	*	H	α-helix	trans	-82.2	-20.6	175.3	-76	-176	169.7	-178	-2.5	114.6	V92 A93	V92-R96 WeakPolarHBondContact O-CB 3.33Å; V92-R96 WeakPolarHBondContact O-CG 3.33Å; V92-R96 PolarHBondContact O-N 3.18Å; A93-R96 PolarHBondContact O-N 3.46Å
97	I	35.8	Very low	36.2	Very low	134 Å²	134	135.1 Å²	135.1	69%	0.687	66%	0.663	S	S	*	*	H	α-helix	trans	-95.4	-22.7	-179.2	-67.7	168	0	0	0	112	A93 R94	A93-I97 VanDerWaalsContact O-CB 3.3Å; A93-I97 WeakPolarHBondContact O-CB 3.34Å; A93-I97 WeakPolarHBondContact O-CD1 3.43Å; A93-I97 WeakPolarHBondContact O-CG1 3.28Å; A93-I97 PolarHBondContact O-N 3.26Å; R94-I97 PolarHBondContact O-N 2.97Å
98	M	33.6	Very low	35.4	Very low	140 Å²	140	140.6 Å²	140.6	69%	0.69	68%	0.683	S	S	*	*	S	Bend	trans	-104.3	20.8	-176.3	-61.6	-176.1	169.2	0	0	114.6	R94 R100	R94-M98 HydrophobicContact CG-CE 4.32Å; R94-M98 HydrophobicContact CG-SD 3.75Å; R94-M98 VanDerWaalsContact O-CB 3.32Å; R94-M98 WeakPolarHBondContact O-CB 3.4Å; R94-M98 WeakPolarHBondContact O-CG 3.44Å; R94-M98 PolarHBondContact O-N 3.17Å; M98-R100 PolarHBondContact O-N 3.39Å
99	G	29.3	Very low	34.5	Very low	59 Å²	59	143.2 Å²	143.2	61%	0.608	70%	0.697	S	S	*	*			trans	-86.9	98.2	178.7	0	0	0	0	0	113.9
100	R	28.6	Very low	34.3	Very low	231 Å²	231	144.1 Å²	144.1	87%	0.872	71%	0.709	S	S	*	*	S	Bend	trans	70.7	93.5	179.1	-55.8	-178.3	179.9	-172.9	-1.3	113.8	M98	M98-R100 PolarHBondContact O-N 3.39Å
101	Q	29	Very low	33.8	Very low	152 Å²	152	146.7 Å²	146.7	71%	0.71	72%	0.724	S	S	*	*				90.1	89.5	73.4	-83.2	176.9	-38.4	0	0	114
102	N	28	Very low	33.1	Very low	170 Å²	170	147.7 Å²	147.7	91%	0.909	74%	0.739	S	S	*	*				-152.7	150	118.5	-93.5	-24.9	0	0	0	108.2
103	W	30	Very low	32.6	Very low	225 Å²	225	151.5 Å²	151.5	85%	0.852	75%	0.753	S	S	*	*			trans	-120.1	165.8	-157.4	-78.2	41.7	0	0	0	113.7
104	L	25.7	Very low	32.6	Very low	160 Å²	160	153.9 Å²	153.9	84%	0.838	76%	0.762	S	S	*	*			trans	-50.2	167.3	168.4	-58.9	155	0	0	0	112.5
105	P	33.9	Very low	32.7	Very low	108 Å²	108	150.2 Å²	150.2	70%	0.701	76%	0.76	S	S	*	*			cis	-149.7	-172.9	22	36.7	-12.3	0	0	0	118.7
106	R	34.3	Very low	32.4	Very low	229 Å²	229	151.5 Å²	151.5	86%	0.864	77%	0.766	S	S	*	*				109.8	-7.7	124.6	-114.7	-179.7	-168.5	179.1	3.4	123.7
107	N	32.8	Very low	32.5	Very low	163 Å²	163	149.7 Å²	149.7	87%	0.872	77%	0.767	S	S	*	*	S	Bend	trans	-149.4	165.3	169.3	-97.5	-28	0	0	0	112.1	D109	N107-D109 PolarHBondContact O-N 3.26Å
108	N	30.8	Very low	32.5	Very low	156 Å²	156	149.3 Å²	149.3	83%	0.834	76%	0.76	S	S	*	*			trans	-71.6	113.5	178.3	-62.6	-12.8	0	0	0	110.6
109	D	33	Very low	32.9	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	75%	0.75	S	S	*	*				174.1	163.7	124.4	-89.3	-21.8	0	0	0	111.9	N107	N107-D109 PolarHBondContact O-N 3.26Å
110	T	33.1	Very low	33.3	Very low	136 Å²	136	150.4 Å²	150.4	83%	0.834	75%	0.746	S	S	*	*			trans	72	138.4	-178.2	72.6	0	0	0	0	117.4
111	V	30.2	Very low	33.4	Very low	148 Å²	148	143.4 Å²	143.4	90%	0.897	73%	0.732	S	S	*	*			trans	-136	131.1	172.1	175.9	0	0	0	0	107.2
112	V	32.8	Very low	33.5	Very low	132 Å²	132	141.1 Å²	141.1	80%	0.8	73%	0.729	S	S	*	*			trans	-104.8	142.3	-179.4	-179	0	0	0	0	110.3
113	E	32.2	Very low	33.9	Very low	151 Å²	151	139.6 Å²	139.6	71%	0.706	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-75.7	146	-170.7	-170.5	163.5	-158.7	0	0	113.7	R119	E113-R119 IonicContact OE1-NH2 2.94Å; E113-R119 PolarHBondContact OE1-NH2 3.31Å; E113-R119 VanDerWaalsContact OE1-NH2 3.12Å
114	V	35	Very low	34.1	Very low	96 Å²	96	134 Å²	134	58%	0.582	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-83.4	125.6	178	178.8	0	0	0	0	110	E116 F118	V114-E116 PolarHBondContact O-N 2.98Å; V114-F118 HydrophobicContact CG1-CB 4.3Å
115	P	37.8	Very low	34.3	Very low	89 Å²	89	131.7 Å²	131.7	58%	0.578	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-55.1	135.6	179.4	-28.1	35.6	0	0	0	113.7	Q117 F118	P115-Q117 PolarHBondContact O-N 3.48Å; P115-F118 PolarHBondContact O-N 3.38Å; P115-F118 VanDerWaalsContact O-N 3.11Å
116	E	36.1	Very low	34.4	Very low	139 Å²	139	130.3 Å²	130.3	65%	0.65	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-57.1	-28.5	-168.4	-105.7	-173	158.6	0	0	115.2	V114 F118 R119	V114-E116 PolarHBondContact O-N 2.98Å; E116-F118 PolarHBondContact O-N 2.87Å; E116-R119 PolarHBondContact O-N 3.01Å; E116-R119 IonicContact OE1-NH1 3.29Å; E116-R119 PolarHBondContact OE1-NH1 3.42Å
117	Q	40.1	Very low	34.6	Very low	179 Å²	179	127.6 Å²	127.6	84%	0.836	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-54.9	-18.1	177.8	-61.1	179.3	6.6	0	0	113.9	P115	P115-Q117 PolarHBondContact O-N 3.48Å
118	F	37.1	Very low	34.7	Very low	126 Å²	126	127 Å²	127	55%	0.553	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-97.1	-13	175.8	-75.7	-87.1	0	0	0	115.1	V114 P115 E116 D120 S121	V114-F118 HydrophobicContact CG1-CB 4.3Å; P115-F118 PolarHBondContact O-N 3.38Å; P115-F118 VanDerWaalsContact O-N 3.11Å; E116-F118 PolarHBondContact O-N 2.87Å; F118-D120 PolarHBondContact O-N 2.99Å; F118-S121 PolarHBondContact O-N 3.49Å
119	R	40.4	Very low	35	Very low	124 Å²	124	126.7 Å²	126.7	47%	0.468	68%	0.675	S	S	.	*	H	α-helix	trans	-60.6	-46.8	-176.1	-82.6	-172.3	177.3	147.7	3.4	112.7	E113 E116 V122 K123	E113-R119 IonicContact OE1-NH2 2.94Å; E113-R119 PolarHBondContact OE1-NH2 3.31Å; E113-R119 VanDerWaalsContact OE1-NH2 3.12Å; E116-R119 PolarHBondContact O-N 3.01Å; E116-R119 IonicContact OE1-NH1 3.29Å; E116-R119 PolarHBondContact OE1-NH1 3.42Å; R119-V122 PolarHBondContact O-N 3.31Å; R119-K123 PolarHBondContact O-N 2.9Å
120	D	37.7	Very low	34.8	Very low	99 Å²	99	123.8 Å²	123.8	53%	0.529	66%	0.664	S	S	.	*	H	α-helix	trans	-76.5	-26.8	-174.7	-67.7	-39.3	0	0	0	113.4	F118 V122 K123 T124	F118-D120 PolarHBondContact O-N 2.99Å; D120-V122 PolarHBondContact O-N 3.05Å; D120-K123 PolarHBondContact O-N 2.67Å; D120-K123 WeakPolarHBondContact OD1-CE 3.47Å; D120-K123 IonicContact OD1-NZ 3.1Å; D120-K123 PolarHBondContact OD1-NZ 3.5Å; D120-T124 PolarHBondContact O-OG1 3.4Å
121	S	31.7	Very low	35	Very low	83 Å²	83	124 Å²	124	58%	0.58	65%	0.654	S	S	*	*	H	α-helix	trans	-63.9	-22.3	170.8	-65.4	0	0	0	0	113	F118	F118-S121 PolarHBondContact O-N 3.49Å
122	V	31.7	Very low	35.4	Very low	105 Å²	105	124 Å²	124	64%	0.636	64%	0.644	S	S	*	*	H	α-helix	trans	-88.5	-28.5	178.4	175.3	0	0	0	0	112	R119 D120	R119-V122 PolarHBondContact O-N 3.31Å; D120-V122 PolarHBondContact O-N 3.05Å
123	K	35.8	Very low	35.5	Very low	137 Å²	137	124 Å²	124	60%	0.596	64%	0.639	S	S	*	*	H	α-helix	trans	-63.3	-43.2	176.4	-75.8	179.5	-173.3	151.3	0	112.4	R119 D120 V125 A126	R119-K123 PolarHBondContact O-N 2.9Å; D120-K123 PolarHBondContact O-N 2.67Å; D120-K123 WeakPolarHBondContact OD1-CE 3.47Å; D120-K123 IonicContact OD1-NZ 3.1Å; D120-K123 PolarHBondContact OD1-NZ 3.5Å; K123-V125 PolarHBondContact O-N 2.86Å; K123-A126 WeakPolarHBondContact O-CB 3.43Å; K123-A126 PolarHBondContact O-N 3.42Å
124	T	33.8	Very low	35.8	Very low	108 Å²	108	121.7 Å²	121.7	66%	0.663	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-8.6	-173.5	-29.4	0	0	0	0	114.4	D120	D120-T124 PolarHBondContact O-OG1 3.4Å
125	V	31.1	Very low	36	Very low	112 Å²	112	125.9 Å²	125.9	68%	0.679	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-14.3	177.1	-173.4	0	0	0	0	112.1	K123 E127	K123-V125 PolarHBondContact O-N 2.86Å; V125-E127 PolarHBondContact O-N 3.02Å
126	A	36	Very low	36	Very low	78 Å²	78	125 Å²	125	65%	0.645	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-6.7	-169.5	0	0	0	0	0	115.5	K123	K123-A126 WeakPolarHBondContact O-CB 3.43Å; K123-A126 PolarHBondContact O-N 3.42Å
127	E	37.1	Very low	35.9	Very low	172 Å²	172	123.5 Å²	123.5	80%	0.804	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	1.9	-169.3	-62.1	-174.7	152.7	0	0	114.6	V125	V125-E127 PolarHBondContact O-N 3.02Å
128	F	35.8	Very low	35.8	Very low	151 Å²	151	119.9 Å²	119.9	66%	0.662	62%	0.62	S	S	*	*			trans	-81.4	123.5	172.1	-85.4	-88	0	0	0	111.8	M69	M69-F128 HydrophobicContact CE-CD1 4.13Å; M69-F128 HydrophobicContact CE-CE1 3.49Å; M69-F128 VanDerWaalsContact CE-CE1 3.49Å; M69-F128 HydrophobicContact CE-CZ 3.72Å
129	E	36.1	Very low	35.7	Very low	149 Å²	149	116.3 Å²	116.3	70%	0.696	62%	0.619	S	S	*	*			trans	-80.7	136.3	174.8	-60.9	-146.4	125.3	0	0	112	F131	E129-F131 PolarHBondContact O-N 3.11Å
130	P	29.5	Very low	35.7	Very low	86 Å²	86	114.7 Å²	114.7	56%	0.558	63%	0.627	S	S	*	*			trans	-92.6	8.4	-163	-9	29.9	0	0	0	116.3	Q132	P130-Q132 PolarHBondContact O-N 3.48Å
131	F	36	Very low	35.9	Very low	139 Å²	139	115 Å²	115	61%	0.61	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-26.3	-153.5	-105.7	-80.7	0	0	0	117.3	E129 T156	E129-F131 PolarHBondContact O-N 3.11Å; F131-T156 HydrophobicContact CE1-CG2 4.28Å; F131-T156 HydrophobicContact CE2-CG2 4.49Å; F131-T156 HydrophobicContact CZ-CG2 3.75Å
132	Q	39.8	Very low	36.3	Very low	149 Å²	149	113.2 Å²	113.2	70%	0.696	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-14.8	-174.6	-76.2	172	-39.1	0	0	115	P130 F134	P130-Q132 PolarHBondContact O-N 3.48Å; Q132-F134 PolarHBondContact O-N 3.24Å
133	L	34.9	Very low	36.5	Very low	131 Å²	131	111.5 Å²	111.5	69%	0.686	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-5.6	-164	-114.3	161.3	0	0	0	116.3
134	F	37.6	Very low	36.7	Very low	104 Å²	104	108.5 Å²	108.5	46%	0.456	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.3	-11.5	-166.9	-74	-81.8	0	0	0	116.1	Q132 S136 L146	Q132-F134 PolarHBondContact O-N 3.24Å; F134-S136 VanDerWaalsContact C-N 3.26Å; F134-S136 PolarHBondContact O-N 3.27Å; F134-L146 HydrophobicContact CE1-CD2 3.89Å; F134-L146 HydrophobicContact CZ-CD2 4.35Å
135	H	39.5	Very low	36.8	Very low	184 Å²	184	105.2 Å²	105.2	85%	0.852	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	6.3	-168.3	-96.5	-61.4	0	0	0	117.1
136	S	39	Very low	37	Very low	71 Å²	71	102.7 Å²	102.7	50%	0.497	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-142.2	24.4	-174.7	88.5	0	0	0	0	117	R79 F134	R79-S136 VanDerWaalsContact NH1-CB 3.33Å; R79-S136 PolarHBondContact NH1-OG 2.83Å; F134-S136 VanDerWaalsContact C-N 3.26Å; F134-S136 PolarHBondContact O-N 3.27Å
137	M	33.3	Very low	37.1	Very low	107 Å²	107	108.4 Å²	108.4	53%	0.527	57%	0.57	S	S	.	*			trans	-110.6	141.9	175.8	-70.1	-163.6	179.5	0	0	112.4	I142	M137-I142 HydrophobicContact CB-CD1 3.87Å; M137-I142 HydrophobicContact CB-CG1 3.57Å; M137-I142 WeakPolarHBondContact O-CD1 3.35Å
138	T	38.6	Very low	37.1	Very low	103 Å²	103	107.9 Å²	107.9	63%	0.632	57%	0.567	S	S	*	*			trans	-82.5	149.1	176.9	47.5	0	0	0	0	111.4	S140 N141 I142	T138-S140 PolarHBondContact O-N 3.29Å; T138-S140 VanDerWaalsContact O-N 3.11Å; T138-N141 PolarHBondContact O-N 3.23Å; T138-I142 PolarHBondContact O-N 3.48Å
139	G	34.8	Very low	37.2	Very low	51 Å²	51	105.9 Å²	105.9	53%	0.526	56%	0.562	S	S	.	*	H	α-helix	trans	-56.3	-35.6	-157.2	0	0	0	0	0	117.1	N141 I142 V143	G139-N141 PolarHBondContact O-N 3Å; G139-I142 PolarHBondContact O-N 3.19Å; G139-V143 WeakPolarHBondContact O-CG2 3.41Å; G139-V143 PolarHBondContact O-N 2.62Å; G139-V143 VanDerWaalsContact O-N 3.11Å
140	S	40.8	Very low	37	Very low	90 Å²	90	100.2 Å²	100.2	63%	0.629	54%	0.544	S	S	*	.	H	α-helix	trans	-65	-41.2	-178.4	51	0	0	0	0	113.2	T138 V143 S144	T138-S140 PolarHBondContact O-N 3.29Å; T138-S140 VanDerWaalsContact O-N 3.11Å; S140-V143 PolarHBondContact O-N 3.12Å; S140-S144 PolarHBondContact O-N 3.01Å
141	N	40.5	Very low	37	Very low	105 Å²	105	104.6 Å²	104.6	56%	0.561	56%	0.561	S	S	*	*	H	α-helix	trans	-73.1	-32.8	177.5	-72	-29.9	0	0	0	111.8	T138 G139 A145	T138-N141 PolarHBondContact O-N 3.23Å; G139-N141 PolarHBondContact O-N 3Å; N141-A145 WeakPolarHBondContact O-CB 3.33Å; N141-A145 PolarHBondContact O-N 3.25Å
142	I	40.2	Very low	37	Very low	45 Å²	45	107 Å²	107	23%	0.231	57%	0.572	C	S	.	*	H	α-helix	trans	-60	-46.6	173.2	-71.8	-175.6	0	0	0	110.7	M137 T138 G139 S144 A145 L146	M137-I142 HydrophobicContact CB-CD1 3.87Å; M137-I142 HydrophobicContact CB-CG1 3.57Å; M137-I142 WeakPolarHBondContact O-CD1 3.35Å; T138-I142 PolarHBondContact O-N 3.48Å; G139-I142 PolarHBondContact O-N 3.19Å; I142-S144 PolarHBondContact O-N 3.39Å; I142-A145 PolarHBondContact O-N 3.49Å; I142-L146 HydrophobicContact CG2-CD1 3.49Å; I142-L146 VanDerWaalsContact CG2-CD1 3.49Å; I142-L146 HydrophobicContact CG2-CG 3.95Å; I142-L146 VanDerWaalsContact O-CB 3.31Å; I142-L146 WeakPolarHBondContact O-CB 3.31Å; I142-L146 WeakPolarHBondContact O-CG 3.3Å; I142-L146 PolarHBondContact O-N 3.07Å
143	V	36.7	Very low	36.7	Very low	70 Å²	70	103.1 Å²	103.1	42%	0.424	56%	0.56	S	S	.	*	H	α-helix	trans	-60.4	-46.1	-178.2	172.3	0	0	0	0	111.7	G139 S140 Y147	G139-V143 WeakPolarHBondContact O-CG2 3.41Å; G139-V143 PolarHBondContact O-N 2.62Å; G139-V143 VanDerWaalsContact O-N 3.11Å; S140-V143 PolarHBondContact O-N 3.12Å; V143-Y147 VanDerWaalsContact O-CB 3.31Å; V143-Y147 WeakPolarHBondContact O-CB 3.44Å; V143-Y147 PolarHBondContact O-N 3.49Å
144	S	38.9	Very low	36.8	Very low	73 Å²	73	100.5 Å²	100.5	51%	0.51	55%	0.547	S	S	.	.	H	α-helix	trans	-66.6	-40.8	178.5	-175	0	0	0	0	112.8	S140 I142 Y147 H148	S140-S144 PolarHBondContact O-N 3.01Å; I142-S144 PolarHBondContact O-N 3.39Å; S144-Y147 PolarHBondContact O-N 3.25Å; S144-H148 PolarHBondContact O-N 2.9Å
145	A	36.1	Very low	36.7	Very low	39 Å²	39	102.8 Å²	102.8	32%	0.322	56%	0.557	S	S	.	*	H	α-helix	trans	-65.6	-46.5	176.2	0	0	0	0	0	112.1	N141 I142 Y147 H148 I149	N141-A145 WeakPolarHBondContact O-CB 3.33Å; N141-A145 PolarHBondContact O-N 3.25Å; I142-A145 PolarHBondContact O-N 3.49Å; A145-Y147 VanDerWaalsContact C-N 3.33Å; A145-Y147 PolarHBondContact O-N 3.06Å; A145-H148 PolarHBondContact O-N 3.17Å; A145-I149 HydrophobicContact CB-CD1 4.48Å; A145-I149 WeakPolarHBondContact O-CB 3.5Å; A145-I149 WeakPolarHBondContact O-CD1 3.48Å; A145-I149 VanDerWaalsContact O-CG1 3.24Å; A145-I149 WeakPolarHBondContact O-CG1 3.41Å; A145-I149 PolarHBondContact O-N 2.67Å
146	L	36.8	Very low	36.6	Very low	59 Å²	59	97.9 Å²	97.9	31%	0.309	54%	0.54	S	S	.	.	H	α-helix	trans	-66.8	-31.6	177.3	-70.2	-177.5	0	0	0	112.5	F134 I142 H148 I149 G150	F134-L146 HydrophobicContact CE1-CD2 3.89Å; F134-L146 HydrophobicContact CZ-CD2 4.35Å; I142-L146 HydrophobicContact CG2-CD1 3.49Å; I142-L146 VanDerWaalsContact CG2-CD1 3.49Å; I142-L146 HydrophobicContact CG2-CG 3.95Å; I142-L146 VanDerWaalsContact O-CB 3.31Å; I142-L146 WeakPolarHBondContact O-CB 3.31Å; I142-L146 WeakPolarHBondContact O-CG 3.3Å; I142-L146 PolarHBondContact O-N 3.07Å; L146-H148 VanDerWaalsContact C-N 3.3Å; L146-H148 PolarHBondContact O-N 2.96Å; L146-I149 PolarHBondContact O-N 3.2Å; L146-G150 VanDerWaalsContact O-CA 3.22Å; L146-G150 WeakPolarHBondContact O-CA 3.48Å; L146-G150 PolarHBondContact O-N 3.01Å
147	Y	37.4	Very low	36.3	Very low	198 Å²	198	98.3 Å²	98.3	78%	0.776	54%	0.536	S	S	*	.	H	α-helix	trans	-62.2	-37.3	174.3	-168.9	-99.4	0	0	0	112.2	V143 S144 A145	V143-Y147 VanDerWaalsContact O-CB 3.31Å; V143-Y147 WeakPolarHBondContact O-CB 3.44Å; V143-Y147 PolarHBondContact O-N 3.49Å; S144-Y147 PolarHBondContact O-N 3.25Å; A145-Y147 VanDerWaalsContact C-N 3.33Å; A145-Y147 PolarHBondContact O-N 3.06Å
148	H	38	Very low	36.7	Very low	162 Å²	162	96.9 Å²	96.9	75%	0.75	53%	0.527	S	S	*	.	H	α-helix	trans	-87.2	-17.7	176.8	-79.3	-60.6	0	0	0	115.2	S144 A145 L146	S144-H148 PolarHBondContact O-N 2.9Å; A145-H148 PolarHBondContact O-N 3.17Å; L146-H148 VanDerWaalsContact C-N 3.3Å; L146-H148 PolarHBondContact O-N 2.96Å
149	I	37.8	Very low	36.9	Very low	109 Å²	109	94.1 Å²	94.1	56%	0.559	51%	0.512	S	S	*	.	H	α-helix	trans	-103.3	-23.7	-178.3	-65	168	0	0	0	112.4	A145 L146 L151	A145-I149 HydrophobicContact CB-CD1 4.48Å; A145-I149 WeakPolarHBondContact O-CB 3.5Å; A145-I149 WeakPolarHBondContact O-CD1 3.48Å; A145-I149 VanDerWaalsContact O-CG1 3.24Å; A145-I149 WeakPolarHBondContact O-CG1 3.41Å; A145-I149 PolarHBondContact O-N 2.67Å; L146-I149 PolarHBondContact O-N 3.2Å; I149-L151 PolarHBondContact O-N 2.91Å; I149-L151 VanDerWaalsContact O-N 3.14Å
150	G	30.8	Very low	37	Very low	30 Å²	30	94 Å²	94	31%	0.309	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-68.1	-18.8	-157.3	0	0	0	0	0	117.6	L146 K152 C153	L146-G150 VanDerWaalsContact O-CA 3.22Å; L146-G150 WeakPolarHBondContact O-CA 3.48Å; L146-G150 PolarHBondContact O-N 3.01Å; G150-K152 PolarHBondContact O-N 3.5Å; G150-C153 PolarHBondContact O-N 3.38Å
151	L	30.4	Very low	37.1	Very low	177 Å²	177	92.7 Å²	92.7	93%	0.927	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-68.3	2.9	-175.1	-86.9	169.1	0	0	0	115.4	I149	I149-L151 PolarHBondContact O-N 2.91Å; I149-L151 VanDerWaalsContact O-N 3.14Å
152	K	34.6	Very low	37.1	Very low	191 Å²	191	98.1 Å²	98.1	83%	0.83	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-127.1	16.2	168.6	-72.1	-170.4	176.4	179.9	0	115.1	G150 N154	G150-K152 PolarHBondContact O-N 3.5Å; K152-N154 PolarHBondContact O-N 3.16Å
153	C	34	Very low	37.5	Very low	67 Å²	67	99.6 Å²	99.6	45%	0.453	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	52.2	171.8	-70	0	0	0	0	113	G150	G150-C153 PolarHBondContact O-N 3.38Å
154	N	36.6	Very low	37.7	Very low	76 Å²	76	100.7 Å²	100.7	41%	0.406	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-44.2	178.2	-145.2	-24	0	0	0	111.4	K152 T156 L157 K224	K152-N154 PolarHBondContact O-N 3.16Å; N154-T156 PolarHBondContact O-N 3.35Å; N154-L157 PolarHBondContact O-N 2.92Å; N154-K224 PolarHBondContact O-NZ 3.11Å; N154-K224 VanDerWaalsContact O-NZ 3.15Å; N154-K224 WeakPolarHBondContact OD1-CE 3.44Å; N154-K224 PolarHBondContact OD1-NZ 3.06Å
155	K	35.3	Very low	38.2	Very low	151 Å²	151	100.7 Å²	100.7	66%	0.657	52%	0.515	S	S	*	.	H	α-helix	trans	-58.4	-35	-174.6	-75.4	-172.2	172	-173.8	0	115.1	L157 F158 S159	K155-L157 PolarHBondContact O-N 3.09Å; K155-F158 WeakPolarHBondContact O-CA 3.46Å; K155-F158 WeakPolarHBondContact O-CB 3.22Å; K155-F158 PolarHBondContact O-N 3.2Å; K155-S159 PolarHBondContact O-N 3.3Å
156	T	38.3	Very low	38.6	Very low	81 Å²	81	105.9 Å²	105.9	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-68.5	-18.7	-173.3	-26.2	0	0	0	0	114.4	F131 N154 S159	F131-T156 HydrophobicContact CE1-CG2 4.28Å; F131-T156 HydrophobicContact CE2-CG2 4.49Å; F131-T156 HydrophobicContact CZ-CG2 3.75Å; N154-T156 PolarHBondContact O-N 3.35Å; T156-S159 PolarHBondContact O-OG 2.86Å; T156-S159 VanDerWaalsContact O-OG 3.14Å
157	L	33.5	Very low	39.3	Very low	80 Å²	80	109.2 Å²	109.2	42%	0.419	55%	0.547	S	S	.	.	H	α-helix	trans	-92.4	-15.3	170.2	-92.9	159.2	0	0	0	112.4	N154 K155 I160 M220	N154-L157 PolarHBondContact O-N 2.92Å; K155-L157 PolarHBondContact O-N 3.09Å; L157-I160 HydrophobicContact CD2-CD1 4.05Å; L157-M220 HydrophobicContact CD2-CE 3.99Å
158	F	39.8	Very low	40	Very low	78 Å²	78	103.7 Å²	103.7	34%	0.342	53%	0.528	S	S	.	.	H	α-helix	trans	-88.7	-8.7	179.6	-93	-83.6	0	0	0	113.5	K155 I160 V161 E217 Y221	K155-F158 WeakPolarHBondContact O-CA 3.46Å; K155-F158 WeakPolarHBondContact O-CB 3.22Å; K155-F158 PolarHBondContact O-N 3.2Å; F158-I160 PolarHBondContact O-N 3.24Å; F158-V161 HydrophobicContact CD1-CG2 3.86Å; F158-V161 HydrophobicContact CE1-CG2 4.41Å; F158-V161 WeakPolarHBondContact O-CB 3.32Å; F158-V161 PolarHBondContact O-N 3.4Å; F158-E217 WeakPolarHBondContact CE1-OE1 3.32Å; F158-Y221 HydrophobicContact CZ-CD2 4.48Å
159	S	43.3	Very low	40.5	Very low	44 Å²	44	97 Å²	97	31%	0.308	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-64.5	-26.7	167.2	45.6	0	0	0	0	112.5	K155 T156 V161 R162	K155-S159 PolarHBondContact O-N 3.3Å; T156-S159 PolarHBondContact O-OG 2.86Å; T156-S159 VanDerWaalsContact O-OG 3.14Å; S159-V161 PolarHBondContact O-N 2.92Å; S159-R162 WeakPolarHBondContact O-CB 3.41Å; S159-R162 PolarHBondContact O-N 3.08Å
160	I	36.7	Very low	41.1	Very low	48 Å²	48	97.4 Å²	97.4	25%	0.246	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-57.9	-30.1	173.7	-60.4	180	0	0	0	111.4	L157 F158 R162 W163 I176	L157-I160 HydrophobicContact CD2-CD1 4.05Å; F158-I160 PolarHBondContact O-N 3.24Å; I160-R162 VanDerWaalsContact C-N 3.28Å; I160-R162 PolarHBondContact O-N 3.2Å; I160-W163 HydrophobicContact CB-CE3 4.08Å; I160-W163 HydrophobicContact CB-CZ3 3.9Å; I160-W163 HydrophobicContact CG1-CE3 4.37Å; I160-W163 HydrophobicContact CG1-CH2 3.9Å; I160-W163 HydrophobicContact CG1-CZ3 3.71Å; I160-W163 HydrophobicContact CG2-CE3 3.81Å; I160-W163 HydrophobicContact CG2-CZ3 3.7Å; I160-I176 HydrophobicContact CD1-CD1 4.45Å
161	V	43.6	Very low	42.2	Very low	63 Å²	63	102.2 Å²	102.2	38%	0.382	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-79.8	-8.9	-179.9	-163.9	0	0	0	0	112.4	F158 S159 E217	F158-V161 HydrophobicContact CD1-CG2 3.86Å; F158-V161 HydrophobicContact CE1-CG2 4.41Å; F158-V161 WeakPolarHBondContact O-CB 3.32Å; F158-V161 PolarHBondContact O-N 3.4Å; S159-V161 PolarHBondContact O-N 2.92Å; V161-E217 HydrophobicContact CG1-CG 4.07Å; V161-E217 HydrophobicContact CG2-CG 3.74Å
162	R	40.9	Very low	43.1	Very low	220 Å²	220	98.6 Å²	98.6	83%	0.83	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-92.1	-7.7	176.8	-84.2	-173.2	167.9	-177	-3.9	114.2	S159 I160	S159-R162 WeakPolarHBondContact O-CB 3.41Å; S159-R162 PolarHBondContact O-N 3.08Å; I160-R162 VanDerWaalsContact C-N 3.28Å; I160-R162 PolarHBondContact O-N 3.2Å
163	W	48.3	Very low	43.7	Very low	76 Å²	76	93.5 Å²	93.5	29%	0.288	48%	0.478	S	S	.	.			trans	-71.2	134.1	176.7	-62.8	-38.2	0	0	0	110.2	I160 E168 A169 H172	I160-W163 HydrophobicContact CB-CE3 4.08Å; I160-W163 HydrophobicContact CB-CZ3 3.9Å; I160-W163 HydrophobicContact CG1-CE3 4.37Å; I160-W163 HydrophobicContact CG1-CH2 3.9Å; I160-W163 HydrophobicContact CG1-CZ3 3.71Å; I160-W163 HydrophobicContact CG2-CE3 3.81Å; I160-W163 HydrophobicContact CG2-CZ3 3.7Å; W163-E168 HydrophobicContact CB-CB 4.13Å; W163-E168 HydrophobicContact CG-CB 4.45Å; W163-A169 VanDerWaalsContact CE3-CA 3.45Å; W163-A169 HydrophobicContact CE3-CB 3.74Å; W163-A169 HydrophobicContact CZ3-CB 4.34Å; W163-H172 AromaticContact CE2-CD2 3.87Å; W163-H172 HydrophobicContact CH2-CB 3.41Å; W163-H172 VanDerWaalsContact CH2-CB 3.41Å; W163-H172 HydrophobicContact CZ2-CB 3.54Å; W163-H172 AromaticContact CZ2-CD2 3.72Å; W163-H172 AromaticContact CZ2-CG 3.98Å; W163-H172 HydrophobicContact CZ3-CB 4.1Å; W163-H172 AromaticContact NE1-CD2 3.92Å
164	A	41.3	Very low	44.4	Very low	92 Å²	92	95 Å²	95	76%	0.76	48%	0.481	S	S	*	.	S	Bend	trans	-81.6	-20.3	-168	0	0	0	0	0	112.5	E168	A164-E168 WeakPolarHBondContact CA-OE2 3.31Å; A164-E168 PolarHBondContact N-OE2 3.49Å
165	T	48	Very low	44.9	Very low	73 Å²	73	95.2 Å²	95.2	45%	0.448	49%	0.489	S	S	.	.	S	Bend	trans	-131.9	153.3	-177.1	65.5	0	0	0	0	112.4	Q167 E168 A169	T165-Q167 PolarHBondContact O-N 2.97Å; T165-E168 WeakPolarHBondContact CB-OE2 3.45Å; T165-E168 PolarHBondContact N-OE2 3.03Å; T165-E168 VanDerWaalsContact OG1-CD 3.32Å; T165-E168 VanDerWaalsContact OG1-CG 3.23Å; T165-E168 WeakPolarHBondContact OG1-CG 3.41Å; T165-E168 PolarHBondContact OG1-N 2.98Å; T165-E168 PolarHBondContact OG1-OE2 3.37Å; T165-A169 PolarHBondContact O-N 3.45Å
166	E	44.7	Very low	45.5	Very low	148 Å²	148	91.2 Å²	91.2	69%	0.692	47%	0.474	S	S	*	.	H	α-helix	trans	-62.2	-26.3	173.1	-173.2	163.8	-139.3	0	0	112.3	L170	E166-L170 HydrophobicContact CG-CD1 4.48Å; E166-L170 WeakPolarHBondContact O-CG 3.44Å; E166-L170 PolarHBondContact O-N 3.01Å; E166-L170 VanDerWaalsContact O-N 3.13Å
167	Q	52.4	Low	45.5	Very low	130 Å²	130	95.9 Å²	95.9	61%	0.607	48%	0.482	S	S	*	.	H	α-helix	trans	-76.6	-46.2	-179.5	-169.2	169.3	-14.7	0	0	112.6	T165 A169 L170 E171	T165-Q167 PolarHBondContact O-N 2.97Å; Q167-A169 PolarHBondContact O-N 2.85Å; Q167-L170 PolarHBondContact O-N 2.98Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.4Å; Q167-E171 PolarHBondContact NE2-OE1 3.42Å; Q167-E171 VanDerWaalsContact NE2-OE1 3.09Å; Q167-E171 WeakPolarHBondContact O-CG 3.31Å; Q167-E171 PolarHBondContact O-N 3.46Å
168	E	51	Low	45.7	Very low	82 Å²	82	96.7 Å²	96.7	38%	0.383	49%	0.492	S	S	.	.	H	α-helix	trans	-54.6	-39	170	-72.3	162.8	126.2	0	0	111.5	W163 A164 T165 H172	W163-E168 HydrophobicContact CB-CB 4.13Å; W163-E168 HydrophobicContact CG-CB 4.45Å; A164-E168 WeakPolarHBondContact CA-OE2 3.31Å; A164-E168 PolarHBondContact N-OE2 3.49Å; T165-E168 WeakPolarHBondContact CB-OE2 3.45Å; T165-E168 PolarHBondContact N-OE2 3.03Å; T165-E168 VanDerWaalsContact OG1-CD 3.32Å; T165-E168 VanDerWaalsContact OG1-CG 3.23Å; T165-E168 WeakPolarHBondContact OG1-CG 3.41Å; T165-E168 PolarHBondContact OG1-N 2.98Å; T165-E168 PolarHBondContact OG1-OE2 3.37Å; E168-H172 PolarHBondContact O-N 3.39Å; E168-H172 VanDerWaalsContact O-N 3.12Å
169	A	49	Very low	45.9	Very low	22 Å²	22	98.8 Å²	98.8	18%	0.182	50%	0.502	C	S	.	.	H	α-helix	trans	-68.4	-37.9	179.8	0	0	0	0	0	113.5	W163 T165 Q167 L173	W163-A169 VanDerWaalsContact CE3-CA 3.45Å; W163-A169 HydrophobicContact CE3-CB 3.74Å; W163-A169 HydrophobicContact CZ3-CB 4.34Å; T165-A169 PolarHBondContact O-N 3.45Å; Q167-A169 PolarHBondContact O-N 2.85Å; A169-L173 WeakPolarHBondContact O-CB 3.42Å; A169-L173 WeakPolarHBondContact O-CD1 3.28Å; A169-L173 VanDerWaalsContact O-CG 3.24Å; A169-L173 WeakPolarHBondContact O-CG 3.3Å; A169-L173 PolarHBondContact O-N 2.94Å
170	L	51.1	Low	45.9	Very low	117 Å²	117	100.4 Å²	100.4	61%	0.613	51%	0.513	S	S	*	.	H	α-helix	trans	-71.8	-44.7	175.5	-79	164.5	0	0	0	112.1	E166 Q167 H172 L173	E166-L170 HydrophobicContact CG-CD1 4.48Å; E166-L170 WeakPolarHBondContact O-CG 3.44Å; E166-L170 PolarHBondContact O-N 3.01Å; E166-L170 VanDerWaalsContact O-N 3.13Å; Q167-L170 PolarHBondContact O-N 2.98Å; L170-H172 PolarHBondContact O-N 3.1Å; L170-L173 PolarHBondContact O-N 3.35Å
171	E	52.5	Low	46.2	Very low	131 Å²	131	101.4 Å²	101.4	61%	0.612	53%	0.528	S	S	*	.	H	α-helix	trans	-65.5	-37.8	-178.1	-70.9	178	-165.3	0	0	112	Q167	Q167-E171 WeakPolarHBondContact CG-OE1 3.4Å; Q167-E171 PolarHBondContact NE2-OE1 3.42Å; Q167-E171 VanDerWaalsContact NE2-OE1 3.09Å; Q167-E171 WeakPolarHBondContact O-CG 3.31Å; Q167-E171 PolarHBondContact O-N 3.46Å
172	H	51.4	Low	46	Very low	100 Å²	100	102 Å²	102	46%	0.463	53%	0.529	S	S	.	.	H	α-helix	trans	-80.7	-18.3	174.3	-79.1	-29.3	0	0	0	114.8	W163 E168 L170 D174 S175	W163-H172 AromaticContact CE2-CD2 3.87Å; W163-H172 HydrophobicContact CH2-CB 3.41Å; W163-H172 VanDerWaalsContact CH2-CB 3.41Å; W163-H172 HydrophobicContact CZ2-CB 3.54Å; W163-H172 AromaticContact CZ2-CD2 3.72Å; W163-H172 AromaticContact CZ2-CG 3.98Å; W163-H172 HydrophobicContact CZ3-CB 4.1Å; W163-H172 AromaticContact NE1-CD2 3.92Å; E168-H172 PolarHBondContact O-N 3.39Å; E168-H172 VanDerWaalsContact O-N 3.12Å; L170-H172 PolarHBondContact O-N 3.1Å; H172-D174 VanDerWaalsContact C-N 3.28Å; H172-D174 PolarHBondContact O-N 3.31Å; H172-S175 WeakPolarHBondContact O-CB 3.47Å; H172-S175 PolarHBondContact O-N 3.35Å; H172-S175 VanDerWaalsContact O-N 3.13Å; H172-S175 PolarHBondContact O-OG 3.27Å
173	L	46.5	Very low	46.2	Very low	85 Å²	85	95.9 Å²	95.9	45%	0.445	51%	0.508	S	S	.	.	H	α-helix	trans	-62.5	-33	176.3	-98	166	0	0	0	113	A169 L170 S175 I176	A169-L173 WeakPolarHBondContact O-CB 3.42Å; A169-L173 WeakPolarHBondContact O-CD1 3.28Å; A169-L173 VanDerWaalsContact O-CG 3.24Å; A169-L173 WeakPolarHBondContact O-CG 3.3Å; A169-L173 PolarHBondContact O-N 2.94Å; L170-L173 PolarHBondContact O-N 3.35Å; L173-S175 PolarHBondContact O-N 3.46Å; L173-I176 HydrophobicContact CD2-CD1 4.05Å; L173-I176 WeakPolarHBondContact O-CG1 3.48Å; L173-I176 PolarHBondContact O-N 3.47Å
174	D	48.1	Very low	46	Very low	99 Å²	99	97.1 Å²	97.1	53%	0.529	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-70.8	-18.3	177.7	-128.1	-38.1	0	0	0	112.6	H172 I176 R177	H172-D174 VanDerWaalsContact C-N 3.28Å; H172-D174 PolarHBondContact O-N 3.31Å; D174-I176 PolarHBondContact O-N 2.94Å; D174-R177 WeakPolarHBondContact O-CG 3.5Å; D174-R177 IonicContact OD1-CZ 3.27Å; D174-R177 IonicContact OD1-NE 3.76Å; D174-R177 PolarHBondContact OD1-NE 3.42Å; D174-R177 IonicContact OD1-NH2 2.89Å; D174-R177 PolarHBondContact OD1-NH2 3.49Å; D174-R177 IonicContact OD2-NH2 2.87Å
175	S	48.1	Very low	46.1	Very low	80 Å²	80	97.6 Å²	97.6	56%	0.559	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-69.4	-16.6	175.4	77.2	0	0	0	0	113.6	H172 L173 R177 P178	H172-S175 WeakPolarHBondContact O-CB 3.47Å; H172-S175 PolarHBondContact O-N 3.35Å; H172-S175 VanDerWaalsContact O-N 3.13Å; H172-S175 PolarHBondContact O-OG 3.27Å; L173-S175 PolarHBondContact O-N 3.46Å; S175-R177 PolarHBondContact O-N 3.3Å; S175-P178 WeakPolarHBondContact O-CD 3.45Å
176	I	46.9	Very low	46	Very low	66 Å²	66	98.3 Å²	98.3	34%	0.338	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-78.2	0.9	-173.8	-50.1	-173.3	0	0	0	112.4	I160 L173 D174 P178 F179	I160-I176 HydrophobicContact CD1-CD1 4.45Å; L173-I176 HydrophobicContact CD2-CD1 4.05Å; L173-I176 WeakPolarHBondContact O-CG1 3.48Å; L173-I176 PolarHBondContact O-N 3.47Å; D174-I176 PolarHBondContact O-N 2.94Å; I176-P178 VanDerWaalsContact C-N 3.3Å; I176-P178 WeakPolarHBondContact O-CD 3.34Å; I176-F179 HydrophobicContact CG2-CD2 3.64Å; I176-F179 HydrophobicContact CG2-CE2 4.28Å; I176-F179 HydrophobicContact CG2-CG 4.39Å; I176-F179 PolarHBondContact O-N 3.23Å; I176-F179 VanDerWaalsContact O-N 3.16Å
177	R	38.5	Very low	45.9	Very low	179 Å²	179	96.7 Å²	96.7	68%	0.675	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41	-39.8	176.2	-78.7	174.9	-170.6	-152.6	2.7	116.5	D174 S175 F179 S180	D174-R177 WeakPolarHBondContact O-CG 3.5Å; D174-R177 IonicContact OD1-CZ 3.27Å; D174-R177 IonicContact OD1-NE 3.76Å; D174-R177 PolarHBondContact OD1-NE 3.42Å; D174-R177 IonicContact OD1-NH2 2.89Å; D174-R177 PolarHBondContact OD1-NH2 3.49Å; D174-R177 IonicContact OD2-NH2 2.87Å; S175-R177 PolarHBondContact O-N 3.3Å; R177-F179 PolarHBondContact O-N 3.06Å; R177-F179 VanDerWaalsContact O-N 3.13Å; R177-S180 WeakPolarHBondContact O-CB 3.45Å; R177-S180 PolarHBondContact O-N 3.09Å; R177-S180 PolarHBondContact O-OG 3.31Å
178	P	38.6	Very low	45.8	Very low	98 Å²	98	97.1 Å²	97.1	64%	0.636	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.4	-178.1	-27.9	37.2	0	0	0	115.7	S175 I176 S180	S175-P178 WeakPolarHBondContact O-CD 3.45Å; I176-P178 VanDerWaalsContact C-N 3.3Å; I176-P178 WeakPolarHBondContact O-CD 3.34Å; P178-S180 PolarHBondContact O-N 3.03Å
179	F	43.2	Very low	45.7	Very low	122 Å²	122	99.8 Å²	99.8	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-71.4	-14.8	-178.4	-74.9	-86.9	0	0	0	114.1	I176 R177 A181 L182 F183	I176-F179 HydrophobicContact CG2-CD2 3.64Å; I176-F179 HydrophobicContact CG2-CE2 4.28Å; I176-F179 HydrophobicContact CG2-CG 4.39Å; I176-F179 PolarHBondContact O-N 3.23Å; I176-F179 VanDerWaalsContact O-N 3.16Å; R177-F179 PolarHBondContact O-N 3.06Å; R177-F179 VanDerWaalsContact O-N 3.13Å; F179-A181 VanDerWaalsContact C-N 3.33Å; F179-A181 PolarHBondContact O-N 3.34Å; F179-L182 HydrophobicContact CD1-CD2 4.18Å; F179-L182 WeakPolarHBondContact O-CB 3.34Å; F179-L182 PolarHBondContact O-N 3.49Å; F179-L182 VanDerWaalsContact O-N 3.17Å; F179-F183 PolarHBondContact O-N 2.92Å
180	S	43.7	Very low	44.9	Very low	78 Å²	78	106.1 Å²	106.1	55%	0.545	54%	0.541	S	S	.	.	H	α-helix	trans	-56	-43.5	176.9	53.5	0	0	0	0	113	R177 P178 L182 F183 L184	R177-S180 WeakPolarHBondContact O-CB 3.45Å; R177-S180 PolarHBondContact O-N 3.09Å; R177-S180 PolarHBondContact O-OG 3.31Å; P178-S180 PolarHBondContact O-N 3.03Å; S180-L182 VanDerWaalsContact C-N 3.35Å; S180-L182 PolarHBondContact O-N 3.45Å; S180-F183 PolarHBondContact O-N 3.11Å; S180-L184 PolarHBondContact O-N 3.37Å; S180-L184 VanDerWaalsContact O-N 3.15Å
181	A	42.6	Very low	44	Very low	68 Å²	68	107 Å²	107	56%	0.562	55%	0.554	S	S	*	*	H	α-helix	trans	-68.1	-31.8	178.5	0	0	0	0	0	113.1	F179 L184 H185	F179-A181 VanDerWaalsContact C-N 3.33Å; F179-A181 PolarHBondContact O-N 3.34Å; A181-L184 PolarHBondContact O-N 2.9Å; A181-H185 PolarHBondContact O-N 3Å
182	L	38.3	Very low	43.2	Very low	77 Å²	77	103 Å²	103	40%	0.403	55%	0.548	S	S	.	.	H	α-helix	trans	-67.8	-40.1	177.4	-170.7	69.8	0	0	0	111	F179 S180 H185 I186	F179-L182 HydrophobicContact CD1-CD2 4.18Å; F179-L182 WeakPolarHBondContact O-CB 3.34Å; F179-L182 PolarHBondContact O-N 3.49Å; F179-L182 VanDerWaalsContact O-N 3.17Å; S180-L182 VanDerWaalsContact C-N 3.35Å; S180-L182 PolarHBondContact O-N 3.45Å; L182-H185 PolarHBondContact O-N 3.41Å; L182-I186 WeakPolarHBondContact O-CG1 3.48Å; L182-I186 PolarHBondContact O-N 2.91Å
183	F	45.2	Very low	42.5	Very low	90 Å²	90	108.6 Å²	108.6	40%	0.395	57%	0.571	S	S	.	*	H	α-helix	trans	-66	-42.1	173.8	-88.2	-83.4	0	0	0	112.5	F179 S180 H185 I186 E187 L201	F179-F183 PolarHBondContact O-N 2.92Å; S180-F183 PolarHBondContact O-N 3.11Å; F183-H185 PolarHBondContact O-N 2.79Å; F183-I186 PolarHBondContact O-N 3.25Å; F183-I186 VanDerWaalsContact O-N 3.12Å; F183-E187 WeakPolarHBondContact O-CB 3.28Å; F183-E187 PolarHBondContact O-N 3.38Å; F183-L201 HydrophobicContact CZ-CD1 4.37Å
184	L	45.8	Very low	42.2	Very low	103 Å²	103	113 Å²	113	54%	0.539	58%	0.582	S	S	.	*	H	α-helix	trans	-58	-35.8	176.5	-115.9	90.3	0	0	0	113	S180 A181 E187 Q188	S180-L184 PolarHBondContact O-N 3.37Å; S180-L184 VanDerWaalsContact O-N 3.15Å; A181-L184 PolarHBondContact O-N 2.9Å; L184-E187 WeakPolarHBondContact O-CB 3.33Å; L184-E187 PolarHBondContact O-N 3.41Å; L184-Q188 WeakPolarHBondContact O-CG 3.15Å; L184-Q188 PolarHBondContact O-N 3.02Å
185	H	43.7	Very low	42.1	Very low	101 Å²	101	112.3 Å²	112.3	47%	0.468	58%	0.582	S	S	.	*	H	α-helix	trans	-77	-27.4	179.1	-160	51.6	0	0	0	113.1	A181 L182 F183 Q188 Q189	A181-H185 PolarHBondContact O-N 3Å; L182-H185 PolarHBondContact O-N 3.41Å; F183-H185 PolarHBondContact O-N 2.79Å; H185-Q188 PolarHBondContact ND1-OE1 3.05Å; H185-Q189 WeakPolarHBondContact O-CG 3.38Å
186	I	43.9	Very low	41.9	Very low	88 Å²	88	114.9 Å²	114.9	45%	0.451	58%	0.579	S	S	.	*	H	α-helix	trans	-71.8	-38	169.7	-65.2	166.3	0	0	0	110.3	L182 F183 Q188 Q189	L182-I186 WeakPolarHBondContact O-CG1 3.48Å; L182-I186 PolarHBondContact O-N 2.91Å; F183-I186 PolarHBondContact O-N 3.25Å; F183-I186 VanDerWaalsContact O-N 3.12Å; I186-Q188 PolarHBondContact O-N 3.21Å; I186-Q189 PolarHBondContact O-N 3.33Å
187	E	42.6	Very low	41.7	Very low	114 Å²	114	115.5 Å²	115.5	53%	0.533	59%	0.587	S	S	.	*	H	α-helix	trans	-60.4	-32.4	176.3	-166.5	166.6	-133.5	0	0	112.2	F183 L184 Q189	F183-E187 WeakPolarHBondContact O-CB 3.28Å; F183-E187 PolarHBondContact O-N 3.38Å; L184-E187 WeakPolarHBondContact O-CB 3.33Å; L184-E187 PolarHBondContact O-N 3.41Å; E187-Q189 VanDerWaalsContact C-N 3.31Å; E187-Q189 PolarHBondContact O-N 2.95Å
188	Q	51.2	Low	41.9	Very low	140 Å²	140	109.7 Å²	109.7	65%	0.654	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-12.7	172.9	-71.6	175.6	-16.1	0	0	114.8	L184 H185 I186	L184-Q188 WeakPolarHBondContact O-CG 3.15Å; L184-Q188 PolarHBondContact O-N 3.02Å; H185-Q188 PolarHBondContact ND1-OE1 3.05Å; I186-Q188 PolarHBondContact O-N 3.21Å
189	Q	48.3	Very low	42.4	Very low	138 Å²	138	107.3 Å²	107.3	65%	0.645	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.4	-12	-173.4	-71	-81.1	-39.6	0	0	114.3	H185 I186 E187	H185-Q189 WeakPolarHBondContact O-CG 3.38Å; I186-Q189 PolarHBondContact O-N 3.33Å; E187-Q189 VanDerWaalsContact C-N 3.31Å; E187-Q189 PolarHBondContact O-N 2.95Å
190	M	32.3	Very low	42.8	Very low	155 Å²	155	102 Å²	102	76%	0.764	53%	0.532	S	S	*	.			trans	-132.7	79.8	-173.3	-67.6	-164.9	-178.3	0	0	114.4	G192	M190-G192 PolarHBondContact O-N 3.16Å
191	P	33.6	Very low	43	Very low	135 Å²	135	102.4 Å²	102.4	88%	0.877	53%	0.527	S	S	*	.			trans	-78.9	109	175.8	30.9	-33.6	0	0	0	113
192	G	33.9	Very low	43.4	Very low	47 Å²	47	104.3 Å²	104.3	49%	0.485	53%	0.527	S	S	.	.	S	Bend	trans	130.8	145.6	150.3	0	0	0	0	0	118.6	M190 Y194	M190-G192 PolarHBondContact O-N 3.16Å; G192-Y194 VanDerWaalsContact C-N 3.3Å; G192-Y194 WeakPolarHBondContact O-CD2 3.4Å; G192-Y194 PolarHBondContact O-N 3.2Å
193	K	37.3	Very low	44.3	Very low	217 Å²	217	101.2 Å²	101.2	94%	0.943	51%	0.51	S	S	*	.	S	Bend	trans	61.8	-12.9	162	-67.4	-173.4	177.1	179.2	0	120.7
194	Y	41.1	Very low	44.7	Very low	177 Å²	177	97.1 Å²	97.1	69%	0.694	49%	0.493	S	S	*	.	S	Bend	trans	-93.3	144.5	178.9	-63.3	-78	0	0	0	113.1	G192 R196	G192-Y194 VanDerWaalsContact C-N 3.3Å; G192-Y194 WeakPolarHBondContact O-CD2 3.4Å; G192-Y194 PolarHBondContact O-N 3.2Å; Y194-R196 PolarHBondContact O-N 3.15Å
195	V	45.4	Very low	44.9	Very low	85 Å²	85	100.5 Å²	100.5	52%	0.515	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-61.7	131.6	168.8	178	0	0	0	0	107.7	D199	V195-D199 HydrophobicContact CG1-CB 4.43Å
196	R	43.2	Very low	45.4	Very low	135 Å²	135	99 Å²	99	51%	0.509	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-75.4	138.5	-165.5	-57.6	169.3	-76.7	-152.9	-0	110.2	Y194 T198 D199 T200	Y194-R196 PolarHBondContact O-N 3.15Å; R196-T198 VanDerWaalsContact CB-OG1 3.28Å; R196-T198 WeakPolarHBondContact CB-OG1 3.36Å; R196-T198 PolarHBondContact O-N 3.05Å; R196-T198 VanDerWaalsContact O-N 3.13Å; R196-D199 HydrophobicContact CB-CB 4.39Å; R196-D199 VanDerWaalsContact CB-OD2 3.26Å; R196-D199 WeakPolarHBondContact CB-OD2 3.27Å; R196-D199 IonicContact CZ-OD1 2.69Å; R196-D199 IonicContact CZ-OD2 3.48Å; R196-D199 PolarHBondContact N-OD2 3.42Å; R196-D199 VanDerWaalsContact NE-CG 3.34Å; R196-D199 IonicContact NE-OD1 2.68Å; R196-D199 PolarHBondContact NE-OD1 3.1Å; R196-D199 VanDerWaalsContact NE-OD1 3.17Å; R196-D199 IonicContact NE-OD2 3.32Å; R196-D199 PolarHBondContact NE-OD2 3.06Å; R196-D199 IonicContact NH2-OD1 2.73Å; R196-D199 PolarHBondContact NH2-OD1 3.01Å; R196-D199 IonicContact NH2-OD2 3.65Å; R196-D199 PolarHBondContact NH2-OD2 3.03Å; R196-D199 WeakPolarHBondContact O-CA 3.5Å; R196-D199 WeakPolarHBondContact O-CB 3.32Å; R196-D199 PolarHBondContact O-N 3.37Å; R196-T200 PolarHBondContact O-N 3.03Å
197	P	42.2	Very low	45.9	Very low	78 Å²	78	96.3 Å²	96.3	51%	0.506	49%	0.489	S	S	.	.	H	α-helix	trans	-56.2	-27.6	169.7	-26.8	35.8	0	0	0	112.9	T200 L201	P197-T200 PolarHBondContact O-N 2.83Å; P197-L201 WeakPolarHBondContact O-CB 3.24Å; P197-L201 PolarHBondContact O-N 3.41Å
198	T	43.3	Very low	46.3	Very low	57 Å²	57	91.9 Å²	91.9	35%	0.35	47%	0.472	S	S	.	.	H	α-helix	trans	-67.4	-36.4	170.8	44.3	0	0	0	0	113	R196 L201 L202	R196-T198 VanDerWaalsContact CB-OG1 3.28Å; R196-T198 WeakPolarHBondContact CB-OG1 3.36Å; R196-T198 PolarHBondContact O-N 3.05Å; R196-T198 VanDerWaalsContact O-N 3.13Å; T198-L201 PolarHBondContact O-N 3.39Å; T198-L202 VanDerWaalsContact O-CB 3.27Å; T198-L202 WeakPolarHBondContact O-CB 3.44Å; T198-L202 PolarHBondContact O-N 3.11Å
199	D	50.2	Low	46.3	Very low	49 Å²	49	89.8 Å²	89.8	26%	0.262	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-40.9	172.7	-60.1	-44.8	0	0	0	110.4	V195 R196 L202 W203	V195-D199 HydrophobicContact CG1-CB 4.43Å; R196-D199 HydrophobicContact CB-CB 4.39Å; R196-D199 VanDerWaalsContact CB-OD2 3.26Å; R196-D199 WeakPolarHBondContact CB-OD2 3.27Å; R196-D199 IonicContact CZ-OD1 2.69Å; R196-D199 IonicContact CZ-OD2 3.48Å; R196-D199 PolarHBondContact N-OD2 3.42Å; R196-D199 VanDerWaalsContact NE-CG 3.34Å; R196-D199 IonicContact NE-OD1 2.68Å; R196-D199 PolarHBondContact NE-OD1 3.1Å; R196-D199 VanDerWaalsContact NE-OD1 3.17Å; R196-D199 IonicContact NE-OD2 3.32Å; R196-D199 PolarHBondContact NE-OD2 3.06Å; R196-D199 IonicContact NH2-OD1 2.73Å; R196-D199 PolarHBondContact NH2-OD1 3.01Å; R196-D199 IonicContact NH2-OD2 3.65Å; R196-D199 PolarHBondContact NH2-OD2 3.03Å; R196-D199 WeakPolarHBondContact O-CA 3.5Å; R196-D199 WeakPolarHBondContact O-CB 3.32Å; R196-D199 PolarHBondContact O-N 3.37Å; D199-L202 PolarHBondContact O-N 2.88Å; D199-W203 WeakPolarHBondContact O-CB 3.2Å; D199-W203 PolarHBondContact O-N 3.38Å
200	T	50.5	Low	46.4	Very low	10 Å²	10	88.3 Å²	88.3	6%	0.061	48%	0.481	C	S	.	.	H	α-helix	trans	-67.8	-37.7	176.8	-50.6	0	0	0	0	112.6	R196 P197 A204 I223 I234	R196-T200 PolarHBondContact O-N 3.03Å; P197-T200 PolarHBondContact O-N 2.83Å; T200-A204 WeakPolarHBondContact O-CB 3.04Å; T200-A204 PolarHBondContact O-N 2.98Å; T200-I223 HydrophobicContact CG2-CD1 4.14Å; T200-I223 HydrophobicContact CG2-CG1 4.09Å; T200-I223 HydrophobicContact CG2-CG2 4.46Å; T200-I234 HydrophobicContact CG2-CD1 4.15Å
201	L	49.4	Very low	47.3	Very low	86 Å²	86	84.7 Å²	84.7	45%	0.45	46%	0.461	S	S	.	.	H	α-helix	trans	-69.9	-34.7	173.1	-93.9	159.7	0	0	0	112.7	F183 P197 T198 A204 K205	F183-L201 HydrophobicContact CZ-CD1 4.37Å; P197-L201 WeakPolarHBondContact O-CB 3.24Å; P197-L201 PolarHBondContact O-N 3.41Å; T198-L201 PolarHBondContact O-N 3.39Å; L201-A204 PolarHBondContact O-N 2.81Å; L201-K205 PolarHBondContact O-N 3.47Å
202	L	51	Low	48.1	Very low	109 Å²	109	88.3 Å²	88.3	57%	0.571	46%	0.457	S	S	*	.	H	α-helix	trans	-70.4	-41	174.6	-162.4	73.5	0	0	0	111	T198 D199 K205 C206	T198-L202 VanDerWaalsContact O-CB 3.27Å; T198-L202 WeakPolarHBondContact O-CB 3.44Å; T198-L202 PolarHBondContact O-N 3.11Å; D199-L202 PolarHBondContact O-N 2.88Å; L202-K205 WeakPolarHBondContact O-CB 3.13Å; L202-K205 PolarHBondContact O-N 2.85Å; L202-K205 VanDerWaalsContact O-N 3.17Å; L202-C206 PolarHBondContact O-N 3.1Å; L202-C206 PolarHBondContact O-SG 3.36Å; L202-C206 VanDerWaalsContact O-SG 3.39Å
203	W	57.1	Low	48.8	Very low	11 Å²	11	90.6 Å²	90.6	4%	0.042	47%	0.465	C	S	.	.	H	α-helix	trans	-58.1	-46.3	170.6	176.6	70.9	0	0	0	111.5	D199 K205 C206 F207 L219 P231 I234 I240 Y243	D199-W203 WeakPolarHBondContact O-CB 3.2Å; D199-W203 PolarHBondContact O-N 3.38Å; W203-K205 VanDerWaalsContact C-N 3.33Å; W203-K205 PolarHBondContact O-N 3.07Å; W203-C206 PolarHBondContact O-N 3.07Å; W203-C206 VanDerWaalsContact O-N 3.16Å; W203-F207 AromaticContact CD1-CD2 3.47Å; W203-F207 VanDerWaalsContact CD1-CD2 3.47Å; W203-F207 AromaticContact CD1-CE2 3.76Å; W203-F207 HydrophobicContact CG-CD2 4.37Å; W203-F207 AromaticContact NE1-CD2 3.28Å; W203-F207 VanDerWaalsContact NE1-CD2 3.28Å; W203-F207 AromaticContact NE1-CE2 3.49Å; W203-F207 AromaticContact NE1-CG 3.86Å; W203-F207 PolarHBondContact O-N 3.14Å; W203-L219 HydrophobicContact CH2-CD1 4.32Å; W203-L219 HydrophobicContact CZ3-CD1 3.78Å; W203-P231 HydrophobicContact CD2-CB 3.95Å; W203-P231 HydrophobicContact CD2-CG 4.22Å; W203-P231 HydrophobicContact CE3-CB 4.12Å; W203-P231 HydrophobicContact CE3-CG 4.3Å; W203-P231 HydrophobicContact CG-CG 4.46Å; W203-P231 HydrophobicContact CH2-CB 4.23Å; W203-P231 HydrophobicContact CZ2-CB 4.08Å; W203-P231 HydrophobicContact CZ3-CB 4.25Å; W203-I234 HydrophobicContact CZ3-CG2 4.16Å; W203-I240 HydrophobicContact CH2-CD1 4.33Å; W203-Y243 AromaticContact CE2-CE2 3.83Å; W203-Y243 HydrophobicContact CZ2-CD1 4.27Å; W203-Y243 AromaticContact CZ2-CD2 3.82Å; W203-Y243 HydrophobicContact CZ2-CD2 3.82Å; W203-Y243 HydrophobicContact CZ2-CE1 4.29Å; W203-Y243 AromaticContact CZ2-CE2 3.89Å; W203-Y243 HydrophobicContact CZ2-CE2 3.89Å; W203-Y243 HydrophobicContact CZ2-CG 4.03Å; W203-Y243 AromaticContact NE1-CD2 3.72Å; W203-Y243 AromaticContact NE1-CE2 3.25Å; W203-Y243 AromaticContact NE1-CZ 3.92Å
204	A	53.1	Low	49.7	Very low	5 Å²	5	83.8 Å²	83.8	4%	0.041	44%	0.444	C	S	.	.	H	α-helix	trans	-58.6	-42.4	173.6	0	0	0	0	0	112	T200 L201 C206 A208 L219 I223	T200-A204 WeakPolarHBondContact O-CB 3.04Å; T200-A204 PolarHBondContact O-N 2.98Å; L201-A204 PolarHBondContact O-N 2.81Å; A204-C206 PolarHBondContact O-N 3.19Å; A204-A208 WeakPolarHBondContact O-CB 3.08Å; A204-A208 PolarHBondContact O-N 3.32Å; A204-L219 HydrophobicContact CB-CD2 4.35Å; A204-I223 HydrophobicContact CB-CD1 4.42Å
205	K	49.9	Very low	50.5	Low	174 Å²	174	77.8 Å²	77.8	76%	0.757	43%	0.428	S	S	*	.	H	α-helix	trans	-61.9	-40.5	173.4	-100.1	-166.3	171.9	-168.7	0	113.4	L201 L202 W203	L201-K205 PolarHBondContact O-N 3.47Å; L202-K205 WeakPolarHBondContact O-CB 3.13Å; L202-K205 PolarHBondContact O-N 2.85Å; L202-K205 VanDerWaalsContact O-N 3.17Å; W203-K205 VanDerWaalsContact C-N 3.33Å; W203-K205 PolarHBondContact O-N 3.07Å
206	C	53.4	Low	51.2	Low	69 Å²	69	76.8 Å²	76.8	47%	0.466	42%	0.419	S	S	.	.	H	α-helix	trans	-75.5	-32.4	-178.8	-68.1	0	0	0	0	113.2	L202 W203 A204	L202-C206 PolarHBondContact O-N 3.1Å; L202-C206 PolarHBondContact O-SG 3.36Å; L202-C206 VanDerWaalsContact O-SG 3.39Å; W203-C206 PolarHBondContact O-N 3.07Å; W203-C206 VanDerWaalsContact O-N 3.16Å; A204-C206 PolarHBondContact O-N 3.19Å
207	F	55.6	Low	52.1	Low	32 Å²	32	74.2 Å²	74.2	14%	0.14	41%	0.412	C	S	.	.	H	α-helix	trans	-95.4	-20.6	-179	-88.1	-97.6	0	0	0	114.8	W203 A209 P210 F211 Y243 K246	W203-F207 AromaticContact CD1-CD2 3.47Å; W203-F207 VanDerWaalsContact CD1-CD2 3.47Å; W203-F207 AromaticContact CD1-CE2 3.76Å; W203-F207 HydrophobicContact CG-CD2 4.37Å; W203-F207 AromaticContact NE1-CD2 3.28Å; W203-F207 VanDerWaalsContact NE1-CD2 3.28Å; W203-F207 AromaticContact NE1-CE2 3.49Å; W203-F207 AromaticContact NE1-CG 3.86Å; W203-F207 PolarHBondContact O-N 3.14Å; F207-A209 VanDerWaalsContact C-N 3.34Å; F207-A209 PolarHBondContact O-N 3.18Å; F207-P210 WeakPolarHBondContact O-CD 3.25Å; F207-F211 WeakPolarHBondContact O-CD2 3.49Å; F207-F211 WeakPolarHBondContact O-CE2 3.35Å; F207-Y243 HydrophobicContact CD1-CD2 4.42Å; F207-Y243 AromaticContact CE1-CD2 3.81Å; F207-Y243 HydrophobicContact CE1-CD2 3.81Å; F207-Y243 HydrophobicContact CE2-CD2 4.35Å; F207-Y243 HydrophobicContact CE2-CE2 4.39Å; F207-Y243 AromaticContact CZ-CD2 3.77Å; F207-Y243 HydrophobicContact CZ-CD2 3.77Å; F207-Y243 HydrophobicContact CZ-CE2 4.14Å; F207-K246 HydrophobicContact CE1-CD 3.85Å; F207-K246 HydrophobicContact CZ-CD 3.99Å
208	A	51	Low	53.4	Low	21 Å²	21	78 Å²	78	17%	0.174	42%	0.416	C	S	.	.	S	Bend	trans	-68	-27.7	-175.5	0	0	0	0	0	114.9	A204 P210 F211 M216	A204-A208 WeakPolarHBondContact O-CB 3.08Å; A204-A208 PolarHBondContact O-N 3.32Å; A208-P210 VanDerWaalsContact C-N 3.3Å; A208-F211 PolarHBondContact O-N 3.03Å; A208-M216 HydrophobicContact CB-CE 3.63Å; A208-M216 HydrophobicContact CB-SD 3.68Å
209	A	49.8	Very low	54.5	Low	96 Å²	96	75.8 Å²	75.8	79%	0.793	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	-28.8	-171.6	0	0	0	0	0	117.2	F207	F207-A209 VanDerWaalsContact C-N 3.34Å; F207-A209 PolarHBondContact O-N 3.18Å
210	P	51.4	Low	55.3	Low	107 Å²	107	76.9 Å²	76.9	70%	0.695	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-1.1	177.3	-4.4	26.1	0	0	0	115.4	F207 A208	F207-P210 WeakPolarHBondContact O-CD 3.25Å; A208-P210 VanDerWaalsContact C-N 3.3Å
211	F	51.3	Low	56.2	Low	79 Å²	79	82.7 Å²	82.7	35%	0.346	43%	0.429	S	S	.	.			trans	-107.1	129	-164.1	-66.4	-60.3	0	0	0	115	F207 A208 I240	F207-F211 WeakPolarHBondContact O-CD2 3.49Å; F207-F211 WeakPolarHBondContact O-CE2 3.35Å; A208-F211 PolarHBondContact O-N 3.03Å; F211-I240 HydrophobicContact CZ-CG2 4.13Å
212	R	51	Low	57.2	Low	210 Å²	210	78.6 Å²	78.6	79%	0.792	41%	0.408	S	S	*	.			trans	-52.2	142.9	174.6	-63.4	179.9	177.9	179.6	-1.7	112.1	S214 S215	R212-S214 PolarHBondContact O-N 2.55Å; R212-S215 WeakPolarHBondContact O-CB 3.35Å; R212-S215 PolarHBondContact O-N 2.79Å
213	C	47.9	Very low	57.9	Low	96 Å²	96	75 Å²	75	65%	0.649	39%	0.388	S	S	*	.	H	α-helix	trans	-45.5	-38.4	-174.7	-170	0	0	0	0	115.6	S215 M216 E217	C213-S215 VanDerWaalsContact C-N 3.28Å; C213-S215 PolarHBondContact O-N 2.84Å; C213-M216 WeakPolarHBondContact O-CB 3.37Å; C213-M216 PolarHBondContact O-N 3.23Å; C213-E217 PolarHBondContact O-N 2.77Å; C213-E217 VanDerWaalsContact O-N 3.12Å
214	S	55.2	Low	58.3	Low	74 Å²	74	78.1 Å²	78.1	52%	0.517	40%	0.402	S	S	.	.	H	α-helix	trans	-66	-23.7	179	54.9	0	0	0	0	114.7	R212	R212-S214 PolarHBondContact O-N 2.55Å
215	S	59.5	Low	59.1	Low	50 Å²	50	81.9 Å²	81.9	35%	0.35	42%	0.418	S	S	.	.	H	α-helix	trans	-77.2	-33.7	170.2	-64.6	0	0	0	0	111.7	R212 C213 R218 L219	R212-S215 WeakPolarHBondContact O-CB 3.35Å; R212-S215 PolarHBondContact O-N 2.79Å; C213-S215 VanDerWaalsContact C-N 3.28Å; C213-S215 PolarHBondContact O-N 2.84Å; S215-R218 PolarHBondContact O-N 3Å; S215-L219 WeakPolarHBondContact O-CB 3.29Å; S215-L219 PolarHBondContact O-N 2.87Å
216	M	59.6	Low	60.3	Low	65 Å²	65	74.4 Å²	74.4	32%	0.32	39%	0.386	S	S	.	.	H	α-helix	trans	-67.7	-38.6	179.1	-161.8	63.7	172	0	0	111.4	A208 C213 R218 L219 M220	A208-M216 HydrophobicContact CB-CE 3.63Å; A208-M216 HydrophobicContact CB-SD 3.68Å; C213-M216 WeakPolarHBondContact O-CB 3.37Å; C213-M216 PolarHBondContact O-N 3.23Å; M216-R218 PolarHBondContact O-N 3.12Å; M216-L219 PolarHBondContact O-N 2.99Å; M216-L219 HydrophobicContact SD-CD2 3.96Å; M216-M220 WeakPolarHBondContact O-CB 3.37Å; M216-M220 WeakPolarHBondContact O-CG 3.45Å; M216-M220 PolarHBondContact O-N 3.47Å
217	E	61.8	Low	60.8	Low	81 Å²	81	75.2 Å²	75.2	38%	0.379	39%	0.39	S	S	.	.	H	α-helix	trans	-58.8	-46	173.2	-138	-161.2	148.9	0	0	111.8	F158 V161 C213 M220 Y221	F158-E217 WeakPolarHBondContact CE1-OE1 3.32Å; V161-E217 HydrophobicContact CG1-CG 4.07Å; V161-E217 HydrophobicContact CG2-CG 3.74Å; C213-E217 PolarHBondContact O-N 2.77Å; C213-E217 VanDerWaalsContact O-N 3.12Å; E217-M220 PolarHBondContact O-N 2.62Å; E217-Y221 VanDerWaalsContact O-CB 3.3Å; E217-Y221 WeakPolarHBondContact O-CB 3.43Å; E217-Y221 PolarHBondContact O-N 2.85Å
218	R	68.6	Low	61.4	Low	156 Å²	156	78.7 Å²	78.7	59%	0.589	41%	0.409	S	S	*	.	H	α-helix	trans	-66.6	-39.6	176.9	-66.8	179.5	-175.5	-172.2	1.3	112.4	S215 M216 Y221 A222 I238	S215-R218 PolarHBondContact O-N 3Å; M216-R218 PolarHBondContact O-N 3.12Å; R218-Y221 PolarHBondContact O-N 3Å; R218-A222 VanDerWaalsContact O-CB 3.28Å; R218-A222 WeakPolarHBondContact O-CB 3.34Å; R218-A222 PolarHBondContact O-N 2.81Å; R218-I238 HydrophobicContact CB-CG2 4.03Å
219	L	67.9	Low	62.5	Low	11 Å²	11	78 Å²	78	6%	0.058	40%	0.402	C	S	.	.	H	α-helix	trans	-61.9	-48	175.6	175.4	61.3	0	0	0	111.6	W203 A204 S215 M216 Y221 A222 I223 I234 I238	W203-L219 HydrophobicContact CH2-CD1 4.32Å; W203-L219 HydrophobicContact CZ3-CD1 3.78Å; A204-L219 HydrophobicContact CB-CD2 4.35Å; S215-L219 WeakPolarHBondContact O-CB 3.29Å; S215-L219 PolarHBondContact O-N 2.87Å; M216-L219 PolarHBondContact O-N 2.99Å; M216-L219 HydrophobicContact SD-CD2 3.96Å; L219-Y221 VanDerWaalsContact C-N 3.34Å; L219-Y221 PolarHBondContact O-N 3.45Å; L219-A222 PolarHBondContact O-N 3.21Å; L219-I223 HydrophobicContact CD1-CD1 3.66Å; L219-I223 HydrophobicContact CD1-CG1 4.2Å; L219-I223 HydrophobicContact CG-CD1 3.93Å; L219-I223 WeakPolarHBondContact O-CB 3.28Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.46Å; L219-I223 PolarHBondContact O-N 2.95Å; L219-I234 HydrophobicContact CD1-CG2 4.17Å; L219-I238 HydrophobicContact CB-CD1 4.01Å; L219-I238 HydrophobicContact CD1-CD1 3.45Å; L219-I238 VanDerWaalsContact CD1-CD1 3.45Å; L219-I238 HydrophobicContact CG-CD1 4.34Å
220	M	65.7	Low	63.5	Low	72 Å²	72	75.9 Å²	75.9	36%	0.355	38%	0.377	S	S	.	.	H	α-helix	trans	-65	-37	176	-70	-62.9	-70.5	0	0	112	L157 M216 E217 K224	L157-M220 HydrophobicContact CD2-CE 3.99Å; M216-M220 WeakPolarHBondContact O-CB 3.37Å; M216-M220 WeakPolarHBondContact O-CG 3.45Å; M216-M220 PolarHBondContact O-N 3.47Å; E217-M220 PolarHBondContact O-N 2.62Å; M220-K224 WeakPolarHBondContact O-CB 3.5Å; M220-K224 PolarHBondContact O-N 2.95Å; M220-K224 VanDerWaalsContact O-N 3.07Å
221	Y	69.9	Low	64.6	Low	132 Å²	132	71.1 Å²	71.1	52%	0.518	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-46.7	174.4	-177	-96.2	0	0	0	112.3	F158 E217 R218 L219 K224 K225	F158-Y221 HydrophobicContact CZ-CD2 4.48Å; E217-Y221 VanDerWaalsContact O-CB 3.3Å; E217-Y221 WeakPolarHBondContact O-CB 3.43Å; E217-Y221 PolarHBondContact O-N 2.85Å; R218-Y221 PolarHBondContact O-N 3Å; L219-Y221 VanDerWaalsContact C-N 3.34Å; L219-Y221 PolarHBondContact O-N 3.45Å; Y221-K224 PolarHBondContact O-N 3.36Å; Y221-K225 HydrophobicContact CE1-CD 3.95Å; Y221-K225 VanDerWaalsContact O-CB 3.24Å; Y221-K225 WeakPolarHBondContact O-CB 3.49Å; Y221-K225 PolarHBondContact O-N 2.84Å
222	A	70.4	Confident	65.8	Low	1 Å²	1	67.5 Å²	67.5	1%	0.008	33%	0.331	C	S	.	.	H	α-helix	trans	-61	-50.3	177.9	0	0	0	0	0	112.2	R218 L219 K224 K225 H226 I234 E237 I238	R218-A222 VanDerWaalsContact O-CB 3.28Å; R218-A222 WeakPolarHBondContact O-CB 3.34Å; R218-A222 PolarHBondContact O-N 2.81Å; L219-A222 PolarHBondContact O-N 3.21Å; A222-K224 PolarHBondContact O-N 3.4Å; A222-K225 PolarHBondContact O-N 3.48Å; A222-H226 PolarHBondContact O-N 3.33Å; A222-I234 HydrophobicContact CB-CG2 4.17Å; A222-E237 WeakPolarHBondContact CA-OE2 3.43Å; A222-E237 HydrophobicContact CB-CG 4.29Å; A222-E237 WeakPolarHBondContact CB-OE2 3.4Å; A222-I238 HydrophobicContact CB-CD1 3.84Å; A222-I238 HydrophobicContact CB-CG1 3.58Å
223	I	66.7	Low	67.4	Low	32 Å²	32	57.7 Å²	57.7	16%	0.164	29%	0.294	C	S	.	.	H	α-helix	trans	-58.1	-38.3	175.3	-67.6	166.6	0	0	0	111.1	T200 A204 L219 P227 I234	T200-I223 HydrophobicContact CG2-CD1 4.14Å; T200-I223 HydrophobicContact CG2-CG1 4.09Å; T200-I223 HydrophobicContact CG2-CG2 4.46Å; A204-I223 HydrophobicContact CB-CD1 4.42Å; L219-I223 HydrophobicContact CD1-CD1 3.66Å; L219-I223 HydrophobicContact CD1-CG1 4.2Å; L219-I223 HydrophobicContact CG-CD1 3.93Å; L219-I223 WeakPolarHBondContact O-CB 3.28Å; L219-I223 VanDerWaalsContact O-CG1 3.3Å; L219-I223 WeakPolarHBondContact O-CG1 3.46Å; L219-I223 PolarHBondContact O-N 2.95Å; I223-P227 WeakPolarHBondContact O-CA 3.35Å; I223-I234 HydrophobicContact CG1-CD1 4.09Å; I223-I234 HydrophobicContact CG1-CG2 4.21Å
224	K	64.2	Low	69	Low	78 Å²	78	53.1 Å²	53.1	34%	0.339	26%	0.263	S	S	.	.	H	α-helix	trans	-75.1	-29.9	179.7	-168	175	-157.4	172.2	0	113.6	N154 M220 Y221 A222	N154-K224 PolarHBondContact O-NZ 3.11Å; N154-K224 VanDerWaalsContact O-NZ 3.15Å; N154-K224 WeakPolarHBondContact OD1-CE 3.44Å; N154-K224 PolarHBondContact OD1-NZ 3.06Å; M220-K224 WeakPolarHBondContact O-CB 3.5Å; M220-K224 PolarHBondContact O-N 2.95Å; M220-K224 VanDerWaalsContact O-N 3.07Å; Y221-K224 PolarHBondContact O-N 3.36Å; A222-K224 PolarHBondContact O-N 3.4Å
225	K	71.1	Confident	70.2	Confident	83 Å²	83	49.6 Å²	49.6	36%	0.361	24%	0.239	S	C	.	.	H	α-helix	trans	-78.7	-40.6	177.2	-175	-170.3	171.2	-152.8	0	111.4	Y221 A222 E237	Y221-K225 HydrophobicContact CE1-CD 3.95Å; Y221-K225 VanDerWaalsContact O-CB 3.24Å; Y221-K225 WeakPolarHBondContact O-CB 3.49Å; Y221-K225 PolarHBondContact O-N 2.84Å; A222-K225 PolarHBondContact O-N 3.48Å; K225-E237 IonicContact NZ-OE1 2.72Å; K225-E237 PolarHBondContact NZ-OE1 3.46Å
226	H	73.5	Confident	71.4	Confident	18 Å²	18	47.2 Å²	47.2	8%	0.083	22%	0.222	C	C	.	.			trans	-130.7	64.5	-174.3	-62.9	-65.3	0	0	0	113.2	A222 L228 W229 E237 E279 R281	A222-H226 PolarHBondContact O-N 3.33Å; H226-L228 PolarHBondContact O-N 2.97Å; H226-W229 HydrophobicContact CB-CB 4.14Å; H226-W229 HydrophobicContact CB-CD2 3.39Å; H226-W229 HydrophobicContact CB-CE3 3.68Å; H226-W229 HydrophobicContact CB-CG 3.58Å; H226-W229 HydrophobicContact CB-CH2 4.49Å; H226-W229 HydrophobicContact CB-CZ2 4.28Å; H226-W229 HydrophobicContact CB-CZ3 4.2Å; H226-W229 AromaticContact CD2-CE2 3.86Å; H226-W229 AromaticContact CD2-CE3 3.88Å; H226-W229 AromaticContact CD2-CH2 3.27Å; H226-W229 WeakPolarHBondContact CD2-CH2 3.47Å; H226-W229 AromaticContact CD2-CZ2 3.51Å; H226-W229 AromaticContact CD2-CZ3 3.46Å; H226-W229 VanDerWaalsContact CD2-CZ3 3.46Å; H226-W229 WeakPolarHBondContact CD2-CZ3 3.24Å; H226-W229 AromaticContact CE1-CZ2 3.62Å; H226-W229 AromaticContact CG-CD2 3.67Å; H226-W229 AromaticContact CG-CE2 3.48Å; H226-W229 VanDerWaalsContact CG-CE2 3.48Å; H226-W229 AromaticContact CG-CE3 3.89Å; H226-W229 AromaticContact CG-CH2 3.81Å; H226-W229 AromaticContact CG-CZ2 3.59Å; H226-W229 AromaticContact CG-CZ3 3.94Å; H226-W229 AromaticContact CG-NE1 3.92Å; H226-W229 AromaticContact ND1-CE2 3.64Å; H226-W229 AromaticContact ND1-CZ2 3.65Å; H226-W229 AromaticContact ND1-NE1 3.79Å; H226-W229 AromaticContact NE2-CH2 3.47Å; H226-W229 WeakPolarHBondContact NE2-CH2 3.36Å; H226-W229 AromaticContact NE2-CZ2 3.55Å; H226-W229 WeakPolarHBondContact O-CB 3.3Å; H226-W229 PolarHBondContact O-N 2.9Å; H226-W229 VanDerWaalsContact O-N 3.1Å; H226-E237 IonicContact CD2-OE1 2.68Å; H226-E237 IonicContact CD2-OE2 2.79Å; H226-E237 PolarHBondContact CD2-OE2 2.83Å; H226-E237 IonicContact NE2-OE1 3.86Å; H226-E279 IonicContact CE1-OE1 2.65Å; H226-E279 PolarHBondContact CE1-OE1 3.35Å; H226-E279 IonicContact ND1-OE1 2.68Å; H226-E279 PolarHBondContact ND1-OE1 3.4Å; H226-R281 PolarHBondContact CE1-NH2 2.89Å
227	P	65.8	Low	72.5	Confident	85 Å²	85	44.7 Å²	44.7	55%	0.552	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-7.6	-174.4	28	-37	0	0	0	115.5	I223	I223-P227 WeakPolarHBondContact O-CA 3.35Å
228	L	66.9	Low	73.4	Confident	106 Å²	106	41.4 Å²	41.4	56%	0.555	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-2.5	176.6	-64	178	0	0	0	113.6	H226	H226-L228 PolarHBondContact O-N 2.97Å
229	W	74.3	Confident	73.9	Confident	7 Å²	7	35.2 Å²	35.2	3%	0.027	18%	0.179	C	C	.	.	S	Bend	trans	-77.8	145.2	179.8	-81.3	13.9	0	0	0	112.1	H226 H233 I234 E237 C276 E279 I286	H226-W229 HydrophobicContact CB-CB 4.14Å; H226-W229 HydrophobicContact CB-CD2 3.39Å; H226-W229 HydrophobicContact CB-CE3 3.68Å; H226-W229 HydrophobicContact CB-CG 3.58Å; H226-W229 HydrophobicContact CB-CH2 4.49Å; H226-W229 HydrophobicContact CB-CZ2 4.28Å; H226-W229 HydrophobicContact CB-CZ3 4.2Å; H226-W229 AromaticContact CD2-CE2 3.86Å; H226-W229 AromaticContact CD2-CE3 3.88Å; H226-W229 AromaticContact CD2-CH2 3.27Å; H226-W229 WeakPolarHBondContact CD2-CH2 3.47Å; H226-W229 AromaticContact CD2-CZ2 3.51Å; H226-W229 AromaticContact CD2-CZ3 3.46Å; H226-W229 VanDerWaalsContact CD2-CZ3 3.46Å; H226-W229 WeakPolarHBondContact CD2-CZ3 3.24Å; H226-W229 AromaticContact CE1-CZ2 3.62Å; H226-W229 AromaticContact CG-CD2 3.67Å; H226-W229 AromaticContact CG-CE2 3.48Å; H226-W229 VanDerWaalsContact CG-CE2 3.48Å; H226-W229 AromaticContact CG-CE3 3.89Å; H226-W229 AromaticContact CG-CH2 3.81Å; H226-W229 AromaticContact CG-CZ2 3.59Å; H226-W229 AromaticContact CG-CZ3 3.94Å; H226-W229 AromaticContact CG-NE1 3.92Å; H226-W229 AromaticContact ND1-CE2 3.64Å; H226-W229 AromaticContact ND1-CZ2 3.65Å; H226-W229 AromaticContact ND1-NE1 3.79Å; H226-W229 AromaticContact NE2-CH2 3.47Å; H226-W229 WeakPolarHBondContact NE2-CH2 3.36Å; H226-W229 AromaticContact NE2-CZ2 3.55Å; H226-W229 WeakPolarHBondContact O-CB 3.3Å; H226-W229 PolarHBondContact O-N 2.9Å; H226-W229 VanDerWaalsContact O-N 3.1Å; W229-H233 HydrophobicContact CB-CB 3.98Å; W229-H233 HydrophobicContact CD2-CB 3.86Å; W229-H233 HydrophobicContact CE3-CB 3.84Å; W229-H233 HydrophobicContact CG-CB 3.98Å; W229-I234 HydrophobicContact CB-CD1 4.14Å; W229-I234 HydrophobicContact CB-CG1 3.7Å; W229-I234 HydrophobicContact CE3-CG1 4.12Å; W229-E237 HydrophobicContact CH2-CB 4.43Å; W229-E237 HydrophobicContact CZ3-CB 3.73Å; W229-E237 HydrophobicContact CZ3-CG 4.4Å; W229-C276 HydrophobicContact CG-CB 4.24Å; W229-C276 PolarHBondContact NE1-SG 3.38Å; W229-E279 VanDerWaalsContact CZ2-OE2 3.27Å; W229-E279 WeakPolarHBondContact CZ2-OE2 3.47Å; W229-E279 PolarHBondContact NE1-OE2 3.3Å; W229-I286 HydrophobicContact CD2-CD1 4.26Å; W229-I286 HydrophobicContact CE3-CD1 4.27Å; W229-I286 HydrophobicContact CH2-CB 4.32Å; W229-I286 HydrophobicContact CH2-CD1 3.64Å; W229-I286 HydrophobicContact CH2-CG1 3.82Å; W229-I286 HydrophobicContact CH2-CG2 3.52Å; W229-I286 HydrophobicContact CZ2-CD1 3.58Å; W229-I286 HydrophobicContact CZ2-CG1 3.99Å; W229-I286 HydrophobicContact CZ2-CG2 4.49Å; W229-I286 HydrophobicContact CZ3-CD1 4Å; W229-I286 HydrophobicContact CZ3-CG1 4.46Å; W229-I286 HydrophobicContact CZ3-CG2 3.62Å
230	N	71.4	Confident	74.4	Confident	50 Å²	50	35.9 Å²	35.9	27%	0.267	18%	0.182	S	C	.	.			trans	-70.2	148.8	171	-175.4	-71.7	0	0	0	109.6	V232 H233 I234	N230-V232 PolarHBondContact O-N 3.21Å; N230-V232 PolarHBondContact OD1-N 3.31Å; N230-V232 VanDerWaalsContact OD1-N 3.1Å; N230-H233 WeakPolarHBondContact CB-ND1 3.39Å; N230-H233 WeakPolarHBondContact O-CB 3.25Å; N230-H233 PolarHBondContact O-N 3.25Å; N230-I234 PolarHBondContact O-N 2.76Å; N230-I234 VanDerWaalsContact O-N 3.11Å
231	P	73.1	Confident	75	Confident	7 Å²	7	36.1 Å²	36.1	5%	0.045	18%	0.181	C	C	.	.	H	α-helix	trans	-44.8	-33.1	173.9	-35.1	38.4	0	0	0	116	W203 I234 A235 Y243	W203-P231 HydrophobicContact CD2-CB 3.95Å; W203-P231 HydrophobicContact CD2-CG 4.22Å; W203-P231 HydrophobicContact CE3-CB 4.12Å; W203-P231 HydrophobicContact CE3-CG 4.3Å; W203-P231 HydrophobicContact CG-CG 4.46Å; W203-P231 HydrophobicContact CH2-CB 4.23Å; W203-P231 HydrophobicContact CZ2-CB 4.08Å; W203-P231 HydrophobicContact CZ3-CB 4.25Å; P231-I234 PolarHBondContact O-N 3.38Å; P231-A235 VanDerWaalsContact O-CB 3.25Å; P231-A235 WeakPolarHBondContact O-CB 3.5Å; P231-A235 PolarHBondContact O-N 3.45Å; P231-Y243 HydrophobicContact CB-CE1 4.34Å
232	V	77.9	Confident	75.2	Confident	3 Å²	3	31.4 Å²	31.4	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-40.8	172.9	160.3	0	0	0	0	113.3	N230 A236 Y243 F244 L247 V271 L272 P283	N230-V232 PolarHBondContact O-N 3.21Å; N230-V232 PolarHBondContact OD1-N 3.31Å; N230-V232 VanDerWaalsContact OD1-N 3.1Å; V232-A236 WeakPolarHBondContact O-CB 3.34Å; V232-A236 PolarHBondContact O-N 3.47Å; V232-A236 VanDerWaalsContact O-N 3.1Å; V232-Y243 HydrophobicContact CB-CE1 4.48Å; V232-Y243 HydrophobicContact CG2-CE1 3.7Å; V232-F244 HydrophobicContact CG1-CE1 4.02Å; V232-F244 HydrophobicContact CG1-CZ 4.33Å; V232-F244 WeakPolarHBondContact O-CZ 3.5Å; V232-L247 HydrophobicContact CG2-CD1 3.75Å; V232-V271 HydrophobicContact CB-CG1 3.81Å; V232-V271 HydrophobicContact CG1-CG1 4.11Å; V232-V271 HydrophobicContact CG2-CG1 3.6Å; V232-L272 HydrophobicContact CG1-CD2 4.3Å; V232-P283 HydrophobicContact CG1-CB 3.91Å; V232-P283 HydrophobicContact CG1-CG 3.61Å
233	H	84.6	Confident	75.4	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.019	18%	0.176	C	C	.	.	H	α-helix	trans	-70	-38.4	175.6	-57.9	108.3	0	0	0	111.1	W229 N230 A236 E237 S274 C276 I286	W229-H233 HydrophobicContact CB-CB 3.98Å; W229-H233 HydrophobicContact CD2-CB 3.86Å; W229-H233 HydrophobicContact CE3-CB 3.84Å; W229-H233 HydrophobicContact CG-CB 3.98Å; N230-H233 WeakPolarHBondContact CB-ND1 3.39Å; N230-H233 WeakPolarHBondContact O-CB 3.25Å; N230-H233 PolarHBondContact O-N 3.25Å; H233-A236 WeakPolarHBondContact O-CB 3.48Å; H233-A236 PolarHBondContact O-N 3.27Å; H233-E237 PolarHBondContact O-N 2.97Å; H233-E237 VanDerWaalsContact O-N 3.14Å; H233-S274 PolarHBondContact CE1-OG 2.77Å; H233-S274 PolarHBondContact NE2-O 3.28Å; H233-C276 PolarHBondContact NE2-N 3.07Å; H233-I286 HydrophobicContact CB-CD1 3.78Å
234	I	80.5	Confident	75.9	Confident	1 Å²	1	31 Å²	31	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-66	-45.8	177.1	-66.7	178.7	0	0	0	111	T200 W203 L219 A222 I223 W229 N230 P231 A236 E237 I238	T200-I234 HydrophobicContact CG2-CD1 4.15Å; W203-I234 HydrophobicContact CZ3-CG2 4.16Å; L219-I234 HydrophobicContact CD1-CG2 4.17Å; A222-I234 HydrophobicContact CB-CG2 4.17Å; I223-I234 HydrophobicContact CG1-CD1 4.09Å; I223-I234 HydrophobicContact CG1-CG2 4.21Å; W229-I234 HydrophobicContact CB-CD1 4.14Å; W229-I234 HydrophobicContact CB-CG1 3.7Å; W229-I234 HydrophobicContact CE3-CG1 4.12Å; N230-I234 PolarHBondContact O-N 2.76Å; N230-I234 VanDerWaalsContact O-N 3.11Å; P231-I234 PolarHBondContact O-N 3.38Å; I234-A236 VanDerWaalsContact C-N 3.27Å; I234-A236 PolarHBondContact O-N 2.97Å; I234-E237 PolarHBondContact O-N 3.5Å; I234-I238 HydrophobicContact CG2-CD1 3.47Å; I234-I238 VanDerWaalsContact CG2-CD1 3.47Å; I234-I238 HydrophobicContact CG2-CG1 4.47Å; I234-I238 VanDerWaalsContact O-CD1 3.32Å; I234-I238 WeakPolarHBondContact O-CD1 3.45Å; I234-I238 VanDerWaalsContact O-CG1 3.29Å; I234-I238 WeakPolarHBondContact O-CG1 3.41Å; I234-I238 PolarHBondContact O-N 3.23Å; I234-I238 VanDerWaalsContact O-N 3.07Å
235	A	80.1	Confident	76.3	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-33.8	174.8	0	0	0	0	0	112.9	P231 G239 I240 Y243 F244	P231-A235 VanDerWaalsContact O-CB 3.25Å; P231-A235 WeakPolarHBondContact O-CB 3.5Å; P231-A235 PolarHBondContact O-N 3.45Å; A235-G239 PolarHBondContact O-N 3.17Å; A235-I240 HydrophobicContact CB-CB 4.25Å; A235-I240 PolarHBondContact O-N 2.83Å; A235-I240 VanDerWaalsContact O-N 3.17Å; A235-Y243 HydrophobicContact CB-CD1 3.41Å; A235-Y243 VanDerWaalsContact CB-CD1 3.41Å; A235-Y243 HydrophobicContact CB-CE1 4.13Å; A235-Y243 HydrophobicContact CB-CG 4.13Å; A235-F244 HydrophobicContact CB-CE2 3.71Å; A235-F244 HydrophobicContact CB-CZ 4.15Å
236	A	85.4	Confident	76.2	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67.8	-32.3	174.9	0	0	0	0	0	113.2	V232 H233 I234 F244 P283 I286 A287 Q292 M299	V232-A236 WeakPolarHBondContact O-CB 3.34Å; V232-A236 PolarHBondContact O-N 3.47Å; V232-A236 VanDerWaalsContact O-N 3.1Å; H233-A236 WeakPolarHBondContact O-CB 3.48Å; H233-A236 PolarHBondContact O-N 3.27Å; I234-A236 VanDerWaalsContact C-N 3.27Å; I234-A236 PolarHBondContact O-N 2.97Å; A236-F244 HydrophobicContact CB-CZ 4.13Å; A236-P283 HydrophobicContact CB-CB 4.24Å; A236-P283 WeakPolarHBondContact CB-O 3.46Å; A236-I286 HydrophobicContact CB-CB 4.41Å; A236-I286 HydrophobicContact CB-CG2 4.22Å; A236-A287 HydrophobicContact CB-CB 4.25Å; A236-A287 WeakPolarHBondContact O-CA 3.37Å; A236-Q292 WeakPolarHBondContact O-CG 3.18Å; A236-M299 HydrophobicContact CB-CE 4.04Å
237	E	82.1	Confident	75.8	Confident	12 Å²	12	32.5 Å²	32.5	6%	0.056	18%	0.179	C	C	.	.	H	α-helix	trans	-74.6	-44.8	172.8	162.2	167.7	-108.9	0	0	112.3	A222 K225 H226 W229 H233 I234 I286 N290 Q292	A222-E237 WeakPolarHBondContact CA-OE2 3.43Å; A222-E237 HydrophobicContact CB-CG 4.29Å; A222-E237 WeakPolarHBondContact CB-OE2 3.4Å; K225-E237 IonicContact NZ-OE1 2.72Å; K225-E237 PolarHBondContact NZ-OE1 3.46Å; H226-E237 IonicContact CD2-OE1 2.68Å; H226-E237 IonicContact CD2-OE2 2.79Å; H226-E237 PolarHBondContact CD2-OE2 2.83Å; H226-E237 IonicContact NE2-OE1 3.86Å; W229-E237 HydrophobicContact CH2-CB 4.43Å; W229-E237 HydrophobicContact CZ3-CB 3.73Å; W229-E237 HydrophobicContact CZ3-CG 4.4Å; H233-E237 PolarHBondContact O-N 2.97Å; H233-E237 VanDerWaalsContact O-N 3.14Å; I234-E237 PolarHBondContact O-N 3.5Å; E237-I286 HydrophobicContact CB-CG2 3.69Å; E237-N290 WeakPolarHBondContact O-CB 3.35Å; E237-Q292 PolarHBondContact O-NE2 3.43Å
238	I	80.8	Confident	75.8	Confident	12 Å²	12	33.2 Å²	33.2	6%	0.062	18%	0.178	C	C	.	.	H	α-helix	trans	-74.7	-32.9	-172.1	-60.7	156.2	0	0	0	112.6	R218 L219 A222 I234 I240 Q292	R218-I238 HydrophobicContact CB-CG2 4.03Å; L219-I238 HydrophobicContact CB-CD1 4.01Å; L219-I238 HydrophobicContact CD1-CD1 3.45Å; L219-I238 VanDerWaalsContact CD1-CD1 3.45Å; L219-I238 HydrophobicContact CG-CD1 4.34Å; A222-I238 HydrophobicContact CB-CD1 3.84Å; A222-I238 HydrophobicContact CB-CG1 3.58Å; I234-I238 HydrophobicContact CG2-CD1 3.47Å; I234-I238 VanDerWaalsContact CG2-CD1 3.47Å; I234-I238 HydrophobicContact CG2-CG1 4.47Å; I234-I238 VanDerWaalsContact O-CD1 3.32Å; I234-I238 WeakPolarHBondContact O-CD1 3.45Å; I234-I238 VanDerWaalsContact O-CG1 3.29Å; I234-I238 WeakPolarHBondContact O-CG1 3.41Å; I234-I238 PolarHBondContact O-N 3.23Å; I234-I238 VanDerWaalsContact O-N 3.07Å; I238-I240 HydrophobicContact CB-CD1 4.23Å; I238-I240 HydrophobicContact CB-CG1 3.93Å; I238-I240 HydrophobicContact CD1-CD1 3.9Å; I238-I240 HydrophobicContact CG2-CD1 4.03Å; I238-I240 HydrophobicContact CG2-CG1 3.67Å; I238-Q292 PolarHBondContact O-NE2 2.97Å
239	G	79.6	Confident	75.6	Confident	26 Å²	26	35.4 Å²	35.4	27%	0.268	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.8	23.6	-174.2	0	0	0	0	0	114.5	A235 K241 Q292 I295	A235-G239 PolarHBondContact O-N 3.17Å; G239-K241 VanDerWaalsContact C-N 3.29Å; G239-K241 PolarHBondContact O-N 2.94Å; G239-Q292 VanDerWaalsContact CA-OE1 3.26Å; G239-I295 VanDerWaalsContact C-CD1 3.42Å
240	I	78.3	Confident	74.6	Confident	24 Å²	24	36.6 Å²	36.6	12%	0.123	19%	0.192	C	C	.	.			trans	-79.5	73.8	-176.8	-46.2	176.6	0	0	0	110.9	W203 F211 A235 I238 G242 Y243 F244	W203-I240 HydrophobicContact CH2-CD1 4.33Å; F211-I240 HydrophobicContact CZ-CG2 4.13Å; A235-I240 HydrophobicContact CB-CB 4.25Å; A235-I240 PolarHBondContact O-N 2.83Å; A235-I240 VanDerWaalsContact O-N 3.17Å; I238-I240 HydrophobicContact CB-CD1 4.23Å; I238-I240 HydrophobicContact CB-CG1 3.93Å; I238-I240 HydrophobicContact CD1-CD1 3.9Å; I238-I240 HydrophobicContact CG2-CD1 4.03Å; I238-I240 HydrophobicContact CG2-CG1 3.67Å; I240-G242 PolarHBondContact O-N 3.1Å; I240-Y243 WeakPolarHBondContact O-CB 3.45Å; I240-Y243 PolarHBondContact O-N 3.13Å; I240-F244 WeakPolarHBondContact O-CD2 3.42Å
241	K	78.5	Confident	73.7	Confident	78 Å²	78	40.4 Å²	40.4	34%	0.339	21%	0.208	S	C	.	.	H	α-helix	trans	-52.6	-42.5	178	-166.8	-159.3	179.8	-141.7	0	111.9	G239 Y243 F244 E245 I295	G239-K241 VanDerWaalsContact C-N 3.29Å; G239-K241 PolarHBondContact O-N 2.94Å; K241-Y243 PolarHBondContact O-N 3.27Å; K241-F244 WeakPolarHBondContact O-CA 3.37Å; K241-F244 WeakPolarHBondContact O-CB 3.45Å; K241-F244 PolarHBondContact O-N 3.08Å; K241-E245 WeakPolarHBondContact CE-OE1 3.37Å; K241-E245 HydrophobicContact CG-CG 4.45Å; K241-E245 WeakPolarHBondContact CG-OE2 3.44Å; K241-E245 IonicContact NZ-OE1 3.67Å; K241-E245 PolarHBondContact NZ-OE1 3.19Å; K241-E245 IonicContact NZ-OE2 3.69Å; K241-E245 PolarHBondContact O-N 3.14Å; K241-I295 HydrophobicContact CB-CG1 4.25Å
242	G	75.1	Confident	72.6	Confident	33 Å²	33	45 Å²	45	34%	0.34	24%	0.237	S	C	.	.	H	α-helix	trans	-58.3	-20.3	177.5	0	0	0	0	0	115.3	I240 E245 K246	I240-G242 PolarHBondContact O-N 3.1Å; G242-E245 WeakPolarHBondContact CA-OE2 3.35Å; G242-E245 PolarHBondContact N-OE2 3.01Å; G242-K246 WeakPolarHBondContact O-CB 3.46Å; G242-K246 PolarHBondContact O-N 3.12Å
243	Y	74.4	Confident	71.1	Confident	20 Å²	20	47.3 Å²	47.3	8%	0.078	25%	0.247	C	C	.	.	H	α-helix	trans	-77.1	-38	172.1	180	-113	0	0	0	111.7	W203 F207 P231 V232 A235 I240 K241 E245 L247	W203-Y243 AromaticContact CE2-CE2 3.83Å; W203-Y243 HydrophobicContact CZ2-CD1 4.27Å; W203-Y243 AromaticContact CZ2-CD2 3.82Å; W203-Y243 HydrophobicContact CZ2-CD2 3.82Å; W203-Y243 HydrophobicContact CZ2-CE1 4.29Å; W203-Y243 AromaticContact CZ2-CE2 3.89Å; W203-Y243 HydrophobicContact CZ2-CE2 3.89Å; W203-Y243 HydrophobicContact CZ2-CG 4.03Å; W203-Y243 AromaticContact NE1-CD2 3.72Å; W203-Y243 AromaticContact NE1-CE2 3.25Å; W203-Y243 AromaticContact NE1-CZ 3.92Å; F207-Y243 HydrophobicContact CD1-CD2 4.42Å; F207-Y243 AromaticContact CE1-CD2 3.81Å; F207-Y243 HydrophobicContact CE1-CD2 3.81Å; F207-Y243 HydrophobicContact CE2-CD2 4.35Å; F207-Y243 HydrophobicContact CE2-CE2 4.39Å; F207-Y243 AromaticContact CZ-CD2 3.77Å; F207-Y243 HydrophobicContact CZ-CD2 3.77Å; F207-Y243 HydrophobicContact CZ-CE2 4.14Å; P231-Y243 HydrophobicContact CB-CE1 4.34Å; V232-Y243 HydrophobicContact CB-CE1 4.48Å; V232-Y243 HydrophobicContact CG2-CE1 3.7Å; A235-Y243 HydrophobicContact CB-CD1 3.41Å; A235-Y243 VanDerWaalsContact CB-CD1 3.41Å; A235-Y243 HydrophobicContact CB-CE1 4.13Å; A235-Y243 HydrophobicContact CB-CG 4.13Å; I240-Y243 WeakPolarHBondContact O-CB 3.45Å; I240-Y243 PolarHBondContact O-N 3.13Å; K241-Y243 PolarHBondContact O-N 3.27Å; Y243-E245 VanDerWaalsContact C-N 3.31Å; Y243-L247 HydrophobicContact CD1-CD1 3.91Å; Y243-L247 HydrophobicContact CE1-CD1 3.58Å; Y243-L247 HydrophobicContact CE1-CG 4.45Å; Y243-L247 HydrophobicContact CE2-CD1 4.44Å; Y243-L247 HydrophobicContact CE2-CG 4.49Å; Y243-L247 VanDerWaalsContact O-CB 3.32Å; Y243-L247 WeakPolarHBondContact O-CB 3.19Å; Y243-L247 WeakPolarHBondContact O-CG 3.44Å; Y243-L247 PolarHBondContact O-N 3.2Å
244	F	75.5	Confident	69.4	Low	4 Å²	4	49.7 Å²	49.7	2%	0.018	26%	0.262	C	S	.	.	H	α-helix	trans	-71.6	-26.5	172.7	-65.4	-84.5	0	0	0	112.6	V232 A235 A236 I240 K241 L272 I295 F298 M299 L303	V232-F244 HydrophobicContact CG1-CE1 4.02Å; V232-F244 HydrophobicContact CG1-CZ 4.33Å; V232-F244 WeakPolarHBondContact O-CZ 3.5Å; A235-F244 HydrophobicContact CB-CE2 3.71Å; A235-F244 HydrophobicContact CB-CZ 4.15Å; A236-F244 HydrophobicContact CB-CZ 4.13Å; I240-F244 WeakPolarHBondContact O-CD2 3.42Å; K241-F244 WeakPolarHBondContact O-CA 3.37Å; K241-F244 WeakPolarHBondContact O-CB 3.45Å; K241-F244 PolarHBondContact O-N 3.08Å; F244-L272 HydrophobicContact CD1-CD2 4.28Å; F244-L272 HydrophobicContact CE1-CD2 4.01Å; F244-I295 HydrophobicContact CD2-CD1 3.92Å; F244-I295 HydrophobicContact CD2-CG2 4.45Å; F244-I295 HydrophobicContact CE2-CD1 3.79Å; F244-I295 HydrophobicContact CE2-CG2 4.23Å; F244-F298 HydrophobicContact CB-CD1 4.03Å; F244-F298 HydrophobicContact CB-CE1 3.78Å; F244-M299 HydrophobicContact CD1-CE 4.21Å; F244-M299 HydrophobicContact CE1-CE 3.42Å; F244-M299 VanDerWaalsContact CE1-CE 3.42Å; F244-M299 HydrophobicContact CE2-CE 4.24Å; F244-M299 HydrophobicContact CZ-CE 3.44Å; F244-M299 VanDerWaalsContact CZ-CE 3.44Å; F244-L303 HydrophobicContact CB-CD1 4.48Å; F244-L303 HydrophobicContact CD1-CD1 3.98Å
245	E	74.5	Confident	67.8	Low	56 Å²	56	56.1 Å²	56.1	26%	0.262	29%	0.29	S	S	.	.	H	α-helix	trans	-75.6	-47.3	171.7	-67.2	166.4	133	0	0	110.9	K241 G242 Y243 L247 L248 E249 F298	K241-E245 WeakPolarHBondContact CE-OE1 3.37Å; K241-E245 HydrophobicContact CG-CG 4.45Å; K241-E245 WeakPolarHBondContact CG-OE2 3.44Å; K241-E245 IonicContact NZ-OE1 3.67Å; K241-E245 PolarHBondContact NZ-OE1 3.19Å; K241-E245 IonicContact NZ-OE2 3.69Å; K241-E245 PolarHBondContact O-N 3.14Å; G242-E245 WeakPolarHBondContact CA-OE2 3.35Å; G242-E245 PolarHBondContact N-OE2 3.01Å; Y243-E245 VanDerWaalsContact C-N 3.31Å; E245-L247 VanDerWaalsContact C-N 3.3Å; E245-L247 PolarHBondContact O-N 3.07Å; E245-L248 WeakPolarHBondContact O-CA 3.42Å; E245-L248 VanDerWaalsContact O-CB 3.24Å; E245-L248 WeakPolarHBondContact O-CB 3.16Å; E245-L248 PolarHBondContact O-N 3.46Å; E245-E249 WeakPolarHBondContact O-CG 3.5Å; E245-E249 PolarHBondContact O-N 3.16Å; E245-F298 HydrophobicContact CG-CE2 3.76Å; E245-F298 HydrophobicContact CG-CZ 3.67Å
246	K	67.9	Low	66.1	Low	89 Å²	89	64.7 Å²	64.7	39%	0.387	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-33	173.2	-107.4	177.9	169.8	-88.9	0	113.9	F207 G242 L248 E249 D250	F207-K246 HydrophobicContact CE1-CD 3.85Å; F207-K246 HydrophobicContact CZ-CD 3.99Å; G242-K246 WeakPolarHBondContact O-CB 3.46Å; G242-K246 PolarHBondContact O-N 3.12Å; K246-L248 PolarHBondContact O-N 3.15Å; K246-L248 VanDerWaalsContact O-N 3.15Å; K246-E249 PolarHBondContact O-N 2.03Å; K246-E249 VanDerWaalsContact O-N 3.1Å; K246-D250 IonicContact NZ-OD2 3.94Å; K246-D250 PolarHBondContact NZ-OD2 3.3Å; K246-D250 WeakPolarHBondContact O-CB 3.42Å; K246-D250 PolarHBondContact O-N 3.34Å
247	L	65.3	Low	64.3	Low	65 Å²	65	71 Å²	71	34%	0.34	35%	0.347	S	S	.	.	H	α-helix	trans	-62.8	-11.5	170.6	-86.6	168.1	0	0	0	114	V232 Y243 E245 L268	V232-L247 HydrophobicContact CG2-CD1 3.75Å; Y243-L247 HydrophobicContact CD1-CD1 3.91Å; Y243-L247 HydrophobicContact CE1-CD1 3.58Å; Y243-L247 HydrophobicContact CE1-CG 4.45Å; Y243-L247 HydrophobicContact CE2-CD1 4.44Å; Y243-L247 HydrophobicContact CE2-CG 4.49Å; Y243-L247 VanDerWaalsContact O-CB 3.32Å; Y243-L247 WeakPolarHBondContact O-CB 3.19Å; Y243-L247 WeakPolarHBondContact O-CG 3.44Å; Y243-L247 PolarHBondContact O-N 3.2Å; E245-L247 VanDerWaalsContact C-N 3.3Å; E245-L247 PolarHBondContact O-N 3.07Å; L247-L268 HydrophobicContact CB-CD1 3.93Å; L247-L268 HydrophobicContact CD2-CD1 4.17Å; L247-L268 HydrophobicContact CG-CD1 4.46Å
248	L	66.6	Low	62.3	Low	101 Å²	101	73.7 Å²	73.7	53%	0.529	36%	0.362	S	S	.	.	H	α-helix	trans	-104.2	-15.3	174.6	-107.4	159.5	0	0	0	113.2	E245 K246 F298 L303	E245-L248 WeakPolarHBondContact O-CA 3.42Å; E245-L248 VanDerWaalsContact O-CB 3.24Å; E245-L248 WeakPolarHBondContact O-CB 3.16Å; E245-L248 PolarHBondContact O-N 3.46Å; K246-L248 PolarHBondContact O-N 3.15Å; K246-L248 VanDerWaalsContact O-N 3.15Å; L248-F298 HydrophobicContact CD1-CE1 4.13Å; L248-F298 HydrophobicContact CD1-CZ 3.83Å; L248-L303 HydrophobicContact CD1-CD2 3.78Å; L248-L303 HydrophobicContact CG-CD2 4.48Å
249	E	62	Low	60.3	Low	151 Å²	151	78.7 Å²	78.7	71%	0.706	40%	0.397	S	S	*	.	H	α-helix	trans	-117.1	-28	-169	-68.2	176.8	169.7	0	0	114.9	E245 K246 E251	E245-E249 WeakPolarHBondContact O-CG 3.5Å; E245-E249 PolarHBondContact O-N 3.16Å; K246-E249 PolarHBondContact O-N 2.03Å; K246-E249 VanDerWaalsContact O-N 3.1Å; E249-E251 PolarHBondContact O-N 3.15Å
250	D	53.7	Low	58.6	Low	33 Å²	33	83.3 Å²	83.3	18%	0.176	41%	0.414	C	S	.	.			trans	-98.7	89.9	-162.9	-155.4	-41.9	0	0	0	114.7	K246 T252 E253 T254	K246-D250 IonicContact NZ-OD2 3.94Å; K246-D250 PolarHBondContact NZ-OD2 3.3Å; K246-D250 WeakPolarHBondContact O-CB 3.42Å; K246-D250 PolarHBondContact O-N 3.34Å; D250-T252 PolarHBondContact O-N 2.92Å; D250-T252 WeakPolarHBondContact OD1-CA 3.07Å; D250-T252 WeakPolarHBondContact OD1-CB 3.25Å; D250-T252 PolarHBondContact OD1-N 2.9Å; D250-T252 PolarHBondContact OD1-OG1 3.36Å; D250-E253 HydrophobicContact CB-CB 4.29Å; D250-E253 PolarHBondContact OD1-N 3.22Å; D250-T254 PolarHBondContact O-N 2.81Å; D250-T254 PolarHBondContact O-OG1 3.05Å
251	E	51.8	Low	56.5	Low	129 Å²	129	89.3 Å²	89.3	60%	0.603	44%	0.439	S	S	*	.	H	α-helix	trans	-62.3	-15	170.6	-81.8	-148.4	129.9	0	0	114.3	E249 T254	E249-E251 PolarHBondContact O-N 3.15Å; E251-T254 VanDerWaalsContact CA-OG1 3.29Å; E251-T254 WeakPolarHBondContact CA-OG1 3.47Å; E251-T254 PolarHBondContact O-OG1 2.64Å
252	T	48.9	Very low	54.4	Low	104 Å²	104	90.9 Å²	90.9	64%	0.638	46%	0.46	S	S	*	.	H	α-helix	trans	-93.3	-41	-175.1	28.4	0	0	0	0	113	D250 T254 K255	D250-T252 PolarHBondContact O-N 2.92Å; D250-T252 WeakPolarHBondContact OD1-CA 3.07Å; D250-T252 WeakPolarHBondContact OD1-CB 3.25Å; D250-T252 PolarHBondContact OD1-N 2.9Å; D250-T252 PolarHBondContact OD1-OG1 3.36Å; T252-T254 VanDerWaalsContact C-N 3.31Å; T252-T254 PolarHBondContact O-N 3.02Å; T252-K255 WeakPolarHBondContact O-CB 3.39Å; T252-K255 PolarHBondContact O-N 2.91Å
253	E	48.3	Very low	52.7	Low	52 Å²	52	93.6 Å²	93.6	24%	0.243	47%	0.47	C	S	.	.	H	α-helix	trans	-64.8	-34.3	170.4	-89.4	-81.6	103.2	0	0	111.8	D250 K255 R256	D250-E253 HydrophobicContact CB-CB 4.29Å; D250-E253 PolarHBondContact OD1-N 3.22Å; E253-K255 PolarHBondContact O-N 3Å; E253-R256 WeakPolarHBondContact O-CB 3.28Å; E253-R256 PolarHBondContact O-N 3.22Å; E253-R256 IonicContact OE1-NH1 2.64Å
254	T	47.7	Very low	51.2	Low	54 Å²	54	99 Å²	99	33%	0.331	50%	0.496	S	S	.	.	H	α-helix	trans	-58.6	-34.1	173.8	23.5	0	0	0	0	112.4	D250 E251 T252 R256 Y257 N258	D250-T254 PolarHBondContact O-N 2.81Å; D250-T254 PolarHBondContact O-OG1 3.05Å; E251-T254 VanDerWaalsContact CA-OG1 3.29Å; E251-T254 WeakPolarHBondContact CA-OG1 3.47Å; E251-T254 PolarHBondContact O-OG1 2.64Å; T252-T254 VanDerWaalsContact C-N 3.31Å; T252-T254 PolarHBondContact O-N 3.02Å; T254-R256 VanDerWaalsContact C-N 3.25Å; T254-R256 PolarHBondContact O-N 3.31Å; T254-Y257 PolarHBondContact O-N 3.1Å; T254-N258 PolarHBondContact O-N 3.06Å; T254-N258 PolarHBondContact O-OD1 3.35Å
255	K	46.4	Very low	49.8	Very low	136 Å²	136	106.3 Å²	106.3	59%	0.591	54%	0.535	S	S	*	.	H	α-helix	trans	-65.6	-22.4	175.5	-72.1	172.4	-177.6	165.4	0	113.9	T252 E253	T252-K255 WeakPolarHBondContact O-CB 3.39Å; T252-K255 PolarHBondContact O-N 2.91Å; E253-K255 PolarHBondContact O-N 3Å
256	R	44.4	Very low	48.7	Very low	180 Å²	180	108 Å²	108	68%	0.679	55%	0.546	S	S	*	.	H	α-helix	trans	-76.2	-34.8	172.7	-105.8	178.3	174.6	166.8	-1.8	113.1	E253 T254	E253-R256 WeakPolarHBondContact O-CB 3.28Å; E253-R256 PolarHBondContact O-N 3.22Å; E253-R256 IonicContact OE1-NH1 2.64Å; T254-R256 VanDerWaalsContact C-N 3.25Å; T254-R256 PolarHBondContact O-N 3.31Å
257	Y	47.5	Very low	48	Very low	131 Å²	131	106.7 Å²	106.7	51%	0.514	54%	0.543	S	S	.	.	H	α-helix	trans	-82.2	-16.6	176.1	-75.7	-83.1	0	0	0	113.7	T254 C259 I260	T254-Y257 PolarHBondContact O-N 3.1Å; Y257-C259 PolarHBondContact O-N 3.26Å; Y257-I260 PolarHBondContact O-N 2.95Å
258	N	41.7	Very low	47.8	Very low	69 Å²	69	106.1 Å²	106.1	37%	0.369	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-13	178.5	-80.3	-13	0	0	0	115.3	T254 I260	T254-N258 PolarHBondContact O-N 3.06Å; T254-N258 PolarHBondContact O-OD1 3.35Å; N258-I260 PolarHBondContact O-N 3.37Å
259	C	38.5	Very low	47.6	Very low	118 Å²	118	104.6 Å²	104.6	80%	0.797	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-1.5	175.7	-68.7	0	0	0	0	114.7	Y257	Y257-C259 PolarHBondContact O-N 3.26Å
260	I	44.2	Very low	47.7	Very low	123 Å²	123	105.9 Å²	105.9	63%	0.631	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	-33.2	-178.1	-44.5	-176.3	0	0	0	113.3	Y257 N258	Y257-I260 PolarHBondContact O-N 2.95Å; N258-I260 PolarHBondContact O-N 3.37Å
261	F	33.6	Very low	48.5	Very low	150 Å²	150	106.1 Å²	106.1	66%	0.658	54%	0.539	S	S	*	.			trans	-144	135.6	-176.8	-63.3	-70.1	0	0	0	114.2
262	S	33.4	Very low	49.5	Very low	111 Å²	111	100.3 Å²	100.3	78%	0.776	51%	0.511	S	S	*	.			trans	-103.7	106	178.9	46	0	0	0	0	112.7
263	T	40.2	Very low	50.7	Low	90 Å²	90	98.8 Å²	98.8	55%	0.552	50%	0.497	S	S	*	.			trans	165.5	113.7	148.2	27.8	0	0	0	0	109.8	N265 L266	T263-N265 PolarHBondContact O-N 3.39Å; T263-L266 PolarHBondContact O-N 3.17Å
264	Q	42.1	Very low	51.9	Low	133 Å²	133	98 Å²	98	62%	0.621	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-44.9	-168.1	-74.1	165.3	-78.1	0	0	114.5
265	N	48	Very low	52.9	Low	157 Å²	157	99.3 Å²	99.3	84%	0.84	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-12.5	-172	-79.1	-29.9	0	0	0	116	T263	T263-N265 PolarHBondContact O-N 3.39Å
266	L	50.5	Low	54.1	Low	91 Å²	91	92.9 Å²	92.9	48%	0.476	47%	0.473	S	S	.	.	H	α-helix	trans	-81.8	-16.7	-179.1	-122.6	78.1	0	0	0	113.4	T263 R270	T263-L266 PolarHBondContact O-N 3.17Å; L266-R270 WeakPolarHBondContact O-CB 3.41Å; L266-R270 WeakPolarHBondContact O-CG 3.32Å; L266-R270 PolarHBondContact O-N 3.03Å
267	I	53.6	Low	54.8	Low	63 Å²	63	89.6 Å²	89.6	32%	0.323	47%	0.465	S	S	.	.	H	α-helix	trans	-73.9	-52.5	-167.8	-62.2	167.1	0	0	0	111.2	S269 R270 V271	I267-S269 PolarHBondContact O-N 3.41Å; I267-R270 PolarHBondContact O-N 3.33Å; I267-R270 VanDerWaalsContact O-N 3.12Å; I267-V271 HydrophobicContact CG2-CG2 4.31Å; I267-V271 WeakPolarHBondContact O-CG2 3.37Å; I267-V271 PolarHBondContact O-N 3.32Å
268	L	59.9	Low	55.6	Low	52 Å²	52	87.3 Å²	87.3	27%	0.272	47%	0.466	S	S	.	.	H	α-helix	trans	-60.3	-44.5	-172.9	-164.6	71.8	0	0	0	112.2	L247 R270 V271 L272 L303	L247-L268 HydrophobicContact CB-CD1 3.93Å; L247-L268 HydrophobicContact CD2-CD1 4.17Å; L247-L268 HydrophobicContact CG-CD1 4.46Å; L268-R270 PolarHBondContact O-N 2.65Å; L268-V271 PolarHBondContact O-N 3.04Å; L268-L272 HydrophobicContact CG-CD1 3.98Å; L268-L272 WeakPolarHBondContact O-CB 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.06Å; L268-L272 PolarHBondContact O-N 3.38Å; L268-L303 HydrophobicContact CD2-CD2 4.21Å
269	S	63.8	Low	56.7	Low	70 Å²	70	87 Å²	87	49%	0.49	46%	0.462	S	S	.	.	H	α-helix	trans	-61	-43.9	175.8	-179.6	0	0	0	0	112.3	I267 V271 H273	I267-S269 PolarHBondContact O-N 3.41Å; S269-V271 PolarHBondContact O-N 2.87Å; S269-H273 WeakPolarHBondContact O-CB 3.47Å; S269-H273 PolarHBondContact O-N 2.96Å; S269-H273 PolarHBondContact O-ND1 3.36Å
270	R	64.4	Low	58.5	Low	177 Å²	177	81.3 Å²	81.3	67%	0.668	42%	0.424	S	S	*	.	H	α-helix	trans	-64.9	-37.4	178.5	-82.4	179.7	166	178.8	-2.4	113.2	L266 I267 L268 S274	L266-R270 WeakPolarHBondContact O-CB 3.41Å; L266-R270 WeakPolarHBondContact O-CG 3.32Å; L266-R270 PolarHBondContact O-N 3.03Å; I267-R270 PolarHBondContact O-N 3.33Å; I267-R270 VanDerWaalsContact O-N 3.12Å; L268-R270 PolarHBondContact O-N 2.65Å; R270-S274 WeakPolarHBondContact O-CB 3.27Å; R270-S274 PolarHBondContact O-N 3.22Å
271	V	69.3	Low	60.5	Low	39 Å²	39	76.8 Å²	76.8	24%	0.236	40%	0.399	C	S	.	.	H	α-helix	trans	-75.9	-42.4	179.8	-176.9	0	0	0	0	111.2	V232 I267 L268 S269 H273 S274	V232-V271 HydrophobicContact CB-CG1 3.81Å; V232-V271 HydrophobicContact CG1-CG1 4.11Å; V232-V271 HydrophobicContact CG2-CG1 3.6Å; I267-V271 HydrophobicContact CG2-CG2 4.31Å; I267-V271 WeakPolarHBondContact O-CG2 3.37Å; I267-V271 PolarHBondContact O-N 3.32Å; L268-V271 PolarHBondContact O-N 3.04Å; S269-V271 PolarHBondContact O-N 2.87Å; V271-H273 VanDerWaalsContact C-N 3.3Å; V271-H273 PolarHBondContact O-N 3.39Å; V271-S274 WeakPolarHBondContact O-CB 3.36Å; V271-S274 PolarHBondContact O-N 3.39Å; V271-S274 PolarHBondContact O-OG 2.75Å
272	L	72.2	Confident	63.1	Low	6 Å²	6	70.7 Å²	70.7	3%	0.031	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-29.9	178.1	-69.2	169.9	0	0	0	113.3	V232 F244 L268 P283 L303 V305	V232-L272 HydrophobicContact CG1-CD2 4.3Å; F244-L272 HydrophobicContact CD1-CD2 4.28Å; F244-L272 HydrophobicContact CE1-CD2 4.01Å; L268-L272 HydrophobicContact CG-CD1 3.98Å; L268-L272 WeakPolarHBondContact O-CB 3.32Å; L268-L272 WeakPolarHBondContact O-CG 3.06Å; L268-L272 PolarHBondContact O-N 3.38Å; L272-P283 VanDerWaalsContact O-CD 3.31Å; L272-P283 WeakPolarHBondContact O-CD 3.27Å; L272-L303 HydrophobicContact CD1-CB 3.96Å; L272-L303 HydrophobicContact CD1-CD1 3.91Å; L272-L303 HydrophobicContact CD1-CD2 4.12Å; L272-L303 HydrophobicContact CD1-CG 4.22Å; L272-L303 HydrophobicContact CD2-CD1 4.06Å; L272-V305 HydrophobicContact CB-CG2 4.33Å; L272-V305 HydrophobicContact CD1-CG2 4.41Å
273	H	74.2	Confident	65.6	Low	73 Å²	73	65.5 Å²	65.5	34%	0.338	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	19.8	172.4	-57.9	91.8	0	0	0	112.9	S269 V271 Y282	S269-H273 WeakPolarHBondContact O-CB 3.47Å; S269-H273 PolarHBondContact O-N 2.96Å; S269-H273 PolarHBondContact O-ND1 3.36Å; V271-H273 VanDerWaalsContact C-N 3.3Å; V271-H273 PolarHBondContact O-N 3.39Å; H273-Y282 WeakPolarHBondContact O-CE1 3.46Å
274	S	73.7	Confident	67.9	Low	34 Å²	34	61.3 Å²	61.3	24%	0.238	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-86.8	135	170.4	73	0	0	0	0	111.5	H233 R270 V271 P283	H233-S274 PolarHBondContact CE1-OG 2.77Å; H233-S274 PolarHBondContact NE2-O 3.28Å; R270-S274 WeakPolarHBondContact O-CB 3.27Å; R270-S274 PolarHBondContact O-N 3.22Å; V271-S274 WeakPolarHBondContact O-CB 3.36Å; V271-S274 PolarHBondContact O-N 3.39Å; V271-S274 PolarHBondContact O-OG 2.75Å; S274-P283 WeakPolarHBondContact O-CD 3.27Å
275	M	69.2	Low	70.2	Confident	82 Å²	82	55 Å²	55	40%	0.404	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-77.4	137.4	168.6	-72.8	-178.2	-78.7	0	0	110.4	G280 Y282 K312	M275-G280 WeakPolarHBondContact CG-O 3.33Å; M275-Y282 HydrophobicContact CG-CD1 4.37Å; M275-Y282 HydrophobicContact CG-CD2 4.19Å; M275-Y282 HydrophobicContact CG-CE1 3.85Å; M275-Y282 HydrophobicContact CG-CE2 3.6Å; M275-Y282 VanDerWaalsContact CG-CZ 3.43Å; M275-Y282 HydrophobicContact SD-CE2 4.22Å; M275-K312 HydrophobicContact SD-CG 4.34Å
276	C	72.5	Confident	72.1	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.014	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-65.2	148.4	166.4	76.1	0	0	0	0	110.4	W229 H233 E279 G280 R281 I286	W229-C276 HydrophobicContact CG-CB 4.24Å; W229-C276 PolarHBondContact NE1-SG 3.38Å; H233-C276 PolarHBondContact NE2-N 3.07Å; C276-E279 PolarHBondContact SG-OE2 2.71Å; C276-E279 VanDerWaalsContact SG-OE2 3.4Å; C276-G280 WeakPolarHBondContact O-CA 3.44Å; C276-G280 PolarHBondContact O-N 3.39Å; C276-R281 PolarHBondContact N-O 2.92Å; C276-R281 PolarHBondContact SG-N 3.34Å; C276-R281 VanDerWaalsContact SG-N 3.36Å; C276-R281 PolarHBondContact SG-O 3.17Å; C276-I286 HydrophobicContact CB-CD1 4.44Å
277	Q	58.5	Low	73.9	Confident	110 Å²	110	43.1 Å²	43.1	51%	0.514	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	142.3	167.5	-62.1	-75	16.6	0	0	108.4
278	P	64.8	Low	75.6	Confident	83 Å²	83	40.1 Å²	40.1	54%	0.539	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.4	-16.7	3	33.6	-34.6	0	0	0	114.4	G280 K312	P278-G280 PolarHBondContact O-N 2.85Å; P278-K312 PolarHBondContact O-NZ 3.39Å
279	E	64.6	Low	76.9	Confident	62 Å²	62	39.8 Å²	39.8	29%	0.29	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-26.1	-158.4	-55.1	151.8	158.6	0	0	114.1	H226 W229 C276 R281	H226-E279 IonicContact CE1-OE1 2.65Å; H226-E279 PolarHBondContact CE1-OE1 3.35Å; H226-E279 IonicContact ND1-OE1 2.68Å; H226-E279 PolarHBondContact ND1-OE1 3.4Å; W229-E279 VanDerWaalsContact CZ2-OE2 3.27Å; W229-E279 WeakPolarHBondContact CZ2-OE2 3.47Å; W229-E279 PolarHBondContact NE1-OE2 3.3Å; C276-E279 PolarHBondContact SG-OE2 2.71Å; C276-E279 VanDerWaalsContact SG-OE2 3.4Å; E279-R281 HydrophobicContact CB-CG 4.05Å; E279-R281 IonicContact OE1-CZ 2.67Å; E279-R281 IonicContact OE1-NH2 2.86Å; E279-R281 PolarHBondContact OE1-NH2 3.49Å; E279-R281 IonicContact OE2-CZ 3.49Å; E279-R281 VanDerWaalsContact OE2-CZ 3.32Å; E279-R281 IonicContact OE2-NE 2.62Å; E279-R281 PolarHBondContact OE2-NE 3.36Å; E279-R281 IonicContact OE2-NH2 3.59Å; E279-R281 PolarHBondContact OE2-NH2 3.16Å
280	G	76.5	Confident	78	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.188	C	C	.	.			trans	87.4	12	-179.8	0	0	0	0	0	115.4	M275 C276 P278 D311	M275-G280 WeakPolarHBondContact CG-O 3.33Å; C276-G280 WeakPolarHBondContact O-CA 3.44Å; C276-G280 PolarHBondContact O-N 3.39Å; P278-G280 PolarHBondContact O-N 2.85Å; G280-D311 WeakPolarHBondContact O-CB 3.36Å
281	R	84.9	Confident	79	Confident	27 Å²	27	32.8 Å²	32.8	10%	0.102	17%	0.173	C	C	.	.			trans	-82.3	141.9	-177	-55.4	-171.2	-83.6	-167.6	-4	111.2	H226 C276 E279 H285 I286 E289 Y320	H226-R281 PolarHBondContact CE1-NH2 2.89Å; C276-R281 PolarHBondContact N-O 2.92Å; C276-R281 PolarHBondContact SG-N 3.34Å; C276-R281 VanDerWaalsContact SG-N 3.36Å; C276-R281 PolarHBondContact SG-O 3.17Å; E279-R281 HydrophobicContact CB-CG 4.05Å; E279-R281 IonicContact OE1-CZ 2.67Å; E279-R281 IonicContact OE1-NH2 2.86Å; E279-R281 PolarHBondContact OE1-NH2 3.49Å; E279-R281 IonicContact OE2-CZ 3.49Å; E279-R281 VanDerWaalsContact OE2-CZ 3.32Å; E279-R281 IonicContact OE2-NE 2.62Å; E279-R281 PolarHBondContact OE2-NE 3.36Å; E279-R281 IonicContact OE2-NH2 3.59Å; E279-R281 PolarHBondContact OE2-NH2 3.16Å; R281-H285 HydrophobicContact CB-CB 4.42Å; R281-I286 HydrophobicContact CB-CD1 4.2Å; R281-I286 HydrophobicContact CB-CG1 3.96Å; R281-E289 IonicContact CZ-OE1 3.5Å; R281-E289 IonicContact CZ-OE2 3.64Å; R281-E289 IonicContact NH1-OE1 3.21Å; R281-E289 PolarHBondContact NH1-OE1 3.32Å; R281-E289 IonicContact NH1-OE2 2.8Å; R281-E289 PolarHBondContact NH1-OE2 3.35Å; R281-Y320 WeakPolarHBondContact CD-OH 3.28Å; R281-Y320 HydrophobicContact CG-CE1 4.47Å; R281-Y320 WeakPolarHBondContact CG-OH 3.42Å
282	Y	88.3	Confident	79.9	Confident	23 Å²	23	32.9 Å²	32.9	9%	0.09	17%	0.171	C	C	.	.			trans	-84.8	158.4	172.6	-65.9	-96.5	0	0	0	110.2	H273 M275 L284 H285 I286 Q309 V310	H273-Y282 WeakPolarHBondContact O-CE1 3.46Å; M275-Y282 HydrophobicContact CG-CD1 4.37Å; M275-Y282 HydrophobicContact CG-CD2 4.19Å; M275-Y282 HydrophobicContact CG-CE1 3.85Å; M275-Y282 HydrophobicContact CG-CE2 3.6Å; M275-Y282 VanDerWaalsContact CG-CZ 3.43Å; M275-Y282 HydrophobicContact SD-CE2 4.22Å; Y282-L284 PolarHBondContact O-N 2.95Å; Y282-L284 VanDerWaalsContact O-N 3.16Å; Y282-H285 AromaticContact CD2-CE1 3.95Å; Y282-H285 WeakPolarHBondContact O-CB 3.13Å; Y282-H285 PolarHBondContact O-N 3.36Å; Y282-I286 PolarHBondContact O-N 2.72Å; Y282-Q309 HydrophobicContact CD1-CG 4.09Å; Y282-Q309 HydrophobicContact CD2-CG 3.85Å; Y282-Q309 HydrophobicContact CE1-CG 3.78Å; Y282-Q309 HydrophobicContact CE2-CG 3.57Å; Y282-Q309 HydrophobicContact CG-CG 4.11Å; Y282-Q309 PolarHBondContact OH-NE2 3.2Å; Y282-V310 VanDerWaalsContact CE2-O 3.3Å; Y282-V310 WeakPolarHBondContact CE2-O 3.33Å
283	P	86.8	Confident	80.6	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-53.4	-37.1	177.6	-24.8	33.6	0	0	0	112.9	V232 A236 L272 S274 I286 A287 M299	V232-P283 HydrophobicContact CG1-CB 3.91Å; V232-P283 HydrophobicContact CG1-CG 3.61Å; A236-P283 HydrophobicContact CB-CB 4.24Å; A236-P283 WeakPolarHBondContact CB-O 3.46Å; L272-P283 VanDerWaalsContact O-CD 3.31Å; L272-P283 WeakPolarHBondContact O-CD 3.27Å; S274-P283 WeakPolarHBondContact O-CD 3.27Å; P283-I286 PolarHBondContact O-N 2.98Å; P283-A287 WeakPolarHBondContact O-CB 3.39Å; P283-A287 PolarHBondContact O-N 3.41Å; P283-M299 HydrophobicContact CB-CE 3.75Å
284	L	88.9	Confident	81	Confident	2 Å²	2	35 Å²	35	1%	0.01	18%	0.182	C	C	.	.	H	α-helix	trans	-64.2	-39.3	176	-178.7	59.7	0	0	0	112.8	Y282 I286 A287 V288 V296 M299 L300 V305 P307	Y282-L284 PolarHBondContact O-N 2.95Å; Y282-L284 VanDerWaalsContact O-N 3.16Å; L284-I286 VanDerWaalsContact C-N 3.33Å; L284-I286 PolarHBondContact O-N 3.47Å; L284-A287 PolarHBondContact O-N 3.47Å; L284-V288 HydrophobicContact CD1-CG2 4.25Å; L284-V288 VanDerWaalsContact O-CB 3.32Å; L284-V288 WeakPolarHBondContact O-CB 3.47Å; L284-V288 WeakPolarHBondContact O-CG2 3.34Å; L284-V288 PolarHBondContact O-N 3.4Å; L284-V296 HydrophobicContact CD1-CG1 4.02Å; L284-V296 HydrophobicContact CD1-CG2 4.35Å; L284-M299 HydrophobicContact CB-SD 4.08Å; L284-M299 HydrophobicContact CD1-CB 4.06Å; L284-M299 HydrophobicContact CD1-SD 4.04Å; L284-L300 HydrophobicContact CD1-CD2 4.43Å; L284-L300 HydrophobicContact CD1-CG 4.49Å; L284-L300 HydrophobicContact CD2-CD2 4.01Å; L284-V305 HydrophobicContact CB-CG1 4.01Å; L284-V305 HydrophobicContact CD2-CB 4.3Å; L284-V305 HydrophobicContact CD2-CG1 3.85Å; L284-P307 HydrophobicContact CD2-CB 4.16Å
285	H	89.9	Confident	81.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-40.6	177.7	-62.6	-173.1	0	0	0	110.5	R281 Y282 V288 E289 Q309 Q315 Y320	R281-H285 HydrophobicContact CB-CB 4.42Å; Y282-H285 AromaticContact CD2-CE1 3.95Å; Y282-H285 WeakPolarHBondContact O-CB 3.13Å; Y282-H285 PolarHBondContact O-N 3.36Å; H285-V288 PolarHBondContact O-N 3.31Å; H285-E289 VanDerWaalsContact O-CB 3.24Å; H285-E289 WeakPolarHBondContact O-CB 3.11Å; H285-E289 PolarHBondContact O-N 2.92Å; H285-Q309 PolarHBondContact CE1-O 2.96Å; H285-Q309 VanDerWaalsContact CE1-O 3.3Å; H285-Q309 PolarHBondContact NE2-O 3.33Å; H285-Q309 VanDerWaalsContact NE2-O 3.09Å; H285-Q315 PolarHBondContact CE1-O 2.89Å; H285-Y320 HydrophobicContact CB-CD2 3.88Å; H285-Y320 HydrophobicContact CB-CE2 4.02Å; H285-Y320 HydrophobicContact CB-CG 4.16Å; H285-Y320 AromaticContact CG-CD2 3.91Å; H285-Y320 AromaticContact ND1-CD2 3.87Å; H285-Y320 AromaticContact ND1-CE2 3.57Å
286	I	87.8	Confident	82.6	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.4	-40.8	177.2	-64.3	167	0	0	0	111.4	W229 H233 A236 E237 C276 R281 Y282 P283 L284 E289 N290	W229-I286 HydrophobicContact CD2-CD1 4.26Å; W229-I286 HydrophobicContact CE3-CD1 4.27Å; W229-I286 HydrophobicContact CH2-CB 4.32Å; W229-I286 HydrophobicContact CH2-CD1 3.64Å; W229-I286 HydrophobicContact CH2-CG1 3.82Å; W229-I286 HydrophobicContact CH2-CG2 3.52Å; W229-I286 HydrophobicContact CZ2-CD1 3.58Å; W229-I286 HydrophobicContact CZ2-CG1 3.99Å; W229-I286 HydrophobicContact CZ2-CG2 4.49Å; W229-I286 HydrophobicContact CZ3-CD1 4Å; W229-I286 HydrophobicContact CZ3-CG1 4.46Å; W229-I286 HydrophobicContact CZ3-CG2 3.62Å; H233-I286 HydrophobicContact CB-CD1 3.78Å; A236-I286 HydrophobicContact CB-CB 4.41Å; A236-I286 HydrophobicContact CB-CG2 4.22Å; E237-I286 HydrophobicContact CB-CG2 3.69Å; C276-I286 HydrophobicContact CB-CD1 4.44Å; R281-I286 HydrophobicContact CB-CD1 4.2Å; R281-I286 HydrophobicContact CB-CG1 3.96Å; Y282-I286 PolarHBondContact O-N 2.72Å; P283-I286 PolarHBondContact O-N 2.98Å; L284-I286 VanDerWaalsContact C-N 3.33Å; L284-I286 PolarHBondContact O-N 3.47Å; I286-E289 PolarHBondContact O-N 3.12Å; I286-N290 WeakPolarHBondContact O-CB 3.18Å; I286-N290 PolarHBondContact O-N 2.84Å; I286-N290 PolarHBondContact O-ND2 3.36Å
287	A	88.9	Confident	83.2	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-67	-39.6	175.4	0	0	0	0	0	112.4	A236 P283 L284 S291 Q292 I295 V296 M299	A236-A287 HydrophobicContact CB-CB 4.25Å; A236-A287 WeakPolarHBondContact O-CA 3.37Å; P283-A287 WeakPolarHBondContact O-CB 3.39Å; P283-A287 PolarHBondContact O-N 3.41Å; L284-A287 PolarHBondContact O-N 3.47Å; A287-S291 PolarHBondContact O-N 3.05Å; A287-Q292 HydrophobicContact CB-CB 4.36Å; A287-Q292 PolarHBondContact O-N 2.87Å; A287-I295 HydrophobicContact CB-CG2 3.9Å; A287-V296 HydrophobicContact CB-CG2 3.67Å; A287-M299 HydrophobicContact CB-SD 4.18Å
288	V	89.2	Confident	84.5	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.2	-46.3	173.2	161.8	0	0	0	0	111.3	L284 H285 S291 V296 S317 A321 T324 M328 L332	L284-V288 HydrophobicContact CD1-CG2 4.25Å; L284-V288 VanDerWaalsContact O-CB 3.32Å; L284-V288 WeakPolarHBondContact O-CB 3.47Å; L284-V288 WeakPolarHBondContact O-CG2 3.34Å; L284-V288 PolarHBondContact O-N 3.4Å; H285-V288 PolarHBondContact O-N 3.31Å; V288-S291 PolarHBondContact O-N 2.88Å; V288-S291 VanDerWaalsContact O-N 3.1Å; V288-V296 HydrophobicContact CG2-CG1 4.09Å; V288-V296 HydrophobicContact CG2-CG2 3.79Å; V288-S317 WeakPolarHBondContact CG1-O 3.28Å; V288-A321 HydrophobicContact CG1-CB 3.8Å; V288-T324 PolarHBondContact O-OG1 2.99Å; V288-M328 HydrophobicContact CB-CG 4.19Å; V288-M328 HydrophobicContact CG1-CG 3.78Å; V288-M328 HydrophobicContact CG2-CG 4.15Å; V288-M328 HydrophobicContact CG2-SD 4.07Å; V288-L332 HydrophobicContact CG1-CD1 4.01Å; V288-L332 HydrophobicContact CG2-CD1 4Å; V288-L332 HydrophobicContact CG2-CD2 4.01Å; V288-L332 HydrophobicContact CG2-CG 4.34Å
289	E	86.6	Confident	85.5	Confident	45 Å²	45	24.9 Å²	24.9	21%	0.21	12%	0.122	C	C	.	.	H	α-helix	trans	-61.6	-48.5	179.7	-175.4	-179.4	148	0	0	111.3	R281 H285 I286 S291 Y320 T324	R281-E289 IonicContact CZ-OE1 3.5Å; R281-E289 IonicContact CZ-OE2 3.64Å; R281-E289 IonicContact NH1-OE1 3.21Å; R281-E289 PolarHBondContact NH1-OE1 3.32Å; R281-E289 IonicContact NH1-OE2 2.8Å; R281-E289 PolarHBondContact NH1-OE2 3.35Å; H285-E289 VanDerWaalsContact O-CB 3.24Å; H285-E289 WeakPolarHBondContact O-CB 3.11Å; H285-E289 PolarHBondContact O-N 2.92Å; I286-E289 PolarHBondContact O-N 3.12Å; E289-S291 PolarHBondContact O-N 3.48Å; E289-S291 VanDerWaalsContact O-N 3.11Å; E289-Y320 HydrophobicContact CB-CD1 4.1Å; E289-Y320 HydrophobicContact CG-CD1 4.33Å; E289-Y320 WeakPolarHBondContact OE2-CD1 3.3Å; E289-Y320 VanDerWaalsContact OE2-CE1 3.3Å; E289-Y320 WeakPolarHBondContact OE2-CE1 3.12Å; E289-T324 HydrophobicContact CB-CG2 4.37Å; E289-T324 HydrophobicContact CG-CG2 3.96Å; E289-T324 WeakPolarHBondContact O-CB 3.43Å; E289-T324 VanDerWaalsContact O-CG2 3.25Å; E289-T324 WeakPolarHBondContact O-CG2 3.49Å
290	N	86.6	Confident	86.5	Confident	50 Å²	50	23.1 Å²	23.1	27%	0.267	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	9.4	177.1	-67.3	-77.6	0	0	0	113.5	E237 I286 Q292	E237-N290 WeakPolarHBondContact O-CB 3.35Å; I286-N290 WeakPolarHBondContact O-CB 3.18Å; I286-N290 PolarHBondContact O-N 2.84Å; I286-N290 PolarHBondContact O-ND2 3.36Å; N290-Q292 HydrophobicContact CB-CG 3.97Å; N290-Q292 PolarHBondContact O-N 2.89Å
291	S	86.4	Confident	86.8	Confident	49 Å²	49	29 Å²	29	34%	0.343	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	34.7	176.3	-55.7	0	0	0	0	114	A287 V288 E289 T293 S325	A287-S291 PolarHBondContact O-N 3.05Å; V288-S291 PolarHBondContact O-N 2.88Å; V288-S291 VanDerWaalsContact O-N 3.1Å; E289-S291 PolarHBondContact O-N 3.48Å; E289-S291 VanDerWaalsContact O-N 3.11Å; S291-T293 PolarHBondContact O-N 2.61Å; S291-S325 WeakPolarHBondContact OG-CB 3.32Å
292	Q	87.2	Confident	86.7	Confident	41 Å²	41	34.3 Å²	34.3	19%	0.192	17%	0.165	C	C	.	.			trans	-81.2	65	-176.2	-62.2	-69.1	-2.8	0	0	111.2	A236 E237 I238 G239 A287 N290 E294 I295 V296	A236-Q292 WeakPolarHBondContact O-CG 3.18Å; E237-Q292 PolarHBondContact O-NE2 3.43Å; I238-Q292 PolarHBondContact O-NE2 2.97Å; G239-Q292 VanDerWaalsContact CA-OE1 3.26Å; A287-Q292 HydrophobicContact CB-CB 4.36Å; A287-Q292 PolarHBondContact O-N 2.87Å; N290-Q292 HydrophobicContact CB-CG 3.97Å; N290-Q292 PolarHBondContact O-N 2.89Å; Q292-E294 VanDerWaalsContact C-N 3.28Å; Q292-E294 PolarHBondContact O-N 2.76Å; Q292-E294 VanDerWaalsContact O-N 3.1Å; Q292-I295 HydrophobicContact CB-CB 4.14Å; Q292-I295 PolarHBondContact O-N 3Å; Q292-V296 PolarHBondContact O-N 3.16Å
293	T	86.3	Confident	86.3	Confident	19 Å²	19	34.5 Å²	34.5	12%	0.117	17%	0.167	C	C	.	.	H	α-helix	trans	-44.5	-46.6	-171.3	-64.9	0	0	0	0	113.8	S291 V296 K297 E327 V331	S291-T293 PolarHBondContact O-N 2.61Å; T293-V296 PolarHBondContact O-N 3.49Å; T293-K297 HydrophobicContact CG2-CD 4.3Å; T293-K297 WeakPolarHBondContact O-CG 3.46Å; T293-K297 PolarHBondContact O-N 2.91Å; T293-E327 WeakPolarHBondContact CG2-OE1 3.26Å; T293-E327 PolarHBondContact OG1-OE1 3.41Å; T293-V331 HydrophobicContact CG2-CG2 3.95Å
294	E	84.7	Confident	86	Confident	106 Å²	106	41.5 Å²	41.5	50%	0.495	20%	0.198	S	C	.	.	H	α-helix	trans	-71.8	-31.4	-178.8	-63.1	-54.1	112.6	0	0	113.9	Q292 K297 F298	Q292-E294 VanDerWaalsContact C-N 3.28Å; Q292-E294 PolarHBondContact O-N 2.76Å; Q292-E294 VanDerWaalsContact O-N 3.1Å; E294-K297 IonicContact OE1-NZ 2.66Å; E294-K297 PolarHBondContact OE1-NZ 3.21Å; E294-F298 VanDerWaalsContact O-CB 3.31Å; E294-F298 WeakPolarHBondContact O-CB 3.37Å; E294-F298 PolarHBondContact O-N 2.97Å
295	I	86.5	Confident	85.7	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.015	20%	0.199	C	C	.	.	H	α-helix	trans	-72.6	-40.1	171.3	-69.2	-164.4	0	0	0	110.5	G239 K241 F244 A287 Q292 F298 M299	G239-I295 VanDerWaalsContact C-CD1 3.42Å; K241-I295 HydrophobicContact CB-CG1 4.25Å; F244-I295 HydrophobicContact CD2-CD1 3.92Å; F244-I295 HydrophobicContact CD2-CG2 4.45Å; F244-I295 HydrophobicContact CE2-CD1 3.79Å; F244-I295 HydrophobicContact CE2-CG2 4.23Å; A287-I295 HydrophobicContact CB-CG2 3.9Å; Q292-I295 HydrophobicContact CB-CB 4.14Å; Q292-I295 PolarHBondContact O-N 3Å; I295-F298 PolarHBondContact O-N 2.85Å; I295-M299 HydrophobicContact CG2-CE 3.63Å; I295-M299 HydrophobicContact CG2-CG 4.09Å; I295-M299 HydrophobicContact CG2-SD 3.93Å; I295-M299 WeakPolarHBondContact O-CB 3.39Å; I295-M299 WeakPolarHBondContact O-CG 3.27Å; I295-M299 PolarHBondContact O-N 2.83Å
296	V	88.1	Confident	85.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-46.3	177.8	173.9	0	0	0	0	110.5	L284 A287 V288 Q292 T293 F298 M299 L300 M328 V331 L332	L284-V296 HydrophobicContact CD1-CG1 4.02Å; L284-V296 HydrophobicContact CD1-CG2 4.35Å; A287-V296 HydrophobicContact CB-CG2 3.67Å; V288-V296 HydrophobicContact CG2-CG1 4.09Å; V288-V296 HydrophobicContact CG2-CG2 3.79Å; Q292-V296 PolarHBondContact O-N 3.16Å; T293-V296 PolarHBondContact O-N 3.49Å; V296-F298 PolarHBondContact O-N 3.08Å; V296-M299 PolarHBondContact O-N 2.71Å; V296-L300 HydrophobicContact CG1-CD1 3.7Å; V296-L300 HydrophobicContact CG1-CG 4.34Å; V296-L300 WeakPolarHBondContact O-CB 3.42Å; V296-L300 WeakPolarHBondContact O-CG 3.37Å; V296-L300 PolarHBondContact O-N 3.21Å; V296-M328 HydrophobicContact CB-CE 4.1Å; V296-M328 HydrophobicContact CB-SD 3.91Å; V296-M328 HydrophobicContact CG1-SD 3.72Å; V296-M328 HydrophobicContact CG2-CE 3.66Å; V296-M328 HydrophobicContact CG2-SD 3.79Å; V296-V331 HydrophobicContact CG1-CG1 4.21Å; V296-L332 HydrophobicContact CG1-CD2 4.23Å
297	K	86.1	Confident	85	Confident	72 Å²	72	44.1 Å²	44.1	31%	0.313	21%	0.212	S	C	.	.	H	α-helix	trans	-55.1	-50.8	170.3	-70.6	171.7	-173.3	166.7	0	111.9	T293 E294 M299 L300 E301 V331	T293-K297 HydrophobicContact CG2-CD 4.3Å; T293-K297 WeakPolarHBondContact O-CG 3.46Å; T293-K297 PolarHBondContact O-N 2.91Å; E294-K297 IonicContact OE1-NZ 2.66Å; E294-K297 PolarHBondContact OE1-NZ 3.21Å; K297-M299 VanDerWaalsContact C-N 3.33Å; K297-M299 PolarHBondContact O-N 3.33Å; K297-L300 PolarHBondContact O-N 3.47Å; K297-E301 VanDerWaalsContact O-CB 3.3Å; K297-E301 WeakPolarHBondContact O-CB 3.46Å; K297-E301 WeakPolarHBondContact O-CG 3.33Å; K297-E301 PolarHBondContact O-N 3.18Å; K297-V331 HydrophobicContact CG-CG1 4.12Å
298	F	86.1	Confident	84.8	Confident	23 Å²	23	46.3 Å²	46.3	10%	0.101	23%	0.227	C	C	.	.	H	α-helix	trans	-60.3	-40.1	179.6	-168.1	-91.3	0	0	0	112.7	F244 E245 L248 E294 I295 V296 K302 L303	F244-F298 HydrophobicContact CB-CD1 4.03Å; F244-F298 HydrophobicContact CB-CE1 3.78Å; E245-F298 HydrophobicContact CG-CE2 3.76Å; E245-F298 HydrophobicContact CG-CZ 3.67Å; L248-F298 HydrophobicContact CD1-CE1 4.13Å; L248-F298 HydrophobicContact CD1-CZ 3.83Å; E294-F298 VanDerWaalsContact O-CB 3.31Å; E294-F298 WeakPolarHBondContact O-CB 3.37Å; E294-F298 PolarHBondContact O-N 2.97Å; I295-F298 PolarHBondContact O-N 2.85Å; V296-F298 PolarHBondContact O-N 3.08Å; F298-K302 HydrophobicContact CD1-CB 4.48Å; F298-K302 HydrophobicContact CD2-CB 4.23Å; F298-K302 HydrophobicContact CD2-CG 3.82Å; F298-K302 HydrophobicContact CE1-CB 4.45Å; F298-K302 HydrophobicContact CE2-CB 4.22Å; F298-K302 HydrophobicContact CE2-CG 3.95Å; F298-K302 HydrophobicContact CG-CB 4.38Å; F298-K302 HydrophobicContact CG-CG 4.34Å; F298-K302 HydrophobicContact CZ-CB 4.33Å; F298-K302 WeakPolarHBondContact O-CA 3.39Å; F298-K302 WeakPolarHBondContact O-CB 3.49Å; F298-K302 PolarHBondContact O-N 3.3Å; F298-L303 HydrophobicContact CD1-CD1 3.81Å; F298-L303 HydrophobicContact CD1-CG 3.95Å; F298-L303 HydrophobicContact CE1-CD1 3.91Å; F298-L303 HydrophobicContact CE1-CD2 4.14Å; F298-L303 HydrophobicContact CE1-CG 3.87Å; F298-L303 PolarHBondContact O-N 3.26Å
299	M	85.9	Confident	84.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-40.5	175.7	-77.5	-177.5	175.8	0	0	112.5	A236 F244 P283 L284 A287 I295 V296 K297 L303 K304 V305	A236-M299 HydrophobicContact CB-CE 4.04Å; F244-M299 HydrophobicContact CD1-CE 4.21Å; F244-M299 HydrophobicContact CE1-CE 3.42Å; F244-M299 VanDerWaalsContact CE1-CE 3.42Å; F244-M299 HydrophobicContact CE2-CE 4.24Å; F244-M299 HydrophobicContact CZ-CE 3.44Å; F244-M299 VanDerWaalsContact CZ-CE 3.44Å; P283-M299 HydrophobicContact CB-CE 3.75Å; L284-M299 HydrophobicContact CB-SD 4.08Å; L284-M299 HydrophobicContact CD1-CB 4.06Å; L284-M299 HydrophobicContact CD1-SD 4.04Å; A287-M299 HydrophobicContact CB-SD 4.18Å; I295-M299 HydrophobicContact CG2-CE 3.63Å; I295-M299 HydrophobicContact CG2-CG 4.09Å; I295-M299 HydrophobicContact CG2-SD 3.93Å; I295-M299 WeakPolarHBondContact O-CB 3.39Å; I295-M299 WeakPolarHBondContact O-CG 3.27Å; I295-M299 PolarHBondContact O-N 2.83Å; V296-M299 PolarHBondContact O-N 2.71Å; K297-M299 VanDerWaalsContact C-N 3.33Å; K297-M299 PolarHBondContact O-N 3.33Å; M299-L303 HydrophobicContact CG-CD1 4.16Å; M299-L303 CarbonylContact O-C 3.52Å; M299-K304 PolarHBondContact O-N 3.13Å; M299-V305 HydrophobicContact CB-CB 4.42Å; M299-V305 HydrophobicContact CB-CG2 4.15Å; M299-V305 HydrophobicContact CG-CG2 4.48Å; M299-V305 PolarHBondContact O-N 3.17Å
300	L	84.9	Confident	84.6	Confident	24 Å²	24	50.4 Å²	50.4	13%	0.126	25%	0.251	C	S	.	.	H	α-helix	trans	-78.4	-44.2	-178.8	-64.9	169.5	0	0	0	112.6	L284 V296 K297 K304 P307 L332	L284-L300 HydrophobicContact CD1-CD2 4.43Å; L284-L300 HydrophobicContact CD1-CG 4.49Å; L284-L300 HydrophobicContact CD2-CD2 4.01Å; V296-L300 HydrophobicContact CG1-CD1 3.7Å; V296-L300 HydrophobicContact CG1-CG 4.34Å; V296-L300 WeakPolarHBondContact O-CB 3.42Å; V296-L300 WeakPolarHBondContact O-CG 3.37Å; V296-L300 PolarHBondContact O-N 3.21Å; K297-L300 PolarHBondContact O-N 3.47Å; L300-K304 WeakPolarHBondContact O-CA 3.4Å; L300-P307 HydrophobicContact CD2-CB 3.84Å; L300-P307 HydrophobicContact CD2-CG 3.96Å; L300-L332 HydrophobicContact CD1-CD2 4.23Å
301	E	84.1	Confident	84.6	Confident	123 Å²	123	48.4 Å²	48.4	58%	0.575	24%	0.24	S	C	*	.	H	α-helix	trans	-84.6	-48.6	-173.5	-65.3	173.7	-158.4	0	0	113.1	K297	K297-E301 VanDerWaalsContact O-CB 3.3Å; K297-E301 WeakPolarHBondContact O-CB 3.46Å; K297-E301 WeakPolarHBondContact O-CG 3.33Å; K297-E301 PolarHBondContact O-N 3.18Å
302	K	82.6	Confident	84.4	Confident	139 Å²	139	50 Å²	50	60%	0.604	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-50.5	-172.9	-55.2	-60.5	-177.3	179.8	0	111.5	F298	F298-K302 HydrophobicContact CD1-CB 4.48Å; F298-K302 HydrophobicContact CD2-CB 4.23Å; F298-K302 HydrophobicContact CD2-CG 3.82Å; F298-K302 HydrophobicContact CE1-CB 4.45Å; F298-K302 HydrophobicContact CE2-CB 4.22Å; F298-K302 HydrophobicContact CE2-CG 3.95Å; F298-K302 HydrophobicContact CG-CB 4.38Å; F298-K302 HydrophobicContact CG-CG 4.34Å; F298-K302 HydrophobicContact CZ-CB 4.33Å; F298-K302 WeakPolarHBondContact O-CA 3.39Å; F298-K302 WeakPolarHBondContact O-CB 3.49Å; F298-K302 PolarHBondContact O-N 3.3Å
303	L	79.3	Confident	84.2	Confident	27 Å²	27	51.8 Å²	51.8	14%	0.141	25%	0.252	C	S	.	.	S	Bend	trans	-84.6	-9.6	-178.9	-55.4	173.3	0	0	0	113.5	F244 L248 L268 L272 F298 M299 V305	F244-L303 HydrophobicContact CB-CD1 4.48Å; F244-L303 HydrophobicContact CD1-CD1 3.98Å; L248-L303 HydrophobicContact CD1-CD2 3.78Å; L248-L303 HydrophobicContact CG-CD2 4.48Å; L268-L303 HydrophobicContact CD2-CD2 4.21Å; L272-L303 HydrophobicContact CD1-CB 3.96Å; L272-L303 HydrophobicContact CD1-CD1 3.91Å; L272-L303 HydrophobicContact CD1-CD2 4.12Å; L272-L303 HydrophobicContact CD1-CG 4.22Å; L272-L303 HydrophobicContact CD2-CD1 4.06Å; F298-L303 HydrophobicContact CD1-CD1 3.81Å; F298-L303 HydrophobicContact CD1-CG 3.95Å; F298-L303 HydrophobicContact CE1-CD1 3.91Å; F298-L303 HydrophobicContact CE1-CD2 4.14Å; F298-L303 HydrophobicContact CE1-CG 3.87Å; F298-L303 PolarHBondContact O-N 3.26Å; M299-L303 HydrophobicContact CG-CD1 4.16Å; M299-L303 CarbonylContact O-C 3.52Å; L303-V305 HydrophobicContact CB-CG2 4.02Å; L303-V305 PolarHBondContact O-N 3.19Å; L303-V305 VanDerWaalsContact O-N 3.15Å
304	K	80	Confident	84.1	Confident	148 Å²	148	51.4 Å²	51.4	64%	0.643	25%	0.251	S	S	*	.			trans	54.2	28.3	176.7	-59.7	-179	-179.4	176.7	0	114.9	M299 L300	M299-K304 PolarHBondContact O-N 3.13Å; L300-K304 WeakPolarHBondContact O-CA 3.4Å
305	V	82.5	Confident	84.2	Confident	5 Å²	5	47 Å²	47	3%	0.03	23%	0.231	C	C	.	.			trans	-59.5	138.6	178.6	-175.5	0	0	0	0	110.1	L272 L284 M299 L303 P307	L272-V305 HydrophobicContact CB-CG2 4.33Å; L272-V305 HydrophobicContact CD1-CG2 4.41Å; L284-V305 HydrophobicContact CB-CG1 4.01Å; L284-V305 HydrophobicContact CD2-CB 4.3Å; L284-V305 HydrophobicContact CD2-CG1 3.85Å; M299-V305 HydrophobicContact CB-CB 4.42Å; M299-V305 HydrophobicContact CB-CG2 4.15Å; M299-V305 HydrophobicContact CG-CG2 4.48Å; M299-V305 PolarHBondContact O-N 3.17Å; L303-V305 HydrophobicContact CB-CG2 4.02Å; L303-V305 PolarHBondContact O-N 3.19Å; L303-V305 VanDerWaalsContact O-N 3.15Å; V305-P307 VanDerWaalsContact O-CD 3.3Å; V305-P307 WeakPolarHBondContact O-CD 3.49Å
306	N	81.9	Confident	84.4	Confident	53 Å²	53	47.1 Å²	47.1	28%	0.283	23%	0.231	S	C	.	.			trans	-76.8	117	-177.8	-179	31.8	0	0	0	112.3	S308 Q309	N306-S308 PolarHBondContact ND2-OG 2.88Å; N306-S308 PolarHBondContact O-N 3.07Å; N306-S308 PolarHBondContact OD1-N 3.06Å; N306-S308 PolarHBondContact OD1-OG 3.49Å; N306-Q309 PolarHBondContact ND2-N 3.33Å; N306-Q309 WeakPolarHBondContact O-CB 3.44Å; N306-Q309 PolarHBondContact O-N 3.44Å
307	P	81.6	Confident	84.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-20.6	178.9	30	-35.8	0	0	0	114.9	L284 L300 V305 Q309 S317 L332 R337 L338	L284-P307 HydrophobicContact CD2-CB 4.16Å; L300-P307 HydrophobicContact CD2-CB 3.84Å; L300-P307 HydrophobicContact CD2-CG 3.96Å; V305-P307 VanDerWaalsContact O-CD 3.3Å; V305-P307 WeakPolarHBondContact O-CD 3.49Å; P307-Q309 PolarHBondContact O-N 3.09Å; P307-S317 WeakPolarHBondContact O-CB 3.44Å; P307-S317 PolarHBondContact O-N 2.91Å; P307-S317 PolarHBondContact O-OG 2.61Å; P307-L332 HydrophobicContact CB-CD2 4.41Å; P307-R337 HydrophobicContact CG-CB 4.23Å; P307-L338 HydrophobicContact CB-CD1 3.71Å; P307-L338 HydrophobicContact CB-CD2 4.14Å; P307-L338 HydrophobicContact CB-CG 3.83Å; P307-L338 HydrophobicContact CG-CD1 4.18Å; P307-L338 HydrophobicContact CG-CD2 4.4Å; P307-L338 HydrophobicContact CG-CG 3.87Å
308	S	84.1	Confident	84.6	Confident	45 Å²	45	43.7 Å²	43.7	32%	0.315	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	0.3	177.3	67.8	0	0	0	0	113.5	N306	N306-S308 PolarHBondContact ND2-OG 2.88Å; N306-S308 PolarHBondContact O-N 3.07Å; N306-S308 PolarHBondContact OD1-N 3.06Å; N306-S308 PolarHBondContact OD1-OG 3.49Å
309	Q	84.5	Confident	84.9	Confident	61 Å²	61	42.6 Å²	42.6	29%	0.285	21%	0.211	S	C	.	.			trans	-55	139.9	171.4	-162.1	70.5	9.8	0	0	109.8	Y282 H285 N306 P307 N316	Y282-Q309 HydrophobicContact CD1-CG 4.09Å; Y282-Q309 HydrophobicContact CD2-CG 3.85Å; Y282-Q309 HydrophobicContact CE1-CG 3.78Å; Y282-Q309 HydrophobicContact CE2-CG 3.57Å; Y282-Q309 HydrophobicContact CG-CG 4.11Å; Y282-Q309 PolarHBondContact OH-NE2 3.2Å; H285-Q309 PolarHBondContact CE1-O 2.96Å; H285-Q309 VanDerWaalsContact CE1-O 3.3Å; H285-Q309 PolarHBondContact NE2-O 3.33Å; H285-Q309 VanDerWaalsContact NE2-O 3.09Å; N306-Q309 PolarHBondContact ND2-N 3.33Å; N306-Q309 WeakPolarHBondContact O-CB 3.44Å; N306-Q309 PolarHBondContact O-N 3.44Å; P307-Q309 PolarHBondContact O-N 3.09Å; Q309-N316 VanDerWaalsContact O-CA 3.31Å; Q309-N316 WeakPolarHBondContact O-CA 3.18Å; Q309-N316 WeakPolarHBondContact O-CB 3.25Å
310	V	87	Confident	85	Confident	70 Å²	70	43.4 Å²	43.4	42%	0.424	22%	0.215	S	C	.	.			trans	-113.4	142.5	177.9	-69.2	0	0	0	0	111.3	Y282 G314 Q315 N316	Y282-V310 VanDerWaalsContact CE2-O 3.3Å; Y282-V310 WeakPolarHBondContact CE2-O 3.33Å; V310-G314 VanDerWaalsContact CG1-O 3.31Å; V310-G314 WeakPolarHBondContact CG1-O 3.38Å; V310-Q315 WeakPolarHBondContact CA-O 3.46Å; V310-N316 HydrophobicContact CG1-CB 4.01Å
311	D	86.6	Confident	85.2	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.043	21%	0.209	C	C	.	.			trans	-79.2	-169.4	175.2	71.9	4.1	0	0	0	113.1	G280 L313 G314 Q315 Y320	G280-D311 WeakPolarHBondContact O-CB 3.36Å; D311-L313 PolarHBondContact O-N 3.13Å; D311-L313 VanDerWaalsContact OD1-C 3.32Å; D311-L313 VanDerWaalsContact OD1-CA 3.28Å; D311-L313 WeakPolarHBondContact OD1-CA 3.41Å; D311-L313 WeakPolarHBondContact OD1-CB 3.5Å; D311-L313 PolarHBondContact OD1-N 2.92Å; D311-G314 PolarHBondContact O-N 2.86Å; D311-G314 VanDerWaalsContact O-N 3.12Å; D311-G314 PolarHBondContact OD1-N 3.03Å; D311-Q315 PolarHBondContact N-O 3.19Å; D311-Q315 PolarHBondContact OD1-N 3.3Å; D311-Y320 WeakPolarHBondContact OD2-CE2 3.29Å; D311-Y320 PolarHBondContact OD2-OH 3.16Å
312	K	83.3	Confident	85.5	Confident	83 Å²	83	36.4 Å²	36.4	36%	0.361	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.3	176.1	-72.6	177	-171.6	175.9	0	113.9	M275 P278 K347	M275-K312 HydrophobicContact SD-CG 4.34Å; P278-K312 PolarHBondContact O-NZ 3.39Å; K312-K347 WeakPolarHBondContact O-CD 3.43Å; K312-K347 WeakPolarHBondContact O-CE 3.45Å; K312-K347 PolarHBondContact O-NZ 3.17Å
313	L	81.8	Confident	85.6	Confident	79 Å²	79	32.8 Å²	32.8	41%	0.414	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	1.7	178.7	-58.4	177.6	0	0	0	112.9	D311 Q315 K347	D311-L313 PolarHBondContact O-N 3.13Å; D311-L313 VanDerWaalsContact OD1-C 3.32Å; D311-L313 VanDerWaalsContact OD1-CA 3.28Å; D311-L313 WeakPolarHBondContact OD1-CA 3.41Å; D311-L313 WeakPolarHBondContact OD1-CB 3.5Å; D311-L313 PolarHBondContact OD1-N 2.92Å; L313-Q315 HydrophobicContact CB-CG 4.05Å; L313-Q315 PolarHBondContact O-N 2.96Å; L313-K347 WeakPolarHBondContact O-CB 3.34Å; L313-K347 PolarHBondContact O-N 2.74Å
314	G	84.3	Confident	85.8	Confident	10 Å²	10	33 Å²	33	10%	0.103	17%	0.169	C	C	.	.	S	Bend	trans	77.3	6.6	-174	0	0	0	0	0	113.8	V310 D311	V310-G314 VanDerWaalsContact CG1-O 3.31Å; V310-G314 WeakPolarHBondContact CG1-O 3.38Å; D311-G314 PolarHBondContact O-N 2.86Å; D311-G314 VanDerWaalsContact O-N 3.12Å; D311-G314 PolarHBondContact OD1-N 3.03Å
315	Q	88.1	Confident	86	Confident	15 Å²	15	27.1 Å²	27.1	7%	0.07	15%	0.146	C	C	.	.			trans	-82.2	125.9	-179.1	-63	-177.9	29.9	0	0	110	H285 V310 D311 L313 H319 Y320 M355	H285-Q315 PolarHBondContact CE1-O 2.89Å; V310-Q315 WeakPolarHBondContact CA-O 3.46Å; D311-Q315 PolarHBondContact N-O 3.19Å; D311-Q315 PolarHBondContact OD1-N 3.3Å; L313-Q315 HydrophobicContact CB-CG 4.05Å; L313-Q315 PolarHBondContact O-N 2.96Å; Q315-H319 HydrophobicContact CB-CB 3.83Å; Q315-H319 HydrophobicContact CG-CB 4.13Å; Q315-Y320 HydrophobicContact CB-CD2 4.24Å; Q315-Y320 HydrophobicContact CB-CE2 3.69Å; Q315-M355 HydrophobicContact CG-CE 4Å
316	N	89.5	Confident	86.2	Confident	4 Å²	4	28.2 Å²	28.2	2%	0.021	16%	0.156	C	C	.	.			trans	-96.4	178.2	171.7	64.6	34.5	0	0	0	111.4	Q309 V310 L318 H319 Y320	Q309-N316 VanDerWaalsContact O-CA 3.31Å; Q309-N316 WeakPolarHBondContact O-CA 3.18Å; Q309-N316 WeakPolarHBondContact O-CB 3.25Å; V310-N316 HydrophobicContact CG1-CB 4.01Å; N316-L318 PolarHBondContact O-N 3.36Å; N316-L318 VanDerWaalsContact O-N 3.08Å; N316-L318 WeakPolarHBondContact OD1-CB 3.35Å; N316-L318 PolarHBondContact OD1-N 2.91Å; N316-H319 VanDerWaalsContact CG-ND1 3.35Å; N316-H319 PolarHBondContact N-ND1 2.99Å; N316-H319 WeakPolarHBondContact O-CB 3.42Å; N316-H319 PolarHBondContact O-N 3.05Å; N316-H319 PolarHBondContact OD1-N 3.44Å; N316-H319 PolarHBondContact OD1-ND1 2.73Å; N316-Y320 PolarHBondContact O-N 2.92Å
317	S	89.2	Confident	86.4	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-52	-33.7	-179.3	-54.3	0	0	0	0	114.4	V288 P307 Y320 A321 L332	V288-S317 WeakPolarHBondContact CG1-O 3.28Å; P307-S317 WeakPolarHBondContact O-CB 3.44Å; P307-S317 PolarHBondContact O-N 2.91Å; P307-S317 PolarHBondContact O-OG 2.61Å; S317-Y320 PolarHBondContact O-N 3.41Å; S317-A321 WeakPolarHBondContact O-CB 3.3Å; S317-A321 PolarHBondContact O-N 3.07Å; S317-L332 WeakPolarHBondContact O-CD1 3.32Å
318	L	89.9	Confident	86.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-70.5	-31.9	178	-87.1	169.2	0	0	0	113.4	N316 A321 A322 I329 T333 L338 C341 I342 P352 L368	N316-L318 PolarHBondContact O-N 3.36Å; N316-L318 VanDerWaalsContact O-N 3.08Å; N316-L318 WeakPolarHBondContact OD1-CB 3.35Å; N316-L318 PolarHBondContact OD1-N 2.91Å; L318-A321 PolarHBondContact O-N 3.43Å; L318-A322 VanDerWaalsContact O-CB 3.3Å; L318-A322 WeakPolarHBondContact O-CB 3.44Å; L318-A322 PolarHBondContact O-N 3.22Å; L318-I329 HydrophobicContact CD2-CG2 4.26Å; L318-T333 HydrophobicContact CD2-CG2 4.19Å; L318-L338 HydrophobicContact CD1-CB 4.14Å; L318-L338 HydrophobicContact CD1-CD1 4.33Å; L318-L338 HydrophobicContact CD1-CD2 4.18Å; L318-L338 HydrophobicContact CD1-CG 4.47Å; L318-L338 HydrophobicContact CG-CD1 4.11Å; L318-L338 HydrophobicContact CG-CD2 4.46Å; L318-C341 HydrophobicContact CD1-CB 4.14Å; L318-I342 HydrophobicContact CD1-CB 4.44Å; L318-P352 HydrophobicContact CB-CG 4.12Å; L318-L368 HydrophobicContact CD2-CD2 4.27Å
319	H	90.9	Very high	86.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-67.4	-41.1	175	-66.1	76.7	0	0	0	111.1	Q315 N316 Q323 A344 S346 Y350 M355	Q315-H319 HydrophobicContact CB-CB 3.83Å; Q315-H319 HydrophobicContact CG-CB 4.13Å; N316-H319 VanDerWaalsContact CG-ND1 3.35Å; N316-H319 PolarHBondContact N-ND1 2.99Å; N316-H319 WeakPolarHBondContact O-CB 3.42Å; N316-H319 PolarHBondContact O-N 3.05Å; N316-H319 PolarHBondContact OD1-N 3.44Å; N316-H319 PolarHBondContact OD1-ND1 2.73Å; H319-Q323 WeakPolarHBondContact O-CG 3.25Å; H319-Q323 PolarHBondContact O-N 3.16Å; H319-A344 PolarHBondContact NE2-O 3.35Å; H319-S346 PolarHBondContact NE2-N 3.14Å; H319-Y350 PolarHBondContact NE2-O 3.28Å; H319-M355 HydrophobicContact CB-SD 3.86Å
320	Y	89	Confident	86.8	Confident	17 Å²	17	27.8 Å²	27.8	7%	0.067	16%	0.156	C	C	.	.	H	α-helix	trans	-65.1	-44.3	173.8	-79.2	-84.6	0	0	0	111.6	R281 H285 E289 D311 Q315 N316 S317 A322 Q323 T324	R281-Y320 WeakPolarHBondContact CD-OH 3.28Å; R281-Y320 HydrophobicContact CG-CE1 4.47Å; R281-Y320 WeakPolarHBondContact CG-OH 3.42Å; H285-Y320 HydrophobicContact CB-CD2 3.88Å; H285-Y320 HydrophobicContact CB-CE2 4.02Å; H285-Y320 HydrophobicContact CB-CG 4.16Å; H285-Y320 AromaticContact CG-CD2 3.91Å; H285-Y320 AromaticContact ND1-CD2 3.87Å; H285-Y320 AromaticContact ND1-CE2 3.57Å; E289-Y320 HydrophobicContact CB-CD1 4.1Å; E289-Y320 HydrophobicContact CG-CD1 4.33Å; E289-Y320 WeakPolarHBondContact OE2-CD1 3.3Å; E289-Y320 VanDerWaalsContact OE2-CE1 3.3Å; E289-Y320 WeakPolarHBondContact OE2-CE1 3.12Å; D311-Y320 WeakPolarHBondContact OD2-CE2 3.29Å; D311-Y320 PolarHBondContact OD2-OH 3.16Å; Q315-Y320 HydrophobicContact CB-CD2 4.24Å; Q315-Y320 HydrophobicContact CB-CE2 3.69Å; N316-Y320 PolarHBondContact O-N 2.92Å; S317-Y320 PolarHBondContact O-N 3.41Å; Y320-A322 PolarHBondContact O-N 3.3Å; Y320-Q323 PolarHBondContact O-N 3.23Å; Y320-T324 WeakPolarHBondContact O-CG2 3.25Å; Y320-T324 PolarHBondContact O-N 3.17Å; Y320-T324 PolarHBondContact O-OG1 2.87Å; Y320-T324 VanDerWaalsContact O-OG1 3.06Å
321	A	89.8	Confident	86.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65	-38.2	178.4	0	0	0	0	0	113.1	V288 S317 L318 Q323 T324 S325 M328 I329 L332	V288-A321 HydrophobicContact CG1-CB 3.8Å; S317-A321 WeakPolarHBondContact O-CB 3.3Å; S317-A321 PolarHBondContact O-N 3.07Å; L318-A321 PolarHBondContact O-N 3.43Å; A321-Q323 VanDerWaalsContact C-N 3.25Å; A321-Q323 PolarHBondContact O-N 2.93Å; A321-T324 PolarHBondContact O-N 3.45Å; A321-T324 PolarHBondContact O-OG1 3.15Å; A321-S325 PolarHBondContact O-N 3.37Å; A321-M328 HydrophobicContact CB-CB 4.23Å; A321-M328 HydrophobicContact CB-CG 4.06Å; A321-I329 HydrophobicContact CB-CG1 3.72Å; A321-L332 HydrophobicContact CB-CD1 3.59Å
322	A	90.2	Very high	86.6	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-57.7	-37.6	173.4	0	0	0	0	0	113.4	L318 Y320 T324 P352 M355 A356 C364 L368	L318-A322 VanDerWaalsContact O-CB 3.3Å; L318-A322 WeakPolarHBondContact O-CB 3.44Å; L318-A322 PolarHBondContact O-N 3.22Å; Y320-A322 PolarHBondContact O-N 3.3Å; A322-T324 VanDerWaalsContact C-N 3.28Å; A322-T324 PolarHBondContact O-N 2.76Å; A322-P352 HydrophobicContact CB-CB 3.98Å; A322-P352 WeakPolarHBondContact CB-O 3.42Å; A322-M355 HydrophobicContact CB-CB 4.49Å; A322-A356 HydrophobicContact CB-CB 4.18Å; A322-C364 WeakPolarHBondContact O-CB 3.4Å; A322-L368 HydrophobicContact CB-CD1 3.76Å
323	Q	84.8	Confident	86.4	Confident	64 Å²	64	22.9 Å²	22.9	30%	0.299	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	3.2	176.2	-67.9	-174.9	75	0	0	113.5	H319 Y320 A321 M355 R361	H319-Q323 WeakPolarHBondContact O-CG 3.25Å; H319-Q323 PolarHBondContact O-N 3.16Å; Y320-Q323 PolarHBondContact O-N 3.23Å; A321-Q323 VanDerWaalsContact C-N 3.25Å; A321-Q323 PolarHBondContact O-N 2.93Å; Q323-M355 HydrophobicContact CG-CB 3.93Å; Q323-M355 HydrophobicContact CG-SD 4.31Å; Q323-M355 PolarHBondContact NE2-SD 3.27Å; Q323-M355 VanDerWaalsContact NE2-SD 3.38Å; Q323-R361 PolarHBondContact O-NE 3.44Å; Q323-R361 PolarHBondContact O-NH1 2.9Å; Q323-R361 PolarHBondContact O-NH2 2.89Å
324	T	82.1	Confident	86.2	Confident	30 Å²	30	23.3 Å²	23.3	18%	0.184	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.8	-70.8	-174.8	62.5	0	0	0	0	114.6	V288 E289 Y320 A321 A322 R361	V288-T324 PolarHBondContact O-OG1 2.99Å; E289-T324 HydrophobicContact CB-CG2 4.37Å; E289-T324 HydrophobicContact CG-CG2 3.96Å; E289-T324 WeakPolarHBondContact O-CB 3.43Å; E289-T324 VanDerWaalsContact O-CG2 3.25Å; E289-T324 WeakPolarHBondContact O-CG2 3.49Å; Y320-T324 WeakPolarHBondContact O-CG2 3.25Å; Y320-T324 PolarHBondContact O-N 3.17Å; Y320-T324 PolarHBondContact O-OG1 2.87Å; Y320-T324 VanDerWaalsContact O-OG1 3.06Å; A321-T324 PolarHBondContact O-N 3.45Å; A321-T324 PolarHBondContact O-OG1 3.15Å; A322-T324 VanDerWaalsContact C-N 3.28Å; A322-T324 PolarHBondContact O-N 2.76Å; T324-R361 PolarHBondContact O-NE 3.48Å
325	S	85.3	Confident	85.3	Confident	25 Å²	25	24.6 Å²	24.6	18%	0.175	16%	0.156	C	C	.	.			trans	-138.8	130.6	-167.6	176.6	0	0	0	0	114.6	S291 A321 E327 M328 I329	S291-S325 WeakPolarHBondContact OG-CB 3.32Å; A321-S325 PolarHBondContact O-N 3.37Å; S325-E327 VanDerWaalsContact C-N 3.32Å; S325-E327 PolarHBondContact O-N 2.98Å; S325-E327 PolarHBondContact OG-N 3.3Å; S325-M328 PolarHBondContact O-N 2.86Å; S325-M328 PolarHBondContact OG-N 3.43Å; S325-I329 PolarHBondContact O-N 3.06Å
326	A	85.8	Confident	84.2	Confident	28 Å²	28	31.2 Å²	31.2	23%	0.231	19%	0.192	C	C	.	.	H	α-helix	trans	-67.5	-30	174.4	0	0	0	0	0	113.1	G330 S363 C364 A367	A326-G330 PolarHBondContact O-N 2.68Å; A326-S363 WeakPolarHBondContact CB-O 3.31Å; A326-C364 PolarHBondContact N-SG 2.98Å; A326-C364 VanDerWaalsContact N-SG 3.35Å; A326-A367 HydrophobicContact CB-CB 4.02Å
327	E	86.3	Confident	83	Confident	118 Å²	118	37.6 Å²	37.6	55%	0.551	22%	0.216	S	C	*	.	H	α-helix	trans	-67	-43.2	172.8	-174.3	-167.2	133.9	0	0	110.2	T293 S325 I329 G330 V331	T293-E327 WeakPolarHBondContact CG2-OE1 3.26Å; T293-E327 PolarHBondContact OG1-OE1 3.41Å; S325-E327 VanDerWaalsContact C-N 3.32Å; S325-E327 PolarHBondContact O-N 2.98Å; S325-E327 PolarHBondContact OG-N 3.3Å; E327-I329 VanDerWaalsContact C-N 3.32Å; E327-I329 PolarHBondContact O-N 3.14Å; E327-G330 CarbonylContact O-C 3.19Å; E327-G330 WeakPolarHBondContact O-CA 3.44Å; E327-G330 PolarHBondContact O-N 3.08Å; E327-V331 WeakPolarHBondContact O-CG2 3.12Å; E327-V331 PolarHBondContact O-N 3.32Å
328	M	87.2	Confident	82.1	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.9	-34.5	-179.1	-169	58.6	73.3	0	0	112.2	V288 V296 A321 S325 G330 V331 L332	V288-M328 HydrophobicContact CB-CG 4.19Å; V288-M328 HydrophobicContact CG1-CG 3.78Å; V288-M328 HydrophobicContact CG2-CG 4.15Å; V288-M328 HydrophobicContact CG2-SD 4.07Å; V296-M328 HydrophobicContact CB-CE 4.1Å; V296-M328 HydrophobicContact CB-SD 3.91Å; V296-M328 HydrophobicContact CG1-SD 3.72Å; V296-M328 HydrophobicContact CG2-CE 3.66Å; V296-M328 HydrophobicContact CG2-SD 3.79Å; A321-M328 HydrophobicContact CB-CB 4.23Å; A321-M328 HydrophobicContact CB-CG 4.06Å; S325-M328 PolarHBondContact O-N 2.86Å; S325-M328 PolarHBondContact OG-N 3.43Å; M328-G330 VanDerWaalsContact C-N 3.3Å; M328-G330 PolarHBondContact O-N 3.35Å; M328-V331 PolarHBondContact O-N 3.17Å; M328-V331 HydrophobicContact SD-CB 4.33Å; M328-V331 HydrophobicContact SD-CG1 4.43Å; M328-L332 HydrophobicContact CG-CD1 4.18Å; M328-L332 HydrophobicContact CG-CG 4.46Å; M328-L332 VanDerWaalsContact O-CB 3.3Å; M328-L332 WeakPolarHBondContact O-CB 3.32Å; M328-L332 VanDerWaalsContact O-CG 3.27Å; M328-L332 WeakPolarHBondContact O-CG 3.48Å; M328-L332 PolarHBondContact O-N 3.45Å
329	I	87.2	Confident	81	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.2	-45	168.5	-68	158.3	0	0	0	110.4	L318 A321 S325 E327 T333 C364 A367 L368	L318-I329 HydrophobicContact CD2-CG2 4.26Å; A321-I329 HydrophobicContact CB-CG1 3.72Å; S325-I329 PolarHBondContact O-N 3.06Å; E327-I329 VanDerWaalsContact C-N 3.32Å; E327-I329 PolarHBondContact O-N 3.14Å; I329-T333 WeakPolarHBondContact O-CB 3.17Å; I329-T333 WeakPolarHBondContact O-CG2 3.12Å; I329-T333 PolarHBondContact O-N 3.31Å; I329-T333 PolarHBondContact O-OG1 3.11Å; I329-C364 HydrophobicContact CD1-CB 3.81Å; I329-A367 HydrophobicContact CB-CB 4.26Å; I329-A367 HydrophobicContact CD1-CB 4.13Å; I329-A367 HydrophobicContact CG2-CB 4.08Å; I329-L368 HydrophobicContact CD1-CD1 4.15Å; I329-L368 HydrophobicContact CD1-CD2 4.17Å; I329-L368 HydrophobicContact CD1-CG 3.77Å; I329-L368 HydrophobicContact CG1-CD2 4.25Å; I329-L368 HydrophobicContact CG1-CG 4.4Å; I329-L368 HydrophobicContact CG2-CD2 3.87Å; I329-L368 HydrophobicContact CG2-CG 4.26Å
330	G	84.3	Confident	80.2	Confident	32 Å²	32	46 Å²	46	33%	0.33	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-49.2	175.4	0	0	0	0	0	113.1	A326 E327 M328 L332 T333 A334	A326-G330 PolarHBondContact O-N 2.68Å; E327-G330 CarbonylContact O-C 3.19Å; E327-G330 WeakPolarHBondContact O-CA 3.44Å; E327-G330 PolarHBondContact O-N 3.08Å; M328-G330 VanDerWaalsContact C-N 3.3Å; M328-G330 PolarHBondContact O-N 3.35Å; G330-L332 VanDerWaalsContact C-N 3.33Å; G330-L332 PolarHBondContact O-N 2.77Å; G330-T333 WeakPolarHBondContact CA-OG1 3.39Å; G330-T333 PolarHBondContact O-N 3.4Å; G330-T333 PolarHBondContact O-OG1 2.93Å; G330-A334 PolarHBondContact O-N 3.24Å
331	V	84.6	Confident	79.9	Confident	29 Å²	29	45.9 Å²	45.9	18%	0.176	28%	0.28	C	S	.	.	H	α-helix	trans	-60	-41.8	178.8	173.8	0	0	0	0	111.7	T293 V296 K297 E327 M328 A334	T293-V331 HydrophobicContact CG2-CG2 3.95Å; V296-V331 HydrophobicContact CG1-CG1 4.21Å; K297-V331 HydrophobicContact CG-CG1 4.12Å; E327-V331 WeakPolarHBondContact O-CG2 3.12Å; E327-V331 PolarHBondContact O-N 3.32Å; M328-V331 PolarHBondContact O-N 3.17Å; M328-V331 HydrophobicContact SD-CB 4.33Å; M328-V331 HydrophobicContact SD-CG1 4.43Å; V331-A334 PolarHBondContact O-N 2.83Å
332	L	84.9	Confident	79.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-69	-39.3	177.8	-76.4	172.2	0	0	0	112.9	V288 V296 L300 P307 S317 A321 M328 G330 A334 L338	V288-L332 HydrophobicContact CG1-CD1 4.01Å; V288-L332 HydrophobicContact CG2-CD1 4Å; V288-L332 HydrophobicContact CG2-CD2 4.01Å; V288-L332 HydrophobicContact CG2-CG 4.34Å; V296-L332 HydrophobicContact CG1-CD2 4.23Å; L300-L332 HydrophobicContact CD1-CD2 4.23Å; P307-L332 HydrophobicContact CB-CD2 4.41Å; S317-L332 WeakPolarHBondContact O-CD1 3.32Å; A321-L332 HydrophobicContact CB-CD1 3.59Å; M328-L332 HydrophobicContact CG-CD1 4.18Å; M328-L332 HydrophobicContact CG-CG 4.46Å; M328-L332 VanDerWaalsContact O-CB 3.3Å; M328-L332 WeakPolarHBondContact O-CB 3.32Å; M328-L332 VanDerWaalsContact O-CG 3.27Å; M328-L332 WeakPolarHBondContact O-CG 3.48Å; M328-L332 PolarHBondContact O-N 3.45Å; G330-L332 VanDerWaalsContact C-N 3.33Å; G330-L332 PolarHBondContact O-N 2.77Å; L332-A334 VanDerWaalsContact C-N 3.32Å; L332-L338 HydrophobicContact CB-CD1 3.61Å; L332-L338 HydrophobicContact CD2-CD1 3.91Å; L332-L338 HydrophobicContact CG-CD1 4.24Å; L332-L338 WeakPolarHBondContact O-CD1 3.31Å
333	T	80.1	Confident	79.6	Confident	29 Å²	29	49.2 Å²	49.2	18%	0.178	30%	0.298	C	S	.	.	H	α-helix	trans	-79.4	-10	178.2	49	0	0	0	0	114.1	L318 I329 G330 S335 Q371	L318-T333 HydrophobicContact CD2-CG2 4.19Å; I329-T333 WeakPolarHBondContact O-CB 3.17Å; I329-T333 WeakPolarHBondContact O-CG2 3.12Å; I329-T333 PolarHBondContact O-N 3.31Å; I329-T333 PolarHBondContact O-OG1 3.11Å; G330-T333 WeakPolarHBondContact CA-OG1 3.39Å; G330-T333 PolarHBondContact O-N 3.4Å; G330-T333 PolarHBondContact O-OG1 2.93Å; T333-S335 PolarHBondContact O-N 3.06Å; T333-Q371 HydrophobicContact CG2-CG 4.22Å; T333-Q371 PolarHBondContact OG1-NE2 2.94Å
334	A	76.4	Confident	79.7	Confident	89 Å²	89	47.6 Å²	47.6	74%	0.736	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-5.5	173.8	0	0	0	0	0	114	G330 V331 L332	G330-A334 PolarHBondContact O-N 3.24Å; V331-A334 PolarHBondContact O-N 2.83Å; L332-A334 VanDerWaalsContact C-N 3.32Å
335	S	65.6	Low	80	Confident	36 Å²	36	50.6 Å²	50.6	25%	0.252	31%	0.31	S	S	.	.	S	Bend	trans	-116.6	133	164.8	78.7	0	0	0	0	110.2	T333 R337 L338	T333-S335 PolarHBondContact O-N 3.06Å; S335-R337 PolarHBondContact O-N 2.86Å; S335-L338 PolarHBondContact O-N 2.84Å
336	D	65.6	Low	80.1	Confident	154 Å²	154	49.7 Å²	49.7	82%	0.824	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-57.9	-14.3	-177.5	-63.7	-56.8	0	0	0	114.3	L338 A339	D336-L338 PolarHBondContact O-N 3.41Å; D336-A339 PolarHBondContact O-N 3.27Å
337	R	65	Low	79.9	Confident	139 Å²	139	55.9 Å²	55.9	53%	0.525	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-60	-14.4	-179.5	-60.9	-176.9	178.4	-171.2	0	114.8	P307 S335	P307-R337 HydrophobicContact CG-CB 4.23Å; S335-R337 PolarHBondContact O-N 2.86Å
338	L	69.3	Low	79.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-114.6	-1.3	-179.4	-87.2	178.2	0	0	0	115.2	P307 L318 L332 S335 D336 S340 C341	P307-L338 HydrophobicContact CB-CD1 3.71Å; P307-L338 HydrophobicContact CB-CD2 4.14Å; P307-L338 HydrophobicContact CB-CG 3.83Å; P307-L338 HydrophobicContact CG-CD1 4.18Å; P307-L338 HydrophobicContact CG-CD2 4.4Å; P307-L338 HydrophobicContact CG-CG 3.87Å; L318-L338 HydrophobicContact CD1-CB 4.14Å; L318-L338 HydrophobicContact CD1-CD1 4.33Å; L318-L338 HydrophobicContact CD1-CD2 4.18Å; L318-L338 HydrophobicContact CD1-CG 4.47Å; L318-L338 HydrophobicContact CG-CD1 4.11Å; L318-L338 HydrophobicContact CG-CD2 4.46Å; L332-L338 HydrophobicContact CB-CD1 3.61Å; L332-L338 HydrophobicContact CD2-CD1 3.91Å; L332-L338 HydrophobicContact CG-CD1 4.24Å; L332-L338 WeakPolarHBondContact O-CD1 3.31Å; S335-L338 PolarHBondContact O-N 2.84Å; D336-L338 PolarHBondContact O-N 3.41Å; L338-S340 PolarHBondContact O-N 3Å; L338-C341 HydrophobicContact CD2-CB 3.6Å; L338-C341 WeakPolarHBondContact O-CB 3.43Å; L338-C341 PolarHBondContact O-N 3.33Å
339	A	66.9	Low	79.4	Confident	71 Å²	71	54.5 Å²	54.5	59%	0.587	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-58.7	-36.4	-179.6	0	0	0	0	0	112.5	D336 C341	D336-A339 PolarHBondContact O-N 3.27Å; A339-C341 PolarHBondContact O-N 3.48Å
340	S	74.8	Confident	79.4	Confident	106 Å²	106	57.6 Å²	57.6	74%	0.741	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-69	-13.8	174.3	54.8	0	0	0	0	114.6	L338	L338-S340 PolarHBondContact O-N 3Å
341	C	81.6	Confident	79.7	Confident	14 Å²	14	56.2 Å²	56.2	10%	0.095	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-101	-4.3	-172.8	-68	0	0	0	0	114.5	L318 L338 A339 N343 A344	L318-C341 HydrophobicContact CD1-CB 4.14Å; L338-C341 HydrophobicContact CD2-CB 3.6Å; L338-C341 WeakPolarHBondContact O-CB 3.43Å; L338-C341 PolarHBondContact O-N 3.33Å; A339-C341 PolarHBondContact O-N 3.48Å; C341-N343 PolarHBondContact O-N 3.23Å; C341-A344 VanDerWaalsContact O-CB 3.28Å; C341-A344 WeakPolarHBondContact O-CB 3.5Å; C341-A344 PolarHBondContact O-N 3.09Å; C341-A344 VanDerWaalsContact O-N 3.17Å
342	I	86.8	Confident	80	Confident	16 Å²	16	54.8 Å²	54.8	8%	0.082	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-33	-171.9	-166.7	171	0	0	0	114.4	L318 L368 Q371 A373	L318-I342 HydrophobicContact CD1-CB 4.44Å; I342-L368 HydrophobicContact CG1-CD2 4.48Å; I342-Q371 VanDerWaalsContact CD1-C 3.4Å; I342-Q371 HydrophobicContact CD1-CB 3.52Å; I342-Q371 WeakPolarHBondContact CD1-O 3.24Å; I342-A373 HydrophobicContact CD1-CB 4.1Å; I342-A373 HydrophobicContact CG1-CB 3.98Å
343	N	87.7	Confident	80.4	Confident	53 Å²	53	54.8 Å²	54.8	28%	0.283	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	21.3	173.7	-63.1	-55.5	0	0	0	111.7	C341 G372 A373 R374	C341-N343 PolarHBondContact O-N 3.23Å; N343-G372 PolarHBondContact ND2-O 3.09Å; N343-A373 WeakPolarHBondContact OD1-CA 3.49Å; N343-R374 PolarHBondContact OD1-N 3.09Å
344	A	86.3	Confident	80.9	Confident	30 Å²	30	53.6 Å²	53.6	25%	0.248	31%	0.308	C	S	.	.			trans	-65.1	156.2	171.7	0	0	0	0	0	110.7	H319 C341 T351 P352	H319-A344 PolarHBondContact NE2-O 3.35Å; C341-A344 VanDerWaalsContact O-CB 3.28Å; C341-A344 WeakPolarHBondContact O-CB 3.5Å; C341-A344 PolarHBondContact O-N 3.09Å; C341-A344 VanDerWaalsContact O-N 3.17Å; A344-T351 WeakPolarHBondContact O-CA 3.49Å; A344-P352 VanDerWaalsContact O-CD 3.28Å; A344-P352 WeakPolarHBondContact O-CD 3.29Å
345	L	88.3	Confident	81.5	Confident	93 Å²	93	49.9 Å²	49.9	49%	0.487	28%	0.276	S	S	.	.			trans	-108.5	142.5	179.7	-56.4	175.5	0	0	0	110.4	Y350 T351 V377	L345-Y350 WeakPolarHBondContact CA-O 3.5Å; L345-T351 HydrophobicContact CD2-CG2 3.56Å; L345-V377 HydrophobicContact CD2-CG1 4.2Å
346	S	86.8	Confident	82.7	Confident	6 Å²	6	48.2 Å²	48.2	4%	0.042	26%	0.264	C	S	.	.			trans	-66.1	171.7	159.3	78.8	0	0	0	0	110.6	H319 D348 G349 Y350	H319-S346 PolarHBondContact NE2-N 3.14Å; S346-D348 PolarHBondContact O-N 3.17Å; S346-D348 PolarHBondContact OG-N 3.4Å; S346-D348 PolarHBondContact OG-OD2 2.82Å; S346-G349 PolarHBondContact O-N 3.39Å; S346-Y350 PolarHBondContact N-O 3.19Å; S346-Y350 PolarHBondContact OG-N 3.45Å
347	K	83.4	Confident	83.9	Confident	158 Å²	158	40.9 Å²	40.9	69%	0.687	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.2	171.3	-73.8	-178.8	179.9	175.5	0	112.6	K312 L313 G349	K312-K347 WeakPolarHBondContact O-CD 3.43Å; K312-K347 WeakPolarHBondContact O-CE 3.45Å; K312-K347 PolarHBondContact O-NZ 3.17Å; L313-K347 WeakPolarHBondContact O-CB 3.34Å; L313-K347 PolarHBondContact O-N 2.74Å; K347-G349 PolarHBondContact O-N 2.85Å
348	D	78.9	Confident	85	Confident	66 Å²	66	36.2 Å²	36.2	35%	0.353	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	13.2	176.6	-22.3	-79.4	0	0	0	112	S346 Y350 H380	S346-D348 PolarHBondContact O-N 3.17Å; S346-D348 PolarHBondContact OG-N 3.4Å; S346-D348 PolarHBondContact OG-OD2 2.82Å; D348-Y350 VanDerWaalsContact C-N 3.29Å; D348-Y350 HydrophobicContact CB-CD2 3.73Å; D348-Y350 HydrophobicContact CB-CE2 3.68Å; D348-Y350 PolarHBondContact O-N 3.2Å; D348-H380 PolarHBondContact O-CE1 3.35Å
349	G	83	Confident	85.8	Confident	24 Å²	24	37.8 Å²	37.8	25%	0.247	23%	0.227	C	C	.	.	S	Bend	trans	71.1	14.8	173.2	0	0	0	0	0	115.4	S346 K347 C379	S346-G349 PolarHBondContact O-N 3.39Å; K347-G349 PolarHBondContact O-N 2.85Å; G349-C379 WeakPolarHBondContact O-CB 3.42Å; G349-C379 PolarHBondContact O-SG 2.87Å
350	Y	87.5	Confident	86.6	Confident	65 Å²	65	35 Å²	35	26%	0.255	20%	0.204	S	C	.	.			trans	-93.2	134.8	179.4	-60.7	-58.7	0	0	0	112.1	H319 L345 S346 D348 F354 M355 C379 H380	H319-Y350 PolarHBondContact NE2-O 3.28Å; L345-Y350 WeakPolarHBondContact CA-O 3.5Å; S346-Y350 PolarHBondContact N-O 3.19Å; S346-Y350 PolarHBondContact OG-N 3.45Å; D348-Y350 VanDerWaalsContact C-N 3.29Å; D348-Y350 HydrophobicContact CB-CD2 3.73Å; D348-Y350 HydrophobicContact CB-CE2 3.68Å; D348-Y350 PolarHBondContact O-N 3.2Å; Y350-F354 AromaticContact CD1-CD1 3.31Å; Y350-F354 HydrophobicContact CD1-CD1 3.31Å; Y350-F354 AromaticContact CD1-CE1 3.49Å; Y350-F354 HydrophobicContact CD1-CE1 3.49Å; Y350-F354 VanDerWaalsContact CD1-CE1 3.49Å; Y350-F354 HydrophobicContact CD1-CG 4.04Å; Y350-F354 HydrophobicContact CD1-CZ 4.33Å; Y350-F354 AromaticContact CE1-CD1 3.81Å; Y350-F354 HydrophobicContact CE1-CD1 3.81Å; Y350-F354 AromaticContact CE1-CE1 3.45Å; Y350-F354 HydrophobicContact CE1-CE1 3.45Å; Y350-F354 VanDerWaalsContact CE1-CE1 3.45Å; Y350-F354 HydrophobicContact CE1-CZ 4.16Å; Y350-F354 HydrophobicContact CG-CD1 4.21Å; Y350-M355 HydrophobicContact CD2-CE 4.26Å; Y350-M355 HydrophobicContact CG-CE 4.44Å; Y350-C379 HydrophobicContact CD1-CB 3.76Å; Y350-C379 HydrophobicContact CE1-CB 4.26Å; Y350-H380 AromaticContact CE1-ND1 3.6Å; Y350-H380 AromaticContact CZ-CE1 3.78Å; Y350-H380 AromaticContact CZ-ND1 3.65Å; Y350-H380 PolarHBondContact OH-ND1 3.43Å
351	T	91.3	Very high	87.2	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.012	18%	0.183	C	C	.	.			trans	-79.7	161.5	166.9	60.6	0	0	0	0	112.1	A344 L345 L353 F354 M355 V377	A344-T351 WeakPolarHBondContact O-CA 3.49Å; L345-T351 HydrophobicContact CD2-CG2 3.56Å; T351-L353 PolarHBondContact O-N 3.48Å; T351-F354 PolarHBondContact O-N 2.96Å; T351-F354 VanDerWaalsContact O-N 3.17Å; T351-F354 WeakPolarHBondContact OG1-CB 3.31Å; T351-F354 PolarHBondContact OG1-N 3.21Å; T351-M355 WeakPolarHBondContact O-CG 3.47Å; T351-M355 PolarHBondContact O-N 3.13Å; T351-V377 HydrophobicContact CG2-CB 3.96Å; T351-V377 HydrophobicContact CG2-CG1 3.57Å; T351-V377 HydrophobicContact CG2-CG2 4.34Å
352	P	90.3	Very high	87.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-51	-41.4	166.5	-28.9	35.8	0	0	0	112.9	L318 A322 A344 M355 A356 L368	L318-P352 HydrophobicContact CB-CG 4.12Å; A322-P352 HydrophobicContact CB-CB 3.98Å; A322-P352 WeakPolarHBondContact CB-O 3.42Å; A344-P352 VanDerWaalsContact O-CD 3.28Å; A344-P352 WeakPolarHBondContact O-CD 3.29Å; P352-M355 PolarHBondContact O-N 2.87Å; P352-A356 PolarHBondContact O-N 3.13Å; P352-L368 HydrophobicContact CB-CD1 4.08Å; P352-L368 HydrophobicContact CB-CD2 4.05Å; P352-L368 WeakPolarHBondContact O-CD1 3.23Å
353	L	92.1	Very high	87.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.9	-42.7	179.1	-179.1	59.4	0	0	0	112	T351 M355 A356 V357 A365 L368 L369 A373 L375 A384	T351-L353 PolarHBondContact O-N 3.48Å; L353-M355 VanDerWaalsContact C-N 3.33Å; L353-M355 PolarHBondContact O-N 2.96Å; L353-A356 PolarHBondContact O-N 2.76Å; L353-V357 WeakPolarHBondContact O-CG2 3.47Å; L353-V357 PolarHBondContact O-N 3.3Å; L353-V357 VanDerWaalsContact O-N 3.08Å; L353-A365 HydrophobicContact CD1-CB 4.02Å; L353-L368 HydrophobicContact CD1-CB 4.29Å; L353-L369 HydrophobicContact CD1-CD1 4.36Å; L353-L369 HydrophobicContact CD1-CD2 4.31Å; L353-L369 HydrophobicContact CD1-CG 3.98Å; L353-L369 HydrophobicContact CD2-CD2 3.74Å; L353-L369 HydrophobicContact CD2-CG 4.3Å; L353-A373 HydrophobicContact CB-CB 3.99Å; L353-A373 HydrophobicContact CD2-CB 4.02Å; L353-A373 HydrophobicContact CG-CB 4.48Å; L353-L375 HydrophobicContact CD2-CD2 3.86Å; L353-L375 HydrophobicContact CD2-CG 4.2Å; L353-A384 HydrophobicContact CG-CB 4.33Å
354	F	90.9	Very high	87.8	Confident	3 Å²	3	34.3 Å²	34.3	1%	0.013	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-43	174.6	-163.5	-78.5	0	0	0	111.1	Y350 T351 A356 V357 A358 C379 E387	Y350-F354 AromaticContact CD1-CD1 3.31Å; Y350-F354 HydrophobicContact CD1-CD1 3.31Å; Y350-F354 AromaticContact CD1-CE1 3.49Å; Y350-F354 HydrophobicContact CD1-CE1 3.49Å; Y350-F354 VanDerWaalsContact CD1-CE1 3.49Å; Y350-F354 HydrophobicContact CD1-CG 4.04Å; Y350-F354 HydrophobicContact CD1-CZ 4.33Å; Y350-F354 AromaticContact CE1-CD1 3.81Å; Y350-F354 HydrophobicContact CE1-CD1 3.81Å; Y350-F354 AromaticContact CE1-CE1 3.45Å; Y350-F354 HydrophobicContact CE1-CE1 3.45Å; Y350-F354 VanDerWaalsContact CE1-CE1 3.45Å; Y350-F354 HydrophobicContact CE1-CZ 4.16Å; Y350-F354 HydrophobicContact CG-CD1 4.21Å; T351-F354 PolarHBondContact O-N 2.96Å; T351-F354 VanDerWaalsContact O-N 3.17Å; T351-F354 WeakPolarHBondContact OG1-CB 3.31Å; T351-F354 PolarHBondContact OG1-N 3.21Å; F354-A356 PolarHBondContact O-N 3.19Å; F354-V357 PolarHBondContact O-N 3.09Å; F354-A358 HydrophobicContact CD1-CB 4.42Å; F354-A358 HydrophobicContact CE1-CB 4.46Å; F354-A358 WeakPolarHBondContact O-CB 3.39Å; F354-A358 PolarHBondContact O-N 3.17Å; F354-C379 HydrophobicContact CD1-CB 4.38Å; F354-C379 HydrophobicContact CD2-CB 3.61Å; F354-C379 VanDerWaalsContact CD2-SG 3.53Å; F354-C379 HydrophobicContact CE1-CB 4.47Å; F354-C379 HydrophobicContact CE2-CB 3.72Å; F354-C379 HydrophobicContact CG-CB 3.95Å; F354-C379 HydrophobicContact CZ-CB 4.15Å; F354-E387 HydrophobicContact CD1-CG 4.46Å; F354-E387 HydrophobicContact CD2-CB 4.5Å; F354-E387 HydrophobicContact CE1-CB 4.17Å; F354-E387 HydrophobicContact CE1-CG 3.81Å; F354-E387 HydrophobicContact CE2-CB 3.79Å; F354-E387 HydrophobicContact CE2-CG 4.34Å; F354-E387 HydrophobicContact CZ-CB 3.6Å; F354-E387 HydrophobicContact CZ-CG 3.74Å
355	M	89.9	Confident	88	Confident	12 Å²	12	32.9 Å²	32.9	6%	0.059	18%	0.181	C	C	.	.	H	α-helix	trans	-63.4	-37.9	175.9	-68.5	-169.3	177.1	0	0	113.4	Q315 H319 A322 Q323 Y350 T351 P352 L353 V357 S359	Q315-M355 HydrophobicContact CG-CE 4Å; H319-M355 HydrophobicContact CB-SD 3.86Å; A322-M355 HydrophobicContact CB-CB 4.49Å; Q323-M355 HydrophobicContact CG-CB 3.93Å; Q323-M355 HydrophobicContact CG-SD 4.31Å; Q323-M355 PolarHBondContact NE2-SD 3.27Å; Q323-M355 VanDerWaalsContact NE2-SD 3.38Å; Y350-M355 HydrophobicContact CD2-CE 4.26Å; Y350-M355 HydrophobicContact CG-CE 4.44Å; T351-M355 WeakPolarHBondContact O-CG 3.47Å; T351-M355 PolarHBondContact O-N 3.13Å; P352-M355 PolarHBondContact O-N 2.87Å; L353-M355 VanDerWaalsContact C-N 3.33Å; L353-M355 PolarHBondContact O-N 2.96Å; M355-V357 VanDerWaalsContact C-N 3.33Å; M355-V357 PolarHBondContact O-N 3.25Å; M355-S359 WeakPolarHBondContact O-CB 3.26Å; M355-S359 PolarHBondContact O-N 3.1Å; M355-S359 PolarHBondContact O-OG 3.03Å
356	A	90.9	Very high	88.1	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-36.4	175.2	0	0	0	0	0	112.4	A322 P352 L353 F354 R361 C364 A365 L368	A322-A356 HydrophobicContact CB-CB 4.18Å; P352-A356 PolarHBondContact O-N 3.13Å; L353-A356 PolarHBondContact O-N 2.76Å; F354-A356 PolarHBondContact O-N 3.19Å; A356-R361 PolarHBondContact O-N 3.49Å; A356-C364 HydrophobicContact CB-CB 4Å; A356-A365 HydrophobicContact CB-CB 4.36Å; A356-L368 HydrophobicContact CB-CD1 3.87Å
357	V	90.7	Very high	88.2	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-70.9	-50.8	174	174.8	0	0	0	0	111.5	L353 F354 M355 S359 A360 A384 E387 A388 L399 L403	L353-V357 WeakPolarHBondContact O-CG2 3.47Å; L353-V357 PolarHBondContact O-N 3.3Å; L353-V357 VanDerWaalsContact O-N 3.08Å; F354-V357 PolarHBondContact O-N 3.09Å; M355-V357 VanDerWaalsContact C-N 3.33Å; M355-V357 PolarHBondContact O-N 3.25Å; V357-S359 PolarHBondContact O-N 2.89Å; V357-S359 VanDerWaalsContact O-N 3.16Å; V357-A360 WeakPolarHBondContact O-CA 3.42Å; V357-A360 PolarHBondContact O-N 3.48Å; V357-A384 WeakPolarHBondContact CG1-O 3.28Å; V357-A384 HydrophobicContact CG2-CB 4.2Å; V357-E387 HydrophobicContact CG1-CB 4.07Å; V357-E387 HydrophobicContact CG1-CG 3.99Å; V357-A388 HydrophobicContact CG1-CB 3.68Å; V357-L399 HydrophobicContact CG1-CD2 3.98Å; V357-L399 HydrophobicContact CG2-CD1 4.3Å; V357-L403 HydrophobicContact CG2-CD1 4.09Å; V357-L403 HydrophobicContact CG2-CD2 3.93Å
358	A	87.3	Confident	88.5	Confident	41 Å²	41	23.7 Å²	23.7	34%	0.339	15%	0.147	S	C	.	.	H	α-helix	trans	-58.9	-27.6	178.6	0	0	0	0	0	112.5	F354 A360 E387 Q391	F354-A358 HydrophobicContact CD1-CB 4.42Å; F354-A358 HydrophobicContact CE1-CB 4.46Å; F354-A358 WeakPolarHBondContact O-CB 3.39Å; F354-A358 PolarHBondContact O-N 3.17Å; A358-A360 VanDerWaalsContact C-N 3.34Å; A358-E387 HydrophobicContact CB-CG 4.05Å; A358-Q391 PolarHBondContact O-NE2 3.35Å; A358-Q391 VanDerWaalsContact O-NE2 3.08Å; A358-Q391 PolarHBondContact O-OE1 2.83Å
359	S	85.7	Confident	89	Confident	33 Å²	33	21.9 Å²	21.9	23%	0.231	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	4.5	173.6	-59.6	0	0	0	0	114.9	M355 V357 R361	M355-S359 WeakPolarHBondContact O-CB 3.26Å; M355-S359 PolarHBondContact O-N 3.1Å; M355-S359 PolarHBondContact O-OG 3.03Å; V357-S359 PolarHBondContact O-N 2.89Å; V357-S359 VanDerWaalsContact O-N 3.16Å; S359-R361 VanDerWaalsContact C-N 3.31Å; S359-R361 PolarHBondContact O-N 2.91Å
360	A	84.8	Confident	89.2	Confident	14 Å²	14	29.6 Å²	29.6	12%	0.116	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	42.6	-174.2	0	0	0	0	0	114.8	V357 A358 P362 K395	V357-A360 WeakPolarHBondContact O-CA 3.42Å; V357-A360 PolarHBondContact O-N 3.48Å; A358-A360 VanDerWaalsContact C-N 3.34Å; A360-P362 WeakPolarHBondContact O-CD 3.48Å; A360-K395 HydrophobicContact CB-CB 4.4Å; A360-K395 VanDerWaalsContact O-CD 3.28Å; A360-K395 WeakPolarHBondContact O-CD 3.33Å
361	R	88.1	Confident	89.1	Confident	79 Å²	79	31.1 Å²	31.1	30%	0.298	17%	0.174	S	C	.	.			trans	-106.7	83.7	-178.8	-76.3	-174.6	164.2	83.3	-10.5	112.7	Q323 T324 A356 S359 S363 C364 A365	Q323-R361 PolarHBondContact O-NE 3.44Å; Q323-R361 PolarHBondContact O-NH1 2.9Å; Q323-R361 PolarHBondContact O-NH2 2.89Å; T324-R361 PolarHBondContact O-NE 3.48Å; A356-R361 PolarHBondContact O-N 3.49Å; S359-R361 VanDerWaalsContact C-N 3.31Å; S359-R361 PolarHBondContact O-N 2.91Å; R361-S363 VanDerWaalsContact C-N 3.29Å; R361-S363 PolarHBondContact O-N 3.23Å; R361-C364 HydrophobicContact CB-CB 3.85Å; R361-C364 PolarHBondContact O-N 3.07Å; R361-C364 VanDerWaalsContact O-N 3.09Å; R361-A365 PolarHBondContact O-N 3.4Å
362	P	87.9	Confident	88.9	Confident	24 Å²	24	33.1 Å²	33.1	16%	0.156	20%	0.195	C	C	.	.	H	α-helix	trans	-55.9	-37.3	178.9	18.5	-31.1	0	0	0	114	A360 C364 A366 N398	A360-P362 WeakPolarHBondContact O-CD 3.48Å; P362-C364 PolarHBondContact O-N 3.28Å; P362-A366 WeakPolarHBondContact O-CB 3.48Å; P362-A366 PolarHBondContact O-N 2.84Å; P362-N398 HydrophobicContact CB-CB 4.27Å; P362-N398 HydrophobicContact CG-CB 4.1Å
363	S	90.4	Very high	88.8	Confident	71 Å²	71	33.6 Å²	33.6	50%	0.497	20%	0.199	S	C	.	.	H	α-helix	trans	-66.2	-36.4	178.1	51.3	0	0	0	0	113.1	A326 R361 A367	A326-S363 WeakPolarHBondContact CB-O 3.31Å; R361-S363 VanDerWaalsContact C-N 3.29Å; R361-S363 PolarHBondContact O-N 3.23Å; S363-A367 WeakPolarHBondContact O-CB 3.33Å; S363-A367 PolarHBondContact O-N 3.18Å
364	C	90	Very high	88.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-76.6	-39.5	179.7	-59.5	0	0	0	0	110.8	A322 A326 I329 A356 R361 P362 A366 A367 L368	A322-C364 WeakPolarHBondContact O-CB 3.4Å; A326-C364 PolarHBondContact N-SG 2.98Å; A326-C364 VanDerWaalsContact N-SG 3.35Å; I329-C364 HydrophobicContact CD1-CB 3.81Å; A356-C364 HydrophobicContact CB-CB 4Å; R361-C364 HydrophobicContact CB-CB 3.85Å; R361-C364 PolarHBondContact O-N 3.07Å; R361-C364 VanDerWaalsContact O-N 3.09Å; P362-C364 PolarHBondContact O-N 3.28Å; C364-A366 PolarHBondContact O-N 2.86Å; C364-A367 PolarHBondContact O-N 3.1Å; C364-L368 WeakPolarHBondContact O-CG 3.48Å; C364-L368 PolarHBondContact O-N 2.79Å
365	A	90.5	Very high	88.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.8	-47.5	169.5	0	0	0	0	0	111.2	L353 A356 R361 A367 L368 L369 L399 T402	L353-A365 HydrophobicContact CD1-CB 4.02Å; A356-A365 HydrophobicContact CB-CB 4.36Å; R361-A365 PolarHBondContact O-N 3.4Å; A365-A367 PolarHBondContact O-N 3.29Å; A365-L368 PolarHBondContact O-N 2.98Å; A365-L369 WeakPolarHBondContact O-CB 3.34Å; A365-L369 VanDerWaalsContact O-CD1 3.28Å; A365-L369 WeakPolarHBondContact O-CD1 3.3Å; A365-L369 WeakPolarHBondContact O-CG 3.45Å; A365-L369 PolarHBondContact O-N 3.16Å; A365-L399 HydrophobicContact CB-CD1 4.34Å; A365-T402 HydrophobicContact CB-CG2 4.3Å
366	A	89.8	Confident	87.7	Confident	42 Å²	42	43.3 Å²	43.3	35%	0.347	24%	0.241	S	C	.	.	H	α-helix	trans	-59.3	-41.7	176.9	0	0	0	0	0	113.2	P362 C364 K370 T402	P362-A366 WeakPolarHBondContact O-CB 3.48Å; P362-A366 PolarHBondContact O-N 2.84Å; C364-A366 PolarHBondContact O-N 2.86Å; A366-K370 WeakPolarHBondContact O-CB 3.3Å; A366-K370 PolarHBondContact O-N 2.89Å; A366-T402 HydrophobicContact CB-CG2 3.77Å
367	A	88.8	Confident	87.3	Confident	21 Å²	21	45 Å²	45	17%	0.174	25%	0.251	C	S	.	.	H	α-helix	trans	-67	-41.1	178	0	0	0	0	0	112.5	A326 I329 S363 C364 A365 K370 Q371	A326-A367 HydrophobicContact CB-CB 4.02Å; I329-A367 HydrophobicContact CB-CB 4.26Å; I329-A367 HydrophobicContact CD1-CB 4.13Å; I329-A367 HydrophobicContact CG2-CB 4.08Å; S363-A367 WeakPolarHBondContact O-CB 3.33Å; S363-A367 PolarHBondContact O-N 3.18Å; C364-A367 PolarHBondContact O-N 3.1Å; A365-A367 PolarHBondContact O-N 3.29Å; A367-K370 PolarHBondContact O-N 2.94Å; A367-Q371 WeakPolarHBondContact O-CG 3.12Å; A367-Q371 PolarHBondContact O-N 3.46Å
368	L	90.2	Very high	86.8	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-67.5	-44.6	176.5	-70.4	165.2	0	0	0	111.9	L318 A322 I329 I342 P352 L353 A356 C364 A365 K370 Q371 G372 A373	L318-L368 HydrophobicContact CD2-CD2 4.27Å; A322-L368 HydrophobicContact CB-CD1 3.76Å; I329-L368 HydrophobicContact CD1-CD1 4.15Å; I329-L368 HydrophobicContact CD1-CD2 4.17Å; I329-L368 HydrophobicContact CD1-CG 3.77Å; I329-L368 HydrophobicContact CG1-CD2 4.25Å; I329-L368 HydrophobicContact CG1-CG 4.4Å; I329-L368 HydrophobicContact CG2-CD2 3.87Å; I329-L368 HydrophobicContact CG2-CG 4.26Å; I342-L368 HydrophobicContact CG1-CD2 4.48Å; P352-L368 HydrophobicContact CB-CD1 4.08Å; P352-L368 HydrophobicContact CB-CD2 4.05Å; P352-L368 WeakPolarHBondContact O-CD1 3.23Å; L353-L368 HydrophobicContact CD1-CB 4.29Å; A356-L368 HydrophobicContact CB-CD1 3.87Å; C364-L368 WeakPolarHBondContact O-CG 3.48Å; C364-L368 PolarHBondContact O-N 2.79Å; A365-L368 PolarHBondContact O-N 2.98Å; L368-K370 VanDerWaalsContact C-N 3.31Å; L368-K370 PolarHBondContact O-N 2.95Å; L368-Q371 CarbonylContact O-C 3.6Å; L368-Q371 PolarHBondContact O-N 3.05Å; L368-Q371 VanDerWaalsContact O-N 3.09Å; L368-G372 PolarHBondContact O-N 3.09Å; L368-A373 HydrophobicContact CB-CB 3.79Å; L368-A373 VanDerWaalsContact O-CB 3.24Å; L368-A373 WeakPolarHBondContact O-CB 3.48Å; L368-A373 PolarHBondContact O-N 3.11Å
369	L	89.3	Confident	86.3	Confident	29 Å²	29	48.1 Å²	48.1	15%	0.152	26%	0.255	C	S	.	.	H	α-helix	trans	-58.8	-43.5	175.4	-70.6	160.1	0	0	0	111.2	L353 A365 Q371 G372 L375 T402 L403 A406	L353-L369 HydrophobicContact CD1-CD1 4.36Å; L353-L369 HydrophobicContact CD1-CD2 4.31Å; L353-L369 HydrophobicContact CD1-CG 3.98Å; L353-L369 HydrophobicContact CD2-CD2 3.74Å; L353-L369 HydrophobicContact CD2-CG 4.3Å; A365-L369 WeakPolarHBondContact O-CB 3.34Å; A365-L369 VanDerWaalsContact O-CD1 3.28Å; A365-L369 WeakPolarHBondContact O-CD1 3.3Å; A365-L369 WeakPolarHBondContact O-CG 3.45Å; A365-L369 PolarHBondContact O-N 3.16Å; L369-Q371 PolarHBondContact O-N 3.17Å; L369-G372 PolarHBondContact O-N 3.42Å; L369-G372 VanDerWaalsContact O-N 3.11Å; L369-L375 HydrophobicContact CD2-CD1 3.98Å; L369-L375 HydrophobicContact CD2-CD2 4.02Å; L369-L375 HydrophobicContact CD2-CG 3.75Å; L369-T402 HydrophobicContact CD1-CG2 4.26Å; L369-L403 HydrophobicContact CD1-CD2 4.19Å; L369-A406 HydrophobicContact CB-CB 4.29Å; L369-A406 HydrophobicContact CD1-CB 3.76Å; L369-A406 HydrophobicContact CD2-CB 4.08Å; L369-A406 HydrophobicContact CG-CB 4.25Å
370	K	86.9	Confident	85.8	Confident	185 Å²	185	52 Å²	52	80%	0.804	27%	0.269	S	S	*	.	H	α-helix	trans	-61.2	-28.2	176.3	-174.7	176.1	177.4	-174.7	0	113.4	A366 A367 L368	A366-K370 WeakPolarHBondContact O-CB 3.3Å; A366-K370 PolarHBondContact O-N 2.89Å; A367-K370 PolarHBondContact O-N 2.94Å; L368-K370 VanDerWaalsContact C-N 3.31Å; L368-K370 PolarHBondContact O-N 2.95Å
371	Q	86.1	Confident	85.2	Confident	98 Å²	98	52.1 Å²	52.1	46%	0.458	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	3.8	178	-62.1	-68	40.8	0	0	113.8	T333 I342 A367 L368 L369	T333-Q371 HydrophobicContact CG2-CG 4.22Å; T333-Q371 PolarHBondContact OG1-NE2 2.94Å; I342-Q371 VanDerWaalsContact CD1-C 3.4Å; I342-Q371 HydrophobicContact CD1-CB 3.52Å; I342-Q371 WeakPolarHBondContact CD1-O 3.24Å; A367-Q371 WeakPolarHBondContact O-CG 3.12Å; A367-Q371 PolarHBondContact O-N 3.46Å; L368-Q371 CarbonylContact O-C 3.6Å; L368-Q371 PolarHBondContact O-N 3.05Å; L368-Q371 VanDerWaalsContact O-N 3.09Å; L369-Q371 PolarHBondContact O-N 3.17Å
372	G	87.2	Confident	84.9	Confident	44 Å²	44	50.8 Å²	50.8	45%	0.454	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	20.8	176.3	0	0	0	0	0	116	N343 L368 L369	N343-G372 PolarHBondContact ND2-O 3.09Å; L368-G372 PolarHBondContact O-N 3.09Å; L369-G372 PolarHBondContact O-N 3.42Å; L369-G372 VanDerWaalsContact O-N 3.11Å
373	A	88.2	Confident	84.8	Confident	9 Å²	9	49.7 Å²	49.7	7%	0.074	26%	0.26	C	S	.	.			trans	-69	137.1	171.1	0	0	0	0	0	111.6	I342 N343 L353 L368	I342-A373 HydrophobicContact CD1-CB 4.1Å; I342-A373 HydrophobicContact CG1-CB 3.98Å; N343-A373 WeakPolarHBondContact OD1-CA 3.49Å; L353-A373 HydrophobicContact CB-CB 3.99Å; L353-A373 HydrophobicContact CD2-CB 4.02Å; L353-A373 HydrophobicContact CG-CB 4.48Å; L368-A373 HydrophobicContact CB-CB 3.79Å; L368-A373 VanDerWaalsContact O-CB 3.24Å; L368-A373 WeakPolarHBondContact O-CB 3.48Å; L368-A373 PolarHBondContact O-N 3.11Å
374	R	86.2	Confident	84.6	Confident	137 Å²	137	46.4 Å²	46.4	52%	0.517	24%	0.237	S	C	.	.			trans	-95.2	130.2	-170.7	-84.9	178.8	72	169.6	3	113	N343 D376 V377	N343-R374 PolarHBondContact OD1-N 3.09Å; R374-D376 WeakPolarHBondContact CB-OD1 3.45Å; R374-D376 IonicContact CZ-OD1 3.83Å; R374-D376 IonicContact CZ-OD2 3.91Å; R374-D376 IonicContact NE-OD1 3.17Å; R374-D376 PolarHBondContact NE-OD1 3.05Å; R374-D376 IonicContact NE-OD2 2.76Å; R374-D376 PolarHBondContact NE-OD2 3.36Å; R374-D376 IonicContact NH2-OD1 3.56Å; R374-D376 IonicContact NH2-OD2 3.17Å; R374-D376 PolarHBondContact NH2-OD2 3.16Å; R374-V377 HydrophobicContact CB-CG2 3.75Å
375	L	84.8	Confident	84.5	Confident	13 Å²	13	46.4 Å²	46.4	7%	0.068	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-22.1	176.9	-74	165.8	0	0	0	113.5	L353 L369 V377 A384 V385 L403	L353-L375 HydrophobicContact CD2-CD2 3.86Å; L353-L375 HydrophobicContact CD2-CG 4.2Å; L369-L375 HydrophobicContact CD2-CD1 3.98Å; L369-L375 HydrophobicContact CD2-CD2 4.02Å; L369-L375 HydrophobicContact CD2-CG 3.75Å; L375-V377 VanDerWaalsContact C-N 3.29Å; L375-V377 PolarHBondContact O-N 3.04Å; L375-A384 HydrophobicContact CD2-CB 4.08Å; L375-V385 HydrophobicContact CD2-CG2 4.45Å; L375-L403 HydrophobicContact CD2-CD2 3.68Å
376	D	78.3	Confident	84.4	Confident	70 Å²	70	46.4 Å²	46.4	37%	0.374	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	14.6	-177	65.5	-38	0	0	0	113.7	R374 Y378	R374-D376 WeakPolarHBondContact CB-OD1 3.45Å; R374-D376 IonicContact CZ-OD1 3.83Å; R374-D376 IonicContact CZ-OD2 3.91Å; R374-D376 IonicContact NE-OD1 3.17Å; R374-D376 PolarHBondContact NE-OD1 3.05Å; R374-D376 IonicContact NE-OD2 2.76Å; R374-D376 PolarHBondContact NE-OD2 3.36Å; R374-D376 IonicContact NH2-OD1 3.56Å; R374-D376 IonicContact NH2-OD2 3.17Å; R374-D376 PolarHBondContact NH2-OD2 3.16Å; D376-Y378 WeakPolarHBondContact O-CD2 3.34Å
377	V	82.5	Confident	84.3	Confident	34 Å²	34	45.5 Å²	45.5	21%	0.206	23%	0.226	C	C	.	.			trans	-88.1	112.1	170.1	-170.8	0	0	0	0	109.6	L345 T351 R374 L375	L345-V377 HydrophobicContact CD2-CG1 4.2Å; T351-V377 HydrophobicContact CG2-CB 3.96Å; T351-V377 HydrophobicContact CG2-CG1 3.57Å; T351-V377 HydrophobicContact CG2-CG2 4.34Å; R374-V377 HydrophobicContact CB-CG2 3.75Å; L375-V377 VanDerWaalsContact C-N 3.29Å; L375-V377 PolarHBondContact O-N 3.04Å
378	Y	80.3	Confident	84.4	Confident	105 Å²	105	44.5 Å²	44.5	41%	0.412	22%	0.217	S	C	.	.			trans	-81.6	128.4	178.5	-63.5	-98.6	0	0	0	110.8	D376 R382 H386 I413 A416	D376-Y378 WeakPolarHBondContact O-CD2 3.34Å; Y378-R382 WeakPolarHBondContact CA-O 3.32Å; Y378-H386 AromaticContact CE1-CE1 3.87Å; Y378-I413 HydrophobicContact CE1-CG2 4.38Å; Y378-I413 WeakPolarHBondContact OH-CG2 3.23Å; Y378-A416 HydrophobicContact CE1-CB 4.4Å
379	C	77.9	Confident	84.3	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.014	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-119.7	113.2	175.7	-47.6	0	0	0	0	107.2	G349 Y350 F354 R382	G349-C379 WeakPolarHBondContact O-CB 3.42Å; G349-C379 PolarHBondContact O-SG 2.87Å; Y350-C379 HydrophobicContact CD1-CB 3.76Å; Y350-C379 HydrophobicContact CE1-CB 4.26Å; F354-C379 HydrophobicContact CD1-CB 4.38Å; F354-C379 HydrophobicContact CD2-CB 3.61Å; F354-C379 VanDerWaalsContact CD2-SG 3.53Å; F354-C379 HydrophobicContact CE1-CB 4.47Å; F354-C379 HydrophobicContact CE2-CB 3.72Å; F354-C379 HydrophobicContact CG-CB 3.95Å; F354-C379 HydrophobicContact CZ-CB 4.15Å; C379-R382 PolarHBondContact N-O 2.99Å; C379-R382 PolarHBondContact O-N 3.08Å
380	H	73.5	Confident	84.2	Confident	114 Å²	114	46.3 Å²	46.3	53%	0.528	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	62.1	-172	-59.4	101.4	0	0	0	113	D348 Y350 R382	D348-H380 PolarHBondContact O-CE1 3.35Å; Y350-H380 AromaticContact CE1-ND1 3.6Å; Y350-H380 AromaticContact CZ-CE1 3.78Å; Y350-H380 AromaticContact CZ-ND1 3.65Å; Y350-H380 PolarHBondContact OH-ND1 3.43Å; H380-R382 PolarHBondContact O-N 3.49Å
381	G	73.5	Confident	84.1	Confident	17 Å²	17	39 Å²	39	18%	0.175	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.1	-15.1	178.8	0	0	0	0	0	116.1
382	R	80.1	Confident	83.5	Confident	51 Å²	51	42.1 Å²	42.1	19%	0.192	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-113	139	-168.8	-72.2	177.3	-59.9	125.7	11.5	112.4	Y378 C379 H380 H386 E387 E415	Y378-R382 WeakPolarHBondContact CA-O 3.32Å; C379-R382 PolarHBondContact N-O 2.99Å; C379-R382 PolarHBondContact O-N 3.08Å; H380-R382 PolarHBondContact O-N 3.49Å; R382-H386 HydrophobicContact CB-CB 3.95Å; R382-H386 HydrophobicContact CG-CB 4.1Å; R382-E387 IonicContact CZ-OE2 2.77Å; R382-E387 IonicContact NH1-OE2 3.6Å; R382-E387 PolarHBondContact NH1-OE2 2.8Å; R382-E387 IonicContact NH2-OE2 2.99Å; R382-E415 VanDerWaalsContact CD-OE1 3.3Å; R382-E415 WeakPolarHBondContact CD-OE1 3.47Å; R382-E415 HydrophobicContact CG-CG 4.28Å; R382-E415 WeakPolarHBondContact CG-OE1 3.28Å
383	S	86.3	Confident	82.7	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.007	21%	0.205	C	C	.	.			trans	-78.9	168.7	170.8	69.5	0	0	0	0	111.7	V385 H386 E387	S383-V385 PolarHBondContact O-N 3.11Å; S383-V385 VanDerWaalsContact O-N 3.14Å; S383-V385 PolarHBondContact OG-N 3.16Å; S383-V385 VanDerWaalsContact OG-N 3.16Å; S383-H386 PolarHBondContact N-ND1 3.09Å; S383-H386 PolarHBondContact O-N 2.99Å; S383-H386 VanDerWaalsContact O-N 3.13Å; S383-H386 PolarHBondContact OG-N 2.93Å; S383-H386 VanDerWaalsContact OG-N 3.15Å; S383-H386 PolarHBondContact OG-ND1 3.48Å; S383-E387 PolarHBondContact O-N 3.48Å; S383-E387 VanDerWaalsContact O-N 3.1Å
384	A	87	Confident	81.8	Confident	2 Å²	2	47.5 Å²	47.5	2%	0.017	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-16.5	167.9	0	0	0	0	0	113.3	L353 V357 L375	L353-A384 HydrophobicContact CG-CB 4.33Å; V357-A384 WeakPolarHBondContact CG1-O 3.28Å; V357-A384 HydrophobicContact CG2-CB 4.2Å; L375-A384 HydrophobicContact CD2-CB 4.08Å
385	V	88.3	Confident	81.5	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-82.2	-41.3	172.4	-179.8	0	0	0	0	111.3	L375 S383 A388 M389 F411	L375-V385 HydrophobicContact CD2-CG2 4.45Å; S383-V385 PolarHBondContact O-N 3.11Å; S383-V385 VanDerWaalsContact O-N 3.14Å; S383-V385 PolarHBondContact OG-N 3.16Å; S383-V385 VanDerWaalsContact OG-N 3.16Å; V385-A388 WeakPolarHBondContact O-CB 3.25Å; V385-A388 PolarHBondContact O-N 3.36Å; V385-M389 WeakPolarHBondContact O-CG 3.38Å; V385-M389 PolarHBondContact O-N 3.26Å; V385-F411 HydrophobicContact CG1-CB 4.46Å; V385-F411 HydrophobicContact CG1-CD1 3.46Å; V385-F411 VanDerWaalsContact CG1-CD1 3.46Å; V385-F411 HydrophobicContact CG1-CD2 4.06Å; V385-F411 HydrophobicContact CG1-CE1 3.55Å; V385-F411 HydrophobicContact CG1-CE2 4.08Å; V385-F411 HydrophobicContact CG1-CG 3.75Å; V385-F411 HydrophobicContact CG1-CZ 3.86Å; V385-F411 HydrophobicContact CG2-CD2 4.32Å; V385-F411 HydrophobicContact CG2-CE2 4.12Å; V385-F411 HydrophobicContact CG2-CZ 4.46Å
386	H	88.2	Confident	81.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.5	-40.5	177.8	-57.5	131.4	0	0	0	111.8	Y378 R382 S383 A388 M389 I413 A414 E415 V425	Y378-H386 AromaticContact CE1-CE1 3.87Å; R382-H386 HydrophobicContact CB-CB 3.95Å; R382-H386 HydrophobicContact CG-CB 4.1Å; S383-H386 PolarHBondContact N-ND1 3.09Å; S383-H386 PolarHBondContact O-N 2.99Å; S383-H386 VanDerWaalsContact O-N 3.13Å; S383-H386 PolarHBondContact OG-N 2.93Å; S383-H386 VanDerWaalsContact OG-N 3.15Å; S383-H386 PolarHBondContact OG-ND1 3.48Å; H386-A388 VanDerWaalsContact C-N 3.33Å; H386-A388 PolarHBondContact O-N 2.87Å; H386-M389 WeakPolarHBondContact O-CB 3.48Å; H386-M389 PolarHBondContact O-N 3.21Å; H386-I413 WeakPolarHBondContact CE1-CG2 3.38Å; H386-I413 PolarHBondContact NE2-O 2.72Å; H386-A414 PolarHBondContact CE1-O 3.08Å; H386-A414 VanDerWaalsContact NE2-C 3.29Å; H386-A414 WeakPolarHBondContact NE2-CA 3.37Å; H386-E415 WeakPolarHBondContact CE1-CA 3.35Å; H386-E415 PolarHBondContact CE1-N 3.02Å; H386-E415 PolarHBondContact NE2-N 3.37Å; H386-V425 HydrophobicContact CB-CG1 4.31Å; H386-V425 WeakPolarHBondContact O-CG1 3.3Å
387	E	87.9	Confident	81.5	Confident	23 Å²	23	46.8 Å²	46.8	11%	0.107	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-40.9	172.8	-177.7	53.2	-133.9	0	0	111.8	F354 V357 A358 R382 S383 M389 L390 Q391	F354-E387 HydrophobicContact CD1-CG 4.46Å; F354-E387 HydrophobicContact CD2-CB 4.5Å; F354-E387 HydrophobicContact CE1-CB 4.17Å; F354-E387 HydrophobicContact CE1-CG 3.81Å; F354-E387 HydrophobicContact CE2-CB 3.79Å; F354-E387 HydrophobicContact CE2-CG 4.34Å; F354-E387 HydrophobicContact CZ-CB 3.6Å; F354-E387 HydrophobicContact CZ-CG 3.74Å; V357-E387 HydrophobicContact CG1-CB 4.07Å; V357-E387 HydrophobicContact CG1-CG 3.99Å; A358-E387 HydrophobicContact CB-CG 4.05Å; R382-E387 IonicContact CZ-OE2 2.77Å; R382-E387 IonicContact NH1-OE2 3.6Å; R382-E387 PolarHBondContact NH1-OE2 2.8Å; R382-E387 IonicContact NH2-OE2 2.99Å; S383-E387 PolarHBondContact O-N 3.48Å; S383-E387 VanDerWaalsContact O-N 3.1Å; E387-M389 PolarHBondContact O-N 3.01Å; E387-M389 VanDerWaalsContact O-N 3.17Å; E387-L390 PolarHBondContact O-N 3.45Å; E387-L390 VanDerWaalsContact O-N 3.09Å; E387-Q391 WeakPolarHBondContact O-CG 3.29Å; E387-Q391 PolarHBondContact O-N 2.85Å; E387-Q391 PolarHBondContact OE1-NE2 2.88Å
388	A	89.2	Confident	81.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.1	-24.6	177.6	0	0	0	0	0	113.9	V357 V385 H386 L399 L403	V357-A388 HydrophobicContact CG1-CB 3.68Å; V385-A388 WeakPolarHBondContact O-CB 3.25Å; V385-A388 PolarHBondContact O-N 3.36Å; H386-A388 VanDerWaalsContact C-N 3.33Å; H386-A388 PolarHBondContact O-N 2.87Å; A388-L399 HydrophobicContact CB-CD2 4.17Å; A388-L399 HydrophobicContact CB-CG 4.44Å; A388-L403 HydrophobicContact CB-CD1 3.4Å; A388-L403 VanDerWaalsContact CB-CD1 3.4Å
389	M	89.4	Confident	81.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-77.3	-20.2	177.3	-66.3	-58.9	106.7	0	0	113.6	V385 H386 E387 I400 F411 A422 V425 A426 G427 T431 L435	V385-M389 WeakPolarHBondContact O-CG 3.38Å; V385-M389 PolarHBondContact O-N 3.26Å; H386-M389 WeakPolarHBondContact O-CB 3.48Å; H386-M389 PolarHBondContact O-N 3.21Å; E387-M389 PolarHBondContact O-N 3.01Å; E387-M389 VanDerWaalsContact O-N 3.17Å; M389-I400 HydrophobicContact CE-CD1 3.47Å; M389-I400 VanDerWaalsContact CE-CD1 3.47Å; M389-I400 HydrophobicContact CE-CG1 3.55Å; M389-I400 HydrophobicContact CE-CG2 4.34Å; M389-I400 HydrophobicContact SD-CD1 4.46Å; M389-F411 HydrophobicContact CE-CD1 4.42Å; M389-F411 HydrophobicContact CE-CE1 3.75Å; M389-A422 HydrophobicContact CG-CB 3.83Å; M389-A422 WeakPolarHBondContact CG-O 3.47Å; M389-A422 HydrophobicContact SD-CB 3.95Å; M389-V425 HydrophobicContact CB-CB 4.09Å; M389-V425 HydrophobicContact CB-CG1 4Å; M389-A426 CarbonylContact O-C 3.49Å; M389-A426 WeakPolarHBondContact O-CA 3.43Å; M389-G427 PolarHBondContact O-N 3.46Å; M389-T431 WeakPolarHBondContact O-CB 3.45Å; M389-T431 VanDerWaalsContact O-CG2 3.28Å; M389-T431 WeakPolarHBondContact O-CG2 3.41Å; M389-T431 PolarHBondContact O-OG1 3.42Å; M389-L435 HydrophobicContact SD-CB 4.45Å; M389-L435 HydrophobicContact SD-CD2 4.02Å
390	L	86.5	Confident	82.3	Confident	66 Å²	66	43.4 Å²	43.4	35%	0.346	23%	0.226	S	C	.	.	H	α-helix	trans	-90	-20.8	179.2	-67.6	162.5	0	0	0	112.8	E387 V425	E387-L390 PolarHBondContact O-N 3.45Å; E387-L390 VanDerWaalsContact O-N 3.09Å; L390-V425 HydrophobicContact CD1-CG1 4.05Å; L390-V425 HydrophobicContact CD2-CG1 4.07Å; L390-V425 WeakPolarHBondContact CD2-O 3.49Å; L390-V425 HydrophobicContact CG-CG1 3.78Å
391	Q	84.6	Confident	82.9	Confident	31 Å²	31	44.2 Å²	44.2	15%	0.145	22%	0.224	C	C	.	.			trans	-59.5	143.8	-176	-71.2	-65.8	-42.1	0	0	113.1	A358 E387 V396 L399 N428 T431	A358-Q391 PolarHBondContact O-NE2 3.35Å; A358-Q391 VanDerWaalsContact O-NE2 3.08Å; A358-Q391 PolarHBondContact O-OE1 2.83Å; E387-Q391 WeakPolarHBondContact O-CG 3.29Å; E387-Q391 PolarHBondContact O-N 2.85Å; E387-Q391 PolarHBondContact OE1-NE2 2.88Å; Q391-V396 HydrophobicContact CB-CG2 3.9Å; Q391-V396 VanDerWaalsContact O-CG2 3.32Å; Q391-V396 WeakPolarHBondContact O-CG2 3.45Å; Q391-L399 HydrophobicContact CG-CD2 4.25Å; Q391-N428 PolarHBondContact O-ND2 2.91Å; Q391-T431 VanDerWaalsContact O-CG2 3.32Å; Q391-T431 WeakPolarHBondContact O-CG2 3.42Å
392	K	73.5	Confident	83.6	Confident	165 Å²	165	44.6 Å²	44.6	72%	0.717	22%	0.223	S	C	*	.			trans	-117.4	141.5	-177.3	-64.2	-178.2	-178.8	179.1	0	111
393	G	70.4	Confident	84	Confident	39 Å²	39	42.1 Å²	42.1	40%	0.402	21%	0.214	S	C	.	.	S	Bend	trans	106.3	179.1	173.2	0	0	0	0	0	115.6	K395 V396	G393-K395 VanDerWaalsContact C-N 3.3Å; G393-K395 PolarHBondContact O-N 2.73Å; G393-V396 WeakPolarHBondContact O-CB 3.48Å; G393-V396 WeakPolarHBondContact O-CG2 2.93Å; G393-V396 PolarHBondContact O-N 2.81Å
394	P	70.2	Confident	84	Confident	127 Å²	127	43.7 Å²	43.7	83%	0.825	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.5	-162.7	26.6	-35.9	0	0	0	115.1	V396	P394-V396 VanDerWaalsContact C-N 3.31Å
395	K	78.5	Confident	83.9	Confident	123 Å²	123	47.5 Å²	47.5	54%	0.535	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.3	179.6	-65.3	-178	-176.7	174.3	0	113.3	A360 G393 F397 N398 L399	A360-K395 HydrophobicContact CB-CB 4.4Å; A360-K395 VanDerWaalsContact O-CD 3.28Å; A360-K395 WeakPolarHBondContact O-CD 3.33Å; G393-K395 VanDerWaalsContact C-N 3.3Å; G393-K395 PolarHBondContact O-N 2.73Å; K395-F397 VanDerWaalsContact C-N 3.32Å; K395-F397 PolarHBondContact O-N 3.1Å; K395-N398 PolarHBondContact O-N 3.05Å; K395-N398 VanDerWaalsContact O-N 3.13Å; K395-L399 PolarHBondContact O-N 2.97Å
396	V	81.5	Confident	83.7	Confident	1 Å²	1	50 Å²	50	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-49.3	-47.3	-177.5	164.2	0	0	0	0	112.7	Q391 G393 P394 N398 L399 I400 T431 A434	Q391-V396 HydrophobicContact CB-CG2 3.9Å; Q391-V396 VanDerWaalsContact O-CG2 3.32Å; Q391-V396 WeakPolarHBondContact O-CG2 3.45Å; G393-V396 WeakPolarHBondContact O-CB 3.48Å; G393-V396 WeakPolarHBondContact O-CG2 2.93Å; G393-V396 PolarHBondContact O-N 2.81Å; P394-V396 VanDerWaalsContact C-N 3.31Å; V396-N398 VanDerWaalsContact C-N 3.34Å; V396-N398 PolarHBondContact O-N 3.3Å; V396-L399 WeakPolarHBondContact O-CB 3.33Å; V396-L399 PolarHBondContact O-N 3.4Å; V396-L399 VanDerWaalsContact O-N 3.12Å; V396-I400 HydrophobicContact CG1-CD1 3.64Å; V396-I400 HydrophobicContact CG1-CG1 4.43Å; V396-I400 WeakPolarHBondContact O-CG1 3.42Å; V396-I400 PolarHBondContact O-N 3.16Å; V396-T431 HydrophobicContact CG1-CG2 3.45Å; V396-T431 VanDerWaalsContact CG1-CG2 3.45Å; V396-T431 HydrophobicContact CG2-CG2 4.43Å; V396-A434 HydrophobicContact CG1-CB 4.48Å
397	F	81.6	Confident	83.5	Confident	80 Å²	80	51.3 Å²	51.3	35%	0.351	28%	0.282	S	S	.	.	H	α-helix	trans	-60.5	-43.4	-177.6	-169.9	-79.6	0	0	0	112	K395 R401 A434 A437	K395-F397 VanDerWaalsContact C-N 3.32Å; K395-F397 PolarHBondContact O-N 3.1Å; F397-R401 VanDerWaalsContact O-CB 3.27Å; F397-R401 WeakPolarHBondContact O-CB 3.41Å; F397-R401 PolarHBondContact O-N 3.12Å; F397-A434 HydrophobicContact CB-CB 4.22Å; F397-A434 HydrophobicContact CD2-CB 3.62Å; F397-A434 HydrophobicContact CE2-CB 4.33Å; F397-A434 HydrophobicContact CG-CB 4.18Å; F397-A437 HydrophobicContact CE2-CB 3.63Å; F397-A437 HydrophobicContact CZ-CB 3.84Å
398	N	84.4	Confident	83.1	Confident	71 Å²	71	53.4 Å²	53.4	38%	0.38	30%	0.298	S	S	.	.	H	α-helix	trans	-71.7	-32.4	176.6	-83.2	-53.4	0	0	0	112.6	P362 K395 V396 R401 T402	P362-N398 HydrophobicContact CB-CB 4.27Å; P362-N398 HydrophobicContact CG-CB 4.1Å; K395-N398 PolarHBondContact O-N 3.05Å; K395-N398 VanDerWaalsContact O-N 3.13Å; V396-N398 VanDerWaalsContact C-N 3.34Å; V396-N398 PolarHBondContact O-N 3.3Å; N398-R401 PolarHBondContact OD1-NE 3.13Å; N398-R401 PolarHBondContact OD1-NH2 3.38Å; N398-T402 WeakPolarHBondContact O-CB 3.42Å; N398-T402 PolarHBondContact O-N 3.25Å; N398-T402 PolarHBondContact O-OG1 3.14Å; N398-T402 VanDerWaalsContact O-OG1 3.11Å
399	L	87.1	Confident	82.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.9	-50.5	174.8	-176.5	65.5	0	0	0	111.4	V357 A365 A388 Q391 K395 V396 R401 T402 L403	V357-L399 HydrophobicContact CG1-CD2 3.98Å; V357-L399 HydrophobicContact CG2-CD1 4.3Å; A365-L399 HydrophobicContact CB-CD1 4.34Å; A388-L399 HydrophobicContact CB-CD2 4.17Å; A388-L399 HydrophobicContact CB-CG 4.44Å; Q391-L399 HydrophobicContact CG-CD2 4.25Å; K395-L399 PolarHBondContact O-N 2.97Å; V396-L399 WeakPolarHBondContact O-CB 3.33Å; V396-L399 PolarHBondContact O-N 3.4Å; V396-L399 VanDerWaalsContact O-N 3.12Å; L399-R401 VanDerWaalsContact C-N 3.34Å; L399-R401 PolarHBondContact O-N 3.29Å; L399-T402 PolarHBondContact O-N 3.44Å; L399-L403 HydrophobicContact CD1-CD1 4.49Å; L399-L403 HydrophobicContact CG-CD1 4.25Å; L399-L403 WeakPolarHBondContact O-CG 3.36Å; L399-L403 PolarHBondContact O-N 3.33Å
400	I	87	Confident	82.3	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-60.6	-44.9	177	-68.2	171.8	0	0	0	110.4	M389 V396 T402 L403 H404 F411 T431 A434 C438	M389-I400 HydrophobicContact CE-CD1 3.47Å; M389-I400 VanDerWaalsContact CE-CD1 3.47Å; M389-I400 HydrophobicContact CE-CG1 3.55Å; M389-I400 HydrophobicContact CE-CG2 4.34Å; M389-I400 HydrophobicContact SD-CD1 4.46Å; V396-I400 HydrophobicContact CG1-CD1 3.64Å; V396-I400 HydrophobicContact CG1-CG1 4.43Å; V396-I400 WeakPolarHBondContact O-CG1 3.42Å; V396-I400 PolarHBondContact O-N 3.16Å; I400-T402 VanDerWaalsContact C-N 3.34Å; I400-T402 PolarHBondContact O-N 3.37Å; I400-L403 PolarHBondContact O-N 3.15Å; I400-H404 VanDerWaalsContact O-CB 3.24Å; I400-H404 WeakPolarHBondContact O-CB 3.36Å; I400-H404 PolarHBondContact O-N 3.44Å; I400-F411 HydrophobicContact CG2-CE1 4Å; I400-F411 HydrophobicContact CG2-CZ 4.24Å; I400-T431 HydrophobicContact CD1-CG2 4.45Å; I400-A434 HydrophobicContact CB-CB 4.43Å; I400-A434 HydrophobicContact CD1-CB 3.68Å; I400-C438 HydrophobicContact CG2-CB 4.34Å
401	R	86.7	Confident	82	Confident	130 Å²	130	58.3 Å²	58.3	49%	0.491	32%	0.32	S	S	.	.	H	α-helix	trans	-60.6	-38.9	175.3	-168.3	179.2	68.2	83.6	-0.4	113.1	F397 N398 L399 A405	F397-R401 VanDerWaalsContact O-CB 3.27Å; F397-R401 WeakPolarHBondContact O-CB 3.41Å; F397-R401 PolarHBondContact O-N 3.12Å; N398-R401 PolarHBondContact OD1-NE 3.13Å; N398-R401 PolarHBondContact OD1-NH2 3.38Å; L399-R401 VanDerWaalsContact C-N 3.34Å; L399-R401 PolarHBondContact O-N 3.29Å; R401-A405 WeakPolarHBondContact O-CB 3.49Å; R401-A405 PolarHBondContact O-N 2.97Å
402	T	86.9	Confident	81.7	Confident	25 Å²	25	62.2 Å²	62.2	15%	0.153	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-48.2	175.9	-74.2	0	0	0	0	111.9	A365 A366 L369 N398 L399 I400 A405 A406	A365-T402 HydrophobicContact CB-CG2 4.3Å; A366-T402 HydrophobicContact CB-CG2 3.77Å; L369-T402 HydrophobicContact CD1-CG2 4.26Å; N398-T402 WeakPolarHBondContact O-CB 3.42Å; N398-T402 PolarHBondContact O-N 3.25Å; N398-T402 PolarHBondContact O-OG1 3.14Å; N398-T402 VanDerWaalsContact O-OG1 3.11Å; L399-T402 PolarHBondContact O-N 3.44Å; I400-T402 VanDerWaalsContact C-N 3.34Å; I400-T402 PolarHBondContact O-N 3.37Å; T402-A405 PolarHBondContact O-N 3.47Å; T402-A406 PolarHBondContact O-N 3.18Å
403	L	88.3	Confident	81.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.5	-44.7	-179.5	-63.9	168.1	0	0	0	110.6	V357 L369 L375 A388 L399 I400 A405 A406 S407 F411	V357-L403 HydrophobicContact CG2-CD1 4.09Å; V357-L403 HydrophobicContact CG2-CD2 3.93Å; L369-L403 HydrophobicContact CD1-CD2 4.19Å; L375-L403 HydrophobicContact CD2-CD2 3.68Å; A388-L403 HydrophobicContact CB-CD1 3.4Å; A388-L403 VanDerWaalsContact CB-CD1 3.4Å; L399-L403 HydrophobicContact CD1-CD1 4.49Å; L399-L403 HydrophobicContact CG-CD1 4.25Å; L399-L403 WeakPolarHBondContact O-CG 3.36Å; L399-L403 PolarHBondContact O-N 3.33Å; I400-L403 PolarHBondContact O-N 3.15Å; L403-A405 VanDerWaalsContact C-N 3.32Å; L403-A405 PolarHBondContact O-N 2.76Å; L403-A406 PolarHBondContact O-N 2.95Å; L403-A406 VanDerWaalsContact O-N 3.11Å; L403-S407 PolarHBondContact O-N 3.29Å; L403-F411 HydrophobicContact CB-CE2 3.92Å; L403-F411 HydrophobicContact CB-CZ 3.83Å
404	H	86.9	Confident	82.4	Confident	34 Å²	34	56.4 Å²	56.4	16%	0.157	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-34.3	178.4	-174.6	-93.1	0	0	0	112.5	I400 A406 S407 P408 F411 C438	I400-H404 VanDerWaalsContact O-CB 3.24Å; I400-H404 WeakPolarHBondContact O-CB 3.36Å; I400-H404 PolarHBondContact O-N 3.44Å; H404-A406 VanDerWaalsContact C-N 3.26Å; H404-A406 PolarHBondContact O-N 3.34Å; H404-S407 CarbonylContact O-C 3.38Å; H404-P408 VanDerWaalsContact O-CD 3.28Å; H404-P408 WeakPolarHBondContact O-CD 3.45Å; H404-P408 WeakPolarHBondContact O-CG 3.44Å; H404-F411 VanDerWaalsContact CA-CE2 3.48Å; H404-F411 HydrophobicContact CB-CD2 4.33Å; H404-F411 HydrophobicContact CB-CE2 3.76Å; H404-F411 HydrophobicContact CB-CZ 4.04Å; H404-C438 HydrophobicContact CB-CB 4.27Å; H404-C438 PolarHBondContact CE1-O 2.68Å
405	A	85.9	Confident	82.9	Confident	82 Å²	82	51.5 Å²	51.5	68%	0.678	28%	0.281	S	S	*	.	H	α-helix	trans	-71.4	-17.7	175.2	0	0	0	0	0	113.9	R401 T402 L403	R401-A405 WeakPolarHBondContact O-CB 3.49Å; R401-A405 PolarHBondContact O-N 2.97Å; T402-A405 PolarHBondContact O-N 3.47Å; L403-A405 VanDerWaalsContact C-N 3.32Å; L403-A405 PolarHBondContact O-N 2.76Å
406	A	83.2	Confident	82.9	Confident	54 Å²	54	48.6 Å²	48.6	45%	0.446	28%	0.28	S	S	.	.	H	α-helix	trans	-94.5	-36.4	176.2	0	0	0	0	0	112.8	L369 T402 L403 H404	L369-A406 HydrophobicContact CB-CB 4.29Å; L369-A406 HydrophobicContact CD1-CB 3.76Å; L369-A406 HydrophobicContact CD2-CB 4.08Å; L369-A406 HydrophobicContact CG-CB 4.25Å; T402-A406 PolarHBondContact O-N 3.18Å; L403-A406 PolarHBondContact O-N 2.95Å; L403-A406 VanDerWaalsContact O-N 3.11Å; H404-A406 VanDerWaalsContact C-N 3.26Å; H404-A406 PolarHBondContact O-N 3.34Å
407	S	83.2	Confident	82.8	Confident	27 Å²	27	55.8 Å²	55.8	19%	0.189	31%	0.314	C	S	.	.			trans	-153.2	103	169.8	179.3	0	0	0	0	110.3	L403 H404 E409 S410	L403-S407 PolarHBondContact O-N 3.29Å; H404-S407 CarbonylContact O-C 3.38Å; S407-E409 VanDerWaalsContact C-N 3.27Å; S407-E409 PolarHBondContact O-N 3.01Å; S407-S410 WeakPolarHBondContact CB-OG 3.3Å; S407-S410 WeakPolarHBondContact OG-CB 3.24Å; S407-S410 PolarHBondContact OG-N 3.3Å; S407-S410 PolarHBondContact OG-OG 3.29Å
408	P	80.7	Confident	82.9	Confident	67 Å²	67	54.1 Å²	54.1	44%	0.435	31%	0.31	S	S	.	.	S	Bend	trans	-61.2	-39.1	171.8	-22.8	33.1	0	0	0	111.8	H404 S410 F411	H404-P408 VanDerWaalsContact O-CD 3.28Å; H404-P408 WeakPolarHBondContact O-CD 3.45Å; H404-P408 WeakPolarHBondContact O-CG 3.44Å; P408-S410 VanDerWaalsContact C-N 3.28Å; P408-S410 PolarHBondContact O-N 3.43Å; P408-F411 PolarHBondContact O-N 3.25Å
409	E	80.8	Confident	83	Confident	153 Å²	153	50.9 Å²	50.9	72%	0.715	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-64.4	-31.5	-175.4	-63.2	178.4	-169.3	0	0	112.5	S407 F411 N412	S407-E409 VanDerWaalsContact C-N 3.27Å; S407-E409 PolarHBondContact O-N 3.01Å; E409-F411 PolarHBondContact O-N 2.96Å; E409-N412 WeakPolarHBondContact O-CB 3.27Å; E409-N412 PolarHBondContact O-N 2.96Å
410	S	79.9	Confident	83	Confident	15 Å²	15	51.9 Å²	51.9	11%	0.105	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-64	-11.3	178.2	-63	0	0	0	0	114.2	S407 P408	S407-S410 WeakPolarHBondContact CB-OG 3.3Å; S407-S410 WeakPolarHBondContact OG-CB 3.24Å; S407-S410 PolarHBondContact OG-N 3.3Å; S407-S410 PolarHBondContact OG-OG 3.29Å; P408-S410 VanDerWaalsContact C-N 3.28Å; P408-S410 PolarHBondContact O-N 3.43Å
411	F	81	Confident	83.1	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-82	-17.8	172	-76.1	-103.3	0	0	0	113.8	V385 M389 I400 L403 H404 P408 E409 I413 L435 F442	V385-F411 HydrophobicContact CG1-CB 4.46Å; V385-F411 HydrophobicContact CG1-CD1 3.46Å; V385-F411 VanDerWaalsContact CG1-CD1 3.46Å; V385-F411 HydrophobicContact CG1-CD2 4.06Å; V385-F411 HydrophobicContact CG1-CE1 3.55Å; V385-F411 HydrophobicContact CG1-CE2 4.08Å; V385-F411 HydrophobicContact CG1-CG 3.75Å; V385-F411 HydrophobicContact CG1-CZ 3.86Å; V385-F411 HydrophobicContact CG2-CD2 4.32Å; V385-F411 HydrophobicContact CG2-CE2 4.12Å; V385-F411 HydrophobicContact CG2-CZ 4.46Å; M389-F411 HydrophobicContact CE-CD1 4.42Å; M389-F411 HydrophobicContact CE-CE1 3.75Å; I400-F411 HydrophobicContact CG2-CE1 4Å; I400-F411 HydrophobicContact CG2-CZ 4.24Å; L403-F411 HydrophobicContact CB-CE2 3.92Å; L403-F411 HydrophobicContact CB-CZ 3.83Å; H404-F411 VanDerWaalsContact CA-CE2 3.48Å; H404-F411 HydrophobicContact CB-CD2 4.33Å; H404-F411 HydrophobicContact CB-CE2 3.76Å; H404-F411 HydrophobicContact CB-CZ 4.04Å; P408-F411 PolarHBondContact O-N 3.25Å; E409-F411 PolarHBondContact O-N 2.96Å; F411-I413 VanDerWaalsContact C-N 3.27Å; F411-L435 HydrophobicContact CD1-CD1 3.46Å; F411-L435 VanDerWaalsContact CD1-CD1 3.46Å; F411-L435 HydrophobicContact CE1-CD1 3.92Å; F411-L435 HydrophobicContact CG-CD1 4.38Å; F411-F442 HydrophobicContact CB-CE2 4.19Å; F411-F442 WeakPolarHBondContact O-CE2 3.45Å
412	N	78.3	Confident	83.2	Confident	113 Å²	113	46.3 Å²	46.3	60%	0.604	28%	0.28	S	S	*	.	S	Bend	trans	-83.7	-4.8	175.1	-60	-27.5	0	0	0	112.5	E409	E409-N412 WeakPolarHBondContact O-CB 3.27Å; E409-N412 PolarHBondContact O-N 2.96Å
413	I	77.3	Confident	83.3	Confident	42 Å²	42	45.1 Å²	45.1	22%	0.215	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-70.5	132	176	-62.3	175	0	0	0	109.8	Y378 H386 F411	Y378-I413 HydrophobicContact CE1-CG2 4.38Å; Y378-I413 WeakPolarHBondContact OH-CG2 3.23Å; H386-I413 WeakPolarHBondContact CE1-CG2 3.38Å; H386-I413 PolarHBondContact NE2-O 2.72Å; F411-I413 VanDerWaalsContact C-N 3.27Å
414	A	80.5	Confident	83.4	Confident	41 Å²	41	45.5 Å²	45.5	34%	0.339	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-86.3	149.7	172.8	0	0	0	0	0	111.9	H386	H386-A414 PolarHBondContact CE1-O 3.08Å; H386-A414 VanDerWaalsContact NE2-C 3.29Å; H386-A414 WeakPolarHBondContact NE2-CA 3.37Å
415	E	82.2	Confident	83.5	Confident	24 Å²	24	44.5 Å²	44.5	11%	0.112	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-64.4	129.7	169.3	178	175.4	-112.3	0	0	110.1	R382 H386 E417 T418 G419 N420	R382-E415 VanDerWaalsContact CD-OE1 3.3Å; R382-E415 WeakPolarHBondContact CD-OE1 3.47Å; R382-E415 HydrophobicContact CG-CG 4.28Å; R382-E415 WeakPolarHBondContact CG-OE1 3.28Å; H386-E415 WeakPolarHBondContact CE1-CA 3.35Å; H386-E415 PolarHBondContact CE1-N 3.02Å; H386-E415 PolarHBondContact NE2-N 3.37Å; E415-E417 VanDerWaalsContact C-N 3.29Å; E415-E417 PolarHBondContact O-N 3.09Å; E415-T418 WeakPolarHBondContact CB-OG1 3.43Å; E415-T418 WeakPolarHBondContact CG-OG1 3.47Å; E415-T418 PolarHBondContact O-N 3.24Å; E415-T418 WeakPolarHBondContact OE2-CG2 3.48Å; E415-T418 PolarHBondContact OE2-OG1 2.93Å; E415-G419 PolarHBondContact O-N 2.94Å; E415-N420 HydrophobicContact CB-CB 4.01Å; E415-N420 PolarHBondContact N-O 2.74Å; E415-N420 WeakPolarHBondContact OE2-CB 3.5Å; E415-N420 PolarHBondContact OE2-ND2 3.34Å
416	A	78.1	Confident	83.6	Confident	61 Å²	61	40.6 Å²	40.6	50%	0.504	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-24.2	-160.8	0	0	0	0	0	114.8	Y378	Y378-A416 HydrophobicContact CE1-CB 4.4Å
417	E	79.6	Confident	83.5	Confident	152 Å²	152	39.3 Å²	39.3	71%	0.71	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-19.8	-176.6	-66.1	172.6	-160.8	0	0	113	E415	E415-E417 VanDerWaalsContact C-N 3.29Å; E415-E417 PolarHBondContact O-N 3.09Å
418	T	83.1	Confident	83.5	Confident	45 Å²	45	39.4 Å²	39.4	28%	0.276	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-19.7	-165.7	60.6	0	0	0	0	113.9	E415 N420 N448 F449	E415-T418 WeakPolarHBondContact CB-OG1 3.43Å; E415-T418 WeakPolarHBondContact CG-OG1 3.47Å; E415-T418 PolarHBondContact O-N 3.24Å; E415-T418 WeakPolarHBondContact OE2-CG2 3.48Å; E415-T418 PolarHBondContact OE2-OG1 2.93Å; T418-N420 WeakPolarHBondContact CB-ND2 3.45Å; T418-N420 PolarHBondContact O-N 2.93Å; T418-N420 VanDerWaalsContact OG1-CB 3.27Å; T418-N420 WeakPolarHBondContact OG1-CB 3.37Å; T418-N420 PolarHBondContact OG1-N 3.46Å; T418-N420 PolarHBondContact OG1-ND2 3.44Å; T418-N448 WeakPolarHBondContact O-CB 3.47Å; T418-F449 WeakPolarHBondContact O-CB 3.37Å; T418-F449 WeakPolarHBondContact O-CG 3.5Å; T418-F449 PolarHBondContact O-N 3.21Å
419	G	85.7	Confident	83.6	Confident	4 Å²	4	37.7 Å²	37.7	4%	0.041	22%	0.215	C	C	.	.			trans	74.3	5.2	-168.6	0	0	0	0	0	113.6	E415 S421 N448 F449	E415-G419 PolarHBondContact O-N 2.94Å; G419-S421 PolarHBondContact O-N 3.01Å; G419-S421 VanDerWaalsContact O-N 3.16Å; G419-N448 WeakPolarHBondContact O-CA 3.46Å; G419-F449 VanDerWaalsContact CA-CE1 3.5Å; G419-F449 VanDerWaalsContact N-CD2 3.28Å; G419-F449 VanDerWaalsContact N-CE2 3.27Å
420	N	88.3	Confident	83.7	Confident	21 Å²	21	34.4 Å²	34.4	11%	0.112	20%	0.199	C	C	.	.			trans	-64.4	116.5	-175.8	-73.2	-28.8	0	0	0	111.5	E415 T418 H424 V425 N448 L457	E415-N420 HydrophobicContact CB-CB 4.01Å; E415-N420 PolarHBondContact N-O 2.74Å; E415-N420 WeakPolarHBondContact OE2-CB 3.5Å; E415-N420 PolarHBondContact OE2-ND2 3.34Å; T418-N420 WeakPolarHBondContact CB-ND2 3.45Å; T418-N420 PolarHBondContact O-N 2.93Å; T418-N420 VanDerWaalsContact OG1-CB 3.27Å; T418-N420 WeakPolarHBondContact OG1-CB 3.37Å; T418-N420 PolarHBondContact OG1-N 3.46Å; T418-N420 PolarHBondContact OG1-ND2 3.44Å; N420-H424 HydrophobicContact CB-CB 3.72Å; N420-V425 HydrophobicContact CB-CG2 3.75Å; N420-N448 WeakPolarHBondContact OD1-CB 3.27Å; N420-N448 PolarHBondContact OD1-ND2 2.96Å; N420-N448 VanDerWaalsContact OD1-ND2 3.16Å; N420-L457 WeakPolarHBondContact OD1-CD1 3.26Å
421	S	89.6	Confident	84	Confident	12 Å²	12	33.7 Å²	33.7	8%	0.084	19%	0.194	C	C	.	.			trans	-69.1	166.8	165.9	81.6	0	0	0	0	111.7	G419 L423 H424 V425 S446	G419-S421 PolarHBondContact O-N 3.01Å; G419-S421 VanDerWaalsContact O-N 3.16Å; S421-L423 PolarHBondContact O-N 3.42Å; S421-H424 PolarHBondContact N-ND1 3.21Å; S421-H424 VanDerWaalsContact N-ND1 3.13Å; S421-H424 WeakPolarHBondContact O-CB 3.45Å; S421-H424 PolarHBondContact O-N 2.72Å; S421-H424 PolarHBondContact OG-CE1 3.3Å; S421-H424 PolarHBondContact OG-ND1 3.12Å; S421-V425 PolarHBondContact O-N 3.05Å; S421-S446 PolarHBondContact OG-OG 3.12Å
422	A	88.1	Confident	84.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-50.8	-31.6	178.9	0	0	0	0	0	115	M389 A426 L435 F442	M389-A422 HydrophobicContact CG-CB 3.83Å; M389-A422 WeakPolarHBondContact CG-O 3.47Å; M389-A422 HydrophobicContact SD-CB 3.95Å; A422-A426 PolarHBondContact O-N 3.07Å; A422-L435 HydrophobicContact CB-CD2 3.79Å; A422-F442 HydrophobicContact CB-CE2 4.06Å; A422-F442 HydrophobicContact CB-CZ 3.91Å
423	L	89.3	Confident	84.6	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-72.1	-31.5	175.9	-78.5	176	0	0	0	114.2	S421 A426 I432 L435 F442 L444 A454 H458 L470	S421-L423 PolarHBondContact O-N 3.42Å; L423-A426 WeakPolarHBondContact O-CB 3.48Å; L423-I432 HydrophobicContact CD2-CG1 4.43Å; L423-I432 HydrophobicContact CD2-CG2 3.91Å; L423-L435 HydrophobicContact CD2-CD2 3.85Å; L423-L435 HydrophobicContact CG-CD2 3.92Å; L423-F442 HydrophobicContact CB-CE1 4.17Å; L423-F442 HydrophobicContact CD1-CD1 3.38Å; L423-F442 HydrophobicContact CD1-CE1 3.57Å; L423-F442 HydrophobicContact CD1-CG 4.5Å; L423-F442 HydrophobicContact CG-CD1 3.71Å; L423-F442 HydrophobicContact CG-CE1 3.59Å; L423-F442 HydrophobicContact CG-CZ 4.43Å; L423-L444 HydrophobicContact CD1-CD2 3.87Å; L423-A454 HydrophobicContact CB-CB 3.75Å; L423-H458 PolarHBondContact O-NE2 2.9Å; L423-L470 HydrophobicContact CD2-CD2 4.33Å
424	H	90.7	Very high	84.9	Confident	8 Å²	8	28.1 Å²	28.1	4%	0.037	17%	0.165	C	C	.	.	H	α-helix	trans	-69.1	-42.7	175.4	-61.6	91.9	0	0	0	110.4	N420 S421 A426 S446 Q452 T453 A454 L457	N420-H424 HydrophobicContact CB-CB 3.72Å; S421-H424 PolarHBondContact N-ND1 3.21Å; S421-H424 VanDerWaalsContact N-ND1 3.13Å; S421-H424 WeakPolarHBondContact O-CB 3.45Å; S421-H424 PolarHBondContact O-N 2.72Å; S421-H424 PolarHBondContact OG-CE1 3.3Å; S421-H424 PolarHBondContact OG-ND1 3.12Å; H424-A426 PolarHBondContact O-N 3.31Å; H424-S446 PolarHBondContact CE1-O 3.35Å; H424-S446 PolarHBondContact CE1-OG 3.24Å; H424-S446 VanDerWaalsContact CE1-OG 3.28Å; H424-S446 PolarHBondContact NE2-O 3.46Å; H424-Q452 PolarHBondContact NE2-O 3.17Å; H424-Q452 VanDerWaalsContact NE2-O 3.08Å; H424-T453 WeakPolarHBondContact NE2-CA 3.1Å; H424-A454 PolarHBondContact CD2-N 3.47Å; H424-A454 PolarHBondContact NE2-N 3.26Å; H424-A454 VanDerWaalsContact NE2-N 3.16Å; H424-L457 HydrophobicContact CB-CD1 4.07Å
425	V	88.3	Confident	85.2	Confident	13 Å²	13	26.1 Å²	26.1	8%	0.079	15%	0.149	C	C	.	.	H	α-helix	trans	-73.3	-13.8	-180	-172.5	0	0	0	0	112.6	H386 M389 L390 N420 S421 G427	H386-V425 HydrophobicContact CB-CG1 4.31Å; H386-V425 WeakPolarHBondContact O-CG1 3.3Å; M389-V425 HydrophobicContact CB-CB 4.09Å; M389-V425 HydrophobicContact CB-CG1 4Å; L390-V425 HydrophobicContact CD1-CG1 4.05Å; L390-V425 HydrophobicContact CD2-CG1 4.07Å; L390-V425 WeakPolarHBondContact CD2-O 3.49Å; L390-V425 HydrophobicContact CG-CG1 3.78Å; N420-V425 HydrophobicContact CB-CG2 3.75Å; S421-V425 PolarHBondContact O-N 3.05Å; V425-G427 PolarHBondContact O-N 2.93Å
426	A	88	Confident	85.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.			trans	-64.3	97.5	-173.1	0	0	0	0	0	113.9	M389 A422 L423 H424 N428 I432 H458	M389-A426 CarbonylContact O-C 3.49Å; M389-A426 WeakPolarHBondContact O-CA 3.43Å; A422-A426 PolarHBondContact O-N 3.07Å; L423-A426 WeakPolarHBondContact O-CB 3.48Å; H424-A426 PolarHBondContact O-N 3.31Å; A426-N428 VanDerWaalsContact C-N 3.26Å; A426-N428 PolarHBondContact O-N 3.45Å; A426-N428 VanDerWaalsContact O-N 3.11Å; A426-I432 HydrophobicContact CB-CD1 4.17Å; A426-I432 HydrophobicContact CB-CG1 3.41Å; A426-I432 VanDerWaalsContact CB-CG1 3.41Å; A426-H458 PolarHBondContact O-CE1 2.66Å
427	G	80.9	Confident	85.5	Confident	28 Å²	28	25.2 Å²	25.2	29%	0.289	14%	0.143	S	C	.	.			trans	-74	0.9	-168.9	0	0	0	0	0	116.9	M389 V425	M389-G427 PolarHBondContact O-N 3.46Å; V425-G427 PolarHBondContact O-N 2.93Å
428	N	83.6	Confident	85.6	Confident	29 Å²	29	19 Å²	19	16%	0.155	12%	0.117	C	C	.	.	S	Bend	trans	-163.9	163.4	177.6	59.6	86.7	0	0	0	112.7	Q391 A426 Q430 T431 I432 C466	Q391-N428 PolarHBondContact O-ND2 2.91Å; A426-N428 VanDerWaalsContact C-N 3.26Å; A426-N428 PolarHBondContact O-N 3.45Å; A426-N428 VanDerWaalsContact O-N 3.11Å; N428-Q430 PolarHBondContact O-N 3.09Å; N428-Q430 VanDerWaalsContact O-N 3.09Å; N428-Q430 WeakPolarHBondContact OD1-CA 3.45Å; N428-Q430 VanDerWaalsContact OD1-CB 3.25Å; N428-Q430 WeakPolarHBondContact OD1-CB 3.23Å; N428-Q430 PolarHBondContact OD1-N 3.13Å; N428-Q430 VanDerWaalsContact OD1-N 3.09Å; N428-T431 PolarHBondContact N-OG1 3.08Å; N428-T431 WeakPolarHBondContact ND2-CG2 3.38Å; N428-T431 PolarHBondContact O-N 3.5Å; N428-T431 PolarHBondContact O-OG1 2.94Å; N428-T431 PolarHBondContact OD1-N 2.87Å; N428-I432 PolarHBondContact O-N 3.27Å; N428-C466 VanDerWaalsContact CA-SG 3.58Å
429	K	82.4	Confident	85.5	Confident	30 Å²	30	18.2 Å²	18.2	13%	0.13	11%	0.111	C	C	.	.	H	α-helix	trans	-57.1	-30.4	-178.9	74	172.7	-176.2	-178	0	113.2	L433 P465 C466 V469 D626 E630	K429-L433 WeakPolarHBondContact O-CB 3.18Å; K429-L433 VanDerWaalsContact O-CG 3.29Å; K429-L433 WeakPolarHBondContact O-CG 3.37Å; K429-L433 PolarHBondContact O-N 3.36Å; K429-P465 HydrophobicContact CB-CB 4.05Å; K429-P465 HydrophobicContact CD-CB 4.14Å; K429-P465 HydrophobicContact CG-CB 4.36Å; K429-C466 PolarHBondContact N-SG 3.46Å; K429-V469 HydrophobicContact CB-CG2 3.94Å; K429-D626 VanDerWaalsContact NZ-CG 3.26Å; K429-D626 IonicContact NZ-OD1 2.61Å; K429-D626 IonicContact NZ-OD2 2.97Å; K429-D626 PolarHBondContact NZ-OD2 3.46Å; K429-E630 WeakPolarHBondContact CE-OE2 3.19Å; K429-E630 IonicContact NZ-OE1 2.74Å; K429-E630 PolarHBondContact NZ-OE1 3.24Å; K429-E630 IonicContact NZ-OE2 2.92Å; K429-E630 PolarHBondContact NZ-OE2 3.32Å
430	Q	82.8	Confident	85.2	Confident	84 Å²	84	20.1 Å²	20.1	39%	0.393	12%	0.122	S	C	.	.	H	α-helix	trans	-76.1	-33	-177.5	-157.4	66.2	20.5	0	0	112.9	N428 A434	N428-Q430 PolarHBondContact O-N 3.09Å; N428-Q430 VanDerWaalsContact O-N 3.09Å; N428-Q430 WeakPolarHBondContact OD1-CA 3.45Å; N428-Q430 VanDerWaalsContact OD1-CB 3.25Å; N428-Q430 WeakPolarHBondContact OD1-CB 3.23Å; N428-Q430 PolarHBondContact OD1-N 3.13Å; N428-Q430 VanDerWaalsContact OD1-N 3.09Å; Q430-A434 WeakPolarHBondContact O-CB 3.45Å; Q430-A434 PolarHBondContact O-N 2.89Å
431	T	86.4	Confident	84.7	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-68.1	-40.5	173.7	53.6	0	0	0	0	110.8	M389 Q391 V396 I400 N428 A434 L435	M389-T431 WeakPolarHBondContact O-CB 3.45Å; M389-T431 VanDerWaalsContact O-CG2 3.28Å; M389-T431 WeakPolarHBondContact O-CG2 3.41Å; M389-T431 PolarHBondContact O-OG1 3.42Å; Q391-T431 VanDerWaalsContact O-CG2 3.32Å; Q391-T431 WeakPolarHBondContact O-CG2 3.42Å; V396-T431 HydrophobicContact CG1-CG2 3.45Å; V396-T431 VanDerWaalsContact CG1-CG2 3.45Å; V396-T431 HydrophobicContact CG2-CG2 4.43Å; I400-T431 HydrophobicContact CD1-CG2 4.45Å; N428-T431 PolarHBondContact N-OG1 3.08Å; N428-T431 WeakPolarHBondContact ND2-CG2 3.38Å; N428-T431 PolarHBondContact O-N 3.5Å; N428-T431 PolarHBondContact O-OG1 2.94Å; N428-T431 PolarHBondContact OD1-N 2.87Å; T431-A434 PolarHBondContact O-N 2.74Å; T431-L435 WeakPolarHBondContact O-CB 3.41Å; T431-L435 PolarHBondContact O-N 2.94Å
432	I	87.7	Confident	84.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.7	-49.4	173.5	-59.9	179.7	0	0	0	111.4	L423 A426 N428 A434 L435 L436 C466 V469 L470	L423-I432 HydrophobicContact CD2-CG1 4.43Å; L423-I432 HydrophobicContact CD2-CG2 3.91Å; A426-I432 HydrophobicContact CB-CD1 4.17Å; A426-I432 HydrophobicContact CB-CG1 3.41Å; A426-I432 VanDerWaalsContact CB-CG1 3.41Å; N428-I432 PolarHBondContact O-N 3.27Å; I432-A434 VanDerWaalsContact C-N 3.33Å; I432-A434 PolarHBondContact O-N 2.98Å; I432-L435 PolarHBondContact O-N 2.96Å; I432-L436 HydrophobicContact CG2-CD1 3.8Å; I432-L436 HydrophobicContact CG2-CG 4.49Å; I432-L436 WeakPolarHBondContact O-CB 3.22Å; I432-L436 WeakPolarHBondContact O-CG 3.25Å; I432-L436 PolarHBondContact O-N 2.97Å; I432-C466 HydrophobicContact CD1-CB 3.58Å; I432-V469 HydrophobicContact CB-CG1 4.23Å; I432-V469 HydrophobicContact CG2-CG1 3.65Å; I432-L470 HydrophobicContact CD1-CD1 4.37Å; I432-L470 HydrophobicContact CD1-CD2 4.49Å; I432-L470 HydrophobicContact CD1-CG 4.19Å; I432-L470 HydrophobicContact CG2-CD2 4.19Å
433	L	83.9	Confident	84.3	Confident	38 Å²	38	31.7 Å²	31.7	20%	0.199	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-37.2	178.7	-72.5	173.7	0	0	0	112.5	K429 A437 V469 L623	K429-L433 WeakPolarHBondContact O-CB 3.18Å; K429-L433 VanDerWaalsContact O-CG 3.29Å; K429-L433 WeakPolarHBondContact O-CG 3.37Å; K429-L433 PolarHBondContact O-N 3.36Å; L433-A437 VanDerWaalsContact O-CB 3.25Å; L433-A437 WeakPolarHBondContact O-CB 3.41Å; L433-A437 PolarHBondContact O-N 3.41Å; L433-A437 VanDerWaalsContact O-N 3.07Å; L433-V469 HydrophobicContact CD1-CG2 4.36Å; L433-V469 HydrophobicContact CD2-CG1 3.75Å; L433-V469 HydrophobicContact CD2-CG2 4.41Å; L433-V469 HydrophobicContact CG-CG1 3.96Å; L433-V469 HydrophobicContact CG-CG2 4.31Å; L433-L623 HydrophobicContact CD2-CD2 4.43Å
434	A	83.6	Confident	84.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-67.9	-43.1	175.5	0	0	0	0	0	112.7	V396 F397 I400 Q430 T431 I432 A437 C438	V396-A434 HydrophobicContact CG1-CB 4.48Å; F397-A434 HydrophobicContact CB-CB 4.22Å; F397-A434 HydrophobicContact CD2-CB 3.62Å; F397-A434 HydrophobicContact CE2-CB 4.33Å; F397-A434 HydrophobicContact CG-CB 4.18Å; I400-A434 HydrophobicContact CB-CB 4.43Å; I400-A434 HydrophobicContact CD1-CB 3.68Å; Q430-A434 WeakPolarHBondContact O-CB 3.45Å; Q430-A434 PolarHBondContact O-N 2.89Å; T431-A434 PolarHBondContact O-N 2.74Å; I432-A434 VanDerWaalsContact C-N 3.33Å; I432-A434 PolarHBondContact O-N 2.98Å; A434-A437 PolarHBondContact O-N 2.71Å; A434-C438 PolarHBondContact O-N 2.74Å; A434-C438 PolarHBondContact O-SG 3.23Å
435	L	86.8	Confident	84	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-51.7	175.6	177.2	56.2	0	0	0	110.8	M389 F411 A422 L423 T431 I432 A437 C438 N439 F442	M389-L435 HydrophobicContact SD-CB 4.45Å; M389-L435 HydrophobicContact SD-CD2 4.02Å; F411-L435 HydrophobicContact CD1-CD1 3.46Å; F411-L435 VanDerWaalsContact CD1-CD1 3.46Å; F411-L435 HydrophobicContact CE1-CD1 3.92Å; F411-L435 HydrophobicContact CG-CD1 4.38Å; A422-L435 HydrophobicContact CB-CD2 3.79Å; L423-L435 HydrophobicContact CD2-CD2 3.85Å; L423-L435 HydrophobicContact CG-CD2 3.92Å; T431-L435 WeakPolarHBondContact O-CB 3.41Å; T431-L435 PolarHBondContact O-N 2.94Å; I432-L435 PolarHBondContact O-N 2.96Å; L435-A437 PolarHBondContact O-N 3.12Å; L435-C438 PolarHBondContact O-N 2.64Å; L435-C438 VanDerWaalsContact O-N 3.1Å; L435-N439 PolarHBondContact O-N 3.4Å; L435-F442 HydrophobicContact CD1-CD2 3.93Å; L435-F442 HydrophobicContact CD1-CE2 4.25Å; L435-F442 HydrophobicContact CD2-CD2 4.07Å; L435-F442 HydrophobicContact CD2-CE2 4.03Å; L435-F442 HydrophobicContact CD2-CG 4.32Å; L435-F442 HydrophobicContact CD2-CZ 4.27Å; L435-F442 HydrophobicContact CG-CD2 4.17Å; L435-F442 HydrophobicContact CG-CG 4.44Å
436	L	84.6	Confident	84	Confident	10 Å²	10	35 Å²	35	5%	0.052	19%	0.194	C	C	.	.	H	α-helix	trans	-72	-9.2	-179.5	-63.4	173.2	0	0	0	114.1	I432 P440 F442 L444 K473	I432-L436 HydrophobicContact CG2-CD1 3.8Å; I432-L436 HydrophobicContact CG2-CG 4.49Å; I432-L436 WeakPolarHBondContact O-CB 3.22Å; I432-L436 WeakPolarHBondContact O-CG 3.25Å; I432-L436 PolarHBondContact O-N 2.97Å; L436-P440 WeakPolarHBondContact O-CA 3.29Å; L436-F442 HydrophobicContact CD2-CB 4.06Å; L436-L444 HydrophobicContact CD1-CD2 4.02Å; L436-L444 HydrophobicContact CD2-CD2 4.1Å; L436-K473 HydrophobicContact CD1-CB 3.9Å; L436-K473 HydrophobicContact CD1-CD 4.17Å; L436-K473 HydrophobicContact CD1-CG 3.68Å
437	A	81.8	Confident	84.1	Confident	55 Å²	55	41.1 Å²	41.1	46%	0.455	22%	0.217	S	C	.	.	H	α-helix	trans	-89.6	-30.8	168.8	0	0	0	0	0	112.6	F397 L433 A434 L435	F397-A437 HydrophobicContact CE2-CB 3.63Å; F397-A437 HydrophobicContact CZ-CB 3.84Å; L433-A437 VanDerWaalsContact O-CB 3.25Å; L433-A437 WeakPolarHBondContact O-CB 3.41Å; L433-A437 PolarHBondContact O-N 3.41Å; L433-A437 VanDerWaalsContact O-N 3.07Å; A434-A437 PolarHBondContact O-N 2.71Å; L435-A437 PolarHBondContact O-N 3.12Å
438	C	82.1	Confident	84.6	Confident	23 Å²	23	40.3 Å²	40.3	16%	0.155	21%	0.207	C	C	.	.	H	α-helix	trans	-85.1	-40.6	177.6	-61.8	0	0	0	0	112.2	I400 H404 A434 L435	I400-C438 HydrophobicContact CG2-CB 4.34Å; H404-C438 HydrophobicContact CB-CB 4.27Å; H404-C438 PolarHBondContact CE1-O 2.68Å; A434-C438 PolarHBondContact O-N 2.74Å; A434-C438 PolarHBondContact O-SG 3.23Å; L435-C438 PolarHBondContact O-N 2.64Å; L435-C438 VanDerWaalsContact O-N 3.1Å
439	N	81.9	Confident	84.8	Confident	28 Å²	28	44.9 Å²	44.9	15%	0.15	23%	0.225	C	C	.	.			trans	-122.9	88.4	172.3	-173.1	-10.5	0	0	0	109.9	L435 E441 F442	L435-N439 PolarHBondContact O-N 3.4Å; N439-E441 PolarHBondContact O-N 2.99Å; N439-E441 PolarHBondContact OD1-N 3.02Å; N439-E441 VanDerWaalsContact OD1-N 3.15Å; N439-F442 HydrophobicContact CB-CB 4.36Å; N439-F442 PolarHBondContact O-N 3.26Å; N439-F442 PolarHBondContact OD1-N 3.38Å
440	P	77.7	Confident	84.9	Confident	43 Å²	43	47.8 Å²	47.8	28%	0.279	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.8	178.3	-22.1	34.7	0	0	0	114.6	L436 P604 L605	L436-P440 WeakPolarHBondContact O-CA 3.29Å; P440-P604 HydrophobicContact CB-CB 4Å; P440-P604 HydrophobicContact CB-CG 4.29Å; P440-L605 WeakPolarHBondContact O-CD1 3.47Å; P440-L605 WeakPolarHBondContact O-CD2 3.2Å; P440-L605 WeakPolarHBondContact O-CG 3.44Å
441	E	77.8	Confident	85.1	Confident	172 Å²	172	43.9 Å²	43.9	80%	0.804	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.2	11.3	-179.7	-57.7	-161.4	155.3	0	0	112.9	N439 N443	N439-E441 PolarHBondContact O-N 2.99Å; N439-E441 PolarHBondContact OD1-N 3.02Å; N439-E441 VanDerWaalsContact OD1-N 3.15Å; E441-N443 PolarHBondContact O-N 2.96Å
442	F	84.4	Confident	85.2	Confident	10 Å²	10	45.2 Å²	45.2	4%	0.044	23%	0.231	C	C	.	.			trans	-58.5	130.2	176.2	-164	-74.1	0	0	0	111.3	F411 A422 L423 L435 L436 N439 L444	F411-F442 HydrophobicContact CB-CE2 4.19Å; F411-F442 WeakPolarHBondContact O-CE2 3.45Å; A422-F442 HydrophobicContact CB-CE2 4.06Å; A422-F442 HydrophobicContact CB-CZ 3.91Å; L423-F442 HydrophobicContact CB-CE1 4.17Å; L423-F442 HydrophobicContact CD1-CD1 3.38Å; L423-F442 HydrophobicContact CD1-CE1 3.57Å; L423-F442 HydrophobicContact CD1-CG 4.5Å; L423-F442 HydrophobicContact CG-CD1 3.71Å; L423-F442 HydrophobicContact CG-CE1 3.59Å; L423-F442 HydrophobicContact CG-CZ 4.43Å; L435-F442 HydrophobicContact CD1-CD2 3.93Å; L435-F442 HydrophobicContact CD1-CE2 4.25Å; L435-F442 HydrophobicContact CD2-CD2 4.07Å; L435-F442 HydrophobicContact CD2-CE2 4.03Å; L435-F442 HydrophobicContact CD2-CG 4.32Å; L435-F442 HydrophobicContact CD2-CZ 4.27Å; L435-F442 HydrophobicContact CG-CD2 4.17Å; L435-F442 HydrophobicContact CG-CG 4.44Å; L436-F442 HydrophobicContact CD2-CB 4.06Å; N439-F442 HydrophobicContact CB-CB 4.36Å; N439-F442 PolarHBondContact O-N 3.26Å; N439-F442 PolarHBondContact OD1-N 3.38Å; F442-L444 PolarHBondContact O-N 3.48Å
443	N	86	Confident	85.4	Confident	94 Å²	94	45.3 Å²	45.3	50%	0.503	23%	0.231	S	C	.	.			trans	-69.8	104.2	-176.6	-175.8	14.8	0	0	0	112.2	E441 E445 S446	E441-N443 PolarHBondContact O-N 2.96Å; N443-E445 PolarHBondContact O-N 3.35Å; N443-E445 WeakPolarHBondContact OD1-CA 3.49Å; N443-E445 WeakPolarHBondContact OD1-CB 3.24Å; N443-E445 PolarHBondContact OD1-N 3.03Å; N443-S446 PolarHBondContact ND2-N 2.96Å; N443-S446 WeakPolarHBondContact O-CB 3.48Å; N443-S446 PolarHBondContact O-N 3.34Å; N443-S446 VanDerWaalsContact O-N 3.16Å; N443-S446 PolarHBondContact O-OG 3.2Å
444	L	86.3	Confident	85.7	Confident	18 Å²	18	43.5 Å²	43.5	9%	0.094	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.2	173	-63.5	166.6	0	0	0	112.4	L423 L436 F442 S446 L470 K473 A475	L423-L444 HydrophobicContact CD1-CD2 3.87Å; L436-L444 HydrophobicContact CD1-CD2 4.02Å; L436-L444 HydrophobicContact CD2-CD2 4.1Å; F442-L444 PolarHBondContact O-N 3.48Å; L444-S446 VanDerWaalsContact C-N 3.32Å; L444-L470 HydrophobicContact CD2-CD2 4.01Å; L444-K473 VanDerWaalsContact CD1-O 3.25Å; L444-K473 WeakPolarHBondContact CD1-O 3.48Å; L444-A475 HydrophobicContact CB-CB 4.37Å
445	E	87.8	Confident	86	Confident	55 Å²	55	43.6 Å²	43.6	26%	0.257	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	21.8	179.9	-49.9	-48.3	129.3	0	0	112.5	N443 R447 A475 N476	N443-E445 PolarHBondContact O-N 3.35Å; N443-E445 WeakPolarHBondContact OD1-CA 3.49Å; N443-E445 WeakPolarHBondContact OD1-CB 3.24Å; N443-E445 PolarHBondContact OD1-N 3.03Å; E445-R447 PolarHBondContact O-N 3.45Å; E445-A475 VanDerWaalsContact OE1-CA 3.31Å; E445-A475 WeakPolarHBondContact OE1-CA 3.36Å; E445-N476 HydrophobicContact CG-CB 4.46Å; E445-N476 PolarHBondContact OE1-N 3.33Å; E445-N476 WeakPolarHBondContact OE2-CB 3.18Å
446	S	88.5	Confident	86.1	Confident	18 Å²	18	43.6 Å²	43.6	13%	0.126	22%	0.222	C	C	.	.			trans	-56.2	136.5	164.9	63.9	0	0	0	0	109.2	S421 H424 N443 L444	S421-S446 PolarHBondContact OG-OG 3.12Å; H424-S446 PolarHBondContact CE1-O 3.35Å; H424-S446 PolarHBondContact CE1-OG 3.24Å; H424-S446 VanDerWaalsContact CE1-OG 3.28Å; H424-S446 PolarHBondContact NE2-O 3.46Å; N443-S446 PolarHBondContact ND2-N 2.96Å; N443-S446 WeakPolarHBondContact O-CB 3.48Å; N443-S446 PolarHBondContact O-N 3.34Å; N443-S446 VanDerWaalsContact O-N 3.16Å; N443-S446 PolarHBondContact O-OG 3.2Å; L444-S446 VanDerWaalsContact C-N 3.32Å
447	R	89.8	Confident	86.3	Confident	128 Å²	128	44.4 Å²	44.4	48%	0.483	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-109.7	143.6	178.3	-67.3	178.4	171.4	-103.2	1.2	110.8	E445 G451 Q452 T453 H480	E445-R447 PolarHBondContact O-N 3.45Å; R447-G451 WeakPolarHBondContact CG-O 3.46Å; R447-G451 PolarHBondContact NH1-O 3.19Å; R447-Q452 CarbonylContact C-O 3.6Å; R447-Q452 VanDerWaalsContact CA-O 3.29Å; R447-Q452 WeakPolarHBondContact CA-O 3.48Å; R447-T453 HydrophobicContact CG-CG2 4.21Å; R447-H480 VanDerWaalsContact CZ-O 3.22Å; R447-H480 PolarHBondContact NH1-O 3.02Å; R447-H480 PolarHBondContact NH2-O 2.95Å
448	N	90.3	Very high	86.6	Confident	12 Å²	12	42 Å²	42	6%	0.064	21%	0.206	C	C	.	.			trans	-88.9	-172.7	170.3	79.3	-0.9	0	0	0	111.4	T418 G419 N420 N450 G451 Q452	T418-N448 WeakPolarHBondContact O-CB 3.47Å; G419-N448 WeakPolarHBondContact O-CA 3.46Å; N420-N448 WeakPolarHBondContact OD1-CB 3.27Å; N420-N448 PolarHBondContact OD1-ND2 2.96Å; N420-N448 VanDerWaalsContact OD1-ND2 3.16Å; N448-N450 PolarHBondContact O-N 2.75Å; N448-N450 PolarHBondContact OD1-N 3.23Å; N448-G451 PolarHBondContact O-N 3.15Å; N448-Q452 PolarHBondContact N-O 3.42Å; N448-Q452 WeakPolarHBondContact OD1-CB 3.5Å; N448-Q452 PolarHBondContact OD1-N 3.01Å; N448-Q452 VanDerWaalsContact OD1-N 3.08Å
449	F	88.3	Confident	86.7	Confident	124 Å²	124	40.9 Å²	40.9	54%	0.544	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.6	-177.5	-63.4	-23.9	0	0	0	115.4	T418 G419	T418-F449 WeakPolarHBondContact O-CB 3.37Å; T418-F449 WeakPolarHBondContact O-CG 3.5Å; T418-F449 PolarHBondContact O-N 3.21Å; G419-F449 VanDerWaalsContact CA-CE1 3.5Å; G419-F449 VanDerWaalsContact N-CD2 3.28Å; G419-F449 VanDerWaalsContact N-CE2 3.27Å
450	N	84	Confident	86.8	Confident	92 Å²	92	46 Å²	46	49%	0.492	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	13.8	171.9	-54.5	-19.2	0	0	0	111.4	N448 Q452 E482	N448-N450 PolarHBondContact O-N 2.75Å; N448-N450 PolarHBondContact OD1-N 3.23Å; N450-Q452 HydrophobicContact CB-CG 4.04Å; N450-Q452 PolarHBondContact O-N 3.18Å; N450-E482 PolarHBondContact O-N 2.91Å
451	G	86.7	Confident	87	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.01	23%	0.228	C	C	.	.	S	Bend	trans	65.6	-0.7	-169	0	0	0	0	0	115.3	R447 N448 E482	R447-G451 WeakPolarHBondContact CG-O 3.46Å; R447-G451 PolarHBondContact NH1-O 3.19Å; N448-G451 PolarHBondContact O-N 3.15Å; G451-E482 PolarHBondContact N-OE1 3.21Å
452	Q	89.9	Confident	87	Confident	29 Å²	29	43.1 Å²	43.1	14%	0.136	21%	0.209	C	C	.	.			trans	-70.1	144.5	-175.1	-68.3	171.5	-26.2	0	0	111.1	H424 R447 N448 N450 H456 D481	H424-Q452 PolarHBondContact NE2-O 3.17Å; H424-Q452 VanDerWaalsContact NE2-O 3.08Å; R447-Q452 CarbonylContact C-O 3.6Å; R447-Q452 VanDerWaalsContact CA-O 3.29Å; R447-Q452 WeakPolarHBondContact CA-O 3.48Å; N448-Q452 PolarHBondContact N-O 3.42Å; N448-Q452 WeakPolarHBondContact OD1-CB 3.5Å; N448-Q452 PolarHBondContact OD1-N 3.01Å; N448-Q452 VanDerWaalsContact OD1-N 3.08Å; N450-Q452 HydrophobicContact CB-CG 4.04Å; N450-Q452 PolarHBondContact O-N 3.18Å; Q452-H456 HydrophobicContact CB-CB 4.01Å; Q452-H456 HydrophobicContact CG-CB 4.3Å; Q452-D481 HydrophobicContact CB-CB 4.38Å; Q452-D481 HydrophobicContact CG-CB 3.57Å
453	T	92.2	Very high	86.8	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-95.1	168.3	170.2	72.9	0	0	0	0	111.3	H424 R447 L455 H456 L457 A479	H424-T453 WeakPolarHBondContact NE2-CA 3.1Å; R447-T453 HydrophobicContact CG-CG2 4.21Å; T453-L455 PolarHBondContact O-N 2.7Å; T453-L455 VanDerWaalsContact O-N 3.11Å; T453-H456 PolarHBondContact N-ND1 3.2Å; T453-H456 WeakPolarHBondContact O-CB 3.47Å; T453-H456 PolarHBondContact O-N 2.87Å; T453-H456 PolarHBondContact OG1-ND1 3.44Å; T453-L457 PolarHBondContact O-N 3.35Å; T453-A479 HydrophobicContact CG2-CB 4.21Å
454	A	90.3	Very high	86.3	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-56	-32.4	178.1	0	0	0	0	0	112.9	L423 H424 H456 H458 L470	L423-A454 HydrophobicContact CB-CB 3.75Å; H424-A454 PolarHBondContact CD2-N 3.47Å; H424-A454 PolarHBondContact NE2-N 3.26Å; H424-A454 VanDerWaalsContact NE2-N 3.16Å; A454-H456 VanDerWaalsContact C-N 3.33Å; A454-H456 PolarHBondContact O-N 3.36Å; A454-H458 WeakPolarHBondContact O-CB 3.46Å; A454-H458 PolarHBondContact O-CD2 3.47Å; A454-H458 PolarHBondContact O-N 2.87Å; A454-L470 HydrophobicContact CB-CD1 4.04Å
455	L	88.4	Confident	85.8	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-35.7	176.1	-172	64.3	0	0	0	112.3	T453 T459 V467 L470 I471 A475 I477	T453-L455 PolarHBondContact O-N 2.7Å; T453-L455 VanDerWaalsContact O-N 3.11Å; L455-T459 VanDerWaalsContact O-CB 3.26Å; L455-T459 WeakPolarHBondContact O-CB 3.48Å; L455-T459 PolarHBondContact O-N 2.91Å; L455-T459 PolarHBondContact O-OG1 3.29Å; L455-V467 HydrophobicContact CD1-CG1 4.07Å; L455-L470 HydrophobicContact CD1-CB 4.05Å; L455-L470 HydrophobicContact CD1-CD1 4.48Å; L455-I471 HydrophobicContact CD1-CD1 4.42Å; L455-I471 HydrophobicContact CD1-CG1 3.99Å; L455-A475 HydrophobicContact CB-CB 4.45Å; L455-A475 HydrophobicContact CD2-CB 4.36Å; L455-I477 HydrophobicContact CD2-CB 4.44Å; L455-I477 HydrophobicContact CD2-CG1 4.2Å
456	H	89.3	Confident	85.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.6	-53.1	176.5	-67.7	79.7	0	0	0	110.7	Q452 T453 A454 H458 T459 Y460 A479 N485 S487 I490	Q452-H456 HydrophobicContact CB-CB 4.01Å; Q452-H456 HydrophobicContact CG-CB 4.3Å; T453-H456 PolarHBondContact N-ND1 3.2Å; T453-H456 WeakPolarHBondContact O-CB 3.47Å; T453-H456 PolarHBondContact O-N 2.87Å; T453-H456 PolarHBondContact OG1-ND1 3.44Å; A454-H456 VanDerWaalsContact C-N 3.33Å; A454-H456 PolarHBondContact O-N 3.36Å; H456-H458 PolarHBondContact O-N 3.21Å; H456-T459 PolarHBondContact O-N 3.44Å; H456-Y460 WeakPolarHBondContact O-CB 3.49Å; H456-Y460 PolarHBondContact O-N 2.7Å; H456-A479 PolarHBondContact CE1-O 3.29Å; H456-A479 PolarHBondContact NE2-O 2.94Å; H456-A479 VanDerWaalsContact NE2-O 3.08Å; H456-N485 PolarHBondContact NE2-O 3.14Å; H456-S487 PolarHBondContact CD2-OG 3.33Å; H456-S487 PolarHBondContact CE1-OG 2.71Å; H456-S487 PolarHBondContact ND1-OG 2.64Å; H456-S487 PolarHBondContact NE2-N 2.65Å; H456-S487 PolarHBondContact NE2-OG 2.98Å; H456-I490 HydrophobicContact CB-CD1 3.68Å
457	L	88.6	Confident	85.2	Confident	27 Å²	27	38.6 Å²	38.6	14%	0.141	19%	0.188	C	C	.	.	H	α-helix	trans	-63.5	-41.4	179.6	-78.7	-173.1	0	0	0	113	N420 H424 T453 T459 Y460 N461	N420-L457 WeakPolarHBondContact OD1-CD1 3.26Å; H424-L457 HydrophobicContact CB-CD1 4.07Å; T453-L457 PolarHBondContact O-N 3.35Å; L457-T459 VanDerWaalsContact C-N 3.3Å; L457-T459 PolarHBondContact O-N 3.05Å; L457-Y460 PolarHBondContact O-N 3.23Å; L457-N461 VanDerWaalsContact O-CB 3.27Å; L457-N461 WeakPolarHBondContact O-CB 3.22Å; L457-N461 VanDerWaalsContact O-CG 3.24Å; L457-N461 PolarHBondContact O-N 3.03Å; L457-N461 PolarHBondContact O-ND2 3.47Å
458	H	88.4	Confident	84.4	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.019	17%	0.17	C	C	.	.	H	α-helix	trans	-70.4	-27	177.1	-72.1	-57.2	0	0	0	113	L423 A426 A454 H456 S462 N463 C466 V467	L423-H458 PolarHBondContact O-NE2 2.9Å; A426-H458 PolarHBondContact O-CE1 2.66Å; A454-H458 WeakPolarHBondContact O-CB 3.46Å; A454-H458 PolarHBondContact O-CD2 3.47Å; A454-H458 PolarHBondContact O-N 2.87Å; H456-H458 PolarHBondContact O-N 3.21Å; H458-S462 PolarHBondContact O-N 3.34Å; H458-N463 HydrophobicContact CB-CB 4.27Å; H458-N463 PolarHBondContact ND1-ND2 3.25Å; H458-N463 VanDerWaalsContact ND1-ND2 3.18Å; H458-N463 PolarHBondContact O-N 3.45Å; H458-C466 HydrophobicContact CB-CB 4.05Å; H458-V467 VanDerWaalsContact C-CG2 3.5Å; H458-V467 HydrophobicContact CB-CG2 3.96Å; H458-V467 WeakPolarHBondContact O-CG2 3.33Å
459	T	84.3	Confident	83.9	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-72.9	-41	172.1	-56.9	0	0	0	0	111.7	L455 H456 L457 S462 S487 I490 A491 N496 A499	L455-T459 VanDerWaalsContact O-CB 3.26Å; L455-T459 WeakPolarHBondContact O-CB 3.48Å; L455-T459 PolarHBondContact O-N 2.91Å; L455-T459 PolarHBondContact O-OG1 3.29Å; H456-T459 PolarHBondContact O-N 3.44Å; L457-T459 VanDerWaalsContact C-N 3.3Å; L457-T459 PolarHBondContact O-N 3.05Å; T459-S462 PolarHBondContact O-N 2.8Å; T459-S487 WeakPolarHBondContact CG2-O 3.33Å; T459-I490 HydrophobicContact CG2-CB 4.48Å; T459-I490 HydrophobicContact CG2-CG2 4.11Å; T459-A491 HydrophobicContact CG2-CB 3.76Å; T459-N496 PolarHBondContact O-ND2 2.85Å; T459-A499 HydrophobicContact CG2-CB 4.11Å
460	Y	84.3	Confident	83.6	Confident	135 Å²	135	27 Å²	27	53%	0.529	14%	0.142	S	C	.	.	H	α-helix	trans	-62.3	-51.5	174.6	-176.7	-91.9	0	0	0	111.3	H456 L457 S462 I490 V494	H456-Y460 WeakPolarHBondContact O-CB 3.49Å; H456-Y460 PolarHBondContact O-N 2.7Å; L457-Y460 PolarHBondContact O-N 3.23Å; Y460-S462 PolarHBondContact O-N 2.74Å; Y460-I490 HydrophobicContact CD2-CG2 4.18Å; Y460-I490 HydrophobicContact CG-CG2 4.45Å; Y460-V494 HydrophobicContact CD2-CG2 3.72Å; Y460-V494 HydrophobicContact CE2-CG2 4.07Å; Y460-V494 HydrophobicContact CG-CG2 4.41Å
461	N	82.5	Confident	83.2	Confident	98 Å²	98	23.8 Å²	23.8	52%	0.524	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	4.3	176.8	-67.4	-28.6	0	0	0	113.9	L457 N463	L457-N461 VanDerWaalsContact O-CB 3.27Å; L457-N461 WeakPolarHBondContact O-CB 3.22Å; L457-N461 VanDerWaalsContact O-CG 3.24Å; L457-N461 PolarHBondContact O-N 3.03Å; L457-N461 PolarHBondContact O-ND2 3.47Å; N461-N463 PolarHBondContact O-N 3.26Å; N461-N463 VanDerWaalsContact O-N 3.08Å
462	S	76.8	Confident	82.4	Confident	58 Å²	58	24 Å²	24	41%	0.406	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	27.5	-178.4	-60.5	0	0	0	0	114.9	H458 T459 Y460 L464 N496	H458-S462 PolarHBondContact O-N 3.34Å; T459-S462 PolarHBondContact O-N 2.8Å; Y460-S462 PolarHBondContact O-N 2.74Å; S462-L464 PolarHBondContact O-N 3.26Å; S462-N496 WeakPolarHBondContact CA-ND2 3.45Å; S462-N496 PolarHBondContact OG-ND2 2.89Å
463	N	79.6	Confident	81.8	Confident	37 Å²	37	23.9 Å²	23.9	20%	0.198	13%	0.125	C	C	.	.			trans	-82.7	66.7	-176.4	-168.9	-7.7	0	0	0	110.6	H458 N461 P465 C466 V467	H458-N463 HydrophobicContact CB-CB 4.27Å; H458-N463 PolarHBondContact ND1-ND2 3.25Å; H458-N463 VanDerWaalsContact ND1-ND2 3.18Å; H458-N463 PolarHBondContact O-N 3.45Å; N461-N463 PolarHBondContact O-N 3.26Å; N461-N463 VanDerWaalsContact O-N 3.08Å; N463-P465 VanDerWaalsContact C-CD 3.41Å; N463-P465 VanDerWaalsContact C-N 3.33Å; N463-C466 HydrophobicContact CB-CB 4.31Å; N463-C466 PolarHBondContact ND2-SG 3Å; N463-C466 WeakPolarHBondContact O-CB 3.35Å; N463-C466 PolarHBondContact O-N 3.09Å; N463-C466 PolarHBondContact OD1-SG 3.24Å; N463-V467 PolarHBondContact O-N 3.12Å
464	L	75.1	Confident	81	Confident	18 Å²	18	26.6 Å²	26.6	9%	0.094	14%	0.139	C	C	.	.	H	α-helix	trans	-46.6	-45.1	-175.1	-177.3	73.9	0	0	0	113.7	S462 C466 V467 V468 C498 L502 D831	S462-L464 PolarHBondContact O-N 3.26Å; L464-C466 VanDerWaalsContact C-N 3.27Å; L464-C466 PolarHBondContact O-N 3.33Å; L464-V467 PolarHBondContact O-N 2.9Å; L464-V468 HydrophobicContact CD1-CG2 4.31Å; L464-V468 HydrophobicContact CG-CG2 4.29Å; L464-V468 WeakPolarHBondContact O-CG2 3.32Å; L464-V468 PolarHBondContact O-N 3.5Å; L464-C498 HydrophobicContact CD1-CB 4.12Å; L464-C498 WeakPolarHBondContact CD1-O 3.48Å; L464-C498 HydrophobicContact CD2-CB 4.04Å; L464-C498 HydrophobicContact CG-CB 4.5Å; L464-L502 HydrophobicContact CD1-CD1 3.77Å; L464-D831 HydrophobicContact CD2-CB 3.95Å
465	P	76.2	Confident	80.5	Confident	45 Å²	45	27 Å²	27	29%	0.292	14%	0.142	S	C	.	.	H	α-helix	trans	-63.2	-31.9	-180	-23	35.9	0	0	0	113.3	K429 N463 V469	K429-P465 HydrophobicContact CB-CB 4.05Å; K429-P465 HydrophobicContact CD-CB 4.14Å; K429-P465 HydrophobicContact CG-CB 4.36Å; N463-P465 VanDerWaalsContact C-CD 3.41Å; N463-P465 VanDerWaalsContact C-N 3.33Å; P465-V469 WeakPolarHBondContact O-CG2 3.42Å; P465-V469 PolarHBondContact O-N 3.33Å; P465-V469 VanDerWaalsContact O-N 3.14Å
466	C	83.8	Confident	80.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-76.8	-40.1	176	-63.5	0	0	0	0	111.7	N428 K429 I432 H458 N463 L464 V468 V469 L470	N428-C466 VanDerWaalsContact CA-SG 3.58Å; K429-C466 PolarHBondContact N-SG 3.46Å; I432-C466 HydrophobicContact CD1-CB 3.58Å; H458-C466 HydrophobicContact CB-CB 4.05Å; N463-C466 HydrophobicContact CB-CB 4.31Å; N463-C466 PolarHBondContact ND2-SG 3Å; N463-C466 WeakPolarHBondContact O-CB 3.35Å; N463-C466 PolarHBondContact O-N 3.09Å; N463-C466 PolarHBondContact OD1-SG 3.24Å; L464-C466 VanDerWaalsContact C-N 3.27Å; L464-C466 PolarHBondContact O-N 3.33Å; C466-V468 PolarHBondContact O-N 2.88Å; C466-V469 PolarHBondContact O-N 3.48Å; C466-L470 WeakPolarHBondContact O-CB 3.35Å; C466-L470 WeakPolarHBondContact O-CG 3.21Å; C466-L470 PolarHBondContact O-N 3.32Å
467	V	80.4	Confident	79.4	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57.2	-48.2	172.1	174.5	0	0	0	0	110.7	L455 H458 N463 L464 L470 I471	L455-V467 HydrophobicContact CD1-CG1 4.07Å; H458-V467 VanDerWaalsContact C-CG2 3.5Å; H458-V467 HydrophobicContact CB-CG2 3.96Å; H458-V467 WeakPolarHBondContact O-CG2 3.33Å; N463-V467 PolarHBondContact O-N 3.12Å; L464-V467 PolarHBondContact O-N 2.9Å; V467-L470 PolarHBondContact O-N 3.08Å; V467-I471 HydrophobicContact CG1-CD1 3.86Å; V467-I471 WeakPolarHBondContact O-CB 3.32Å; V467-I471 VanDerWaalsContact O-CG1 3.32Å; V467-I471 WeakPolarHBondContact O-CG1 3.49Å; V467-I471 PolarHBondContact O-N 3.27Å
468	V	73.9	Confident	78.6	Confident	16 Å²	16	32.7 Å²	32.7	10%	0.097	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-48.3	176.9	170.2	0	0	0	0	111.3	L464 C466 I471 C472 L502 M622	L464-V468 HydrophobicContact CD1-CG2 4.31Å; L464-V468 HydrophobicContact CG-CG2 4.29Å; L464-V468 WeakPolarHBondContact O-CG2 3.32Å; L464-V468 PolarHBondContact O-N 3.5Å; C466-V468 PolarHBondContact O-N 2.88Å; V468-I471 PolarHBondContact O-N 3.46Å; V468-C472 WeakPolarHBondContact O-CB 3.49Å; V468-C472 PolarHBondContact O-N 3.34Å; V468-C472 PolarHBondContact O-SG 3.41Å; V468-L502 HydrophobicContact CG2-CD1 3.6Å; V468-M622 HydrophobicContact CG1-CE 4.19Å
469	V	78.9	Confident	78.4	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-42.2	179.6	164.8	0	0	0	0	112.3	K429 I432 L433 P465 C466 C472 K473	K429-V469 HydrophobicContact CB-CG2 3.94Å; I432-V469 HydrophobicContact CB-CG1 4.23Å; I432-V469 HydrophobicContact CG2-CG1 3.65Å; L433-V469 HydrophobicContact CD1-CG2 4.36Å; L433-V469 HydrophobicContact CD2-CG1 3.75Å; L433-V469 HydrophobicContact CD2-CG2 4.41Å; L433-V469 HydrophobicContact CG-CG1 3.96Å; L433-V469 HydrophobicContact CG-CG2 4.31Å; P465-V469 WeakPolarHBondContact O-CG2 3.42Å; P465-V469 PolarHBondContact O-N 3.33Å; P465-V469 VanDerWaalsContact O-N 3.14Å; C466-V469 PolarHBondContact O-N 3.48Å; V469-C472 CarbonylContact O-C 3.21Å; V469-C472 PolarHBondContact O-N 3.46Å; V469-K473 HydrophobicContact CG1-CG 4.28Å; V469-K473 WeakPolarHBondContact O-CB 3.47Å; V469-K473 VanDerWaalsContact O-CG 3.3Å; V469-K473 WeakPolarHBondContact O-CG 3.35Å; V469-K473 PolarHBondContact O-N 3.07Å
470	L	82.1	Confident	78.4	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-45.1	177.7	-74.2	170.9	0	0	0	111.6	L423 I432 L444 A454 L455 C466 V467 C472 K473 N474 A475	L423-L470 HydrophobicContact CD2-CD2 4.33Å; I432-L470 HydrophobicContact CD1-CD1 4.37Å; I432-L470 HydrophobicContact CD1-CD2 4.49Å; I432-L470 HydrophobicContact CD1-CG 4.19Å; I432-L470 HydrophobicContact CG2-CD2 4.19Å; L444-L470 HydrophobicContact CD2-CD2 4.01Å; A454-L470 HydrophobicContact CB-CD1 4.04Å; L455-L470 HydrophobicContact CD1-CB 4.05Å; L455-L470 HydrophobicContact CD1-CD1 4.48Å; C466-L470 WeakPolarHBondContact O-CB 3.35Å; C466-L470 WeakPolarHBondContact O-CG 3.21Å; C466-L470 PolarHBondContact O-N 3.32Å; V467-L470 PolarHBondContact O-N 3.08Å; L470-C472 VanDerWaalsContact C-N 3.33Å; L470-C472 PolarHBondContact O-N 3.43Å; L470-K473 CarbonylContact O-C 3.58Å; L470-K473 PolarHBondContact O-N 3.2Å; L470-K473 VanDerWaalsContact O-N 3.15Å; L470-N474 PolarHBondContact O-N 3.46Å; L470-N474 VanDerWaalsContact O-N 3.14Å; L470-A475 HydrophobicContact CB-CB 3.94Å; L470-A475 WeakPolarHBondContact O-CB 3.47Å; L470-A475 PolarHBondContact O-N 3.18Å
471	I	74.8	Confident	78.5	Confident	24 Å²	24	31.6 Å²	31.6	12%	0.123	17%	0.174	C	C	.	.	H	α-helix	trans	-60.4	-43.5	173.2	-68.7	170.4	0	0	0	110.5	L455 V467 V468 K473 N474 I477 K619	L455-I471 HydrophobicContact CD1-CD1 4.42Å; L455-I471 HydrophobicContact CD1-CG1 3.99Å; V467-I471 HydrophobicContact CG1-CD1 3.86Å; V467-I471 WeakPolarHBondContact O-CB 3.32Å; V467-I471 VanDerWaalsContact O-CG1 3.32Å; V467-I471 WeakPolarHBondContact O-CG1 3.49Å; V467-I471 PolarHBondContact O-N 3.27Å; V468-I471 PolarHBondContact O-N 3.46Å; I471-K473 VanDerWaalsContact C-N 3.26Å; I471-K473 PolarHBondContact O-N 3.4Å; I471-N474 PolarHBondContact O-N 3.46Å; I471-I477 HydrophobicContact CD1-CD1 4.36Å; I471-I477 HydrophobicContact CG1-CD1 4.16Å; I471-I477 HydrophobicContact CG1-CG1 4.24Å; I471-I477 HydrophobicContact CG2-CD1 4.15Å; I471-K619 VanDerWaalsContact O-CE 3.27Å; I471-K619 WeakPolarHBondContact O-CE 3.33Å; I471-K619 PolarHBondContact O-NZ 2.91Å
472	C	70.7	Confident	78.6	Confident	6 Å²	6	33.7 Å²	33.7	4%	0.041	18%	0.18	C	C	.	.	H	α-helix	trans	-66	-24.7	177.3	-68.4	0	0	0	0	113.8	V468 V469 L470 K619 L623	V468-C472 WeakPolarHBondContact O-CB 3.49Å; V468-C472 PolarHBondContact O-N 3.34Å; V468-C472 PolarHBondContact O-SG 3.41Å; V469-C472 CarbonylContact O-C 3.21Å; V469-C472 PolarHBondContact O-N 3.46Å; L470-C472 VanDerWaalsContact C-N 3.33Å; L470-C472 PolarHBondContact O-N 3.43Å; C472-K619 HydrophobicContact CB-CB 4.3Å; C472-L623 HydrophobicContact CB-CD1 4.34Å; C472-L623 HydrophobicContact CB-CD2 4.14Å; C472-L623 HydrophobicContact CB-CG 4.14Å
473	K	76.6	Confident	78.9	Confident	26 Å²	26	37.7 Å²	37.7	11%	0.113	20%	0.197	C	C	.	.	H	α-helix	trans	-92.8	2.4	175.8	-66.4	-71.9	-176.6	180	0	114.2	L436 L444 V469 L470 I471	L436-K473 HydrophobicContact CD1-CB 3.9Å; L436-K473 HydrophobicContact CD1-CD 4.17Å; L436-K473 HydrophobicContact CD1-CG 3.68Å; L444-K473 VanDerWaalsContact CD1-O 3.25Å; L444-K473 WeakPolarHBondContact CD1-O 3.48Å; V469-K473 HydrophobicContact CG1-CG 4.28Å; V469-K473 WeakPolarHBondContact O-CB 3.47Å; V469-K473 VanDerWaalsContact O-CG 3.3Å; V469-K473 WeakPolarHBondContact O-CG 3.35Å; V469-K473 PolarHBondContact O-N 3.07Å; L470-K473 CarbonylContact O-C 3.58Å; L470-K473 PolarHBondContact O-N 3.2Å; L470-K473 VanDerWaalsContact O-N 3.15Å; I471-K473 VanDerWaalsContact C-N 3.26Å; I471-K473 PolarHBondContact O-N 3.4Å
474	N	75.7	Confident	78.9	Confident	59 Å²	59	37.7 Å²	37.7	32%	0.316	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	32.6	177.9	-52.2	-42.4	0	0	0	116.7	L470 I471 K619	L470-N474 PolarHBondContact O-N 3.46Å; L470-N474 VanDerWaalsContact O-N 3.14Å; I471-N474 PolarHBondContact O-N 3.46Å; N474-K619 WeakPolarHBondContact OD1-CD 3.3Å; N474-K619 PolarHBondContact OD1-NZ 2.88Å
475	A	80.2	Confident	79.2	Confident	7 Å²	7	39.4 Å²	39.4	6%	0.058	22%	0.215	C	C	.	.			trans	-60.5	144.3	164.1	0	0	0	0	0	111.1	L444 E445 L455 L470 I477	L444-A475 HydrophobicContact CB-CB 4.37Å; E445-A475 VanDerWaalsContact OE1-CA 3.31Å; E445-A475 WeakPolarHBondContact OE1-CA 3.36Å; L455-A475 HydrophobicContact CB-CB 4.45Å; L455-A475 HydrophobicContact CD2-CB 4.36Å; L470-A475 HydrophobicContact CB-CB 3.94Å; L470-A475 WeakPolarHBondContact O-CB 3.47Å; L470-A475 PolarHBondContact O-N 3.18Å; A475-I477 PolarHBondContact O-N 2.82Å
476	N	79	Confident	79.5	Confident	68 Å²	68	37.9 Å²	37.9	36%	0.364	21%	0.205	S	C	.	.			trans	-79	111.6	-176.2	-175.8	16.5	0	0	0	111.5	E445 D478 A479	E445-N476 HydrophobicContact CG-CB 4.46Å; E445-N476 PolarHBondContact OE1-N 3.33Å; E445-N476 WeakPolarHBondContact OE2-CB 3.18Å; N476-D478 VanDerWaalsContact C-N 3.25Å; N476-D478 PolarHBondContact O-N 3.04Å; N476-D478 PolarHBondContact OD1-N 3.03Å; N476-A479 HydrophobicContact CB-CB 4.13Å; N476-A479 PolarHBondContact ND2-N 3.09Å; N476-A479 WeakPolarHBondContact O-CB 3.42Å; N476-A479 PolarHBondContact O-N 3.15Å
477	I	75.2	Confident	79.2	Confident	15 Å²	15	37.9 Å²	37.9	8%	0.077	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-25.6	178.8	-48	177	0	0	0	111.3	L455 I471 A475 V503 D506	L455-I477 HydrophobicContact CD2-CB 4.44Å; L455-I477 HydrophobicContact CD2-CG1 4.2Å; I471-I477 HydrophobicContact CD1-CD1 4.36Å; I471-I477 HydrophobicContact CG1-CD1 4.16Å; I471-I477 HydrophobicContact CG1-CG1 4.24Å; I471-I477 HydrophobicContact CG2-CD1 4.15Å; A475-I477 PolarHBondContact O-N 2.82Å; I477-V503 HydrophobicContact CG2-CG1 3.68Å; I477-D506 HydrophobicContact CD1-CB 3.85Å
478	D	72.8	Confident	78.7	Confident	66 Å²	66	38.4 Å²	38.4	35%	0.353	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	14.3	178.2	-38.7	-57.1	0	0	0	112.3	N476 H480 K510	N476-D478 VanDerWaalsContact C-N 3.25Å; N476-D478 PolarHBondContact O-N 3.04Å; N476-D478 PolarHBondContact OD1-N 3.03Å; D478-H480 PolarHBondContact O-CE1 2.76Å; D478-H480 VanDerWaalsContact O-CE1 3.25Å; D478-H480 PolarHBondContact O-ND1 2.86Å; D478-K510 IonicContact OD1-NZ 3.62Å; D478-K510 PolarHBondContact OD1-NZ 3.19Å; D478-K510 VanDerWaalsContact OD2-CE 3.3Å; D478-K510 WeakPolarHBondContact OD2-CE 3.5Å; D478-K510 IonicContact OD2-NZ 2.76Å; D478-K510 PolarHBondContact OD2-NZ 3.05Å
479	A	83.1	Confident	78.7	Confident	6 Å²	6	41.8 Å²	41.8	5%	0.05	22%	0.222	C	C	.	.			trans	-66.9	141.7	165.9	0	0	0	0	0	108.9	T453 H456 N476 T486	T453-A479 HydrophobicContact CG2-CB 4.21Å; H456-A479 PolarHBondContact CE1-O 3.29Å; H456-A479 PolarHBondContact NE2-O 2.94Å; H456-A479 VanDerWaalsContact NE2-O 3.08Å; N476-A479 HydrophobicContact CB-CB 4.13Å; N476-A479 PolarHBondContact ND2-N 3.09Å; N476-A479 WeakPolarHBondContact O-CB 3.42Å; N476-A479 PolarHBondContact O-N 3.15Å; A479-T486 WeakPolarHBondContact O-CA 3.37Å; A479-T486 WeakPolarHBondContact O-CB 3.29Å
480	H	84.4	Confident	78.7	Confident	99 Å²	99	42 Å²	42	46%	0.458	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-109.9	139.3	176.1	-49.9	83.5	0	0	0	108.8	R447 D478 G484 N485 T486	R447-H480 VanDerWaalsContact CZ-O 3.22Å; R447-H480 PolarHBondContact NH1-O 3.02Å; R447-H480 PolarHBondContact NH2-O 2.95Å; D478-H480 PolarHBondContact O-CE1 2.76Å; D478-H480 VanDerWaalsContact O-CE1 3.25Å; D478-H480 PolarHBondContact O-ND1 2.86Å; H480-G484 PolarHBondContact CD2-O 3.4Å; H480-N485 CarbonylContact C-O 3.43Å; H480-N485 WeakPolarHBondContact CA-O 3.34Å; H480-T486 WeakPolarHBondContact CD2-CG2 3.47Å
481	D	86.2	Confident	78.2	Confident	11 Å²	11	42 Å²	42	6%	0.059	22%	0.223	C	C	.	.			trans	-77.4	-171.7	164.6	64.8	19	0	0	0	112	Q452 D483 G484 N485	Q452-D481 HydrophobicContact CB-CB 4.38Å; Q452-D481 HydrophobicContact CG-CB 3.57Å; D481-D483 VanDerWaalsContact C-N 3.32Å; D481-D483 PolarHBondContact O-N 3.12Å; D481-D483 PolarHBondContact OD1-N 3.38Å; D481-G484 PolarHBondContact O-N 3.37Å; D481-G484 VanDerWaalsContact O-N 3.1Å; D481-G484 PolarHBondContact OD1-N 2.68Å; D481-N485 PolarHBondContact N-O 2.95Å; D481-N485 WeakPolarHBondContact OD1-CA 3.48Å; D481-N485 WeakPolarHBondContact OD1-CB 3.3Å; D481-N485 PolarHBondContact OD1-N 2.9Å
482	E	85	Confident	77.9	Confident	143 Å²	143	45.1 Å²	45.1	67%	0.668	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-27.1	-176.9	-82.7	167.8	-160.7	0	0	114.1	N450 G451 G484	N450-E482 PolarHBondContact O-N 2.91Å; G451-E482 PolarHBondContact N-OE1 3.21Å; E482-G484 PolarHBondContact O-N 2.91Å
483	D	82.5	Confident	78	Confident	142 Å²	142	49 Å²	49	76%	0.759	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-3.4	172.3	-72.2	-41.9	0	0	0	112.5	D481 N485	D481-D483 VanDerWaalsContact C-N 3.32Å; D481-D483 PolarHBondContact O-N 3.12Å; D481-D483 PolarHBondContact OD1-N 3.38Å; D483-N485 VanDerWaalsContact C-N 3.27Å; D483-N485 WeakPolarHBondContact CB-ND2 3.42Å
484	G	80.3	Confident	77.6	Confident	37 Å²	37	50.3 Å²	50.3	38%	0.381	28%	0.276	S	S	.	.	S	Bend	trans	78.3	7.1	-172	0	0	0	0	0	113.8	H480 D481 E482 T486	H480-G484 PolarHBondContact CD2-O 3.4Å; D481-G484 PolarHBondContact O-N 3.37Å; D481-G484 VanDerWaalsContact O-N 3.1Å; D481-G484 PolarHBondContact OD1-N 2.68Å; E482-G484 PolarHBondContact O-N 2.91Å; G484-T486 PolarHBondContact O-N 2.95Å
485	N	81.1	Confident	76.8	Confident	54 Å²	54	51.8 Å²	51.8	29%	0.289	29%	0.292	S	S	.	.			trans	-72.9	129.2	176.8	-67.6	-67.7	0	0	0	109.6	H456 H480 D481 D483 H489 I490	H456-N485 PolarHBondContact NE2-O 3.14Å; H480-N485 CarbonylContact C-O 3.43Å; H480-N485 WeakPolarHBondContact CA-O 3.34Å; D481-N485 PolarHBondContact N-O 2.95Å; D481-N485 WeakPolarHBondContact OD1-CA 3.48Å; D481-N485 WeakPolarHBondContact OD1-CB 3.3Å; D481-N485 PolarHBondContact OD1-N 2.9Å; D483-N485 VanDerWaalsContact C-N 3.27Å; D483-N485 WeakPolarHBondContact CB-ND2 3.42Å; N485-H489 HydrophobicContact CB-CB 3.89Å; N485-H489 WeakPolarHBondContact OD1-CB 3.36Å; N485-I490 HydrophobicContact CB-CG1 4.43Å
486	T	82.2	Confident	75.8	Confident	12 Å²	12	52 Å²	52	7%	0.074	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-84.1	168.9	161.5	69.3	0	0	0	0	110.7	A479 H480 G484 L488 H489 I490	A479-T486 WeakPolarHBondContact O-CA 3.37Å; A479-T486 WeakPolarHBondContact O-CB 3.29Å; H480-T486 WeakPolarHBondContact CD2-CG2 3.47Å; G484-T486 PolarHBondContact O-N 2.95Å; T486-L488 PolarHBondContact O-N 2.86Å; T486-L488 PolarHBondContact OG1-N 2.83Å; T486-H489 PolarHBondContact N-ND1 2.76Å; T486-H489 WeakPolarHBondContact O-CB 3.3Å; T486-H489 PolarHBondContact O-N 3.43Å; T486-H489 PolarHBondContact OG1-ND1 3.17Å; T486-I490 PolarHBondContact O-N 3.17Å
487	S	77.3	Confident	74.7	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-58.1	-19.6	173.7	-63.2	0	0	0	0	113.1	H456 T459 A491	H456-S487 PolarHBondContact CD2-OG 3.33Å; H456-S487 PolarHBondContact CE1-OG 2.71Å; H456-S487 PolarHBondContact ND1-OG 2.64Å; H456-S487 PolarHBondContact NE2-N 2.65Å; H456-S487 PolarHBondContact NE2-OG 2.98Å; T459-S487 WeakPolarHBondContact CG2-O 3.33Å; S487-A491 WeakPolarHBondContact O-CB 3.35Å; S487-A491 PolarHBondContact O-N 3.21Å
488	L	69.8	Low	73.5	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.063	33%	0.333	C	S	.	.	H	α-helix	trans	-69.6	-44.6	169.7	-177.1	53.6	0	0	0	112.5	T486 I490 A491 I492 M500 V503 I504 W507	T486-L488 PolarHBondContact O-N 2.86Å; T486-L488 PolarHBondContact OG1-N 2.83Å; L488-I490 VanDerWaalsContact C-N 3.28Å; L488-I490 PolarHBondContact O-N 3.23Å; L488-A491 PolarHBondContact O-N 3.11Å; L488-A491 VanDerWaalsContact O-N 3.14Å; L488-I492 HydrophobicContact CD1-CD1 4.15Å; L488-I492 HydrophobicContact CD1-CG1 4.29Å; L488-I492 HydrophobicContact CG-CD1 3.97Å; L488-I492 VanDerWaalsContact O-CG1 3.29Å; L488-I492 WeakPolarHBondContact O-CG1 3.44Å; L488-I492 PolarHBondContact O-N 3.42Å; L488-M500 HydrophobicContact CD1-SD 4.32Å; L488-V503 HydrophobicContact CB-CG1 3.56Å; L488-V503 HydrophobicContact CD1-CB 4.18Å; L488-V503 HydrophobicContact CD1-CG1 3.87Å; L488-V503 HydrophobicContact CG-CG1 4.22Å; L488-I504 HydrophobicContact CD1-CG1 3.62Å; L488-W507 HydrophobicContact CD2-CB 3.89Å; L488-W507 HydrophobicContact CD2-CD2 3.98Å; L488-W507 HydrophobicContact CD2-CG 3.54Å
489	H	75.4	Confident	72.6	Confident	87 Å²	87	58.8 Å²	58.8	40%	0.403	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-39.5	179.4	-64.1	82.5	0	0	0	110.6	N485 T486 I492 S493	N485-H489 HydrophobicContact CB-CB 3.89Å; N485-H489 WeakPolarHBondContact OD1-CB 3.36Å; T486-H489 PolarHBondContact N-ND1 2.76Å; T486-H489 WeakPolarHBondContact O-CB 3.3Å; T486-H489 PolarHBondContact O-N 3.43Å; T486-H489 PolarHBondContact OG1-ND1 3.17Å; H489-I492 PolarHBondContact O-N 3.35Å; H489-S493 WeakPolarHBondContact O-CB 3.47Å; H489-S493 PolarHBondContact O-N 2.6Å; H489-S493 PolarHBondContact O-OG 3.49Å
490	I	78.7	Confident	71	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.041	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-45.1	171.5	-63.5	-173.6	0	0	0	112	H456 T459 Y460 N485 T486 L488 I492 S493 V494	H456-I490 HydrophobicContact CB-CD1 3.68Å; T459-I490 HydrophobicContact CG2-CB 4.48Å; T459-I490 HydrophobicContact CG2-CG2 4.11Å; Y460-I490 HydrophobicContact CD2-CG2 4.18Å; Y460-I490 HydrophobicContact CG-CG2 4.45Å; N485-I490 HydrophobicContact CB-CG1 4.43Å; T486-I490 PolarHBondContact O-N 3.17Å; L488-I490 VanDerWaalsContact C-N 3.28Å; L488-I490 PolarHBondContact O-N 3.23Å; I490-I492 VanDerWaalsContact C-N 3.26Å; I490-I492 PolarHBondContact O-N 3.34Å; I490-S493 PolarHBondContact O-N 2.89Å; I490-S493 PolarHBondContact O-OG 3.17Å; I490-V494 HydrophobicContact CG2-CG2 4.28Å; I490-V494 WeakPolarHBondContact O-CG2 3.33Å; I490-V494 PolarHBondContact O-N 3.41Å
491	A	71.4	Confident	69.3	Low	0 Å²	0	59 Å²	59	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-36.1	178.3	0	0	0	0	0	112.4	T459 S487 L488 N496 A499 M500	T459-A491 HydrophobicContact CG2-CB 3.76Å; S487-A491 WeakPolarHBondContact O-CB 3.35Å; S487-A491 PolarHBondContact O-N 3.21Å; L488-A491 PolarHBondContact O-N 3.11Å; L488-A491 VanDerWaalsContact O-N 3.14Å; A491-N496 PolarHBondContact O-N 3.3Å; A491-A499 HydrophobicContact CB-CB 4.44Å; A491-M500 HydrophobicContact CB-CG 3.98Å; A491-M500 HydrophobicContact CB-SD 3.95Å; A491-M500 WeakPolarHBondContact O-CG 3.36Å
492	I	67.9	Low	67.7	Low	90 Å²	90	61.9 Å²	61.9	46%	0.462	34%	0.338	S	S	.	.	H	α-helix	trans	-67.7	-53.6	174.1	-66	164	0	0	0	110.5	L488 H489 I490 V494 S495 M500	L488-I492 HydrophobicContact CD1-CD1 4.15Å; L488-I492 HydrophobicContact CD1-CG1 4.29Å; L488-I492 HydrophobicContact CG-CD1 3.97Å; L488-I492 VanDerWaalsContact O-CG1 3.29Å; L488-I492 WeakPolarHBondContact O-CG1 3.44Å; L488-I492 PolarHBondContact O-N 3.42Å; H489-I492 PolarHBondContact O-N 3.35Å; I490-I492 VanDerWaalsContact C-N 3.26Å; I490-I492 PolarHBondContact O-N 3.34Å; I492-V494 PolarHBondContact O-N 3.45Å; I492-S495 PolarHBondContact O-N 3.46Å; I492-M500 HydrophobicContact CB-CE 4.45Å; I492-M500 HydrophobicContact CB-SD 4.27Å; I492-M500 HydrophobicContact CG1-CE 3.71Å; I492-M500 HydrophobicContact CG1-SD 3.49Å; I492-M500 WeakPolarHBondContact CG1-SD 3.17Å
493	S	72.7	Confident	66.1	Low	88 Å²	88	55.1 Å²	55.1	62%	0.615	31%	0.307	S	S	*	.	H	α-helix	trans	-64.9	-39	-172.1	66	0	0	0	0	113.1	H489 I490 S495	H489-S493 WeakPolarHBondContact O-CB 3.47Å; H489-S493 PolarHBondContact O-N 2.6Å; H489-S493 PolarHBondContact O-OG 3.49Å; I490-S493 PolarHBondContact O-N 2.89Å; I490-S493 PolarHBondContact O-OG 3.17Å; S493-S495 PolarHBondContact O-N 2.84Å
494	V	68.4	Low	64.5	Low	52 Å²	52	51 Å²	51	32%	0.315	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-0.8	176.9	-173.9	0	0	0	0	112.1	Y460 I490 I492 N496	Y460-V494 HydrophobicContact CD2-CG2 3.72Å; Y460-V494 HydrophobicContact CE2-CG2 4.07Å; Y460-V494 HydrophobicContact CG-CG2 4.41Å; I490-V494 HydrophobicContact CG2-CG2 4.28Å; I490-V494 WeakPolarHBondContact O-CG2 3.33Å; I490-V494 PolarHBondContact O-N 3.41Å; I492-V494 PolarHBondContact O-N 3.45Å; V494-N496 PolarHBondContact O-N 2.99Å
495	S	58.7	Low	63.1	Low	91 Å²	91	54.4 Å²	54.4	64%	0.636	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	32.2	-173.2	-66.9	0	0	0	0	113.3	I492 S493 R497	I492-S495 PolarHBondContact O-N 3.46Å; S493-S495 PolarHBondContact O-N 2.84Å; S495-R497 VanDerWaalsContact C-N 3.3Å; S495-R497 WeakPolarHBondContact O-CG 3.46Å; S495-R497 PolarHBondContact O-N 3.43Å
496	N	59.6	Low	61.6	Low	11 Å²	11	53 Å²	53	6%	0.059	28%	0.281	C	S	.	.			trans	-74.1	80.4	-175.3	-179.4	-9.6	0	0	0	110.6	T459 S462 A491 V494 C498 A499 M500	T459-N496 PolarHBondContact O-ND2 2.85Å; S462-N496 WeakPolarHBondContact CA-ND2 3.45Å; S462-N496 PolarHBondContact OG-ND2 2.89Å; A491-N496 PolarHBondContact O-N 3.3Å; V494-N496 PolarHBondContact O-N 2.99Å; N496-C498 PolarHBondContact O-N 3.09Å; N496-C498 PolarHBondContact OD1-N 2.98Å; N496-A499 HydrophobicContact CB-CB 4.46Å; N496-A499 VanDerWaalsContact ND2-CB 3.31Å; N496-A499 WeakPolarHBondContact ND2-CB 3.34Å; N496-A499 PolarHBondContact O-N 3.03Å; N496-A499 PolarHBondContact OD1-N 2.9Å; N496-M500 VanDerWaalsContact O-CB 3.29Å; N496-M500 WeakPolarHBondContact O-CB 3.46Å; N496-M500 WeakPolarHBondContact O-CG 3.37Å; N496-M500 PolarHBondContact O-N 3.41Å
497	R	55.2	Low	59.9	Low	219 Å²	219	58 Å²	58	83%	0.826	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-15.5	-178.1	-61.2	-171.1	-176.4	-155.8	0	114.3	S495 P501	S495-R497 VanDerWaalsContact C-N 3.3Å; S495-R497 WeakPolarHBondContact O-CG 3.46Å; S495-R497 PolarHBondContact O-N 3.43Å; R497-P501 WeakPolarHBondContact O-CD 3.4Å
498	C	50.2	Low	58.2	Low	72 Å²	72	62.5 Å²	62.5	49%	0.486	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-42.2	-179.9	-62.1	0	0	0	0	112.4	L464 N496	L464-C498 HydrophobicContact CD1-CB 4.12Å; L464-C498 WeakPolarHBondContact CD1-O 3.48Å; L464-C498 HydrophobicContact CD2-CB 4.04Å; L464-C498 HydrophobicContact CG-CB 4.5Å; N496-C498 PolarHBondContact O-N 3.09Å; N496-C498 PolarHBondContact OD1-N 2.98Å
499	A	53.6	Low	57.1	Low	0 Å²	0	64 Å²	64	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-75.8	-34.2	173.4	0	0	0	0	0	112.3	T459 A491 N496 L502 V503	T459-A499 HydrophobicContact CG2-CB 4.11Å; A491-A499 HydrophobicContact CB-CB 4.44Å; N496-A499 HydrophobicContact CB-CB 4.46Å; N496-A499 VanDerWaalsContact ND2-CB 3.31Å; N496-A499 WeakPolarHBondContact ND2-CB 3.34Å; N496-A499 PolarHBondContact O-N 3.03Å; N496-A499 PolarHBondContact OD1-N 2.9Å; A499-L502 PolarHBondContact O-N 3.44Å; A499-V503 PolarHBondContact O-N 2.73Å; A499-V503 VanDerWaalsContact O-N 3.17Å
500	M	50.3	Low	55.8	Low	46 Å²	46	63.8 Å²	63.8	23%	0.227	33%	0.328	C	S	.	.	H	α-helix	trans	-45.9	-53.2	-177.3	-85.8	-78.4	-89.6	0	0	113.8	L488 A491 I492 N496 L502 V503 I504	L488-M500 HydrophobicContact CD1-SD 4.32Å; A491-M500 HydrophobicContact CB-CG 3.98Å; A491-M500 HydrophobicContact CB-SD 3.95Å; A491-M500 WeakPolarHBondContact O-CG 3.36Å; I492-M500 HydrophobicContact CB-CE 4.45Å; I492-M500 HydrophobicContact CB-SD 4.27Å; I492-M500 HydrophobicContact CG1-CE 3.71Å; I492-M500 HydrophobicContact CG1-SD 3.49Å; I492-M500 WeakPolarHBondContact CG1-SD 3.17Å; N496-M500 VanDerWaalsContact O-CB 3.29Å; N496-M500 WeakPolarHBondContact O-CB 3.46Å; N496-M500 WeakPolarHBondContact O-CG 3.37Å; N496-M500 PolarHBondContact O-N 3.41Å; M500-L502 PolarHBondContact O-N 3.4Å; M500-V503 PolarHBondContact O-N 2.7Å; M500-I504 HydrophobicContact CB-CD1 4.22Å; M500-I504 HydrophobicContact CE-CD1 3.71Å; M500-I504 WeakPolarHBondContact O-CB 3.49Å; M500-I504 WeakPolarHBondContact O-CG1 3.31Å; M500-I504 PolarHBondContact O-N 2.91Å; M500-I504 HydrophobicContact SD-CD1 3.81Å; M500-I504 HydrophobicContact SD-CG1 4.38Å
501	P	49.1	Very low	54.3	Low	65 Å²	65	67.4 Å²	67.4	42%	0.422	35%	0.347	S	S	.	.	H	α-helix	trans	-57.4	-44.8	178.4	-26.1	34.8	0	0	0	113.9	R497 V503 F505	R497-P501 WeakPolarHBondContact O-CD 3.4Å; P501-V503 VanDerWaalsContact C-N 3.34Å; P501-V503 PolarHBondContact O-N 2.87Å; P501-F505 WeakPolarHBondContact O-CB 3.42Å; P501-F505 WeakPolarHBondContact O-CD2 3.46Å; P501-F505 PolarHBondContact O-N 2.95Å
502	L	52.1	Low	52.8	Low	70 Å²	70	76.7 Å²	76.7	37%	0.366	39%	0.391	S	S	.	.	H	α-helix	trans	-64.3	-40.1	-176.6	-67.8	168.9	0	0	0	111.9	L464 V468 A499 M500	L464-L502 HydrophobicContact CD1-CD1 3.77Å; V468-L502 HydrophobicContact CG2-CD1 3.6Å; A499-L502 PolarHBondContact O-N 3.44Å; M500-L502 PolarHBondContact O-N 3.4Å
503	V	52.5	Low	51.6	Low	2 Å²	2	77.5 Å²	77.5	1%	0.012	40%	0.396	C	S	.	.	H	α-helix	trans	-80.2	-40.4	-179.2	-171.8	0	0	0	0	111.3	I477 L488 A499 M500 P501 F505 D506 W507	I477-V503 HydrophobicContact CG2-CG1 3.68Å; L488-V503 HydrophobicContact CB-CG1 3.56Å; L488-V503 HydrophobicContact CD1-CB 4.18Å; L488-V503 HydrophobicContact CD1-CG1 3.87Å; L488-V503 HydrophobicContact CG-CG1 4.22Å; A499-V503 PolarHBondContact O-N 2.73Å; A499-V503 VanDerWaalsContact O-N 3.17Å; M500-V503 PolarHBondContact O-N 2.7Å; P501-V503 VanDerWaalsContact C-N 3.34Å; P501-V503 PolarHBondContact O-N 2.87Å; V503-F505 VanDerWaalsContact C-N 3.31Å; V503-F505 PolarHBondContact O-N 2.91Å; V503-D506 PolarHBondContact O-N 3.25Å; V503-W507 PolarHBondContact O-N 2.88Å
504	I	48.2	Very low	50.4	Low	54 Å²	54	81.2 Å²	81.2	28%	0.277	40%	0.404	S	S	.	.	H	α-helix	trans	-61.1	-39.1	173.8	-72	171	0	0	0	111	L488 M500 D506 W507 L508	L488-I504 HydrophobicContact CD1-CG1 3.62Å; M500-I504 HydrophobicContact CB-CD1 4.22Å; M500-I504 HydrophobicContact CE-CD1 3.71Å; M500-I504 WeakPolarHBondContact O-CB 3.49Å; M500-I504 WeakPolarHBondContact O-CG1 3.31Å; M500-I504 PolarHBondContact O-N 2.91Å; M500-I504 HydrophobicContact SD-CD1 3.81Å; M500-I504 HydrophobicContact SD-CG1 4.38Å; I504-D506 VanDerWaalsContact C-N 3.33Å; I504-D506 PolarHBondContact O-N 3.11Å; I504-W507 PolarHBondContact O-N 2.73Å; I504-L508 HydrophobicContact CG2-CD1 3.48Å; I504-L508 VanDerWaalsContact CG2-CD1 3.48Å; I504-L508 HydrophobicContact CG2-CG 3.82Å; I504-L508 WeakPolarHBondContact O-CB 3.45Å; I504-L508 WeakPolarHBondContact O-CG 3.49Å; I504-L508 PolarHBondContact O-N 3.39Å
505	F	50.4	Low	49.2	Very low	110 Å²	110	83.3 Å²	83.3	48%	0.482	42%	0.421	S	S	.	.	H	α-helix	trans	-60.7	-41.1	176.8	-92.6	-61	0	0	0	112	P501 V503 W507 L509	P501-F505 WeakPolarHBondContact O-CB 3.42Å; P501-F505 WeakPolarHBondContact O-CD2 3.46Å; P501-F505 PolarHBondContact O-N 2.95Å; V503-F505 VanDerWaalsContact C-N 3.31Å; V503-F505 PolarHBondContact O-N 2.91Å; F505-W507 VanDerWaalsContact C-N 3.35Å; F505-W507 PolarHBondContact O-N 3.35Å; F505-L509 WeakPolarHBondContact O-CD1 3.34Å; F505-L509 WeakPolarHBondContact O-CG 3.48Å; F505-L509 PolarHBondContact O-N 2.72Å
506	D	49.8	Very low	48.2	Very low	25 Å²	25	82 Å²	82	13%	0.134	41%	0.406	C	S	.	.	H	α-helix	trans	-68.3	-36.1	178.7	-144.5	84.2	0	0	0	112.4	I477 V503 I504 K510 R615	I477-D506 HydrophobicContact CD1-CB 3.85Å; V503-D506 PolarHBondContact O-N 3.25Å; I504-D506 VanDerWaalsContact C-N 3.33Å; I504-D506 PolarHBondContact O-N 3.11Å; D506-K510 WeakPolarHBondContact O-CD 3.36Å; D506-K510 WeakPolarHBondContact OD2-CE 3.23Å; D506-K510 IonicContact OD2-NZ 3.89Å; D506-K510 PolarHBondContact OD2-NZ 3.23Å; D506-R615 IonicContact OD1-CZ 3.82Å; D506-R615 VanDerWaalsContact OD1-CZ 3.27Å; D506-R615 IonicContact OD1-NE 2.63Å; D506-R615 PolarHBondContact OD1-NE 2.9Å; D506-R615 IonicContact OD1-NH2 2.72Å; D506-R615 PolarHBondContact OD1-NH2 3.34Å; D506-R615 IonicContact OD2-CZ 3.73Å; D506-R615 IonicContact OD2-NH2 2.76Å; D506-R615 PolarHBondContact OD2-NH2 3.37Å
507	W	46.8	Very low	47.2	Very low	115 Å²	115	85.7 Å²	85.7	44%	0.436	43%	0.429	S	S	.	.	H	α-helix	trans	-72.2	-44.2	178.9	-171.9	93.3	0	0	0	113.2	L488 V503 I504 F505 L509 K510 N511	L488-W507 HydrophobicContact CD2-CB 3.89Å; L488-W507 HydrophobicContact CD2-CD2 3.98Å; L488-W507 HydrophobicContact CD2-CG 3.54Å; V503-W507 PolarHBondContact O-N 2.88Å; I504-W507 PolarHBondContact O-N 2.73Å; F505-W507 VanDerWaalsContact C-N 3.35Å; F505-W507 PolarHBondContact O-N 3.35Å; W507-L509 PolarHBondContact O-N 2.98Å; W507-K510 PolarHBondContact O-N 3.23Å; W507-N511 WeakPolarHBondContact CZ2-ND2 3.45Å; W507-N511 PolarHBondContact NE1-ND2 2.96Å; W507-N511 PolarHBondContact O-N 3.42Å
508	L	41.5	Very low	46.5	Very low	95 Å²	95	83.6 Å²	83.6	50%	0.497	43%	0.426	S	S	.	.	H	α-helix	trans	-66.1	-22.4	176.2	-74.2	178	0	0	0	113.5	I504	I504-L508 HydrophobicContact CG2-CD1 3.48Å; I504-L508 VanDerWaalsContact CG2-CD1 3.48Å; I504-L508 HydrophobicContact CG2-CG 3.82Å; I504-L508 WeakPolarHBondContact O-CB 3.45Å; I504-L508 WeakPolarHBondContact O-CG 3.49Å; I504-L508 PolarHBondContact O-N 3.39Å
509	L	46.4	Very low	45.7	Very low	45 Å²	45	85.7 Å²	85.7	24%	0.236	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-10.9	174	-63.9	166.6	0	0	0	112.7	F505 W507 M563	F505-L509 WeakPolarHBondContact O-CD1 3.34Å; F505-L509 WeakPolarHBondContact O-CG 3.48Å; F505-L509 PolarHBondContact O-N 2.72Å; W507-L509 PolarHBondContact O-N 2.98Å; L509-M563 HydrophobicContact CD2-CG 4.04Å
510	K	48	Very low	45	Very low	82 Å²	82	90.6 Å²	90.6	36%	0.357	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-46	175.5	-74.7	161.8	172.1	152.6	0	112.3	D478 D506 W507	D478-K510 IonicContact OD1-NZ 3.62Å; D478-K510 PolarHBondContact OD1-NZ 3.19Å; D478-K510 VanDerWaalsContact OD2-CE 3.3Å; D478-K510 WeakPolarHBondContact OD2-CE 3.5Å; D478-K510 IonicContact OD2-NZ 2.76Å; D478-K510 PolarHBondContact OD2-NZ 3.05Å; D506-K510 WeakPolarHBondContact O-CD 3.36Å; D506-K510 WeakPolarHBondContact OD2-CE 3.23Å; D506-K510 IonicContact OD2-NZ 3.89Å; D506-K510 PolarHBondContact OD2-NZ 3.23Å; W507-K510 PolarHBondContact O-N 3.23Å
511	N	46.6	Very low	44.5	Very low	84 Å²	84	94.8 Å²	94.8	45%	0.449	48%	0.479	S	S	.	.	S	Bend	trans	-82.7	121.8	-175.2	-74	-31.6	0	0	0	111.9	W507	W507-N511 WeakPolarHBondContact CZ2-ND2 3.45Å; W507-N511 PolarHBondContact NE1-ND2 2.96Å; W507-N511 PolarHBondContact O-N 3.42Å
512	Q	41.3	Very low	44.1	Very low	194 Å²	194	94.8 Å²	94.8	91%	0.907	48%	0.476	S	S	*	.			trans	-69.5	132.8	-176.8	-58.4	-175.1	33.7	0	0	110.3
513	N	43	Very low	43.3	Very low	108 Å²	108	97.4 Å²	97.4	58%	0.578	48%	0.484	S	S	*	.			trans	-122.6	116.4	178.2	-155.6	-23.3	0	0	0	109.2	S515	N513-S515 VanDerWaalsContact C-N 3.29Å; N513-S515 PolarHBondContact O-N 3.15Å
514	E	46	Very low	42.3	Very low	166 Å²	166	101.3 Å²	101.3	78%	0.776	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-71.9	-19.7	-157.8	-60.7	-177.8	120.2	0	0	114.1	I516 T517	E514-I516 PolarHBondContact O-N 2.9Å; E514-T517 WeakPolarHBondContact O-CB 3.43Å; E514-T517 PolarHBondContact O-N 3.37Å; E514-T517 VanDerWaalsContact O-N 3.12Å; E514-T517 PolarHBondContact O-OG1 3.32Å
515	S	43	Very low	41.5	Very low	96 Å²	96	101.7 Å²	101.7	67%	0.671	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-61.4	-20.5	-171.6	-42	0	0	0	0	114.7	N513 T517	N513-S515 VanDerWaalsContact C-N 3.29Å; N513-S515 PolarHBondContact O-N 3.15Å; S515-T517 VanDerWaalsContact C-N 3.29Å; S515-T517 PolarHBondContact O-N 3.1Å
516	I	39.2	Very low	41.1	Very low	64 Å²	64	100.6 Å²	100.6	33%	0.328	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-80.3	-8.2	-178.5	-70.5	165.2	0	0	0	112.6	E514 K518 L519 L520	E514-I516 PolarHBondContact O-N 2.9Å; I516-K518 PolarHBondContact O-N 2.82Å; I516-K518 VanDerWaalsContact O-N 3.16Å; I516-L519 HydrophobicContact CG2-CB 4.38Å; I516-L519 WeakPolarHBondContact O-CB 3.48Å; I516-L519 PolarHBondContact O-N 2.83Å; I516-L520 PolarHBondContact O-N 2.86Å
517	T	38.5	Very low	40.9	Very low	87 Å²	87	102.8 Å²	102.8	53%	0.534	55%	0.551	S	S	.	*	H	α-helix	trans	-56.8	-32	174	-48.2	0	0	0	0	112.2	E514 S515 L519 L520 L521	E514-T517 WeakPolarHBondContact O-CB 3.43Å; E514-T517 PolarHBondContact O-N 3.37Å; E514-T517 VanDerWaalsContact O-N 3.12Å; E514-T517 PolarHBondContact O-OG1 3.32Å; S515-T517 VanDerWaalsContact C-N 3.29Å; S515-T517 PolarHBondContact O-N 3.1Å; T517-L519 VanDerWaalsContact C-N 3.31Å; T517-L519 PolarHBondContact O-N 3.5Å; T517-L520 PolarHBondContact O-N 2.99Å; T517-L521 PolarHBondContact O-N 2.98Å
518	K	40	Very low	40.8	Very low	176 Å²	176	101.7 Å²	101.7	77%	0.765	55%	0.554	S	S	*	*	H	α-helix	trans	-65.7	-24.5	173.6	-77.7	-174	172.8	-177.8	0	114.8	I516	I516-K518 PolarHBondContact O-N 2.82Å; I516-K518 VanDerWaalsContact O-N 3.16Å
519	L	34.1	Very low	41	Very low	115 Å²	115	100.6 Å²	100.6	60%	0.602	55%	0.551	S	S	*	*	H	α-helix	trans	-81.6	-26.7	176	-92.4	159.7	0	0	0	112.7	I516 T517	I516-L519 HydrophobicContact CG2-CB 4.38Å; I516-L519 WeakPolarHBondContact O-CB 3.48Å; I516-L519 PolarHBondContact O-N 2.83Å; T517-L519 VanDerWaalsContact C-N 3.31Å; T517-L519 PolarHBondContact O-N 3.5Å
520	L	38	Very low	41.1	Very low	104 Å²	104	104.4 Å²	104.4	55%	0.545	57%	0.567	S	S	.	*	H	α-helix	trans	-81.1	-26	177.1	-70.4	166.7	0	0	0	112.6	I516 T517 L522 F523	I516-L520 PolarHBondContact O-N 2.86Å; T517-L520 PolarHBondContact O-N 2.99Å; L520-L522 PolarHBondContact O-N 2.93Å; L520-L522 VanDerWaalsContact O-N 3.12Å; L520-F523 PolarHBondContact O-N 3.44Å
521	L	40.2	Very low	41.4	Very low	133 Å²	133	103.2 Å²	103.2	70%	0.696	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-64.5	-10.4	177.8	-82.7	164.7	0	0	0	114.8	T517 F523	T517-L521 PolarHBondContact O-N 2.98Å; L521-F523 VanDerWaalsContact C-N 3.31Å; L521-F523 PolarHBondContact O-N 3.24Å
522	L	39.6	Very low	41.8	Very low	65 Å²	65	105.4 Å²	105.4	34%	0.34	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-79.5	-7.8	179.5	-65.5	166.6	0	0	0	114.1	L520 V1495	L520-L522 PolarHBondContact O-N 2.93Å; L520-L522 VanDerWaalsContact O-N 3.12Å; L522-V1495 HydrophobicContact CB-CG1 3.81Å; L522-V1495 HydrophobicContact CD1-CG1 3.99Å; L522-V1495 HydrophobicContact CD1-CG2 3.93Å; L522-V1495 HydrophobicContact CD2-CG1 4.15Å; L522-V1495 HydrophobicContact CG-CG1 4.19Å
523	F	35.1	Very low	42.6	Very low	125 Å²	125	101.4 Å²	101.4	55%	0.548	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-102	3.1	-172.3	-76.7	-77.5	0	0	0	116.3	L520 L521 A525	L520-F523 PolarHBondContact O-N 3.44Å; L521-F523 VanDerWaalsContact C-N 3.31Å; L521-F523 PolarHBondContact O-N 3.24Å; F523-A525 VanDerWaalsContact C-N 3.25Å; F523-A525 PolarHBondContact O-N 3.44Å
524	G	32.5	Very low	43.7	Very low	84 Å²	84	98.2 Å²	98.2	87%	0.866	54%	0.538	S	S	*	.			trans	66.2	-1.5	157.8	0	0	0	0	0	119.8
525	A	31.2	Very low	44.3	Very low	62 Å²	62	93.6 Å²	93.6	51%	0.512	52%	0.521	S	S	.	.	S	Bend	trans	-154.7	173.5	176.8	0	0	0	0	0	110.8	F523 P527	F523-A525 VanDerWaalsContact C-N 3.25Å; F523-A525 PolarHBondContact O-N 3.44Å; A525-P527 WeakPolarHBondContact O-CD 3.45Å; A525-P527 VanDerWaalsContact O-N 3.15Å
526	D	41.4	Very low	45.2	Very low	88 Å²	88	93 Å²	93	47%	0.471	51%	0.506	S	S	.	.			trans	-64.3	110.5	173.8	178.1	4.2	0	0	0	110.7	N528	D526-N528 PolarHBondContact O-N 2.97Å; D526-N528 WeakPolarHBondContact OD1-CB 3.47Å; D526-N528 PolarHBondContact OD1-N 3.32Å; D526-N528 PolarHBondContact OD1-ND2 2.72Å
527	P	47.4	Very low	46.2	Very low	70 Å²	70	96.8 Å²	96.8	46%	0.455	53%	0.527	S	S	.	.	H	α-helix	trans	-69.5	-16.5	-173.9	30.3	-36.3	0	0	0	112.9	A525 V529 V531	A525-P527 WeakPolarHBondContact O-CD 3.45Å; A525-P527 VanDerWaalsContact O-N 3.15Å; P527-V529 VanDerWaalsContact C-N 3.3Å; P527-V529 PolarHBondContact O-N 3.13Å; P527-V531 WeakPolarHBondContact O-CB 3.36Å; P527-V531 VanDerWaalsContact O-CG2 3.28Å; P527-V531 WeakPolarHBondContact O-CG2 3.38Å
528	N	44.6	Very low	47.3	Very low	92 Å²	92	96.1 Å²	96.1	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-73	-21.2	-174.6	-62.7	-82.4	0	0	0	113.5	D526 K532	D526-N528 PolarHBondContact O-N 2.97Å; D526-N528 WeakPolarHBondContact OD1-CB 3.47Å; D526-N528 PolarHBondContact OD1-N 3.32Å; D526-N528 PolarHBondContact OD1-ND2 2.72Å; N528-K532 WeakPolarHBondContact O-CD 3.43Å; N528-K532 WeakPolarHBondContact O-CG 3.46Å
529	V	44.2	Very low	48.4	Very low	73 Å²	73	92.9 Å²	92.9	44%	0.442	52%	0.523	S	S	.	.	H	α-helix	trans	-90.3	-52.6	-174.8	-177.1	0	0	0	0	111.5	P527 N533	P527-V529 VanDerWaalsContact C-N 3.3Å; P527-V529 PolarHBondContact O-N 3.13Å; V529-N533 PolarHBondContact O-N 3.38Å
530	H	49.1	Very low	50.3	Low	124 Å²	124	93.5 Å²	93.5	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-69.4	-40.5	-174.7	-67.3	8.2	0	0	0	112.5	K532 N533 K534	H530-K532 VanDerWaalsContact C-N 3.32Å; H530-K532 PolarHBondContact O-N 3.24Å; H530-N533 PolarHBondContact O-N 3.47Å; H530-K534 PolarHBondContact O-N 3.15Å; H530-K534 VanDerWaalsContact O-N 3.1Å
531	V	54.1	Low	52.4	Low	57 Å²	57	89.2 Å²	89.2	35%	0.345	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-32.5	-177.9	176.5	0	0	0	0	112.7	P527 L568 I575	P527-V531 WeakPolarHBondContact O-CB 3.36Å; P527-V531 VanDerWaalsContact O-CG2 3.28Å; P527-V531 WeakPolarHBondContact O-CG2 3.38Å; V531-L568 HydrophobicContact CG1-CD2 4.38Å; V531-I575 HydrophobicContact CG1-CD1 3.92Å
532	K	56	Low	54.5	Low	131 Å²	131	83.9 Å²	83.9	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-72.2	-41.3	177.1	-76.7	-178.7	-178.5	172.9	0	112.8	N528 H530 I570	N528-K532 WeakPolarHBondContact O-CD 3.43Å; N528-K532 WeakPolarHBondContact O-CG 3.46Å; H530-K532 VanDerWaalsContact C-N 3.32Å; H530-K532 PolarHBondContact O-N 3.24Å; K532-I570 HydrophobicContact CD-CD1 4.44Å; K532-I570 HydrophobicContact CG-CD1 3.7Å
533	N	56.7	Low	56.8	Low	110 Å²	110	81.8 Å²	81.8	59%	0.588	46%	0.463	S	S	*	.	H	α-helix	trans	-87.2	-15.5	-171.3	-66.7	-4.1	0	0	0	113.3	V529 H530 V535	V529-N533 PolarHBondContact O-N 3.38Å; H530-N533 PolarHBondContact O-N 3.47Å; N533-V535 VanDerWaalsContact C-N 3.29Å; N533-V535 HydrophobicContact CB-CG2 4.3Å; N533-V535 PolarHBondContact O-N 3.39Å
534	K	67.6	Low	59.4	Low	41 Å²	41	75.8 Å²	75.8	18%	0.178	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	43.5	-178	-45.2	-172.2	-165.8	-168.1	0	113	H530 K540 V541 Q574 I575 D577	H530-K534 PolarHBondContact O-N 3.15Å; H530-K534 VanDerWaalsContact O-N 3.1Å; K534-K540 WeakPolarHBondContact O-CA 3.24Å; K534-V541 WeakPolarHBondContact CB-O 3.39Å; K534-V541 WeakPolarHBondContact O-CG2 3.35Å; K534-V541 PolarHBondContact O-N 2.89Å; K534-Q574 PolarHBondContact NZ-O 3.34Å; K534-I575 WeakPolarHBondContact CE-O 3.4Å; K534-I575 PolarHBondContact NZ-O 2.89Å; K534-D577 WeakPolarHBondContact CD-OD2 3.1Å; K534-D577 IonicContact NZ-OD1 3.87Å; K534-D577 PolarHBondContact NZ-OD1 2.84Å; K534-D577 IonicContact NZ-OD2 2.71Å; K534-D577 PolarHBondContact NZ-OD2 3.06Å
535	V	58.5	Low	62.3	Low	69 Å²	69	71.9 Å²	71.9	42%	0.418	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.5	176.5	178.7	0	0	0	0	109.7	N533 K539	N533-V535 VanDerWaalsContact C-N 3.29Å; N533-V535 HydrophobicContact CB-CG2 4.3Å; N533-V535 PolarHBondContact O-N 3.39Å; V535-K539 CarbonylContact C-O 3.59Å; V535-K539 VanDerWaalsContact CA-O 3.24Å; V535-K539 WeakPolarHBondContact CA-O 3.44Å
536	K	61.4	Low	65.3	Low	83 Å²	83	69 Å²	69	36%	0.361	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.5	167	-171.9	-169.2	171.6	-171.4	0	106.7	G538 K539 V541 N810	K536-G538 PolarHBondContact O-N 3.28Å; K536-G538 VanDerWaalsContact O-N 3.11Å; K536-K539 PolarHBondContact N-O 3.12Å; K536-K539 PolarHBondContact O-N 3.24Å; K536-K539 VanDerWaalsContact O-O 3.12Å; K536-V541 HydrophobicContact CB-CG1 3.8Å; K536-V541 HydrophobicContact CB-CG2 4.04Å; K536-N810 PolarHBondContact NZ-O 3.17Å
537	D	59.7	Low	67.8	Low	144 Å²	144	64.8 Å²	64.8	77%	0.77	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	39.2	176	-48.7	-37.7	0	0	0	114.2	K539	D537-K539 PolarHBondContact O-N 3.44Å
538	G	61.6	Low	70	Confident	73 Å²	73	61.4 Å²	61.4	75%	0.753	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	-10.7	-178.3	0	0	0	0	0	115.5	K536	K536-G538 PolarHBondContact O-N 3.28Å; K536-G538 VanDerWaalsContact O-N 3.11Å
539	K	63.5	Low	72	Confident	107 Å²	107	57 Å²	57	47%	0.465	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	150.5	178.6	-55.2	-175.1	-165.8	167.9	0	112.6	V535 K536 D537 E746	V535-K539 CarbonylContact C-O 3.59Å; V535-K539 VanDerWaalsContact CA-O 3.24Å; V535-K539 WeakPolarHBondContact CA-O 3.44Å; K536-K539 PolarHBondContact N-O 3.12Å; K536-K539 PolarHBondContact O-N 3.24Å; K536-K539 VanDerWaalsContact O-O 3.12Å; D537-K539 PolarHBondContact O-N 3.44Å; K539-E746 WeakPolarHBondContact CD-OE1 3.48Å; K539-E746 WeakPolarHBondContact CD-OE2 3.34Å; K539-E746 IonicContact NZ-OE1 2.71Å; K539-E746 PolarHBondContact NZ-OE1 2.87Å; K539-E746 IonicContact NZ-OE2 3.31Å; K539-E746 PolarHBondContact NZ-OE2 3.5Å
540	K	74.4	Confident	73.6	Confident	128 Å²	128	53.8 Å²	53.8	56%	0.557	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	124.6	171.1	172.9	-177.5	153.1	-156.1	0	110.1	K534 E743	K534-K540 WeakPolarHBondContact O-CA 3.24Å; K540-E743 WeakPolarHBondContact CE-OE1 3.24Å; K540-E743 IonicContact NZ-OE1 3.58Å; K540-E743 PolarHBondContact NZ-OE1 3.27Å; K540-E743 IonicContact NZ-OE2 2.72Å; K540-E743 PolarHBondContact NZ-OE2 3.19Å
541	V	81.6	Confident	75.2	Confident	14 Å²	14	48.4 Å²	48.4	9%	0.085	26%	0.264	C	S	.	.			trans	-116.7	150	-178.9	-68.9	0	0	0	0	112.6	K534 K536 E746	K534-V541 WeakPolarHBondContact CB-O 3.39Å; K534-V541 WeakPolarHBondContact O-CG2 3.35Å; K534-V541 PolarHBondContact O-N 2.89Å; K536-V541 HydrophobicContact CB-CG1 3.8Å; K536-V541 HydrophobicContact CB-CG2 4.04Å; V541-E746 WeakPolarHBondContact CA-O 3.39Å; V541-E746 HydrophobicContact CG1-CG 4.29Å
542	S	85.5	Confident	76.3	Confident	21 Å²	21	46.5 Å²	46.5	15%	0.147	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	142.2	176.9	-66.3	0	0	0	0	112	E746 G748	S542-E746 PolarHBondContact N-O 3.19Å; S542-G748 PolarHBondContact O-N 3.3Å
543	V	86.9	Confident	77.4	Confident	21 Å²	21	42.1 Å²	42.1	13%	0.127	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.2	168.5	179.7	0	0	0	0	109.8	I575 V576 D577 W578 L751	V543-I575 HydrophobicContact CB-CG2 4.43Å; V543-I575 WeakPolarHBondContact CB-O 3.4Å; V543-I575 HydrophobicContact CG1-CG2 4.41Å; V543-I575 HydrophobicContact CG2-CG2 4.05Å; V543-V576 HydrophobicContact CG1-CG2 4.48Å; V543-D577 PolarHBondContact N-OD2 3.49Å; V543-D577 PolarHBondContact O-N 2.94Å; V543-W578 PolarHBondContact O-N 3.28Å; V543-L751 HydrophobicContact CG1-CD1 3.74Å
544	V	90.7	Very high	78.5	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.6	-177.6	-175.2	0	0	0	0	110.2	W578 T725 I729 V747 C749 F750 L751	V544-W578 HydrophobicContact CB-CB 4.4Å; V544-W578 HydrophobicContact CG1-CB 4.15Å; V544-W578 HydrophobicContact CG2-CB 4.09Å; V544-T725 HydrophobicContact CG1-CG2 3.67Å; V544-I729 HydrophobicContact CG1-CD1 4.24Å; V544-I729 HydrophobicContact CG2-CD1 3.75Å; V544-V747 HydrophobicContact CB-CG1 4.5Å; V544-V747 HydrophobicContact CG2-CB 4.43Å; V544-V747 HydrophobicContact CG2-CG1 3.69Å; V544-V747 HydrophobicContact CG2-CG2 3.9Å; V544-C749 PolarHBondContact N-O 3.13Å; V544-F750 HydrophobicContact CB-CD2 3.84Å; V544-F750 HydrophobicContact CB-CE2 4.12Å; V544-F750 HydrophobicContact CB-CG 4.31Å; V544-F750 HydrophobicContact CG1-CD2 3.75Å; V544-F750 HydrophobicContact CG1-CE2 3.49Å; V544-F750 VanDerWaalsContact CG1-CE2 3.49Å; V544-F750 HydrophobicContact CG1-CG 4.41Å; V544-F750 HydrophobicContact CG1-CZ 3.93Å; V544-F750 HydrophobicContact CG2-CD2 4.37Å; V544-L751 PolarHBondContact O-N 3.16Å
545	L	92.4	Very high	78.9	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	119.2	175.6	-178.3	63.9	0	0	0	111	L547 L561 V576 W578 V579 A580 I592 L751 V753	L545-L547 HydrophobicContact CD1-CD2 3.76Å; L545-L547 HydrophobicContact CD2-CD1 4.29Å; L545-L547 HydrophobicContact CD2-CD2 4.03Å; L545-L547 HydrophobicContact CD2-CG 4.31Å; L545-L547 HydrophobicContact CG-CD2 3.72Å; L545-L547 HydrophobicContact CG-CG 4.06Å; L545-L561 HydrophobicContact CD1-CD2 4.04Å; L545-L561 HydrophobicContact CD2-CD2 4.2Å; L545-V576 HydrophobicContact CB-CG1 3.62Å; L545-V576 HydrophobicContact CB-CG2 4.19Å; L545-V576 HydrophobicContact CD2-CG2 4.21Å; L545-W578 PolarHBondContact N-O 3.43Å; L545-V579 WeakPolarHBondContact O-CA 3.19Å; L545-A580 PolarHBondContact O-N 3.31Å; L545-I592 HydrophobicContact CD2-CD1 3.85Å; L545-L751 CarbonylContact C-O 3.56Å; L545-L751 WeakPolarHBondContact CA-O 3.39Å; L545-L751 HydrophobicContact CD1-CB 3.8Å; L545-V753 HydrophobicContact CD1-CG2 4.02Å
546	A	94.1	Very high	79.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	124.3	175.6	0	0	0	0	0	110.8	A580 P721 F750 L751 S752 V753	A546-A580 WeakPolarHBondContact CA-O 3.44Å; A546-P721 HydrophobicContact CB-CG 4.21Å; A546-F750 HydrophobicContact CB-CE1 3.71Å; A546-F750 HydrophobicContact CB-CZ 4.01Å; A546-L751 PolarHBondContact N-O 2.64Å; A546-S752 WeakPolarHBondContact O-CA 3.3Å; A546-V753 PolarHBondContact O-N 3.14Å
547	L	93.8	Very high	80.9	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.6	-174.2	-57.1	-175.8	0	0	0	112.1	L545 I557 L561 A580 G581 T582 L588 I592 V753	L545-L547 HydrophobicContact CD1-CD2 3.76Å; L545-L547 HydrophobicContact CD2-CD1 4.29Å; L545-L547 HydrophobicContact CD2-CD2 4.03Å; L545-L547 HydrophobicContact CD2-CG 4.31Å; L545-L547 HydrophobicContact CG-CD2 3.72Å; L545-L547 HydrophobicContact CG-CG 4.06Å; L547-I557 HydrophobicContact CB-CD1 4.43Å; L547-I557 HydrophobicContact CD1-CG2 4.43Å; L547-I557 HydrophobicContact CD2-CG2 3.8Å; L547-L561 HydrophobicContact CD1-CD1 4.35Å; L547-L561 HydrophobicContact CD2-CD1 4.15Å; L547-A580 PolarHBondContact N-O 2.84Å; L547-G581 WeakPolarHBondContact O-CA 3.38Å; L547-T582 PolarHBondContact O-N 3.35Å; L547-T582 VanDerWaalsContact O-N 3.14Å; L547-L588 HydrophobicContact CD1-CB 4.02Å; L547-I592 HydrophobicContact CD1-CD1 4.19Å; L547-V753 HydrophobicContact CD2-CB 3.87Å; L547-V753 HydrophobicContact CD2-CG2 4.23Å
548	D	93.4	Very high	81.8	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.141	C	C	.	.			trans	-70.9	157.2	-175.4	-66.3	6	0	0	0	114.4	I557 T582 G585 N719 V753 G754 T794 R815	D548-I557 HydrophobicContact CB-CD1 4.45Å; D548-I557 WeakPolarHBondContact O-CD1 3.2Å; D548-T582 CarbonylContact C-O 3.57Å; D548-G585 VanDerWaalsContact O-CA 3.3Å; D548-G585 WeakPolarHBondContact O-CA 3.48Å; D548-G585 PolarHBondContact O-N 3.06Å; D548-G585 VanDerWaalsContact O-N 3.16Å; D548-N719 VanDerWaalsContact CA-O 3.26Å; D548-N719 WeakPolarHBondContact CA-O 3.44Å; D548-V753 PolarHBondContact N-O 3.27Å; D548-V753 VanDerWaalsContact N-O 3.14Å; D548-G754 WeakPolarHBondContact OD2-CA 3.44Å; D548-T794 HydrophobicContact CB-CG2 3.97Å; D548-T794 WeakPolarHBondContact OD2-CB 3.46Å; D548-T794 VanDerWaalsContact OD2-CG2 3.25Å; D548-T794 WeakPolarHBondContact OD2-CG2 3.47Å; D548-R815 IonicContact OD1-CZ 2.99Å; D548-R815 IonicContact OD1-NH1 2.71Å; D548-R815 PolarHBondContact OD1-NH1 3.22Å; D548-R815 IonicContact OD1-NH2 2.68Å; D548-R815 IonicContact OD2-CZ 3.33Å; D548-R815 IonicContact OD2-NH1 2.73Å; D548-R815 PolarHBondContact OD2-NH1 3.45Å; D548-R815 VanDerWaalsContact OD2-NH1 3.17Å; D548-R815 IonicContact OD2-NH2 3.73Å; D548-R815 PolarHBondContact OD2-NH2 3.29Å
549	G	87.8	Confident	82.3	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.112	C	C	.	.			trans	-74.7	161.8	160.8	0	0	0	0	0	113	T582 N719 T755	G549-T582 WeakPolarHBondContact CA-O 3.37Å; G549-T582 PolarHBondContact N-O 3.35Å; G549-N719 WeakPolarHBondContact CA-OD1 3.41Å; G549-N719 PolarHBondContact N-O 3.09Å; G549-N719 PolarHBondContact N-OD1 3.04Å; G549-T755 WeakPolarHBondContact O-CG2 3.46Å; G549-T755 PolarHBondContact O-OG1 3.32Å
550	G	77.7	Confident	82.9	Confident	4 Å²	4	17.3 Å²	17.3	4%	0.041	9%	0.092	C	C	.	.			trans	168.6	9.2	177.7	0	0	0	0	0	118.8	R553 L826	G550-R553 PolarHBondContact O-NE 2.95Å; G550-L826 VanDerWaalsContact C-CD2 3.43Å; G550-L826 WeakPolarHBondContact O-CD2 3.45Å
551	G	81.8	Confident	83.1	Confident	12 Å²	12	11.3 Å²	11.3	12%	0.124	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	63.4	-146.8	-177.8	0	0	0	0	0	111.8	R553 G554 T584 Y621 L826	G551-R553 PolarHBondContact O-N 2.78Å; G551-G554 PolarHBondContact O-N 3.37Å; G551-T584 PolarHBondContact O-OG1 2.65Å; G551-Y621 VanDerWaalsContact C-OH 3.28Å; G551-Y621 PolarHBondContact O-OH 2.89Å; G551-L826 CarbonylContact C-O 3.42Å; G551-L826 WeakPolarHBondContact CA-O 3.46Å
552	T	76.6	Confident	82.5	Confident	17 Å²	17	11 Å²	11	10%	0.104	6%	0.064	C	C	.	.	G	3₁₀ helix	trans	-57.4	-13.9	-172.7	57.1	0	0	0	0	115.4	G554 Y621 K625 F629 L826 T828	T552-G554 PolarHBondContact O-N 3.28Å; T552-G554 VanDerWaalsContact O-N 3.14Å; T552-Y621 WeakPolarHBondContact CA-OH 3.28Å; T552-Y621 WeakPolarHBondContact O-CE1 3.45Å; T552-K625 HydrophobicContact CG2-CB 3.99Å; T552-F629 HydrophobicContact CG2-CD2 4.2Å; T552-F629 HydrophobicContact CG2-CE2 3.78Å; T552-L826 PolarHBondContact N-O 3.33Å; T552-T828 PolarHBondContact OG1-N 3.34Å; T552-T828 PolarHBondContact OG1-O 3.3Å
553	R	80.5	Confident	81.7	Confident	39 Å²	39	14 Å²	14	15%	0.147	8%	0.077	C	C	.	.	G	3₁₀ helix	trans	-64.1	-5.4	168.7	-60.9	-178.5	-69.2	159.1	-9.6	115	G550 G551 V555 V556 T755 G756 F824	G550-R553 PolarHBondContact O-NE 2.95Å; G551-R553 PolarHBondContact O-N 2.78Å; R553-V555 PolarHBondContact O-N 2.85Å; R553-V556 WeakPolarHBondContact O-CB 3.43Å; R553-V556 WeakPolarHBondContact O-CG2 3.22Å; R553-V556 PolarHBondContact O-N 3.08Å; R553-T755 HydrophobicContact CB-CG2 4.5Å; R553-T755 WeakPolarHBondContact CB-O 3.49Å; R553-G756 PolarHBondContact NH1-O 3.25Å; R553-F824 HydrophobicContact CG-CB 4.07Å
554	G	78.3	Confident	81	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-51.9	-26.9	174.7	0	0	0	0	0	114.9	G551 T552 V556 I557 V558 T584	G551-G554 PolarHBondContact O-N 3.37Å; T552-G554 PolarHBondContact O-N 3.28Å; T552-G554 VanDerWaalsContact O-N 3.14Å; G554-V556 PolarHBondContact O-N 3.47Å; G554-I557 WeakPolarHBondContact O-CB 3.35Å; G554-I557 PolarHBondContact O-N 3.33Å; G554-V558 PolarHBondContact O-N 3.01Å; G554-V558 VanDerWaalsContact O-N 3.14Å; G554-T584 VanDerWaalsContact CA-CG2 3.49Å
555	V	76	Confident	80.1	Confident	35 Å²	35	15.8 Å²	15.8	21%	0.212	8%	0.084	C	C	.	.	H	α-helix	trans	-55.5	-31.2	173.8	-173.9	0	0	0	0	112.3	R553 V558 Q559 Q618 Y621 M622	R553-V555 PolarHBondContact O-N 2.85Å; V555-V558 PolarHBondContact O-N 3.41Å; V555-Q559 WeakPolarHBondContact O-CB 3.31Å; V555-Q559 PolarHBondContact O-N 2.78Å; V555-Q618 HydrophobicContact CG1-CG 4.32Å; V555-Y621 HydrophobicContact CG2-CD1 3.48Å; V555-Y621 VanDerWaalsContact CG2-CD1 3.48Å; V555-Y621 HydrophobicContact CG2-CE1 4.07Å; V555-Y621 HydrophobicContact CG2-CG 4.31Å; V555-M622 HydrophobicContact CG2-SD 4.02Å
556	V	79.8	Confident	78.8	Confident	29 Å²	29	19 Å²	19	18%	0.176	10%	0.099	C	C	.	.	H	α-helix	trans	-62.4	-45.8	175.5	-179.4	0	0	0	0	110.9	R553 G554 Q559 T560 L820	R553-V556 WeakPolarHBondContact O-CB 3.43Å; R553-V556 WeakPolarHBondContact O-CG2 3.22Å; R553-V556 PolarHBondContact O-N 3.08Å; G554-V556 PolarHBondContact O-N 3.47Å; V556-Q559 PolarHBondContact O-N 2.75Å; V556-T560 PolarHBondContact O-N 3.04Å; V556-T560 PolarHBondContact O-OG1 2.92Å; V556-T560 VanDerWaalsContact O-OG1 3.07Å; V556-L820 HydrophobicContact CG2-CD2 4.36Å
557	I	83.6	Confident	77.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-47.2	175	-64.8	-179.9	0	0	0	110	L547 D548 G554 Q559 T560 L561 L588 V753 T755	L547-I557 HydrophobicContact CB-CD1 4.43Å; L547-I557 HydrophobicContact CD1-CG2 4.43Å; L547-I557 HydrophobicContact CD2-CG2 3.8Å; D548-I557 HydrophobicContact CB-CD1 4.45Å; D548-I557 WeakPolarHBondContact O-CD1 3.2Å; G554-I557 WeakPolarHBondContact O-CB 3.35Å; G554-I557 PolarHBondContact O-N 3.33Å; I557-Q559 VanDerWaalsContact C-N 3.33Å; I557-Q559 PolarHBondContact O-N 3.17Å; I557-T560 PolarHBondContact O-N 3.41Å; I557-L561 HydrophobicContact CG2-CD1 3.71Å; I557-L561 HydrophobicContact CG2-CG 4.14Å; I557-L561 WeakPolarHBondContact O-CB 3.38Å; I557-L561 VanDerWaalsContact O-CG 3.3Å; I557-L561 WeakPolarHBondContact O-CG 3.36Å; I557-L561 PolarHBondContact O-N 2.89Å; I557-L588 HydrophobicContact CB-CD1 3.78Å; I557-L588 HydrophobicContact CG2-CD1 3.69Å; I557-V753 HydrophobicContact CB-CG1 4.27Å; I557-V753 WeakPolarHBondContact CD1-O 3.48Å; I557-V753 HydrophobicContact CG1-CG1 4.16Å; I557-V753 HydrophobicContact CG2-CB 4.38Å; I557-V753 HydrophobicContact CG2-CG1 4.01Å; I557-T755 HydrophobicContact CD1-CG2 3.57Å; I557-T755 HydrophobicContact CG1-CG2 3.97Å
558	V	77.1	Confident	76	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.006	14%	0.139	C	C	.	.	H	α-helix	trans	-60.7	-42.5	-179.7	-175	0	0	0	0	111.7	G554 V555 L561 L562 L588 Q618	G554-V558 PolarHBondContact O-N 3.01Å; G554-V558 VanDerWaalsContact O-N 3.14Å; V555-V558 PolarHBondContact O-N 3.41Å; V558-L561 PolarHBondContact O-N 2.92Å; V558-L562 HydrophobicContact CG1-CD1 4.04Å; V558-L562 HydrophobicContact CG1-CG 4.48Å; V558-L562 WeakPolarHBondContact O-CB 3.46Å; V558-L562 WeakPolarHBondContact O-CG 3.45Å; V558-L562 PolarHBondContact O-N 3Å; V558-L588 HydrophobicContact CG2-CD1 3.68Å; V558-L588 HydrophobicContact CG2-CD2 3.46Å; V558-L588 VanDerWaalsContact CG2-CD2 3.46Å; V558-L588 HydrophobicContact CG2-CG 4.21Å; V558-Q618 HydrophobicContact CG1-CB 3.69Å; V558-Q618 HydrophobicContact CG1-CG 4.11Å
559	Q	72.1	Confident	74.8	Confident	30 Å²	30	37.3 Å²	37.3	14%	0.14	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-42	177	-173.2	61.5	31.6	0	0	111.7	V555 V556 I557 L562 M563	V555-Q559 WeakPolarHBondContact O-CB 3.31Å; V555-Q559 PolarHBondContact O-N 2.78Å; V556-Q559 PolarHBondContact O-N 2.75Å; I557-Q559 VanDerWaalsContact C-N 3.33Å; I557-Q559 PolarHBondContact O-N 3.17Å; Q559-L562 PolarHBondContact O-N 3.06Å; Q559-M563 HydrophobicContact CG-CE 4.48Å; Q559-M563 WeakPolarHBondContact O-CG 3.5Å; Q559-M563 PolarHBondContact O-N 3.14Å; Q559-M563 VanDerWaalsContact O-N 3.16Å
560	T	76.1	Confident	73.9	Confident	10 Å²	10	38.5 Å²	38.5	6%	0.061	18%	0.184	C	C	.	.	H	α-helix	trans	-63	-47.4	175.2	-60.5	0	0	0	0	111.8	V556 I557 L562 M563 I564 V753 F816	V556-T560 PolarHBondContact O-N 3.04Å; V556-T560 PolarHBondContact O-OG1 2.92Å; V556-T560 VanDerWaalsContact O-OG1 3.07Å; I557-T560 PolarHBondContact O-N 3.41Å; T560-L562 VanDerWaalsContact C-N 3.34Å; T560-L562 PolarHBondContact O-N 3.36Å; T560-M563 PolarHBondContact O-N 3.21Å; T560-I564 HydrophobicContact CG2-CD1 4.27Å; T560-I564 WeakPolarHBondContact O-CG1 3.49Å; T560-I564 PolarHBondContact O-N 2.89Å; T560-I564 VanDerWaalsContact O-N 3.17Å; T560-V753 HydrophobicContact CG2-CG1 3.72Å; T560-F816 HydrophobicContact CG2-CB 3.68Å; T560-F816 HydrophobicContact CG2-CG 4.08Å
561	L	79.4	Confident	73.7	Confident	2 Å²	2	40 Å²	40	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-65.9	-35.4	179	-65.2	177	0	0	0	112.3	L545 L547 I557 V558 I564 E565 L572 I592 L614 V753	L545-L561 HydrophobicContact CD1-CD2 4.04Å; L545-L561 HydrophobicContact CD2-CD2 4.2Å; L547-L561 HydrophobicContact CD1-CD1 4.35Å; L547-L561 HydrophobicContact CD2-CD1 4.15Å; I557-L561 HydrophobicContact CG2-CD1 3.71Å; I557-L561 HydrophobicContact CG2-CG 4.14Å; I557-L561 WeakPolarHBondContact O-CB 3.38Å; I557-L561 VanDerWaalsContact O-CG 3.3Å; I557-L561 WeakPolarHBondContact O-CG 3.36Å; I557-L561 PolarHBondContact O-N 2.89Å; V558-L561 PolarHBondContact O-N 2.92Å; L561-I564 PolarHBondContact O-N 2.95Å; L561-E565 WeakPolarHBondContact O-CB 3.37Å; L561-E565 PolarHBondContact O-N 3.01Å; L561-L572 HydrophobicContact CB-CD1 3.87Å; L561-L572 HydrophobicContact CD2-CD1 3.88Å; L561-L572 HydrophobicContact CG-CD1 4.38Å; L561-I592 HydrophobicContact CD1-CD1 3.78Å; L561-L614 HydrophobicContact CB-CD1 3.55Å; L561-V753 HydrophobicContact CD2-CG2 4.03Å
562	L	69.9	Low	73.4	Confident	9 Å²	9	40 Å²	40	5%	0.047	19%	0.19	C	C	.	.	H	α-helix	trans	-60.5	-43.9	172.7	-86.6	166.4	0	0	0	112.5	V558 Q559 T560 I564 E565 Q566 L614 R615 Q618	V558-L562 HydrophobicContact CG1-CD1 4.04Å; V558-L562 HydrophobicContact CG1-CG 4.48Å; V558-L562 WeakPolarHBondContact O-CB 3.46Å; V558-L562 WeakPolarHBondContact O-CG 3.45Å; V558-L562 PolarHBondContact O-N 3Å; Q559-L562 PolarHBondContact O-N 3.06Å; T560-L562 VanDerWaalsContact C-N 3.34Å; T560-L562 PolarHBondContact O-N 3.36Å; L562-I564 VanDerWaalsContact C-N 3.28Å; L562-I564 PolarHBondContact O-N 2.87Å; L562-E565 PolarHBondContact O-N 3.29Å; L562-Q566 WeakPolarHBondContact O-CB 3.39Å; L562-Q566 VanDerWaalsContact O-CG 3.28Å; L562-Q566 WeakPolarHBondContact O-CG 3.33Å; L562-Q566 PolarHBondContact O-N 3.27Å; L562-L614 HydrophobicContact CD2-CB 3.71Å; L562-L614 HydrophobicContact CG-CB 3.84Å; L562-R615 HydrophobicContact CD2-CB 4.31Å; L562-Q618 VanDerWaalsContact CD1-OE1 3.28Å
563	M	66.9	Low	73.5	Confident	84 Å²	84	41.9 Å²	41.9	41%	0.414	20%	0.196	S	C	.	.	H	α-helix	trans	-63.7	-35.2	176.2	-68.6	-176.2	-65.3	0	0	111.8	L509 Q559 T560 R567	L509-M563 HydrophobicContact CD2-CG 4.04Å; Q559-M563 HydrophobicContact CG-CE 4.48Å; Q559-M563 WeakPolarHBondContact O-CG 3.5Å; Q559-M563 PolarHBondContact O-N 3.14Å; Q559-M563 VanDerWaalsContact O-N 3.16Å; T560-M563 PolarHBondContact O-N 3.21Å; M563-R567 WeakPolarHBondContact O-CB 3.42Å; M563-R567 WeakPolarHBondContact O-CG 3.48Å; M563-R567 PolarHBondContact O-N 2.84Å; M563-R567 VanDerWaalsContact O-N 3.16Å
564	I	72.3	Confident	73.3	Confident	28 Å²	28	44.4 Å²	44.4	14%	0.144	21%	0.209	C	C	.	.	H	α-helix	trans	-70	-47.2	174.7	-60.9	168.1	0	0	0	110.8	T560 L561 L562 Q566 R567 L568 L572 L751 F816	T560-I564 HydrophobicContact CG2-CD1 4.27Å; T560-I564 WeakPolarHBondContact O-CG1 3.49Å; T560-I564 PolarHBondContact O-N 2.89Å; T560-I564 VanDerWaalsContact O-N 3.17Å; L561-I564 PolarHBondContact O-N 2.95Å; L562-I564 VanDerWaalsContact C-N 3.28Å; L562-I564 PolarHBondContact O-N 2.87Å; I564-Q566 VanDerWaalsContact C-N 3.31Å; I564-Q566 PolarHBondContact O-N 3.43Å; I564-R567 PolarHBondContact O-N 2.9Å; I564-R567 VanDerWaalsContact O-N 3.15Å; I564-L568 HydrophobicContact CG2-CD1 3.69Å; I564-L568 HydrophobicContact CG2-CG 4.16Å; I564-L568 WeakPolarHBondContact O-CB 3.29Å; I564-L568 WeakPolarHBondContact O-CG 3.42Å; I564-L568 PolarHBondContact O-N 3.22Å; I564-L572 HydrophobicContact CG2-CD2 4.02Å; I564-L751 HydrophobicContact CD1-CD2 4.32Å; I564-F816 HydrophobicContact CD1-CD2 4.35Å; I564-F816 HydrophobicContact CD1-CE2 4.12Å; I564-F816 HydrophobicContact CD1-CZ 4.45Å
565	E	72.8	Confident	73.3	Confident	29 Å²	29	45.1 Å²	45.1	14%	0.136	21%	0.212	C	C	.	.	H	α-helix	trans	-55.9	-44.2	178	-172.1	175.6	-174.3	0	0	111.7	L561 L562 K569 P571 L572 L614	L561-E565 WeakPolarHBondContact O-CB 3.37Å; L561-E565 PolarHBondContact O-N 3.01Å; L562-E565 PolarHBondContact O-N 3.29Å; E565-K569 PolarHBondContact O-N 3.19Å; E565-P571 WeakPolarHBondContact OE1-CA 3.48Å; E565-L572 HydrophobicContact CB-CG 4.24Å; E565-L614 WeakPolarHBondContact OE2-CD1 3.41Å
566	Q	63.9	Low	73.7	Confident	69 Å²	69	43.7 Å²	43.7	32%	0.322	20%	0.204	S	C	.	.	H	α-helix	trans	-66.1	-40.1	176.9	-71.3	171.9	3.6	0	0	113.2	L562 I564 K569	L562-Q566 WeakPolarHBondContact O-CB 3.39Å; L562-Q566 VanDerWaalsContact O-CG 3.28Å; L562-Q566 WeakPolarHBondContact O-CG 3.33Å; L562-Q566 PolarHBondContact O-N 3.27Å; I564-Q566 VanDerWaalsContact C-N 3.31Å; I564-Q566 PolarHBondContact O-N 3.43Å; Q566-K569 PolarHBondContact O-N 3.25Å
567	R	64.4	Low	74	Confident	143 Å²	143	43.9 Å²	43.9	54%	0.54	20%	0.204	S	C	.	.	H	α-helix	trans	-70.1	-37.4	179	-71	-76.5	166.5	-174.4	-7.2	112.1	M563 I564 K569	M563-R567 WeakPolarHBondContact O-CB 3.42Å; M563-R567 WeakPolarHBondContact O-CG 3.48Å; M563-R567 PolarHBondContact O-N 2.84Å; M563-R567 VanDerWaalsContact O-N 3.16Å; I564-R567 PolarHBondContact O-N 2.9Å; I564-R567 VanDerWaalsContact O-N 3.15Å; R567-K569 VanDerWaalsContact C-N 3.34Å
568	L	66.3	Low	74.4	Confident	58 Å²	58	44.1 Å²	44.1	30%	0.304	21%	0.205	S	C	.	.	H	α-helix	trans	-76.7	-19	176.4	-65.2	177.2	0	0	0	113.4	V531 I564 I570 L572 I575	V531-L568 HydrophobicContact CG1-CD2 4.38Å; I564-L568 HydrophobicContact CG2-CD1 3.69Å; I564-L568 HydrophobicContact CG2-CG 4.16Å; I564-L568 WeakPolarHBondContact O-CB 3.29Å; I564-L568 WeakPolarHBondContact O-CG 3.42Å; I564-L568 PolarHBondContact O-N 3.22Å; L568-I570 WeakPolarHBondContact O-CG1 3.36Å; L568-I570 PolarHBondContact O-N 3.38Å; L568-I570 VanDerWaalsContact O-N 3.09Å; L568-L572 HydrophobicContact CD1-CD2 3.92Å; L568-I575 HydrophobicContact CB-CD1 4.45Å; L568-I575 HydrophobicContact CD1-CD1 3.87Å
569	K	67	Low	75.2	Confident	184 Å²	184	44.1 Å²	44.1	80%	0.8	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	20.3	-173.1	-57.3	179	179.8	176.3	0	113.8	E565 Q566 R567	E565-K569 PolarHBondContact O-N 3.19Å; Q566-K569 PolarHBondContact O-N 3.25Å; R567-K569 VanDerWaalsContact C-N 3.34Å
570	I	69.5	Low	76.2	Confident	25 Å²	25	42.7 Å²	42.7	13%	0.128	20%	0.198	C	C	.	.	S	Bend	trans	-137.2	130.4	-176.2	-62.9	164.2	0	0	0	108.1	K532 L568 L572 Q574 I575	K532-I570 HydrophobicContact CD-CD1 4.44Å; K532-I570 HydrophobicContact CG-CD1 3.7Å; L568-I570 WeakPolarHBondContact O-CG1 3.36Å; L568-I570 PolarHBondContact O-N 3.38Å; L568-I570 VanDerWaalsContact O-N 3.09Å; I570-L572 PolarHBondContact O-N 2.91Å; I570-Q574 HydrophobicContact CG2-CB 4.2Å; I570-I575 HydrophobicContact CB-CD1 3.77Å; I570-I575 HydrophobicContact CB-CG1 4.5Å; I570-I575 HydrophobicContact CD1-CD1 4.17Å; I570-I575 HydrophobicContact CG2-CD1 3.63Å; I570-I575 HydrophobicContact CG2-CG1 3.8Å
571	P	72.7	Confident	77	Confident	37 Å²	37	42.2 Å²	42.2	24%	0.24	20%	0.196	C	C	.	.			trans	-60.2	131.1	178	-25.9	35.7	0	0	0	113.5	E565 Y573 Q574	E565-P571 WeakPolarHBondContact OE1-CA 3.48Å; P571-Y573 HydrophobicContact CB-CD1 3.64Å; P571-Y573 HydrophobicContact CB-CE1 3.31Å; P571-Y573 HydrophobicContact CG-CE1 4.1Å; P571-Y573 PolarHBondContact O-N 3.29Å; P571-Y573 VanDerWaalsContact O-N 3.08Å; P571-Q574 HydrophobicContact CB-CG 4.47Å; P571-Q574 WeakPolarHBondContact O-CB 3.34Å; P571-Q574 PolarHBondContact O-N 3.44Å
572	L	76.6	Confident	77.6	Confident	10 Å²	10	42.1 Å²	42.1	5%	0.052	20%	0.195	C	C	.	.	H	α-helix	trans	-58.2	-29.6	-172.5	-69.7	179.6	0	0	0	114.4	L561 I564 E565 L568 I570 Q574 I575 V576 L614	L561-L572 HydrophobicContact CB-CD1 3.87Å; L561-L572 HydrophobicContact CD2-CD1 3.88Å; L561-L572 HydrophobicContact CG-CD1 4.38Å; I564-L572 HydrophobicContact CG2-CD2 4.02Å; E565-L572 HydrophobicContact CB-CG 4.24Å; L568-L572 HydrophobicContact CD1-CD2 3.92Å; I570-L572 PolarHBondContact O-N 2.91Å; L572-Q574 PolarHBondContact O-N 2.97Å; L572-Q574 VanDerWaalsContact O-N 3.12Å; L572-I575 PolarHBondContact O-N 3.41Å; L572-I575 VanDerWaalsContact O-N 3.11Å; L572-V576 HydrophobicContact CB-CG2 4.44Å; L572-V576 WeakPolarHBondContact O-CG2 3.39Å; L572-V576 PolarHBondContact O-N 3.14Å; L572-L614 HydrophobicContact CD1-CD1 3.98Å
573	Y	79.1	Confident	78.6	Confident	58 Å²	58	42.1 Å²	42.1	23%	0.227	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-16.5	176.5	74	-98.2	0	0	0	113.7	P571 I592 K596 K661	P571-Y573 HydrophobicContact CB-CD1 3.64Å; P571-Y573 HydrophobicContact CB-CE1 3.31Å; P571-Y573 HydrophobicContact CG-CE1 4.1Å; P571-Y573 PolarHBondContact O-N 3.29Å; P571-Y573 VanDerWaalsContact O-N 3.08Å; Y573-I592 VanDerWaalsContact CB-O 3.23Å; Y573-I592 WeakPolarHBondContact CB-O 3.39Å; Y573-K596 HydrophobicContact CE2-CG 4.17Å; Y573-K596 VanDerWaalsContact OH-CE 3.29Å; Y573-K596 WeakPolarHBondContact OH-CE 3.35Å; Y573-K661 VanDerWaalsContact O-CE 3.22Å; Y573-K661 WeakPolarHBondContact O-CE 3.5Å
574	Q	76	Confident	79.5	Confident	92 Å²	92	38.6 Å²	38.6	43%	0.43	18%	0.179	S	C	.	.	H	α-helix	trans	-84.4	-39.6	174.7	-56.3	-178.4	3.9	0	0	111	K534 I570 P571 L572	K534-Q574 PolarHBondContact NZ-O 3.34Å; I570-Q574 HydrophobicContact CG2-CB 4.2Å; P571-Q574 HydrophobicContact CB-CG 4.47Å; P571-Q574 WeakPolarHBondContact O-CB 3.34Å; P571-Q574 PolarHBondContact O-N 3.44Å; L572-Q574 PolarHBondContact O-N 2.97Å; L572-Q574 VanDerWaalsContact O-N 3.12Å
575	I	78.1	Confident	80.2	Confident	14 Å²	14	37.3 Å²	37.3	7%	0.072	17%	0.172	C	C	.	.	H	α-helix	trans	-86.1	-45	-173.2	-65.4	174.1	0	0	0	112.6	V531 K534 V543 L568 I570 L572	V531-I575 HydrophobicContact CG1-CD1 3.92Å; K534-I575 WeakPolarHBondContact CE-O 3.4Å; K534-I575 PolarHBondContact NZ-O 2.89Å; V543-I575 HydrophobicContact CB-CG2 4.43Å; V543-I575 WeakPolarHBondContact CB-O 3.4Å; V543-I575 HydrophobicContact CG1-CG2 4.41Å; V543-I575 HydrophobicContact CG2-CG2 4.05Å; L568-I575 HydrophobicContact CB-CD1 4.45Å; L568-I575 HydrophobicContact CD1-CD1 3.87Å; I570-I575 HydrophobicContact CB-CD1 3.77Å; I570-I575 HydrophobicContact CB-CG1 4.5Å; I570-I575 HydrophobicContact CD1-CD1 4.17Å; I570-I575 HydrophobicContact CG2-CD1 3.63Å; I570-I575 HydrophobicContact CG2-CG1 3.8Å; L572-I575 PolarHBondContact O-N 3.41Å; L572-I575 VanDerWaalsContact O-N 3.11Å
576	V	83.9	Confident	81.1	Confident	5 Å²	5	35.9 Å²	35.9	3%	0.03	17%	0.166	C	C	.	.			trans	-70.1	144.8	178.5	-177.2	0	0	0	0	109.8	V543 L545 L572 W578 V579 K661	V543-V576 HydrophobicContact CG1-CG2 4.48Å; L545-V576 HydrophobicContact CB-CG1 3.62Å; L545-V576 HydrophobicContact CB-CG2 4.19Å; L545-V576 HydrophobicContact CD2-CG2 4.21Å; L572-V576 HydrophobicContact CB-CG2 4.44Å; L572-V576 WeakPolarHBondContact O-CG2 3.39Å; L572-V576 PolarHBondContact O-N 3.14Å; V576-W578 VanDerWaalsContact CG1-O 3.23Å; V576-W578 WeakPolarHBondContact CG1-O 3.21Å; V576-V579 HydrophobicContact CG1-CG2 3.69Å; V576-K661 WeakPolarHBondContact O-CD 3.21Å; V576-K661 VanDerWaalsContact O-CE 3.25Å; V576-K661 WeakPolarHBondContact O-CE 3.4Å; V576-K661 PolarHBondContact O-NZ 2.92Å
577	D	87.3	Confident	82.2	Confident	34 Å²	34	33.6 Å²	33.6	18%	0.182	16%	0.155	C	C	.	.			trans	-122.1	-37.8	178.9	-61.7	-60.8	0	0	0	113.2	K534 V543 K661 K662	K534-D577 WeakPolarHBondContact CD-OD2 3.1Å; K534-D577 IonicContact NZ-OD1 3.87Å; K534-D577 PolarHBondContact NZ-OD1 2.84Å; K534-D577 IonicContact NZ-OD2 2.71Å; K534-D577 PolarHBondContact NZ-OD2 3.06Å; V543-D577 PolarHBondContact N-OD2 3.49Å; V543-D577 PolarHBondContact O-N 2.94Å; D577-K661 IonicContact OD1-NZ 3.84Å; D577-K661 PolarHBondContact OD1-NZ 3.49Å; D577-K662 PolarHBondContact O-N 3Å
578	W	92.3	Very high	83.1	Confident	4 Å²	4	27 Å²	27	2%	0.015	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.5	170.4	-79.9	74.2	0	0	0	110	V543 V544 L545 V576 K662 V664 Y683 E728 I729 Y732 V745	V543-W578 PolarHBondContact O-N 3.28Å; V544-W578 HydrophobicContact CB-CB 4.4Å; V544-W578 HydrophobicContact CG1-CB 4.15Å; V544-W578 HydrophobicContact CG2-CB 4.09Å; L545-W578 PolarHBondContact N-O 3.43Å; V576-W578 VanDerWaalsContact CG1-O 3.23Å; V576-W578 WeakPolarHBondContact CG1-O 3.21Å; W578-K662 HydrophobicContact CD2-CB 3.51Å; W578-K662 HydrophobicContact CD2-CG 4.03Å; W578-K662 HydrophobicContact CE3-CB 3.78Å; W578-K662 HydrophobicContact CG-CB 3.92Å; W578-K662 HydrophobicContact CG-CG 4.42Å; W578-K662 HydrophobicContact CH2-CB 4.27Å; W578-K662 HydrophobicContact CH2-CG 4.43Å; W578-K662 HydrophobicContact CZ2-CB 4.03Å; W578-K662 HydrophobicContact CZ2-CD 4.35Å; W578-K662 HydrophobicContact CZ2-CG 3.83Å; W578-K662 HydrophobicContact CZ3-CB 4.15Å; W578-V664 HydrophobicContact CE3-CG2 3.92Å; W578-V664 HydrophobicContact CZ3-CG2 3.82Å; W578-Y683 HydrophobicContact CH2-CE1 4.09Å; W578-Y683 HydrophobicContact CZ3-CE1 4.18Å; W578-E728 HydrophobicContact CZ3-CG 4.47Å; W578-I729 HydrophobicContact CD2-CD1 4.21Å; W578-I729 HydrophobicContact CD2-CG1 3.89Å; W578-I729 HydrophobicContact CE3-CD1 4.3Å; W578-I729 HydrophobicContact CE3-CG1 3.77Å; W578-I729 HydrophobicContact CG-CD1 4.43Å; W578-I729 HydrophobicContact CH2-CG1 4.08Å; W578-I729 HydrophobicContact CZ2-CG1 4.19Å; W578-I729 HydrophobicContact CZ3-CG1 3.86Å; W578-Y732 HydrophobicContact CH2-CD1 4.47Å; W578-Y732 HydrophobicContact CH2-CD2 4.27Å; W578-Y732 AromaticContact CH2-CG 3.96Å; W578-Y732 HydrophobicContact CH2-CG 3.96Å; W578-Y732 AromaticContact CZ2-CD1 4Å; W578-Y732 HydrophobicContact CZ2-CD1 4Å; W578-Y732 HydrophobicContact CZ2-CD2 4.35Å; W578-Y732 HydrophobicContact CZ2-CE1 4.46Å; W578-Y732 AromaticContact CZ2-CG 3.94Å; W578-Y732 HydrophobicContact CZ2-CG 3.94Å; W578-V745 HydrophobicContact CZ2-CG2 3.91Å
579	V	91.9	Very high	84.1	Confident	1 Å²	1	24.2 Å²	24.2	1%	0.006	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.1	176.3	-169.5	0	0	0	0	109.2	L545 V576 I592 A593 K662 L663 V664	L545-V579 WeakPolarHBondContact O-CA 3.19Å; V576-V579 HydrophobicContact CG1-CG2 3.69Å; V579-I592 HydrophobicContact CG2-CG2 4.43Å; V579-A593 HydrophobicContact CG2-CB 4.41Å; V579-K662 PolarHBondContact N-O 2.95Å; V579-L663 HydrophobicContact CB-CD1 4.32Å; V579-L663 WeakPolarHBondContact O-CA 3.36Å; V579-V664 PolarHBondContact O-N 3Å
580	A	94.2	Very high	85	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	141.8	173.1	0	0	0	0	0	110.8	L545 A546 L547 V664 P721 T725	L545-A580 PolarHBondContact O-N 3.31Å; A546-A580 WeakPolarHBondContact CA-O 3.44Å; L547-A580 PolarHBondContact N-O 2.84Å; A580-V664 VanDerWaalsContact CA-O 3.31Å; A580-V664 WeakPolarHBondContact CA-O 3.38Å; A580-V664 HydrophobicContact CB-CB 4.01Å; A580-V664 HydrophobicContact CB-CG1 4.25Å; A580-P721 HydrophobicContact CB-CB 4.41Å; A580-P721 HydrophobicContact CB-CG 4.4Å; A580-T725 HydrophobicContact CB-CG2 3.81Å; A580-T725 WeakPolarHBondContact CB-OG1 3.19Å
581	G	92.5	Very high	85.6	Confident	1 Å²	1	15 Å²	15	1%	0.01	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	151.5	179.6	0	0	0	0	0	115	L547 V664 T666	L547-G581 WeakPolarHBondContact O-CA 3.38Å; G581-V664 PolarHBondContact N-O 3.13Å; G581-T666 PolarHBondContact O-N 2.99Å
582	T	92.7	Very high	86	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	131.5	178	-53.3	0	0	0	0	110.2	L547 D548 G549 T584 G585 A586 T666 G715 A718	L547-T582 PolarHBondContact O-N 3.35Å; L547-T582 VanDerWaalsContact O-N 3.14Å; D548-T582 CarbonylContact C-O 3.57Å; G549-T582 WeakPolarHBondContact CA-O 3.37Å; G549-T582 PolarHBondContact N-O 3.35Å; T582-T584 PolarHBondContact O-N 2.78Å; T582-G585 WeakPolarHBondContact O-CA 3.48Å; T582-G585 PolarHBondContact O-N 2.92Å; T582-A586 PolarHBondContact O-N 3.16Å; T582-T666 WeakPolarHBondContact CA-OG1 3.37Å; T582-T666 WeakPolarHBondContact CB-OG1 3.47Å; T582-T666 VanDerWaalsContact CG2-OG1 3.25Å; T582-T666 WeakPolarHBondContact CG2-OG1 3.44Å; T582-T666 PolarHBondContact OG1-OG1 3.23Å; T582-G715 VanDerWaalsContact CG2-N 3.34Å; T582-A718 WeakPolarHBondContact CG2-O 3.3Å; T582-A718 PolarHBondContact OG1-O 3.47Å
583	S	90	Very high	86.4	Confident	8 Å²	8	13.2 Å²	13.2	6%	0.056	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-113.3	174.8	-169.1	0	0	0	0	112.5	A586 L587 T697 D713	S583-A586 WeakPolarHBondContact O-CB 3.5Å; S583-A586 PolarHBondContact O-N 3Å; S583-L587 PolarHBondContact O-N 3.31Å; S583-T697 WeakPolarHBondContact CA-O 3.37Å; S583-T697 WeakPolarHBondContact CB-O 3.47Å; S583-T697 PolarHBondContact N-OG1 3.21Å; S583-D713 WeakPolarHBondContact CB-OD1 3.22Å; S583-D713 WeakPolarHBondContact CB-OD2 3.24Å; S583-D713 PolarHBondContact OG-OD2 2.99Å
584	T	86.7	Confident	86.4	Confident	11 Å²	11	10.9 Å²	10.9	7%	0.067	6%	0.058	C	C	.	.	H	α-helix	trans	-63.1	-37.6	173.2	-68.5	0	0	0	0	113.5	G551 G554 T582 A586 L587 L588 Y621	G551-T584 PolarHBondContact O-OG1 2.65Å; G554-T584 VanDerWaalsContact CA-CG2 3.49Å; T582-T584 PolarHBondContact O-N 2.78Å; T584-A586 PolarHBondContact O-N 3.04Å; T584-L587 WeakPolarHBondContact O-CB 3.32Å; T584-L587 PolarHBondContact O-N 3.04Å; T584-L588 HydrophobicContact CG2-CD1 4.46Å; T584-L588 WeakPolarHBondContact O-CG 3.44Å; T584-L588 PolarHBondContact O-N 3.18Å; T584-L588 VanDerWaalsContact O-N 3.11Å; T584-Y621 HydrophobicContact CG2-CE2 3.63Å; T584-Y621 WeakPolarHBondContact CG2-OH 3.48Å; T584-Y621 PolarHBondContact OG1-OH 2.75Å
585	G	87.4	Confident	86.3	Confident	0 Å²	0	7 Å²	7	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-61.4	-31.7	172.9	0	0	0	0	0	112.9	D548 T582 G589	D548-G585 VanDerWaalsContact O-CA 3.3Å; D548-G585 WeakPolarHBondContact O-CA 3.48Å; D548-G585 PolarHBondContact O-N 3.06Å; D548-G585 VanDerWaalsContact O-N 3.16Å; T582-G585 WeakPolarHBondContact O-CA 3.48Å; T582-G585 PolarHBondContact O-N 2.92Å; G585-G589 PolarHBondContact O-N 3.47Å
586	A	90.4	Very high	85.4	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-67.6	-39.3	173.7	0	0	0	0	0	112.7	T582 S583 T584 G589 T590 I665 L694 T697	T582-A586 PolarHBondContact O-N 3.16Å; S583-A586 WeakPolarHBondContact O-CB 3.5Å; S583-A586 PolarHBondContact O-N 3Å; T584-A586 PolarHBondContact O-N 3.04Å; A586-G589 PolarHBondContact O-N 2.81Å; A586-T590 VanDerWaalsContact O-CB 3.3Å; A586-T590 WeakPolarHBondContact O-CB 3.45Å; A586-T590 PolarHBondContact O-N 3.14Å; A586-T590 PolarHBondContact O-OG1 3.43Å; A586-I665 HydrophobicContact CB-CD1 4.45Å; A586-I665 HydrophobicContact CB-CG1 4.1Å; A586-I665 HydrophobicContact CB-CG2 3.87Å; A586-L694 HydrophobicContact CB-CD2 4.21Å; A586-T697 HydrophobicContact CB-CG2 3.59Å
587	L	87	Confident	84.1	Confident	20 Å²	20	16.9 Å²	16.9	11%	0.105	10%	0.095	C	C	.	.	H	α-helix	trans	-63.1	-46.4	175.2	-179.7	64.1	0	0	0	111.3	S583 T584 T590 A591 Y621 L645 I648 L694	S583-L587 PolarHBondContact O-N 3.31Å; T584-L587 WeakPolarHBondContact O-CB 3.32Å; T584-L587 PolarHBondContact O-N 3.04Å; L587-T590 PolarHBondContact O-N 3.16Å; L587-A591 PolarHBondContact O-N 3.31Å; L587-A591 VanDerWaalsContact O-N 3.12Å; L587-Y621 HydrophobicContact CD2-CE2 4.45Å; L587-L645 HydrophobicContact CD1-CD2 3.8Å; L587-I648 HydrophobicContact CD1-CD1 4.46Å; L587-I648 HydrophobicContact CD1-CG2 4.38Å; L587-L694 HydrophobicContact CB-CD2 4.38Å; L587-L694 HydrophobicContact CD1-CD1 3.99Å
588	L	84.7	Confident	82.7	Confident	5 Å²	5	15.8 Å²	15.8	3%	0.026	9%	0.089	C	C	.	.	H	α-helix	trans	-65.3	-43.7	176.8	-61.8	-179.2	0	0	0	111.8	L547 I557 V558 T584 T590 A591 I592 V617 Y621	L547-L588 HydrophobicContact CD1-CB 4.02Å; I557-L588 HydrophobicContact CB-CD1 3.78Å; I557-L588 HydrophobicContact CG2-CD1 3.69Å; V558-L588 HydrophobicContact CG2-CD1 3.68Å; V558-L588 HydrophobicContact CG2-CD2 3.46Å; V558-L588 VanDerWaalsContact CG2-CD2 3.46Å; V558-L588 HydrophobicContact CG2-CG 4.21Å; T584-L588 HydrophobicContact CG2-CD1 4.46Å; T584-L588 WeakPolarHBondContact O-CG 3.44Å; T584-L588 PolarHBondContact O-N 3.18Å; T584-L588 VanDerWaalsContact O-N 3.11Å; L588-T590 VanDerWaalsContact C-N 3.34Å; L588-T590 PolarHBondContact O-N 2.88Å; L588-A591 WeakPolarHBondContact O-CB 3.42Å; L588-A591 PolarHBondContact O-N 3.04Å; L588-I592 WeakPolarHBondContact O-CG1 3.3Å; L588-I592 PolarHBondContact O-N 2.77Å; L588-I592 VanDerWaalsContact O-N 3.09Å; L588-V617 HydrophobicContact CD2-CG1 3.52Å; L588-Y621 HydrophobicContact CD2-CD2 4.49Å
589	G	86	Confident	80.9	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-39.2	177.5	0	0	0	0	0	112.8	G585 A586 I592 A593	G585-G589 PolarHBondContact O-N 3.47Å; A586-G589 PolarHBondContact O-N 2.81Å; G589-I592 PolarHBondContact O-N 2.94Å; G589-A593 WeakPolarHBondContact O-CB 3.35Å; G589-A593 PolarHBondContact O-N 3.15Å
590	T	87.2	Confident	79	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64	-40.3	174.1	-58.8	0	0	0	0	111.9	A586 L587 L588 I592 A593 L594 V649 L663 L690 L694	A586-T590 VanDerWaalsContact O-CB 3.3Å; A586-T590 WeakPolarHBondContact O-CB 3.45Å; A586-T590 PolarHBondContact O-N 3.14Å; A586-T590 PolarHBondContact O-OG1 3.43Å; L587-T590 PolarHBondContact O-N 3.16Å; L588-T590 VanDerWaalsContact C-N 3.34Å; L588-T590 PolarHBondContact O-N 2.88Å; T590-I592 VanDerWaalsContact C-N 3.32Å; T590-I592 PolarHBondContact O-N 3.38Å; T590-A593 PolarHBondContact O-N 3.4Å; T590-L594 HydrophobicContact CG2-CD1 4.01Å; T590-L594 HydrophobicContact CG2-CG 4.43Å; T590-L594 WeakPolarHBondContact O-CB 3.25Å; T590-L594 WeakPolarHBondContact O-CG 3.4Å; T590-L594 PolarHBondContact O-N 2.89Å; T590-V649 HydrophobicContact CG2-CG1 4.14Å; T590-L663 HydrophobicContact CG2-CD2 4.31Å; T590-L690 HydrophobicContact CG2-CD1 3.85Å; T590-L690 HydrophobicContact CG2-CD2 3.72Å; T590-L690 HydrophobicContact CG2-CG 4Å; T590-L694 HydrophobicContact CG2-CD1 4.22Å
591	A	80.7	Confident	76.7	Confident	14 Å²	14	26.5 Å²	26.5	12%	0.116	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-38.1	175.4	0	0	0	0	0	112.2	L587 L588 G595 L598 V617	L587-A591 PolarHBondContact O-N 3.31Å; L587-A591 VanDerWaalsContact O-N 3.12Å; L588-A591 WeakPolarHBondContact O-CB 3.42Å; L588-A591 PolarHBondContact O-N 3.04Å; A591-G595 PolarHBondContact O-N 3.05Å; A591-G595 VanDerWaalsContact O-N 3.13Å; A591-L598 HydrophobicContact CB-CD2 4.06Å; A591-V617 HydrophobicContact CB-CG2 4.14Å
592	I	81.3	Confident	74.4	Confident	8 Å²	8	28.3 Å²	28.3	4%	0.041	16%	0.158	C	C	.	.	H	α-helix	trans	-68.5	-44.3	174.4	-63.5	163.6	0	0	0	110.9	L545 L547 L561 Y573 V579 L588 G589 T590 L594 G595 L614	L545-I592 HydrophobicContact CD2-CD1 3.85Å; L547-I592 HydrophobicContact CD1-CD1 4.19Å; L561-I592 HydrophobicContact CD1-CD1 3.78Å; Y573-I592 VanDerWaalsContact CB-O 3.23Å; Y573-I592 WeakPolarHBondContact CB-O 3.39Å; V579-I592 HydrophobicContact CG2-CG2 4.43Å; L588-I592 WeakPolarHBondContact O-CG1 3.3Å; L588-I592 PolarHBondContact O-N 2.77Å; L588-I592 VanDerWaalsContact O-N 3.09Å; G589-I592 PolarHBondContact O-N 2.94Å; T590-I592 VanDerWaalsContact C-N 3.32Å; T590-I592 PolarHBondContact O-N 3.38Å; I592-L594 PolarHBondContact O-N 2.77Å; I592-G595 PolarHBondContact O-N 2.94Å; I592-L614 HydrophobicContact CD1-CD2 4.45Å; I592-L614 HydrophobicContact CG1-CD2 4.09Å
593	A	84.4	Confident	72.1	Confident	2 Å²	2	28.9 Å²	28.9	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-68.5	-32.7	-178	0	0	0	0	0	113.6	V579 G589 T590 V658 K661 L663	V579-A593 HydrophobicContact CG2-CB 4.41Å; G589-A593 WeakPolarHBondContact O-CB 3.35Å; G589-A593 PolarHBondContact O-N 3.15Å; T590-A593 PolarHBondContact O-N 3.4Å; A593-V658 HydrophobicContact CB-CG1 3.7Å; A593-K661 HydrophobicContact CB-CB 4.17Å; A593-L663 HydrophobicContact CB-CB 4.49Å; A593-L663 HydrophobicContact CB-CD1 4.21Å; A593-L663 HydrophobicContact CB-CD2 4.41Å
594	L	79.8	Confident	69.7	Low	10 Å²	10	32.3 Å²	32.3	5%	0.052	18%	0.183	C	C	.	.	H	α-helix	trans	-73.2	-33.5	170.2	-73.8	170.3	0	0	0	112.2	T590 I592 K596 S597 L598 V649 V658 L690	T590-L594 HydrophobicContact CG2-CD1 4.01Å; T590-L594 HydrophobicContact CG2-CG 4.43Å; T590-L594 WeakPolarHBondContact O-CB 3.25Å; T590-L594 WeakPolarHBondContact O-CG 3.4Å; T590-L594 PolarHBondContact O-N 2.89Å; I592-L594 PolarHBondContact O-N 2.77Å; L594-K596 PolarHBondContact O-N 2.94Å; L594-K596 VanDerWaalsContact O-N 3.14Å; L594-S597 VanDerWaalsContact O-CB 3.32Å; L594-S597 WeakPolarHBondContact O-CB 3.36Å; L594-S597 PolarHBondContact O-N 3.29Å; L594-L598 HydrophobicContact CB-CB 4.23Å; L594-L598 HydrophobicContact CB-CD1 4.43Å; L594-L598 HydrophobicContact CD1-CD1 3.75Å; L594-V649 HydrophobicContact CD1-CB 4.41Å; L594-V649 HydrophobicContact CD1-CG1 4.09Å; L594-V658 HydrophobicContact CD2-CG2 3.92Å; L594-V658 HydrophobicContact CG-CG2 4.34Å; L594-L690 HydrophobicContact CD1-CD2 4.08Å; L594-L690 HydrophobicContact CD2-CD2 4.49Å
595	G	73.7	Confident	67.2	Low	11 Å²	11	35.2 Å²	35.2	11%	0.113	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	51.7	-116.7	176	0	0	0	0	0	112.9	A591 I592 S597 L598	A591-G595 PolarHBondContact O-N 3.05Å; A591-G595 VanDerWaalsContact O-N 3.13Å; I592-G595 PolarHBondContact O-N 2.94Å; G595-S597 PolarHBondContact O-N 3.14Å; G595-L598 PolarHBondContact O-N 2.9Å
596	K	60.5	Low	64.7	Low	149 Å²	149	37.2 Å²	37.2	65%	0.648	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-60.3	-29.2	177.1	-71.5	-174	178.6	179.5	0	113.4	Y573 L594 L598 R612	Y573-K596 HydrophobicContact CE2-CG 4.17Å; Y573-K596 VanDerWaalsContact OH-CE 3.29Å; Y573-K596 WeakPolarHBondContact OH-CE 3.35Å; L594-K596 PolarHBondContact O-N 2.94Å; L594-K596 VanDerWaalsContact O-N 3.14Å; K596-L598 VanDerWaalsContact C-N 3.3Å; K596-L598 PolarHBondContact O-N 3.32Å; K596-R612 PolarHBondContact O-NH1 2.69Å
597	S	55.1	Low	62.3	Low	77 Å²	77	46.4 Å²	46.4	54%	0.538	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-77.4	-7.9	-175.3	-56.1	0	0	0	0	114.6	L594 G595 K599	L594-S597 VanDerWaalsContact O-CB 3.32Å; L594-S597 WeakPolarHBondContact O-CB 3.36Å; L594-S597 PolarHBondContact O-N 3.29Å; G595-S597 PolarHBondContact O-N 3.14Å; S597-K599 PolarHBondContact O-N 2.85Å
598	L	57.7	Low	59.9	Low	10 Å²	10	55.5 Å²	55.5	5%	0.052	29%	0.29	C	S	.	.			trans	-61.3	121.8	-177	-174.3	65.5	0	0	0	112.6	A591 L594 G595 K596 I600 R612	A591-L598 HydrophobicContact CB-CD2 4.06Å; L594-L598 HydrophobicContact CB-CB 4.23Å; L594-L598 HydrophobicContact CB-CD1 4.43Å; L594-L598 HydrophobicContact CD1-CD1 3.75Å; G595-L598 PolarHBondContact O-N 2.9Å; K596-L598 VanDerWaalsContact C-N 3.3Å; K596-L598 PolarHBondContact O-N 3.32Å; L598-I600 HydrophobicContact CD2-CD1 4.11Å; L598-I600 HydrophobicContact CD2-CG1 4Å; L598-I600 HydrophobicContact CG-CG1 3.99Å; L598-I600 PolarHBondContact O-N 3.24Å; L598-R612 PolarHBondContact O-NH1 3.46Å; L598-R612 VanDerWaalsContact O-NH1 3.11Å
599	K	54.9	Low	57.5	Low	126 Å²	126	58.4 Å²	58.4	55%	0.548	31%	0.311	S	S	.	.			trans	-98	72.3	-176.2	-66.2	176.4	-176.2	166.2	0	112.1	S597 A601	S597-K599 PolarHBondContact O-N 2.85Å; K599-A601 PolarHBondContact O-N 3.17Å
600	I	52.7	Low	55.1	Low	40 Å²	40	64.7 Å²	64.7	21%	0.205	36%	0.355	C	S	.	.			trans	-68.6	101.9	176.5	-52.8	177.6	0	0	0	110.1	L598 I603 N616	L598-I600 HydrophobicContact CD2-CD1 4.11Å; L598-I600 HydrophobicContact CD2-CG1 4Å; L598-I600 HydrophobicContact CG-CG1 3.99Å; L598-I600 PolarHBondContact O-N 3.24Å; I600-I603 HydrophobicContact CG2-CG1 4.44Å; I600-N616 HydrophobicContact CD1-CB 4.21Å
601	A	45.6	Very low	52.9	Low	65 Å²	65	68.3 Å²	68.3	54%	0.537	38%	0.38	S	S	.	.			trans	-84.2	-21.1	178.4	0	0	0	0	0	113.9	K599 I603 S647	K599-A601 PolarHBondContact O-N 3.17Å; A601-I603 PolarHBondContact O-N 3.01Å; A601-S647 PolarHBondContact N-O 3.27Å
602	I	44.4	Very low	51.6	Low	39 Å²	39	74.5 Å²	74.5	20%	0.2	40%	0.4	C	S	.	.	S	Bend	trans	-73.7	-6	-171.3	-56	-179.5	0	0	0	113.4	L620 L624 S647 I648	I602-L620 HydrophobicContact CD1-CD1 3.91Å; I602-L624 HydrophobicContact CD1-CD2 4.41Å; I602-S647 VanDerWaalsContact CG1-OG 3.25Å; I602-S647 WeakPolarHBondContact CG1-OG 3.25Å; I602-I648 HydrophobicContact CD1-CG1 4.42Å
603	I	44.5	Very low	50.6	Low	12 Å²	12	75.7 Å²	75.7	6%	0.062	41%	0.409	C	S	.	.			trans	-129.5	90.9	178.2	-51.9	178.7	0	0	0	110.3	I600 A601 L605 C606	I600-I603 HydrophobicContact CG2-CG1 4.44Å; A601-I603 PolarHBondContact O-N 3.01Å; I603-L605 HydrophobicContact CG2-CB 4.13Å; I603-L605 PolarHBondContact O-N 3.34Å; I603-L605 VanDerWaalsContact O-N 3.17Å; I603-C606 HydrophobicContact CG2-CB 4.45Å; I603-C606 PolarHBondContact O-N 3.42Å
604	P	38.8	Very low	49.7	Very low	80 Å²	80	76.4 Å²	76.4	52%	0.519	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-26.7	178.8	-26.2	35.4	0	0	0	114.6	P440 C606	P440-P604 HydrophobicContact CB-CB 4Å; P440-P604 HydrophobicContact CB-CG 4.29Å; P604-C606 VanDerWaalsContact C-N 3.34Å; P604-C606 PolarHBondContact O-N 3.16Å
605	L	34.9	Very low	48.9	Very low	71 Å²	71	79.3 Å²	79.3	37%	0.372	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.7	-177.3	-82.6	162.5	0	0	0	115.2	P440 I603 K607	P440-L605 WeakPolarHBondContact O-CD1 3.47Å; P440-L605 WeakPolarHBondContact O-CD2 3.2Å; P440-L605 WeakPolarHBondContact O-CG 3.44Å; I603-L605 HydrophobicContact CG2-CB 4.13Å; I603-L605 PolarHBondContact O-N 3.34Å; I603-L605 VanDerWaalsContact O-N 3.17Å; L605-K607 PolarHBondContact O-N 3.36Å
606	C	34.8	Very low	48.4	Very low	42 Å²	42	79.8 Å²	79.8	28%	0.284	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	30.7	-170.5	-77	0	0	0	0	115.1	I603 P604	I603-C606 HydrophobicContact CG2-CB 4.45Å; I603-C606 PolarHBondContact O-N 3.42Å; P604-C606 VanDerWaalsContact C-N 3.34Å; P604-C606 PolarHBondContact O-N 3.16Å
607	K	39	Very low	48.7	Very low	194 Å²	194	73.3 Å²	73.3	84%	0.843	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-15	176.1	-75.3	-175.9	178.7	175.6	0	114.9	L605	L605-K607 PolarHBondContact O-N 3.36Å
608	K	37.2	Very low	49.3	Very low	210 Å²	210	71.5 Å²	71.5	91%	0.913	38%	0.379	S	S	*	.	S	Bend	trans	-124.4	-3.6	-174.9	-73.5	-178.4	176.1	173.9	0	116.3
609	S	34.1	Very low	49.6	Very low	66 Å²	66	72.4 Å²	72.4	46%	0.462	38%	0.382	S	S	.	.			trans	-98.3	119.5	-179.4	58.3	0	0	0	0	112.4	S611	S609-S611 VanDerWaalsContact C-N 3.33Å; S609-S611 PolarHBondContact O-N 2.71Å
610	S	35.6	Very low	50.2	Low	133 Å²	133	66.9 Å²	66.9	93%	0.93	36%	0.359	S	S	*	.			trans	-79.2	5.8	-167.3	48.9	0	0	0	0	117
611	S	41.2	Very low	51	Low	75 Å²	75	66 Å²	66	52%	0.524	35%	0.353	S	S	.	.			trans	-121.3	93.7	-177.8	53.1	0	0	0	0	113.9	S609 S613	S609-S611 VanDerWaalsContact C-N 3.33Å; S609-S611 PolarHBondContact O-N 2.71Å; S611-S613 PolarHBondContact O-N 2.66Å
612	R	52.8	Low	52.1	Low	145 Å²	145	64.9 Å²	64.9	55%	0.547	34%	0.337	S	S	.	.			trans	-75	74.2	165.8	-68.4	-177.5	177.8	-176.8	-7	110.1	K596 L598	K596-R612 PolarHBondContact O-NH1 2.69Å; L598-R612 PolarHBondContact O-NH1 3.46Å; L598-R612 VanDerWaalsContact O-NH1 3.11Å
613	S	60.1	Low	53.2	Low	33 Å²	33	63.8 Å²	63.8	23%	0.231	33%	0.332	C	S	.	.			trans	-92.2	165.2	-177.1	63.2	0	0	0	0	113.1	S611 R615 N616	S611-S613 PolarHBondContact O-N 2.66Å; S613-R615 PolarHBondContact O-N 3Å; S613-R615 VanDerWaalsContact O-N 3.07Å; S613-R615 WeakPolarHBondContact OG-CB 3.34Å; S613-N616 PolarHBondContact O-N 2.88Å
614	L	66.3	Low	54.6	Low	16 Å²	16	63.6 Å²	63.6	8%	0.084	33%	0.331	C	S	.	.	H	α-helix	trans	-56.1	-22	171.9	-77.6	173.9	0	0	0	113.5	L561 L562 E565 L572 I592 N616 V617 Q618	L561-L614 HydrophobicContact CB-CD1 3.55Å; L562-L614 HydrophobicContact CD2-CB 3.71Å; L562-L614 HydrophobicContact CG-CB 3.84Å; E565-L614 WeakPolarHBondContact OE2-CD1 3.41Å; L572-L614 HydrophobicContact CD1-CD1 3.98Å; I592-L614 HydrophobicContact CD1-CD2 4.45Å; I592-L614 HydrophobicContact CG1-CD2 4.09Å; L614-N616 PolarHBondContact O-N 2.83Å; L614-V617 HydrophobicContact CD2-CG2 4.46Å; L614-V617 WeakPolarHBondContact O-CA 3.5Å; L614-V617 WeakPolarHBondContact O-CB 3.41Å; L614-V617 PolarHBondContact O-N 2.81Å; L614-Q618 PolarHBondContact O-N 2.93Å
615	R	64.1	Low	56.3	Low	71 Å²	71	60.6 Å²	60.6	27%	0.268	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-32.4	176.3	-142.8	-177.6	-155.5	149	10.4	111.8	D506 L562 S613 Q618 K619	D506-R615 IonicContact OD1-CZ 3.82Å; D506-R615 VanDerWaalsContact OD1-CZ 3.27Å; D506-R615 IonicContact OD1-NE 2.63Å; D506-R615 PolarHBondContact OD1-NE 2.9Å; D506-R615 IonicContact OD1-NH2 2.72Å; D506-R615 PolarHBondContact OD1-NH2 3.34Å; D506-R615 IonicContact OD2-CZ 3.73Å; D506-R615 IonicContact OD2-NH2 2.76Å; D506-R615 PolarHBondContact OD2-NH2 3.37Å; L562-R615 HydrophobicContact CD2-CB 4.31Å; S613-R615 PolarHBondContact O-N 3Å; S613-R615 VanDerWaalsContact O-N 3.07Å; S613-R615 WeakPolarHBondContact OG-CB 3.34Å; R615-Q618 WeakPolarHBondContact O-CB 3.35Å; R615-Q618 PolarHBondContact O-N 3.15Å; R615-K619 WeakPolarHBondContact O-CG 3.41Å; R615-K619 PolarHBondContact O-N 2.77Å; R615-K619 VanDerWaalsContact O-N 3.12Å
616	N	63.1	Low	58.1	Low	22 Å²	22	58.3 Å²	58.3	12%	0.118	30%	0.298	C	S	.	.	H	α-helix	trans	-73.1	-32.4	174.8	-64.8	-11.4	0	0	0	111.5	I600 S613 L614 L620	I600-N616 HydrophobicContact CD1-CB 4.21Å; S613-N616 PolarHBondContact O-N 2.88Å; L614-N616 PolarHBondContact O-N 2.83Å; N616-L620 VanDerWaalsContact O-CB 3.23Å; N616-L620 WeakPolarHBondContact O-CB 3.5Å; N616-L620 PolarHBondContact O-N 3.37Å
617	V	66.9	Low	60	Low	12 Å²	12	60 Å²	60	7%	0.073	30%	0.304	C	S	.	.	H	α-helix	trans	-67.8	-38	172.7	-173.8	0	0	0	0	110.4	L588 A591 L614 Y621	L588-V617 HydrophobicContact CD2-CG1 3.52Å; A591-V617 HydrophobicContact CB-CG2 4.14Å; L614-V617 HydrophobicContact CD2-CG2 4.46Å; L614-V617 WeakPolarHBondContact O-CA 3.5Å; L614-V617 WeakPolarHBondContact O-CB 3.41Å; L614-V617 PolarHBondContact O-N 2.81Å; V617-Y621 VanDerWaalsContact O-CB 3.3Å; V617-Y621 WeakPolarHBondContact O-CB 3.14Å; V617-Y621 PolarHBondContact O-N 3.3Å
618	Q	66	Low	61.8	Low	39 Å²	39	51.4 Å²	51.4	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-50.2	173.8	-161	175.2	24.6	0	0	112	V555 V558 L562 L614 R615 Y621 M622	V555-Q618 HydrophobicContact CG1-CG 4.32Å; V558-Q618 HydrophobicContact CG1-CB 3.69Å; V558-Q618 HydrophobicContact CG1-CG 4.11Å; L562-Q618 VanDerWaalsContact CD1-OE1 3.28Å; L614-Q618 PolarHBondContact O-N 2.93Å; R615-Q618 WeakPolarHBondContact O-CB 3.35Å; R615-Q618 PolarHBondContact O-N 3.15Å; Q618-Y621 PolarHBondContact O-N 3.21Å; Q618-M622 WeakPolarHBondContact O-CG 3.01Å; Q618-M622 PolarHBondContact O-N 3.32Å
619	K	65.7	Low	63.8	Low	29 Å²	29	42.4 Å²	42.4	13%	0.126	23%	0.228	C	C	.	.	H	α-helix	trans	-64	-43	179	-67.3	178.8	-177	-154	0	112.3	I471 C472 N474 R615 Y621 M622 L623	I471-K619 VanDerWaalsContact O-CE 3.27Å; I471-K619 WeakPolarHBondContact O-CE 3.33Å; I471-K619 PolarHBondContact O-NZ 2.91Å; C472-K619 HydrophobicContact CB-CB 4.3Å; N474-K619 WeakPolarHBondContact OD1-CD 3.3Å; N474-K619 PolarHBondContact OD1-NZ 2.88Å; R615-K619 WeakPolarHBondContact O-CG 3.41Å; R615-K619 PolarHBondContact O-N 2.77Å; R615-K619 VanDerWaalsContact O-N 3.12Å; K619-Y621 VanDerWaalsContact C-N 3.33Å; K619-Y621 PolarHBondContact O-N 2.94Å; K619-M622 PolarHBondContact O-N 2.88Å; K619-L623 WeakPolarHBondContact O-CG 3.47Å; K619-L623 PolarHBondContact O-N 2.99Å
620	L	67.2	Low	65.5	Low	10 Å²	10	43.3 Å²	43.3	5%	0.052	23%	0.225	C	C	.	.	H	α-helix	trans	-55.4	-48.9	171.1	170.4	64.7	0	0	0	110.8	I602 N616 M622 L623 L624 I648	I602-L620 HydrophobicContact CD1-CD1 3.91Å; N616-L620 VanDerWaalsContact O-CB 3.23Å; N616-L620 WeakPolarHBondContact O-CB 3.5Å; N616-L620 PolarHBondContact O-N 3.37Å; L620-M622 VanDerWaalsContact C-N 3.32Å; L620-M622 PolarHBondContact O-N 3.18Å; L620-L623 PolarHBondContact O-N 3.47Å; L620-L623 VanDerWaalsContact O-N 3.13Å; L620-L624 HydrophobicContact CD1-CD1 3.85Å; L620-L624 HydrophobicContact CD1-CD2 4.32Å; L620-L624 HydrophobicContact CD1-CG 3.91Å; L620-L624 HydrophobicContact CD2-CD1 4.46Å; L620-L624 HydrophobicContact CG-CD1 3.77Å; L620-L624 HydrophobicContact CG-CG 4.26Å; L620-L624 VanDerWaalsContact O-CG 3.3Å; L620-L624 WeakPolarHBondContact O-CG 3.43Å; L620-L624 PolarHBondContact O-N 3Å; L620-I648 HydrophobicContact CD1-CG1 4.16Å; L620-I648 HydrophobicContact CD2-CD1 4.42Å; L620-I648 HydrophobicContact CD2-CG1 4.04Å; L620-I648 HydrophobicContact CD2-CG2 4.06Å
621	Y	69.3	Low	66.9	Low	22 Å²	22	40.9 Å²	40.9	9%	0.086	22%	0.221	C	C	.	.	H	α-helix	trans	-63.3	-37.1	-177.5	-157.1	-79.8	0	0	0	112.8	G551 T552 V555 T584 L587 L588 V617 Q618 K619 L623 L624 K625	G551-Y621 VanDerWaalsContact C-OH 3.28Å; G551-Y621 PolarHBondContact O-OH 2.89Å; T552-Y621 WeakPolarHBondContact CA-OH 3.28Å; T552-Y621 WeakPolarHBondContact O-CE1 3.45Å; V555-Y621 HydrophobicContact CG2-CD1 3.48Å; V555-Y621 VanDerWaalsContact CG2-CD1 3.48Å; V555-Y621 HydrophobicContact CG2-CE1 4.07Å; V555-Y621 HydrophobicContact CG2-CG 4.31Å; T584-Y621 HydrophobicContact CG2-CE2 3.63Å; T584-Y621 WeakPolarHBondContact CG2-OH 3.48Å; T584-Y621 PolarHBondContact OG1-OH 2.75Å; L587-Y621 HydrophobicContact CD2-CE2 4.45Å; L588-Y621 HydrophobicContact CD2-CD2 4.49Å; V617-Y621 VanDerWaalsContact O-CB 3.3Å; V617-Y621 WeakPolarHBondContact O-CB 3.14Å; V617-Y621 PolarHBondContact O-N 3.3Å; Q618-Y621 PolarHBondContact O-N 3.21Å; K619-Y621 VanDerWaalsContact C-N 3.33Å; K619-Y621 PolarHBondContact O-N 2.94Å; Y621-L623 VanDerWaalsContact C-N 3.32Å; Y621-L623 PolarHBondContact O-N 2.89Å; Y621-L624 PolarHBondContact O-N 3.17Å; Y621-K625 PolarHBondContact O-N 2.99Å
622	M	68.1	Low	68.2	Low	42 Å²	42	39.4 Å²	39.4	21%	0.207	21%	0.206	C	C	.	.	H	α-helix	trans	-67.8	-26.3	175	-71.2	-60.7	-64.5	0	0	114	V468 V555 Q618 K619 L620 K625	V468-M622 HydrophobicContact CG1-CE 4.19Å; V555-M622 HydrophobicContact CG2-SD 4.02Å; Q618-M622 WeakPolarHBondContact O-CG 3.01Å; Q618-M622 PolarHBondContact O-N 3.32Å; K619-M622 PolarHBondContact O-N 2.88Å; L620-M622 VanDerWaalsContact C-N 3.32Å; L620-M622 PolarHBondContact O-N 3.18Å; M622-K625 WeakPolarHBondContact O-CE 3.17Å; M622-K625 WeakPolarHBondContact O-CG 3.5Å
623	L	67.6	Low	68.8	Low	16 Å²	16	41.5 Å²	41.5	8%	0.084	22%	0.219	C	C	.	.	H	α-helix	trans	-81.8	-42	173.3	-65.4	170.3	0	0	0	111.5	L433 C472 K619 L620 Y621 K625 D626 D627	L433-L623 HydrophobicContact CD2-CD2 4.43Å; C472-L623 HydrophobicContact CB-CD1 4.34Å; C472-L623 HydrophobicContact CB-CD2 4.14Å; C472-L623 HydrophobicContact CB-CG 4.14Å; K619-L623 WeakPolarHBondContact O-CG 3.47Å; K619-L623 PolarHBondContact O-N 2.99Å; L620-L623 PolarHBondContact O-N 3.47Å; L620-L623 VanDerWaalsContact O-N 3.13Å; Y621-L623 VanDerWaalsContact C-N 3.32Å; Y621-L623 PolarHBondContact O-N 2.89Å; L623-K625 VanDerWaalsContact C-N 3.25Å; L623-K625 PolarHBondContact O-N 2.76Å; L623-D626 PolarHBondContact O-N 3.17Å; L623-D626 VanDerWaalsContact O-N 3.09Å; L623-D627 PolarHBondContact O-N 2.62Å
624	L	73.9	Confident	68.9	Low	8 Å²	8	43.8 Å²	43.8	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-30.5	-177.6	-72.9	174	0	0	0	114	I602 L620 Y621 D626 I628 I648	I602-L624 HydrophobicContact CD1-CD2 4.41Å; L620-L624 HydrophobicContact CD1-CD1 3.85Å; L620-L624 HydrophobicContact CD1-CD2 4.32Å; L620-L624 HydrophobicContact CD1-CG 3.91Å; L620-L624 HydrophobicContact CD2-CD1 4.46Å; L620-L624 HydrophobicContact CG-CD1 3.77Å; L620-L624 HydrophobicContact CG-CG 4.26Å; L620-L624 VanDerWaalsContact O-CG 3.3Å; L620-L624 WeakPolarHBondContact O-CG 3.43Å; L620-L624 PolarHBondContact O-N 3Å; Y621-L624 PolarHBondContact O-N 3.17Å; L624-D626 PolarHBondContact O-N 3.41Å; L624-I628 HydrophobicContact CB-CD1 4.07Å; L624-I628 WeakPolarHBondContact O-CB 3.41Å; L624-I628 WeakPolarHBondContact O-CD1 3.34Å; L624-I628 WeakPolarHBondContact O-CG1 3.3Å; L624-I628 PolarHBondContact O-N 2.78Å; L624-I648 HydrophobicContact CD1-CD1 3.54Å; L624-I648 HydrophobicContact CD2-CD1 4.12Å; L624-I648 HydrophobicContact CG-CD1 4.46Å
625	K	75.1	Confident	68.8	Low	17 Å²	17	46.3 Å²	46.3	7%	0.074	24%	0.24	C	C	.	.	H	α-helix	trans	-57.2	-40.5	176.7	82.2	-172.7	170.3	66.7	0	111.3	T552 Y621 M622 L623 F629 T829 D831	T552-K625 HydrophobicContact CG2-CB 3.99Å; Y621-K625 PolarHBondContact O-N 2.99Å; M622-K625 WeakPolarHBondContact O-CE 3.17Å; M622-K625 WeakPolarHBondContact O-CG 3.5Å; L623-K625 VanDerWaalsContact C-N 3.25Å; L623-K625 PolarHBondContact O-N 2.76Å; K625-F629 WeakPolarHBondContact O-CB 3.43Å; K625-F629 WeakPolarHBondContact O-CD2 3.37Å; K625-F629 PolarHBondContact O-N 2.9Å; K625-T829 PolarHBondContact NZ-O 2.94Å; K625-D831 WeakPolarHBondContact CE-OD1 3.42Å; K625-D831 IonicContact NZ-OD1 3.27Å; K625-D831 PolarHBondContact NZ-OD1 2.78Å; K625-D831 IonicContact NZ-OD2 3.91Å
626	D	72.5	Confident	69.2	Low	23 Å²	23	44 Å²	44	12%	0.123	23%	0.231	C	C	.	.	H	α-helix	trans	-77.1	-51.5	-177.6	-69	-5.2	0	0	0	109.6	K429 L623 L624 I628 F629 E630	K429-D626 VanDerWaalsContact NZ-CG 3.26Å; K429-D626 IonicContact NZ-OD1 2.61Å; K429-D626 IonicContact NZ-OD2 2.97Å; K429-D626 PolarHBondContact NZ-OD2 3.46Å; L623-D626 PolarHBondContact O-N 3.17Å; L623-D626 VanDerWaalsContact O-N 3.09Å; L624-D626 PolarHBondContact O-N 3.41Å; D626-I628 VanDerWaalsContact C-N 3.3Å; D626-I628 PolarHBondContact O-N 2.72Å; D626-F629 PolarHBondContact O-N 3.29Å; D626-E630 HydrophobicContact CB-CB 4.45Å; D626-E630 WeakPolarHBondContact CB-OE2 3.48Å; D626-E630 WeakPolarHBondContact O-CA 3.28Å; D626-E630 WeakPolarHBondContact O-CB 3.45Å; D626-E630 PolarHBondContact O-N 3.11Å
627	D	73.8	Confident	69.8	Low	78 Å²	78	45.6 Å²	45.6	42%	0.417	24%	0.244	S	C	.	.	H	α-helix	trans	-51.8	-47.4	178.6	-71.9	-29.7	0	0	0	112	L623 R640	L623-D627 PolarHBondContact O-N 2.62Å; D627-R640 WeakPolarHBondContact O-CD 3.48Å; D627-R640 PolarHBondContact O-NH1 3.07Å
628	I	77.5	Confident	70.4	Confident	13 Å²	13	46 Å²	46	7%	0.067	25%	0.248	C	C	.	.	H	α-helix	trans	-75.5	-48.6	-174.1	-63.4	163.1	0	0	0	111.2	L624 D626 Q632 M641 F704	L624-I628 HydrophobicContact CB-CD1 4.07Å; L624-I628 WeakPolarHBondContact O-CB 3.41Å; L624-I628 WeakPolarHBondContact O-CD1 3.34Å; L624-I628 WeakPolarHBondContact O-CG1 3.3Å; L624-I628 PolarHBondContact O-N 2.78Å; D626-I628 VanDerWaalsContact C-N 3.3Å; D626-I628 PolarHBondContact O-N 2.72Å; I628-Q632 PolarHBondContact O-NE2 2.94Å; I628-M641 HydrophobicContact CD1-SD 3.53Å; I628-M641 VanDerWaalsContact CD1-SD 3.53Å; I628-M641 HydrophobicContact CG1-SD 4.17Å; I628-M641 HydrophobicContact CG2-CB 4.48Å; I628-M641 HydrophobicContact CG2-SD 4.49Å; I628-F704 HydrophobicContact CG2-CE1 4.24Å; I628-F704 HydrophobicContact CG2-CZ 3.76Å
629	F	79.6	Confident	71.2	Confident	21 Å²	21	46.8 Å²	46.8	9%	0.092	26%	0.257	C	S	.	.	H	α-helix	trans	-108.1	-23.5	-164.8	-59.1	-65.8	0	0	0	114.4	T552 K625 D626 Q632 Y636 F704 D827 T829	T552-F629 HydrophobicContact CG2-CD2 4.2Å; T552-F629 HydrophobicContact CG2-CE2 3.78Å; K625-F629 WeakPolarHBondContact O-CB 3.43Å; K625-F629 WeakPolarHBondContact O-CD2 3.37Å; K625-F629 PolarHBondContact O-N 2.9Å; D626-F629 PolarHBondContact O-N 3.29Å; F629-Q632 PolarHBondContact O-N 3.46Å; F629-Y636 HydrophobicContact CB-CE1 4.11Å; F629-Y636 AromaticContact CD1-CD1 3.95Å; F629-Y636 HydrophobicContact CD1-CD1 3.95Å; F629-Y636 AromaticContact CD1-CD2 3.68Å; F629-Y636 HydrophobicContact CD1-CD2 3.68Å; F629-Y636 AromaticContact CD1-CE1 3.88Å; F629-Y636 HydrophobicContact CD1-CE1 3.88Å; F629-Y636 AromaticContact CD1-CE2 3.57Å; F629-Y636 HydrophobicContact CD1-CE2 3.57Å; F629-Y636 AromaticContact CD1-CG 3.88Å; F629-Y636 HydrophobicContact CD1-CG 3.88Å; F629-Y636 AromaticContact CD1-CZ 3.71Å; F629-Y636 AromaticContact CE1-CD2 3.88Å; F629-Y636 HydrophobicContact CE1-CD2 3.88Å; F629-Y636 AromaticContact CE1-CE2 3.99Å; F629-Y636 HydrophobicContact CE1-CE2 3.99Å; F629-Y636 HydrophobicContact CE1-CG 4.33Å; F629-F704 HydrophobicContact CD1-CZ 4.42Å; F629-F704 AromaticContact CE1-CE2 3.88Å; F629-F704 HydrophobicContact CE1-CE2 3.88Å; F629-F704 AromaticContact CE1-CZ 3.58Å; F629-F704 HydrophobicContact CE1-CZ 3.58Å; F629-F704 HydrophobicContact CZ-CE2 4.24Å; F629-F704 HydrophobicContact CZ-CZ 4.13Å; F629-D827 HydrophobicContact CD1-CB 3.84Å; F629-D827 HydrophobicContact CD2-CB 4.33Å; F629-D827 HydrophobicContact CE1-CB 3.86Å; F629-D827 HydrophobicContact CE2-CB 4.36Å; F629-D827 HydrophobicContact CG-CB 4.08Å; F629-D827 HydrophobicContact CZ-CB 4.13Å; F629-T829 HydrophobicContact CB-CG2 3.28Å; F629-T829 HydrophobicContact CD2-CG2 4.36Å; F629-T829 HydrophobicContact CG-CG2 4.25Å
630	E	69.3	Low	72.1	Confident	85 Å²	85	49.7 Å²	49.7	40%	0.397	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	135.9	-173.6	-163.5	173	-177.8	0	0	112.2	K429 D626 Q632 R640	K429-E630 WeakPolarHBondContact CE-OE2 3.19Å; K429-E630 IonicContact NZ-OE1 2.74Å; K429-E630 PolarHBondContact NZ-OE1 3.24Å; K429-E630 IonicContact NZ-OE2 2.92Å; K429-E630 PolarHBondContact NZ-OE2 3.32Å; D626-E630 HydrophobicContact CB-CB 4.45Å; D626-E630 WeakPolarHBondContact CB-OE2 3.48Å; D626-E630 WeakPolarHBondContact O-CA 3.28Å; D626-E630 WeakPolarHBondContact O-CB 3.45Å; D626-E630 PolarHBondContact O-N 3.11Å; E630-Q632 PolarHBondContact O-N 3.06Å; E630-R640 PolarHBondContact O-NH1 3.25Å; E630-R640 PolarHBondContact O-NH2 3.32Å
631	G	65.6	Low	72.8	Confident	82 Å²	82	50 Å²	50	85%	0.845	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	3.7	-176.7	0	0	0	0	0	115.6
632	Q	68.7	Low	73.7	Confident	44 Å²	44	51.2 Å²	51.2	21%	0.206	28%	0.275	C	S	.	.			trans	-100.5	162.3	176.1	-67.1	-154.7	69.8	0	0	112.6	I628 F629 E630 Y636 S637	I628-Q632 PolarHBondContact O-NE2 2.94Å; F629-Q632 PolarHBondContact O-N 3.46Å; E630-Q632 PolarHBondContact O-N 3.06Å; Q632-Y636 HydrophobicContact CB-CD1 3.46Å; Q632-Y636 VanDerWaalsContact CB-CD1 3.46Å; Q632-Y636 HydrophobicContact CB-CE1 3.65Å; Q632-Y636 HydrophobicContact CG-CD1 4.33Å; Q632-S637 VanDerWaalsContact OE1-CB 3.31Å
633	K	63.5	Low	74.5	Confident	188 Å²	188	55.1 Å²	55.1	82%	0.817	29%	0.293	S	S	*	.			trans	-113.1	152.3	167.8	-66.8	-175.1	179	-177.4	0	109.3	P635	K633-P635 CarbonylContact O-C 3.58Å; K633-P635 VanDerWaalsContact O-O 3.11Å
634	R	62.6	Low	75.1	Confident	81 Å²	81	54.9 Å²	54.9	31%	0.306	29%	0.293	S	S	.	.	S	Bend	trans	-70.2	144.4	174.5	-64.9	-172.9	-167.5	172.2	5.8	111.3	Y636 Y703 D827	R634-Y636 HydrophobicContact CG-CD2 4.07Å; R634-Y636 HydrophobicContact CG-CE2 3.46Å; R634-Y636 VanDerWaalsContact CG-CE2 3.46Å; R634-Y703 VanDerWaalsContact CZ-CE1 3.43Å; R634-D827 IonicContact CZ-OD1 2.74Å; R634-D827 IonicContact CZ-OD2 2.64Å; R634-D827 IonicContact NE-OD2 2.96Å; R634-D827 PolarHBondContact NE-OD2 3.14Å; R634-D827 IonicContact NH2-OD1 2.68Å; R634-D827 PolarHBondContact NH2-OD1 2.74Å; R634-D827 IonicContact NH2-OD2 3.95Å; R634-D827 PolarHBondContact NH2-OD2 2.92Å
635	P	65.3	Low	75.6	Confident	70 Å²	70	54.6 Å²	54.6	46%	0.455	29%	0.291	S	S	.	.	S	Bend	cis	-70.2	140.5	-9.8	31.5	-35.9	0	0	0	111.2	K633 Y703 I1532	K633-P635 CarbonylContact O-C 3.58Å; K633-P635 VanDerWaalsContact O-O 3.11Å; P635-Y703 CarbonylContact C-O 3.5Å; P635-Y703 WeakPolarHBondContact CA-O 3.46Å; P635-I1532 HydrophobicContact CG-CD1 4.01Å
636	Y	72.5	Confident	76.1	Confident	23 Å²	23	56.6 Å²	56.6	9%	0.09	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-69.7	143.5	-177.2	-68	-73.1	0	0	0	111.8	F629 Q632 R634 S638 Y703 F704 D827	F629-Y636 HydrophobicContact CB-CE1 4.11Å; F629-Y636 AromaticContact CD1-CD1 3.95Å; F629-Y636 HydrophobicContact CD1-CD1 3.95Å; F629-Y636 AromaticContact CD1-CD2 3.68Å; F629-Y636 HydrophobicContact CD1-CD2 3.68Å; F629-Y636 AromaticContact CD1-CE1 3.88Å; F629-Y636 HydrophobicContact CD1-CE1 3.88Å; F629-Y636 AromaticContact CD1-CE2 3.57Å; F629-Y636 HydrophobicContact CD1-CE2 3.57Å; F629-Y636 AromaticContact CD1-CG 3.88Å; F629-Y636 HydrophobicContact CD1-CG 3.88Å; F629-Y636 AromaticContact CD1-CZ 3.71Å; F629-Y636 AromaticContact CE1-CD2 3.88Å; F629-Y636 HydrophobicContact CE1-CD2 3.88Å; F629-Y636 AromaticContact CE1-CE2 3.99Å; F629-Y636 HydrophobicContact CE1-CE2 3.99Å; F629-Y636 HydrophobicContact CE1-CG 4.33Å; Q632-Y636 HydrophobicContact CB-CD1 3.46Å; Q632-Y636 VanDerWaalsContact CB-CD1 3.46Å; Q632-Y636 HydrophobicContact CB-CE1 3.65Å; Q632-Y636 HydrophobicContact CG-CD1 4.33Å; R634-Y636 HydrophobicContact CG-CD2 4.07Å; R634-Y636 HydrophobicContact CG-CE2 3.46Å; R634-Y636 VanDerWaalsContact CG-CE2 3.46Å; Y636-S638 PolarHBondContact O-N 3.37Å; Y636-Y703 HydrophobicContact CD2-CD1 4.41Å; Y636-Y703 WeakPolarHBondContact CD2-O 3.02Å; Y636-Y703 HydrophobicContact CE2-CD1 4.11Å; Y636-Y703 PolarHBondContact N-O 3.12Å; Y636-F704 VanDerWaalsContact CB-CE1 3.5Å; Y636-F704 HydrophobicContact CG-CE1 4.44Å; Y636-D827 HydrophobicContact CE2-CB 4.07Å; Y636-D827 PolarHBondContact OH-OD2 3.43Å
637	S	74.1	Confident	76.3	Confident	55 Å²	55	57.3 Å²	57.3	39%	0.385	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-65.7	123.9	175.8	-175.1	0	0	0	0	111	Q632 S639	Q632-S637 VanDerWaalsContact OE1-CB 3.31Å; S637-S639 PolarHBondContact O-N 3.02Å; S637-S639 VanDerWaalsContact O-N 3.16Å; S637-S639 PolarHBondContact OG-N 2.55Å; S637-S639 PolarHBondContact OG-OG 3.13Å
638	S	80	Confident	76.3	Confident	21 Å²	21	53.9 Å²	53.9	15%	0.147	29%	0.288	C	S	.	.	H	α-helix	trans	-55.5	-28.8	174.4	-62	0	0	0	0	113.4	Y636 R640 M641 E642 R695 S705	Y636-S638 PolarHBondContact O-N 3.37Å; S638-R640 PolarHBondContact O-N 3.42Å; S638-M641 PolarHBondContact O-N 2.93Å; S638-E642 WeakPolarHBondContact O-CG 3.42Å; S638-E642 PolarHBondContact O-N 3.34Å; S638-R695 PolarHBondContact OG-NH2 2.98Å; S638-S705 PolarHBondContact OG-OG 3.3Å; S638-S705 VanDerWaalsContact OG-OG 3.05Å
639	S	84	Confident	76.3	Confident	55 Å²	55	53.5 Å²	53.5	39%	0.385	29%	0.286	S	S	.	.	H	α-helix	trans	-56.2	-51.4	-173.9	57.9	0	0	0	0	113.3	S637 M641 E642 E643	S637-S639 PolarHBondContact O-N 3.02Å; S637-S639 VanDerWaalsContact O-N 3.16Å; S637-S639 PolarHBondContact OG-N 2.55Å; S637-S639 PolarHBondContact OG-OG 3.13Å; S639-M641 PolarHBondContact O-N 3.21Å; S639-E642 PolarHBondContact O-N 3.3Å; S639-E643 WeakPolarHBondContact O-CG 3.41Å; S639-E643 PolarHBondContact O-N 3.03Å
640	R	82.9	Confident	76.3	Confident	89 Å²	89	52.9 Å²	52.9	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-61.7	-44.7	-179.7	-64.2	-158.9	-165	163.7	4.1	111.7	D627 E630 S638 E642 E643 S644	D627-R640 WeakPolarHBondContact O-CD 3.48Å; D627-R640 PolarHBondContact O-NH1 3.07Å; E630-R640 PolarHBondContact O-NH1 3.25Å; E630-R640 PolarHBondContact O-NH2 3.32Å; S638-R640 PolarHBondContact O-N 3.42Å; R640-E642 VanDerWaalsContact C-N 3.3Å; R640-E642 PolarHBondContact O-N 3.19Å; R640-E643 PolarHBondContact O-N 3.26Å; R640-S644 WeakPolarHBondContact O-CB 3.49Å; R640-S644 PolarHBondContact O-N 3.5Å; R640-S644 PolarHBondContact O-OG 3.34Å; R640-S644 VanDerWaalsContact O-OG 3.12Å
641	M	83.1	Confident	77.1	Confident	16 Å²	16	52.9 Å²	52.9	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-61.3	-40.5	178.2	-178.1	55.9	170.4	0	0	111.6	I628 S638 S639 L645 T698 F704	I628-M641 HydrophobicContact CD1-SD 3.53Å; I628-M641 VanDerWaalsContact CD1-SD 3.53Å; I628-M641 HydrophobicContact CG1-SD 4.17Å; I628-M641 HydrophobicContact CG2-CB 4.48Å; I628-M641 HydrophobicContact CG2-SD 4.49Å; S638-M641 PolarHBondContact O-N 2.93Å; S639-M641 PolarHBondContact O-N 3.21Å; M641-L645 HydrophobicContact CE-CD1 4.13Å; M641-L645 HydrophobicContact CE-CD2 4.41Å; M641-L645 HydrophobicContact CE-CG 4.3Å; M641-L645 HydrophobicContact CG-CD1 4.28Å; M641-L645 WeakPolarHBondContact O-CB 3.47Å; M641-L645 VanDerWaalsContact O-CG 3.24Å; M641-L645 WeakPolarHBondContact O-CG 3.42Å; M641-L645 PolarHBondContact O-N 3.48Å; M641-L645 HydrophobicContact SD-CD1 4.48Å; M641-L645 HydrophobicContact SD-CG 4.38Å; M641-T698 HydrophobicContact CE-CG2 3.75Å; M641-T698 WeakPolarHBondContact CE-OG1 3.44Å; M641-F704 HydrophobicContact CB-CE1 4.1Å; M641-F704 HydrophobicContact CB-CZ 4.46Å
642	E	88.1	Confident	78	Confident	49 Å²	49	53.1 Å²	53.1	23%	0.229	28%	0.282	C	S	.	.	H	α-helix	trans	-68.9	-40.8	175.5	-73	-179	-142.8	0	0	113.5	S638 S639 R640 L645 K646 W691 R695	S638-E642 WeakPolarHBondContact O-CG 3.42Å; S638-E642 PolarHBondContact O-N 3.34Å; S639-E642 PolarHBondContact O-N 3.3Å; R640-E642 VanDerWaalsContact C-N 3.3Å; R640-E642 PolarHBondContact O-N 3.19Å; E642-L645 PolarHBondContact O-N 3.29Å; E642-K646 VanDerWaalsContact O-CB 3.32Å; E642-K646 WeakPolarHBondContact O-CB 3.14Å; E642-K646 VanDerWaalsContact O-CD 3.26Å; E642-K646 WeakPolarHBondContact O-CD 3.49Å; E642-K646 WeakPolarHBondContact O-CG 3.29Å; E642-K646 PolarHBondContact O-N 2.71Å; E642-K646 IonicContact OE2-NZ 2.76Å; E642-K646 PolarHBondContact OE2-NZ 3.09Å; E642-W691 HydrophobicContact CB-CZ3 4.27Å; E642-W691 HydrophobicContact CG-CE3 4.42Å; E642-W691 HydrophobicContact CG-CZ3 3.93Å; E642-W691 WeakPolarHBondContact OE2-CZ3 3.26Å; E642-R695 HydrophobicContact CG-CG 3.9Å
643	E	84.5	Confident	78.9	Confident	123 Å²	123	51.4 Å²	51.4	58%	0.575	28%	0.275	S	S	*	.	H	α-helix	trans	-61.4	-46	174.9	-75.3	168.2	-168	0	0	111	S639 R640 K646 S647	S639-E643 WeakPolarHBondContact O-CG 3.41Å; S639-E643 PolarHBondContact O-N 3.03Å; R640-E643 PolarHBondContact O-N 3.26Å; E643-K646 PolarHBondContact O-N 2.79Å; E643-S647 VanDerWaalsContact O-CB 3.31Å; E643-S647 WeakPolarHBondContact O-CB 3.42Å; E643-S647 PolarHBondContact O-N 2.94Å
644	S	80.3	Confident	80.1	Confident	12 Å²	12	43.9 Å²	43.9	8%	0.084	25%	0.245	C	C	.	.	H	α-helix	trans	-54.8	-53.4	170.8	-65.7	0	0	0	0	111.5	R640 K646 S647 I648	R640-S644 WeakPolarHBondContact O-CB 3.49Å; R640-S644 PolarHBondContact O-N 3.5Å; R640-S644 PolarHBondContact O-OG 3.34Å; R640-S644 VanDerWaalsContact O-OG 3.12Å; S644-K646 PolarHBondContact O-N 3.24Å; S644-S647 WeakPolarHBondContact O-CB 3.26Å; S644-S647 PolarHBondContact O-N 3.42Å; S644-S647 VanDerWaalsContact O-N 3.08Å; S644-I648 VanDerWaalsContact O-CD1 3.32Å; S644-I648 WeakPolarHBondContact O-CD1 3.43Å; S644-I648 WeakPolarHBondContact O-CG1 3.46Å; S644-I648 PolarHBondContact O-N 3.02Å
645	L	84.7	Confident	81.2	Confident	1 Å²	1	40 Å²	40	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-44.8	-179.9	-72.1	173.1	0	0	0	112.5	L587 M641 E642 S647 I648 V649 W691 L694 R695	L587-L645 HydrophobicContact CD1-CD2 3.8Å; M641-L645 HydrophobicContact CE-CD1 4.13Å; M641-L645 HydrophobicContact CE-CD2 4.41Å; M641-L645 HydrophobicContact CE-CG 4.3Å; M641-L645 HydrophobicContact CG-CD1 4.28Å; M641-L645 WeakPolarHBondContact O-CB 3.47Å; M641-L645 VanDerWaalsContact O-CG 3.24Å; M641-L645 WeakPolarHBondContact O-CG 3.42Å; M641-L645 PolarHBondContact O-N 3.48Å; M641-L645 HydrophobicContact SD-CD1 4.48Å; M641-L645 HydrophobicContact SD-CG 4.38Å; E642-L645 PolarHBondContact O-N 3.29Å; L645-S647 PolarHBondContact O-N 3.34Å; L645-I648 PolarHBondContact O-N 3.27Å; L645-I648 VanDerWaalsContact O-N 3.14Å; L645-V649 WeakPolarHBondContact O-CG2 3.1Å; L645-V649 PolarHBondContact O-N 2.84Å; L645-V649 VanDerWaalsContact O-N 3.17Å; L645-W691 HydrophobicContact CB-CB 4.04Å; L645-L694 HydrophobicContact CD1-CB 4.05Å; L645-L694 HydrophobicContact CD2-CB 3.84Å; L645-L694 HydrophobicContact CD2-CD1 4.12Å; L645-R695 HydrophobicContact CD1-CB 3.85Å
646	K	85.9	Confident	82	Confident	59 Å²	59	38.7 Å²	38.7	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-58.2	-34.4	174.9	-71.3	159	-165.6	163.6	0	111.7	E642 E643 S644 G650 P651 W691	E642-K646 VanDerWaalsContact O-CB 3.32Å; E642-K646 WeakPolarHBondContact O-CB 3.14Å; E642-K646 VanDerWaalsContact O-CD 3.26Å; E642-K646 WeakPolarHBondContact O-CD 3.49Å; E642-K646 WeakPolarHBondContact O-CG 3.29Å; E642-K646 PolarHBondContact O-N 2.71Å; E642-K646 IonicContact OE2-NZ 2.76Å; E642-K646 PolarHBondContact OE2-NZ 3.09Å; E643-K646 PolarHBondContact O-N 2.79Å; S644-K646 PolarHBondContact O-N 3.24Å; K646-G650 CarbonylContact O-C 3.58Å; K646-G650 WeakPolarHBondContact O-CA 3.14Å; K646-G650 PolarHBondContact O-N 2.98Å; K646-P651 HydrophobicContact CB-CB 4.24Å; K646-P651 HydrophobicContact CG-CB 4.35Å; K646-P651 WeakPolarHBondContact O-CD 3.44Å; K646-W691 HydrophobicContact CD-CD2 4.28Å; K646-W691 HydrophobicContact CD-CE3 4.39Å; K646-W691 VanDerWaalsContact CE-CE3 3.44Å; K646-W691 VanDerWaalsContact CE-CZ2 3.42Å; K646-W691 HydrophobicContact CG-CB 4.29Å; K646-W691 HydrophobicContact CG-CD2 3.62Å; K646-W691 HydrophobicContact CG-CE3 4.06Å; K646-W691 HydrophobicContact CG-CG 3.72Å
647	S	76.3	Confident	82.5	Confident	39 Å²	39	41.4 Å²	41.4	27%	0.273	24%	0.241	S	C	.	.	H	α-helix	trans	-81.5	-16.5	179	-162.6	0	0	0	0	114.6	A601 I602 E643 S644 L645	A601-S647 PolarHBondContact N-O 3.27Å; I602-S647 VanDerWaalsContact CG1-OG 3.25Å; I602-S647 WeakPolarHBondContact CG1-OG 3.25Å; E643-S647 VanDerWaalsContact O-CB 3.31Å; E643-S647 WeakPolarHBondContact O-CB 3.42Å; E643-S647 PolarHBondContact O-N 2.94Å; S644-S647 WeakPolarHBondContact O-CB 3.26Å; S644-S647 PolarHBondContact O-N 3.42Å; S644-S647 VanDerWaalsContact O-N 3.08Å; L645-S647 PolarHBondContact O-N 3.34Å
648	I	73.9	Confident	82.9	Confident	6 Å²	6	38.9 Å²	38.9	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-91.4	-48.5	179.6	-64.5	158.7	0	0	0	112.2	L587 I602 L620 L624 S644 L645	L587-I648 HydrophobicContact CD1-CD1 4.46Å; L587-I648 HydrophobicContact CD1-CG2 4.38Å; I602-I648 HydrophobicContact CD1-CG1 4.42Å; L620-I648 HydrophobicContact CD1-CG1 4.16Å; L620-I648 HydrophobicContact CD2-CD1 4.42Å; L620-I648 HydrophobicContact CD2-CG1 4.04Å; L620-I648 HydrophobicContact CD2-CG2 4.06Å; L624-I648 HydrophobicContact CD1-CD1 3.54Å; L624-I648 HydrophobicContact CD2-CD1 4.12Å; L624-I648 HydrophobicContact CG-CD1 4.46Å; S644-I648 VanDerWaalsContact O-CD1 3.32Å; S644-I648 WeakPolarHBondContact O-CD1 3.43Å; S644-I648 WeakPolarHBondContact O-CG1 3.46Å; S644-I648 PolarHBondContact O-N 3.02Å; L645-I648 PolarHBondContact O-N 3.27Å; L645-I648 VanDerWaalsContact O-N 3.14Å
649	V	78	Confident	82.5	Confident	4 Å²	4	43.9 Å²	43.9	2%	0.024	25%	0.253	C	S	.	.	H	α-helix	trans	-100.3	-20.9	-178.7	-59.2	0	0	0	0	113.3	T590 L594 L645 T653 L690 W691 L694	T590-V649 HydrophobicContact CG2-CG1 4.14Å; L594-V649 HydrophobicContact CD1-CB 4.41Å; L594-V649 HydrophobicContact CD1-CG1 4.09Å; L645-V649 WeakPolarHBondContact O-CG2 3.1Å; L645-V649 PolarHBondContact O-N 2.84Å; L645-V649 VanDerWaalsContact O-N 3.17Å; V649-T653 VanDerWaalsContact O-CB 3.25Å; V649-T653 WeakPolarHBondContact O-CB 3.38Å; V649-T653 PolarHBondContact O-OG1 3.33Å; V649-L690 HydrophobicContact CB-CD2 4.06Å; V649-L690 HydrophobicContact CB-CG 4.36Å; V649-L690 HydrophobicContact CG1-CD2 4.14Å; V649-L690 HydrophobicContact CG1-CG 4.36Å; V649-L690 HydrophobicContact CG2-CB 4.29Å; V649-L690 HydrophobicContact CG2-CD2 4.41Å; V649-L690 HydrophobicContact CG2-CG 4.22Å; V649-W691 HydrophobicContact CG2-CB 3.8Å; V649-L694 HydrophobicContact CG1-CD1 3.84Å
650	G	78.9	Confident	82	Confident	9 Å²	9	45.2 Å²	45.2	9%	0.093	26%	0.263	C	S	.	.			trans	103.2	140.1	-172.9	0	0	0	0	0	112.1	K646 S652 T653	K646-G650 CarbonylContact O-C 3.58Å; K646-G650 WeakPolarHBondContact O-CA 3.14Å; K646-G650 PolarHBondContact O-N 2.98Å; G650-S652 VanDerWaalsContact C-N 3.3Å; G650-S652 PolarHBondContact O-N 3.37Å; G650-T653 PolarHBondContact O-N 3.49Å
651	P	85.6	Confident	82.1	Confident	85 Å²	85	42.2 Å²	42.2	55%	0.552	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-24.7	-173.3	28	-35.6	0	0	0	113.6	K646 W691	K646-P651 HydrophobicContact CB-CB 4.24Å; K646-P651 HydrophobicContact CG-CB 4.35Å; K646-P651 WeakPolarHBondContact O-CD 3.44Å; P651-W691 VanDerWaalsContact O-CD1 3.3Å; P651-W691 PolarHBondContact O-NE1 2.92Å
652	S	86.4	Confident	82.4	Confident	86 Å²	86	44 Å²	44	60%	0.601	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	2	178.5	67.9	0	0	0	0	113.7	G650	G650-S652 VanDerWaalsContact C-N 3.3Å; G650-S652 PolarHBondContact O-N 3.37Å
653	T	86	Confident	82.5	Confident	8 Å²	8	41.7 Å²	41.7	5%	0.049	25%	0.249	C	C	.	.			trans	-77.4	130.3	-176.2	-55.2	0	0	0	0	109.6	V649 G650 D657 L690	V649-T653 VanDerWaalsContact O-CB 3.25Å; V649-T653 WeakPolarHBondContact O-CB 3.38Å; V649-T653 PolarHBondContact O-OG1 3.33Å; G650-T653 PolarHBondContact O-N 3.49Å; T653-D657 HydrophobicContact CG2-CB 3.87Å; T653-L690 HydrophobicContact CG2-CB 4.49Å; T653-L690 HydrophobicContact CG2-CD2 3.95Å; T653-L690 WeakPolarHBondContact O-CB 3.18Å; T653-L690 PolarHBondContact O-N 2.82Å
654	T	88.7	Confident	82.9	Confident	31 Å²	31	36 Å²	36	19%	0.19	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-101.7	172.2	-175.1	65.5	0	0	0	0	111.8	A656 D657 P686 L688	T654-A656 VanDerWaalsContact C-N 3.28Å; T654-A656 PolarHBondContact OG1-N 3.06Å; T654-D657 PolarHBondContact N-OD2 3.33Å; T654-D657 PolarHBondContact OG1-N 3.21Å; T654-D657 PolarHBondContact OG1-OD2 3.27Å; T654-P686 WeakPolarHBondContact CB-O 3.14Å; T654-L688 CarbonylContact C-O 3.59Å; T654-L688 VanDerWaalsContact CA-O 3.28Å; T654-L688 WeakPolarHBondContact CA-O 3.48Å
655	M	87.1	Confident	83.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-65.2	-32.6	169	-69.2	-69.1	-67.9	0	0	111.7	D657 V658 F680 N682 L685 P686 L688 L690 V693	M655-D657 VanDerWaalsContact C-N 3.31Å; M655-D657 PolarHBondContact O-N 2.75Å; M655-V658 WeakPolarHBondContact O-CB 3.3Å; M655-V658 PolarHBondContact O-N 3.37Å; M655-F680 HydrophobicContact CE-CB 4.32Å; M655-N682 HydrophobicContact CB-CB 4.43Å; M655-N682 HydrophobicContact CE-CB 4.19Å; M655-N682 VanDerWaalsContact O-CB 3.31Å; M655-N682 WeakPolarHBondContact O-CB 3.35Å; M655-L685 WeakPolarHBondContact CB-O 3.26Å; M655-P686 PolarHBondContact N-O 3.37Å; M655-L688 HydrophobicContact CG-CB 4.02Å; M655-L688 WeakPolarHBondContact CG-O 3.25Å; M655-L688 PolarHBondContact N-O 3.43Å; M655-L690 HydrophobicContact SD-CD1 3.49Å; M655-L690 WeakPolarHBondContact SD-CD1 3.47Å; M655-V693 HydrophobicContact CG-CG2 4.08Å; M655-V693 HydrophobicContact SD-CB 4.12Å; M655-V693 HydrophobicContact SD-CG1 3.92Å; M655-V693 HydrophobicContact SD-CG2 3.99Å
656	A	81.8	Confident	83.9	Confident	41 Å²	41	35.4 Å²	35.4	34%	0.339	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.7	177.8	0	0	0	0	0	113.9	T654 V658 T659 P686	T654-A656 VanDerWaalsContact C-N 3.28Å; T654-A656 PolarHBondContact OG1-N 3.06Å; A656-V658 PolarHBondContact O-N 2.88Å; A656-V658 VanDerWaalsContact O-N 3.09Å; A656-T659 VanDerWaalsContact O-CG2 3.32Å; A656-T659 WeakPolarHBondContact O-CG2 3.18Å; A656-P686 HydrophobicContact CB-CB 3.75Å; A656-P686 WeakPolarHBondContact CB-O 3.16Å; A656-P686 PolarHBondContact N-O 2.7Å
657	D	83.1	Confident	84.1	Confident	80 Å²	80	32.6 Å²	32.6	43%	0.428	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.4	176.9	-68.4	-69.4	0	0	0	113	T653 T654 M655 T659	T653-D657 HydrophobicContact CG2-CB 3.87Å; T654-D657 PolarHBondContact N-OD2 3.33Å; T654-D657 PolarHBondContact OG1-N 3.21Å; T654-D657 PolarHBondContact OG1-OD2 3.27Å; M655-D657 VanDerWaalsContact C-N 3.31Å; M655-D657 PolarHBondContact O-N 2.75Å; D657-T659 VanDerWaalsContact C-N 3.28Å; D657-T659 PolarHBondContact O-N 2.97Å; D657-T659 VanDerWaalsContact O-N 3.09Å
658	V	80.9	Confident	84.6	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.018	19%	0.193	C	C	.	.			trans	-82.7	71.6	171.2	-170.6	0	0	0	0	109.3	A593 L594 M655 A656 L663 N682 L690	A593-V658 HydrophobicContact CB-CG1 3.7Å; L594-V658 HydrophobicContact CD2-CG2 3.92Å; L594-V658 HydrophobicContact CG-CG2 4.34Å; M655-V658 WeakPolarHBondContact O-CB 3.3Å; M655-V658 PolarHBondContact O-N 3.37Å; A656-V658 PolarHBondContact O-N 2.88Å; A656-V658 VanDerWaalsContact O-N 3.09Å; V658-L663 HydrophobicContact CB-CD2 4.5Å; V658-L663 HydrophobicContact CG1-CB 4.14Å; V658-L663 HydrophobicContact CG1-CD2 4.14Å; V658-L663 HydrophobicContact CG2-CD2 4.01Å; V658-N682 HydrophobicContact CB-CB 4.38Å; V658-N682 PolarHBondContact O-ND2 2.85Å; V658-L690 HydrophobicContact CG2-CD2 4.13Å
659	T	72.7	Confident	85.2	Confident	125 Å²	125	32.3 Å²	32.3	77%	0.767	20%	0.201	S	C	*	.			trans	-80	-31.9	-172.3	55.6	0	0	0	0	114.8	A656 D657	A656-T659 VanDerWaalsContact O-CG2 3.32Å; A656-T659 WeakPolarHBondContact O-CG2 3.18Å; D657-T659 VanDerWaalsContact C-N 3.28Å; D657-T659 PolarHBondContact O-N 2.97Å; D657-T659 VanDerWaalsContact O-N 3.09Å
660	S	72.5	Confident	85.1	Confident	84 Å²	84	32.5 Å²	32.5	59%	0.587	20%	0.202	S	C	*	.	S	Bend	trans	-92.3	-3.8	-165.5	69.7	0	0	0	0	116.1
661	K	85.2	Confident	84.9	Confident	26 Å²	26	38.2 Å²	38.2	11%	0.113	22%	0.224	C	C	.	.	S	Bend	trans	-144.6	154.2	-173.5	-59.4	-64.7	151.2	-175.4	0	111	Y573 V576 D577 A593 N682	Y573-K661 VanDerWaalsContact O-CE 3.22Å; Y573-K661 WeakPolarHBondContact O-CE 3.5Å; V576-K661 WeakPolarHBondContact O-CD 3.21Å; V576-K661 VanDerWaalsContact O-CE 3.25Å; V576-K661 WeakPolarHBondContact O-CE 3.4Å; V576-K661 PolarHBondContact O-NZ 2.92Å; D577-K661 IonicContact OD1-NZ 3.84Å; D577-K661 PolarHBondContact OD1-NZ 3.49Å; A593-K661 HydrophobicContact CB-CB 4.17Å; K661-N682 PolarHBondContact O-ND2 2.68Å
662	K	90.1	Very high	84.4	Confident	53 Å²	53	36.9 Å²	36.9	23%	0.23	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	117.3	171.5	-59.3	-72.2	-171.5	170.1	0	108.1	D577 W578 V579 Y683 Y732	D577-K662 PolarHBondContact O-N 3Å; W578-K662 HydrophobicContact CD2-CB 3.51Å; W578-K662 HydrophobicContact CD2-CG 4.03Å; W578-K662 HydrophobicContact CE3-CB 3.78Å; W578-K662 HydrophobicContact CG-CB 3.92Å; W578-K662 HydrophobicContact CG-CG 4.42Å; W578-K662 HydrophobicContact CH2-CB 4.27Å; W578-K662 HydrophobicContact CH2-CG 4.43Å; W578-K662 HydrophobicContact CZ2-CB 4.03Å; W578-K662 HydrophobicContact CZ2-CD 4.35Å; W578-K662 HydrophobicContact CZ2-CG 3.83Å; W578-K662 HydrophobicContact CZ3-CB 4.15Å; V579-K662 PolarHBondContact N-O 2.95Å; K662-Y683 HydrophobicContact CB-CD1 4.47Å; K662-Y683 HydrophobicContact CB-CE1 4.46Å; K662-Y683 HydrophobicContact CD-CD1 3.65Å; K662-Y683 HydrophobicContact CD-CE1 4.22Å; K662-Y683 HydrophobicContact CD-CG 4.22Å; K662-Y732 VanDerWaalsContact NZ-CE2 3.3Å; K662-Y732 PolarHBondContact NZ-OH 3.07Å
663	L	90.9	Very high	83.5	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123	-175.3	179.1	62.1	0	0	0	110.4	V579 T590 A593 V658 I665 N682 L690	V579-L663 HydrophobicContact CB-CD1 4.32Å; V579-L663 WeakPolarHBondContact O-CA 3.36Å; T590-L663 HydrophobicContact CG2-CD2 4.31Å; A593-L663 HydrophobicContact CB-CB 4.49Å; A593-L663 HydrophobicContact CB-CD1 4.21Å; A593-L663 HydrophobicContact CB-CD2 4.41Å; V658-L663 HydrophobicContact CB-CD2 4.5Å; V658-L663 HydrophobicContact CG1-CB 4.14Å; V658-L663 HydrophobicContact CG1-CD2 4.14Å; V658-L663 HydrophobicContact CG2-CD2 4.01Å; L663-I665 HydrophobicContact CD1-CD1 4.4Å; L663-I665 HydrophobicContact CD1-CG1 4.22Å; L663-I665 HydrophobicContact CD2-CD1 4.11Å; L663-I665 HydrophobicContact CG-CD1 4.17Å; L663-I665 HydrophobicContact CG-CG1 4.2Å; L663-N682 HydrophobicContact CB-CB 4.47Å; L663-N682 PolarHBondContact N-OD1 3.41Å; L663-N682 PolarHBondContact O-N 3.44Å; L663-N682 PolarHBondContact O-OD1 2.81Å; L663-L690 HydrophobicContact CD2-CD1 4.38Å
664	V	92.1	Very high	82.8	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	112.9	-173.4	177.7	0	0	0	0	108.9	W578 V579 A580 G581 I679 E728	W578-V664 HydrophobicContact CE3-CG2 3.92Å; W578-V664 HydrophobicContact CZ3-CG2 3.82Å; V579-V664 PolarHBondContact O-N 3Å; A580-V664 VanDerWaalsContact CA-O 3.31Å; A580-V664 WeakPolarHBondContact CA-O 3.38Å; A580-V664 HydrophobicContact CB-CB 4.01Å; A580-V664 HydrophobicContact CB-CG1 4.25Å; G581-V664 PolarHBondContact N-O 3.13Å; V664-I679 HydrophobicContact CG1-CG2 3.62Å; V664-E728 HydrophobicContact CG2-CG 4.45Å
665	I	93.2	Very high	82.1	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.2	-177.5	-64.5	174.5	0	0	0	110.4	A586 L663 I679 F680 V693 L694 T697	A586-I665 HydrophobicContact CB-CD1 4.45Å; A586-I665 HydrophobicContact CB-CG1 4.1Å; A586-I665 HydrophobicContact CB-CG2 3.87Å; L663-I665 HydrophobicContact CD1-CD1 4.4Å; L663-I665 HydrophobicContact CD1-CG1 4.22Å; L663-I665 HydrophobicContact CD2-CD1 4.11Å; L663-I665 HydrophobicContact CG-CD1 4.17Å; L663-I665 HydrophobicContact CG-CG1 4.2Å; I665-I679 WeakPolarHBondContact O-CA 3.18Å; I665-F680 HydrophobicContact CB-CB 4.28Å; I665-F680 HydrophobicContact CG2-CD2 4.41Å; I665-F680 PolarHBondContact N-O 3.14Å; I665-F680 PolarHBondContact O-N 2.97Å; I665-V693 HydrophobicContact CB-CG1 4.25Å; I665-V693 HydrophobicContact CD1-CG1 3.88Å; I665-V693 HydrophobicContact CG2-CG1 4.06Å; I665-L694 HydrophobicContact CD1-CD2 4.26Å; I665-T697 HydrophobicContact CG2-CG2 3.65Å
666	T	92.9	Very high	81.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	140.8	-177.6	63	0	0	0	0	112.8	G581 T582 T697 A718 P721	G581-T666 PolarHBondContact O-N 2.99Å; T582-T666 WeakPolarHBondContact CA-OG1 3.37Å; T582-T666 WeakPolarHBondContact CB-OG1 3.47Å; T582-T666 VanDerWaalsContact CG2-OG1 3.25Å; T582-T666 WeakPolarHBondContact CG2-OG1 3.44Å; T582-T666 PolarHBondContact OG1-OG1 3.23Å; T666-T697 WeakPolarHBondContact O-CB 3.43Å; T666-T697 PolarHBondContact O-OG1 3.37Å; T666-A718 HydrophobicContact CG2-CB 4Å; T666-P721 HydrophobicContact CG2-CB 4.12Å
667	S	91	Very high	82.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	156.5	169.9	178.3	0	0	0	0	109.9	H678 C696 V712	S667-H678 PolarHBondContact N-O 3.07Å; S667-H678 CarbonylContact O-C 3.57Å; S667-H678 WeakPolarHBondContact O-CA 3.43Å; S667-H678 WeakPolarHBondContact O-CB 3.19Å; S667-H678 PolarHBondContact O-N 2.87Å; S667-C696 PolarHBondContact OG-O 2.9Å; S667-V712 PolarHBondContact OG-O 3.37Å
668	V	86.8	Confident	82.4	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.4	-178.1	178.5	0	0	0	0	110.1	I670 L675 L677 Y711 V712 L716 M717	V668-I670 HydrophobicContact CG1-CG2 4.45Å; V668-L675 HydrophobicContact CG1-CB 4.1Å; V668-L675 HydrophobicContact CG1-CD1 4.07Å; V668-L675 HydrophobicContact CG1-CD2 4.29Å; V668-L675 HydrophobicContact CG1-CG 4.41Å; V668-L677 HydrophobicContact CG2-CD1 4.39Å; V668-Y711 WeakPolarHBondContact O-CA 3.31Å; V668-V712 HydrophobicContact CB-CG2 3.79Å; V668-V712 HydrophobicContact CG1-CG2 4.26Å; V668-V712 PolarHBondContact N-O 3.46Å; V668-V712 PolarHBondContact O-N 3.27Å; V668-L716 HydrophobicContact CG2-CB 4.18Å; V668-M717 HydrophobicContact CB-SD 4.48Å; V668-M717 HydrophobicContact CG1-SD 3.93Å; V668-M717 HydrophobicContact CG2-CB 4.07Å; V668-M717 HydrophobicContact CG2-CG 3.82Å; V668-M717 HydrophobicContact CG2-SD 3.83Å
669	L	85.2	Confident	82.9	Confident	40 Å²	40	37.9 Å²	37.9	21%	0.209	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	114.1	177.7	176.5	65.9	0	0	0	109.8	K671 L675 R676 H678 M710 Y711	L669-K671 HydrophobicContact CD1-CB 4.17Å; L669-K671 HydrophobicContact CG-CB 4.32Å; L669-L675 WeakPolarHBondContact O-CD2 3.43Å; L669-R676 PolarHBondContact N-O 3.31Å; L669-H678 HydrophobicContact CB-CB 4.43Å; L669-M710 CarbonylContact C-O 3.57Å; L669-M710 WeakPolarHBondContact CA-O 3.15Å; L669-M710 HydrophobicContact CD1-CB 4.24Å; L669-M710 HydrophobicContact CD1-CE 3.78Å; L669-Y711 HydrophobicContact CD1-CE1 4.13Å
670	I	77	Confident	83.8	Confident	7 Å²	7	32.3 Å²	32.3	4%	0.036	16%	0.159	C	C	.	.			trans	-97.5	16.3	-173.8	61.9	160.6	0	0	0	114.9	V668 L675 M710 V712 L1528 M1548	V668-I670 HydrophobicContact CG1-CG2 4.45Å; I670-L675 HydrophobicContact CB-CD2 4.12Å; I670-L675 HydrophobicContact CG2-CD2 3.87Å; I670-M710 WeakPolarHBondContact CG1-O 3.48Å; I670-M710 PolarHBondContact N-O 3.33Å; I670-V712 HydrophobicContact CD1-CG1 4.08Å; I670-V712 HydrophobicContact CG2-CB 4.45Å; I670-V712 HydrophobicContact CG2-CG1 4Å; I670-V712 HydrophobicContact CG2-CG2 3.67Å; I670-L1528 HydrophobicContact CD1-CB 4.28Å; I670-L1528 HydrophobicContact CD1-CD1 3.95Å; I670-L1528 HydrophobicContact CD1-CG 4.27Å; I670-M1548 HydrophobicContact CB-CE 4.46Å; I670-M1548 HydrophobicContact CG2-CE 4.26Å
671	K	74.7	Confident	84.6	Confident	130 Å²	130	30.1 Å²	30.1	57%	0.565	14%	0.138	S	C	*	.	S	Bend	trans	-69.8	-42	-176	-170	-176.3	175.8	178.6	0	113.3	L669 I1525	L669-K671 HydrophobicContact CD1-CB 4.17Å; L669-K671 HydrophobicContact CG-CB 4.32Å; K671-I1525 PolarHBondContact O-N 3.22Å
672	N	73.3	Confident	84.8	Confident	56 Å²	56	29.8 Å²	29.8	30%	0.299	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	154.4	-179.2	-66.6	25.2	0	0	0	109.9	P674 M1523 I1525	N672-P674 CarbonylContact O-C 3.56Å; N672-M1523 CarbonylContact C-O 3.57Å; N672-M1523 VanDerWaalsContact CA-O 3.25Å; N672-M1523 WeakPolarHBondContact CA-O 3.39Å; N672-I1525 VanDerWaalsContact C-CD1 3.47Å; N672-I1525 WeakPolarHBondContact O-CD1 3.24Å
673	H	68.4	Low	84.5	Confident	20 Å²	20	30.4 Å²	30.4	9%	0.093	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	139.3	162.4	-177	-71.2	0	0	0	108.4	D1522 M1523 I1525 D1551	H673-D1522 CarbonylContact O-C 3.4Å; H673-D1522 WeakPolarHBondContact O-CA 3.49Å; H673-M1523 HydrophobicContact CB-CB 4.47Å; H673-M1523 PolarHBondContact N-O 3.42Å; H673-M1523 PolarHBondContact O-N 3.05Å; H673-I1525 HydrophobicContact CB-CD1 3.89Å; H673-I1525 HydrophobicContact CB-CG1 3.83Å; H673-D1551 IonicContact CD2-OD2 3.45Å; H673-D1551 IonicContact CE1-OD2 3.36Å; H673-D1551 IonicContact NE2-OD2 3.48Å; H673-D1551 PolarHBondContact NE2-OD2 3.04Å
674	P	70.5	Confident	83.8	Confident	41 Å²	41	35.8 Å²	35.8	27%	0.266	16%	0.164	S	C	.	.	S	Bend	cis	-70.1	151.9	-6.1	29.4	-35.4	0	0	0	112.3	N672	N672-P674 CarbonylContact O-C 3.56Å
675	L	75.6	Confident	82.6	Confident	16 Å²	16	38.4 Å²	38.4	8%	0.084	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-63.8	153.1	-177.4	-71.1	179.2	0	0	0	112.8	V668 L669 I670 I1525 M1548 Q1552	V668-L675 HydrophobicContact CG1-CB 4.1Å; V668-L675 HydrophobicContact CG1-CD1 4.07Å; V668-L675 HydrophobicContact CG1-CD2 4.29Å; V668-L675 HydrophobicContact CG1-CG 4.41Å; L669-L675 WeakPolarHBondContact O-CD2 3.43Å; I670-L675 HydrophobicContact CB-CD2 4.12Å; I670-L675 HydrophobicContact CG2-CD2 3.87Å; L675-I1525 HydrophobicContact CD2-CD1 3.88Å; L675-M1548 HydrophobicContact CD1-CB 4.05Å; L675-M1548 HydrophobicContact CD1-CE 3.93Å; L675-M1548 HydrophobicContact CD2-CE 3.98Å; L675-M1548 HydrophobicContact CG-CE 4.32Å; L675-Q1552 HydrophobicContact CB-CG 4.12Å; L675-Q1552 HydrophobicContact CD1-CG 4.03Å
676	R	81.7	Confident	81.3	Confident	129 Å²	129	41.5 Å²	41.5	49%	0.487	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127	-176.2	-56.6	-174.1	-174.1	-175.3	0.8	111.5	L669 H678 D1522	L669-R676 PolarHBondContact N-O 3.31Å; R676-H678 PolarHBondContact O-N 3.27Å; R676-H678 VanDerWaalsContact O-N 3.15Å; R676-D1522 IonicContact CZ-OD1 2.85Å; R676-D1522 IonicContact CZ-OD2 3.39Å; R676-D1522 IonicContact NH2-OD1 3.17Å; R676-D1522 PolarHBondContact NH2-OD1 3.02Å; R676-D1522 IonicContact NH2-OD2 2.68Å; R676-D1522 PolarHBondContact NH2-OD2 2.94Å
677	L	86.5	Confident	80.6	Confident	13 Å²	13	49.8 Å²	49.8	7%	0.068	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	105.5	173.2	178.7	66.2	0	0	0	110.1	V668 M717 A718 D724 R1559	V668-L677 HydrophobicContact CG2-CD1 4.39Å; L677-M717 HydrophobicContact CB-CB 4.3Å; L677-M717 HydrophobicContact CB-CE 3.76Å; L677-M717 HydrophobicContact CB-SD 3.83Å; L677-M717 HydrophobicContact CD1-CB 4.15Å; L677-A718 HydrophobicContact CD1-CB 4.09Å; L677-A718 HydrophobicContact CD2-CB 3.58Å; L677-D724 HydrophobicContact CD2-CB 4.48Å; L677-R1559 HydrophobicContact CB-CG 4.12Å; L677-R1559 HydrophobicContact CD2-CG 4.09Å; L677-R1559 PolarHBondContact O-NH2 3.31Å
678	H	90	Very high	80.4	Confident	48 Å²	48	53 Å²	53	22%	0.222	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	140.8	169.9	-163.5	85.5	0	0	0	110	S667 L669 R676 F680 Y711	S667-H678 PolarHBondContact N-O 3.07Å; S667-H678 CarbonylContact O-C 3.57Å; S667-H678 WeakPolarHBondContact O-CA 3.43Å; S667-H678 WeakPolarHBondContact O-CB 3.19Å; S667-H678 PolarHBondContact O-N 2.87Å; L669-H678 HydrophobicContact CB-CB 4.43Å; R676-H678 PolarHBondContact O-N 3.27Å; R676-H678 VanDerWaalsContact O-N 3.15Å; H678-F680 AromaticContact CD2-CD1 3.72Å; H678-F680 AromaticContact CD2-CD2 3.94Å; H678-F680 AromaticContact CD2-CE1 3.57Å; H678-F680 AromaticContact CD2-CE2 3.82Å; H678-F680 AromaticContact CD2-CG 3.91Å; H678-F680 AromaticContact CD2-CZ 3.62Å; H678-F680 AromaticContact NE2-CD1 3.58Å; H678-F680 AromaticContact NE2-CE1 3.47Å; H678-F680 WeakPolarHBondContact NE2-CE1 3.32Å; H678-F680 AromaticContact NE2-CZ 3.99Å; H678-Y711 HydrophobicContact CB-CE1 4.19Å; H678-Y711 AromaticContact CD2-CE1 3.95Å; H678-Y711 AromaticContact CG-CE1 3.9Å
679	I	90.4	Very high	80.6	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.015	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	115.8	173.9	-68.5	-177.9	0	0	0	107	V664 I665 R681 D724 R1559	V664-I679 HydrophobicContact CG1-CG2 3.62Å; I665-I679 WeakPolarHBondContact O-CA 3.18Å; I679-R681 HydrophobicContact CG2-CG 3.94Å; I679-R681 PolarHBondContact O-NH1 2.9Å; I679-D724 HydrophobicContact CD1-CB 4.34Å; I679-R1559 VanDerWaalsContact CD1-NH2 3.31Å
680	F	91.6	Very high	80.8	Confident	8 Å²	8	54.2 Å²	54.2	4%	0.035	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	133.7	170.1	-61.7	-78.5	0	0	0	109.1	M655 I665 H678 L685 L688 V693 C696 Y711	M655-F680 HydrophobicContact CE-CB 4.32Å; I665-F680 HydrophobicContact CB-CB 4.28Å; I665-F680 HydrophobicContact CG2-CD2 4.41Å; I665-F680 PolarHBondContact N-O 3.14Å; I665-F680 PolarHBondContact O-N 2.97Å; H678-F680 AromaticContact CD2-CD1 3.72Å; H678-F680 AromaticContact CD2-CD2 3.94Å; H678-F680 AromaticContact CD2-CE1 3.57Å; H678-F680 AromaticContact CD2-CE2 3.82Å; H678-F680 AromaticContact CD2-CG 3.91Å; H678-F680 AromaticContact CD2-CZ 3.62Å; H678-F680 AromaticContact NE2-CD1 3.58Å; H678-F680 AromaticContact NE2-CE1 3.47Å; H678-F680 WeakPolarHBondContact NE2-CE1 3.32Å; H678-F680 AromaticContact NE2-CZ 3.99Å; F680-L685 HydrophobicContact CD1-CD1 4.33Å; F680-L688 HydrophobicContact CD1-CD1 3.88Å; F680-L688 HydrophobicContact CE1-CD1 4.06Å; F680-V693 HydrophobicContact CB-CG1 3.67Å; F680-V693 HydrophobicContact CD1-CG1 4.26Å; F680-V693 HydrophobicContact CD1-CG2 3.99Å; F680-V693 HydrophobicContact CD2-CG1 3.71Å; F680-V693 HydrophobicContact CE1-CG2 4.31Å; F680-V693 HydrophobicContact CE2-CG1 4.37Å; F680-V693 HydrophobicContact CG-CG1 3.63Å; F680-V693 HydrophobicContact CG-CG2 4.21Å; F680-C696 HydrophobicContact CE2-CB 3.89Å; F680-C696 HydrophobicContact CZ-CB 4.11Å; F680-Y711 HydrophobicContact CE1-CE1 4.42Å; F680-Y711 HydrophobicContact CE2-CD1 4.41Å; F680-Y711 HydrophobicContact CE2-CE1 4.44Å; F680-Y711 AromaticContact CZ-CD1 3.96Å; F680-Y711 HydrophobicContact CZ-CD1 3.96Å; F680-Y711 AromaticContact CZ-CE1 3.71Å; F680-Y711 HydrophobicContact CZ-CE1 3.71Å
681	R	90.2	Very high	81.4	Confident	38 Å²	38	55.4 Å²	55.4	14%	0.143	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	130.4	-174.5	-55.3	167.6	-175.7	90	10.3	109.5	I679 Y683 Q684 L685 E728	I679-R681 HydrophobicContact CG2-CG 3.94Å; I679-R681 PolarHBondContact O-NH1 2.9Å; R681-Y683 VanDerWaalsContact C-N 3.26Å; R681-Y683 HydrophobicContact CB-CD1 4.17Å; R681-Y683 HydrophobicContact CB-CD2 4.45Å; R681-Y683 HydrophobicContact CB-CE1 3.92Å; R681-Y683 HydrophobicContact CB-CE2 4.23Å; R681-Y683 HydrophobicContact CB-CG 4.42Å; R681-Y683 HydrophobicContact CG-CE1 4.23Å; R681-Y683 HydrophobicContact CG-CE2 4.32Å; R681-Y683 PolarHBondContact O-N 3.39Å; R681-Q684 HydrophobicContact CB-CB 4.07Å; R681-Q684 PolarHBondContact O-N 3.26Å; R681-L685 PolarHBondContact O-N 2.9Å; R681-E728 IonicContact CZ-OE1 2.71Å; R681-E728 IonicContact CZ-OE2 3.76Å; R681-E728 IonicContact NE-OE1 3.4Å; R681-E728 PolarHBondContact NE-OE1 2.67Å; R681-E728 IonicContact NE-OE2 2.77Å; R681-E728 PolarHBondContact NE-OE2 3.17Å; R681-E728 IonicContact NH2-OE1 2.68Å; R681-E728 PolarHBondContact NH2-OE1 2.89Å; R681-E728 IonicContact NH2-OE2 2.87Å; R681-E728 PolarHBondContact NH2-OE2 2.89Å
682	N	88.1	Confident	82.2	Confident	19 Å²	19	52.5 Å²	52.5	10%	0.102	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-29.6	174.7	64.9	-40.4	0	0	0	113.2	M655 V658 K661 L663 Q684	M655-N682 HydrophobicContact CB-CB 4.43Å; M655-N682 HydrophobicContact CE-CB 4.19Å; M655-N682 VanDerWaalsContact O-CB 3.31Å; M655-N682 WeakPolarHBondContact O-CB 3.35Å; V658-N682 HydrophobicContact CB-CB 4.38Å; V658-N682 PolarHBondContact O-ND2 2.85Å; K661-N682 PolarHBondContact O-ND2 2.68Å; L663-N682 HydrophobicContact CB-CB 4.47Å; L663-N682 PolarHBondContact N-OD1 3.41Å; L663-N682 PolarHBondContact O-N 3.44Å; L663-N682 PolarHBondContact O-OD1 2.81Å; N682-Q684 VanDerWaalsContact C-N 3.3Å; N682-Q684 PolarHBondContact O-N 3.26Å
683	Y	83.6	Confident	83.1	Confident	67 Å²	67	50 Å²	50	26%	0.263	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	9.6	178.9	59.5	-92.2	0	0	0	114.8	W578 K662 R681 E728 Y732	W578-Y683 HydrophobicContact CH2-CE1 4.09Å; W578-Y683 HydrophobicContact CZ3-CE1 4.18Å; K662-Y683 HydrophobicContact CB-CD1 4.47Å; K662-Y683 HydrophobicContact CB-CE1 4.46Å; K662-Y683 HydrophobicContact CD-CD1 3.65Å; K662-Y683 HydrophobicContact CD-CE1 4.22Å; K662-Y683 HydrophobicContact CD-CG 4.22Å; R681-Y683 VanDerWaalsContact C-N 3.26Å; R681-Y683 HydrophobicContact CB-CD1 4.17Å; R681-Y683 HydrophobicContact CB-CD2 4.45Å; R681-Y683 HydrophobicContact CB-CE1 3.92Å; R681-Y683 HydrophobicContact CB-CE2 4.23Å; R681-Y683 HydrophobicContact CB-CG 4.42Å; R681-Y683 HydrophobicContact CG-CE1 4.23Å; R681-Y683 HydrophobicContact CG-CE2 4.32Å; R681-Y683 PolarHBondContact O-N 3.39Å; Y683-E728 WeakPolarHBondContact OH-CG 3.46Å; Y683-E728 PolarHBondContact OH-OE1 3.09Å; Y683-Y732 HydrophobicContact CD2-CD2 4.15Å; Y683-Y732 HydrophobicContact CD2-CE2 4.34Å; Y683-Y732 AromaticContact CE2-CD2 3.86Å; Y683-Y732 HydrophobicContact CE2-CD2 3.86Å; Y683-Y732 HydrophobicContact CE2-CE2 4.49Å
684	Q	76	Confident	84.1	Confident	114 Å²	114	49 Å²	49	53%	0.533	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135	-29.9	177.5	-165.1	-177	22.5	0	0	113.7	R681 N682 P686	R681-Q684 HydrophobicContact CB-CB 4.07Å; R681-Q684 PolarHBondContact O-N 3.26Å; N682-Q684 VanDerWaalsContact C-N 3.3Å; N682-Q684 PolarHBondContact O-N 3.26Å; Q684-P686 WeakPolarHBondContact O-CD 3.19Å
685	L	68.1	Low	85.1	Confident	56 Å²	56	47.2 Å²	47.2	29%	0.293	22%	0.221	S	C	.	.			trans	-125.9	67.8	-172.2	-63.8	170.2	0	0	0	110.7	M655 F680 R681 E687 L688	M655-L685 WeakPolarHBondContact CB-O 3.26Å; F680-L685 HydrophobicContact CD1-CD1 4.33Å; R681-L685 PolarHBondContact O-N 2.9Å; L685-E687 PolarHBondContact O-N 3.22Å; L685-L688 HydrophobicContact CB-CD1 3.79Å; L685-L688 HydrophobicContact CB-CG 4.15Å; L685-L688 HydrophobicContact CD1-CD1 3.85Å; L685-L688 HydrophobicContact CG-CD1 4.32Å
686	P	65.3	Low	85.8	Confident	65 Å²	65	46.7 Å²	46.7	42%	0.422	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-44.6	-167	21.2	-32.4	0	0	0	113.8	T654 M655 A656 Q684 L688	T654-P686 WeakPolarHBondContact CB-O 3.14Å; M655-P686 PolarHBondContact N-O 3.37Å; A656-P686 HydrophobicContact CB-CB 3.75Å; A656-P686 WeakPolarHBondContact CB-O 3.16Å; A656-P686 PolarHBondContact N-O 2.7Å; Q684-P686 WeakPolarHBondContact O-CD 3.19Å; P686-L688 VanDerWaalsContact C-N 3.33Å; P686-L688 PolarHBondContact O-N 2.96Å
687	E	78.9	Confident	86.3	Confident	175 Å²	175	40.5 Å²	40.5	82%	0.818	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-7.1	-169	-60.5	180	169.6	0	0	114.9	L685 L689	L685-E687 PolarHBondContact O-N 3.22Å; E687-L689 PolarHBondContact O-N 2.64Å
688	L	87.3	Confident	86.2	Confident	69 Å²	69	40.3 Å²	40.3	36%	0.361	19%	0.194	S	C	.	.	S	Bend	trans	-69	129.1	-177.2	-70.7	-175.8	0	0	0	111.7	T654 M655 F680 L685 P686 L690 V693	T654-L688 CarbonylContact C-O 3.59Å; T654-L688 VanDerWaalsContact CA-O 3.28Å; T654-L688 WeakPolarHBondContact CA-O 3.48Å; M655-L688 HydrophobicContact CG-CB 4.02Å; M655-L688 WeakPolarHBondContact CG-O 3.25Å; M655-L688 PolarHBondContact N-O 3.43Å; F680-L688 HydrophobicContact CD1-CD1 3.88Å; F680-L688 HydrophobicContact CE1-CD1 4.06Å; L685-L688 HydrophobicContact CB-CD1 3.79Å; L685-L688 HydrophobicContact CB-CG 4.15Å; L685-L688 HydrophobicContact CD1-CD1 3.85Å; L685-L688 HydrophobicContact CG-CD1 4.32Å; P686-L688 VanDerWaalsContact C-N 3.33Å; P686-L688 PolarHBondContact O-N 2.96Å; L688-L690 PolarHBondContact O-N 2.88Å; L688-V693 HydrophobicContact CB-CG2 4.02Å; L688-V693 HydrophobicContact CD1-CG2 4.26Å
689	L	90.9	Very high	85.7	Confident	64 Å²	64	38 Å²	38	34%	0.335	18%	0.183	S	C	.	.	B	Isolated β-bridge	trans	-62	119.9	175.4	-67.1	173.6	0	0	0	111.1	E687 W691 K692 V693	E687-L689 PolarHBondContact O-N 2.64Å; L689-W691 VanDerWaalsContact C-N 3.32Å; L689-W691 HydrophobicContact CD1-CZ2 4.2Å; L689-W691 PolarHBondContact O-N 3.19Å; L689-K692 HydrophobicContact CB-CB 4.21Å; L689-K692 WeakPolarHBondContact O-CA 3.31Å; L689-K692 WeakPolarHBondContact O-CB 3.49Å; L689-K692 PolarHBondContact O-N 2.83Å; L689-V693 PolarHBondContact O-N 2.93Å
690	L	89	Confident	85.1	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62	-37.3	-172.6	-177.6	57.6	0	0	0	112.3	T590 L594 V649 T653 M655 V658 L663 L688 K692 V693 L694	T590-L690 HydrophobicContact CG2-CD1 3.85Å; T590-L690 HydrophobicContact CG2-CD2 3.72Å; T590-L690 HydrophobicContact CG2-CG 4Å; L594-L690 HydrophobicContact CD1-CD2 4.08Å; L594-L690 HydrophobicContact CD2-CD2 4.49Å; V649-L690 HydrophobicContact CB-CD2 4.06Å; V649-L690 HydrophobicContact CB-CG 4.36Å; V649-L690 HydrophobicContact CG1-CD2 4.14Å; V649-L690 HydrophobicContact CG1-CG 4.36Å; V649-L690 HydrophobicContact CG2-CB 4.29Å; V649-L690 HydrophobicContact CG2-CD2 4.41Å; V649-L690 HydrophobicContact CG2-CG 4.22Å; T653-L690 HydrophobicContact CG2-CB 4.49Å; T653-L690 HydrophobicContact CG2-CD2 3.95Å; T653-L690 WeakPolarHBondContact O-CB 3.18Å; T653-L690 PolarHBondContact O-N 2.82Å; M655-L690 HydrophobicContact SD-CD1 3.49Å; M655-L690 WeakPolarHBondContact SD-CD1 3.47Å; V658-L690 HydrophobicContact CG2-CD2 4.13Å; L663-L690 HydrophobicContact CD2-CD1 4.38Å; L688-L690 PolarHBondContact O-N 2.88Å; L690-K692 VanDerWaalsContact C-N 3.28Å; L690-K692 PolarHBondContact O-N 2.78Å; L690-V693 PolarHBondContact O-N 3.45Å; L690-L694 WeakPolarHBondContact O-CB 3.42Å; L690-L694 WeakPolarHBondContact O-CG 3.43Å; L690-L694 PolarHBondContact O-N 3.02Å
691	W	90.2	Very high	83.8	Confident	32 Å²	32	40.2 Å²	40.2	12%	0.121	20%	0.2	C	C	.	.	H	α-helix	trans	-65.2	-31.4	174.3	71.8	-99.2	0	0	0	112.3	E642 L645 K646 V649 P651 L689 R695	E642-W691 HydrophobicContact CB-CZ3 4.27Å; E642-W691 HydrophobicContact CG-CE3 4.42Å; E642-W691 HydrophobicContact CG-CZ3 3.93Å; E642-W691 WeakPolarHBondContact OE2-CZ3 3.26Å; L645-W691 HydrophobicContact CB-CB 4.04Å; K646-W691 HydrophobicContact CD-CD2 4.28Å; K646-W691 HydrophobicContact CD-CE3 4.39Å; K646-W691 VanDerWaalsContact CE-CE3 3.44Å; K646-W691 VanDerWaalsContact CE-CZ2 3.42Å; K646-W691 HydrophobicContact CG-CB 4.29Å; K646-W691 HydrophobicContact CG-CD2 3.62Å; K646-W691 HydrophobicContact CG-CE3 4.06Å; K646-W691 HydrophobicContact CG-CG 3.72Å; V649-W691 HydrophobicContact CG2-CB 3.8Å; P651-W691 VanDerWaalsContact O-CD1 3.3Å; P651-W691 PolarHBondContact O-NE1 2.92Å; L689-W691 VanDerWaalsContact C-N 3.32Å; L689-W691 HydrophobicContact CD1-CZ2 4.2Å; L689-W691 PolarHBondContact O-N 3.19Å; W691-R695 WeakPolarHBondContact O-CB 3.39Å; W691-R695 PolarHBondContact O-N 3.2Å
692	K	91.2	Very high	82.5	Confident	69 Å²	69	41.2 Å²	41.2	30%	0.3	21%	0.211	S	C	.	.	H	α-helix	trans	-75.8	-40.8	177.9	-165.3	176.9	-172.6	-176	0	111	L689 L690 L694 R695 C696 D708	L689-K692 HydrophobicContact CB-CB 4.21Å; L689-K692 WeakPolarHBondContact O-CA 3.31Å; L689-K692 WeakPolarHBondContact O-CB 3.49Å; L689-K692 PolarHBondContact O-N 2.83Å; L690-K692 VanDerWaalsContact C-N 3.28Å; L690-K692 PolarHBondContact O-N 2.78Å; K692-L694 VanDerWaalsContact C-N 3.31Å; K692-L694 PolarHBondContact O-N 3.1Å; K692-R695 WeakPolarHBondContact O-CB 3.38Å; K692-R695 PolarHBondContact O-N 2.89Å; K692-R695 VanDerWaalsContact O-N 3.09Å; K692-C696 PolarHBondContact O-N 3.4Å; K692-C696 PolarHBondContact O-SG 3.49Å; K692-C696 VanDerWaalsContact O-SG 3.34Å; K692-D708 WeakPolarHBondContact CE-OD1 3.29Å; K692-D708 WeakPolarHBondContact CE-OD2 3.39Å; K692-D708 IonicContact NZ-OD1 2.62Å; K692-D708 PolarHBondContact NZ-OD1 2.72Å; K692-D708 IonicContact NZ-OD2 3.85Å; K692-D708 PolarHBondContact NZ-OD2 3.32Å
693	V	91.3	Very high	81.6	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.024	21%	0.21	C	C	.	.	H	α-helix	trans	-57.3	-44.9	170.2	171.3	0	0	0	0	111	M655 I665 F680 L688 L689 L690 R695 C696 T697	M655-V693 HydrophobicContact CG-CG2 4.08Å; M655-V693 HydrophobicContact SD-CB 4.12Å; M655-V693 HydrophobicContact SD-CG1 3.92Å; M655-V693 HydrophobicContact SD-CG2 3.99Å; I665-V693 HydrophobicContact CB-CG1 4.25Å; I665-V693 HydrophobicContact CD1-CG1 3.88Å; I665-V693 HydrophobicContact CG2-CG1 4.06Å; F680-V693 HydrophobicContact CB-CG1 3.67Å; F680-V693 HydrophobicContact CD1-CG1 4.26Å; F680-V693 HydrophobicContact CD1-CG2 3.99Å; F680-V693 HydrophobicContact CD2-CG1 3.71Å; F680-V693 HydrophobicContact CE1-CG2 4.31Å; F680-V693 HydrophobicContact CE2-CG1 4.37Å; F680-V693 HydrophobicContact CG-CG1 3.63Å; F680-V693 HydrophobicContact CG-CG2 4.21Å; L688-V693 HydrophobicContact CB-CG2 4.02Å; L688-V693 HydrophobicContact CD1-CG2 4.26Å; L689-V693 PolarHBondContact O-N 2.93Å; L690-V693 PolarHBondContact O-N 3.45Å; V693-R695 VanDerWaalsContact C-N 3.34Å; V693-R695 PolarHBondContact O-N 3.47Å; V693-C696 WeakPolarHBondContact O-CB 3.44Å; V693-C696 PolarHBondContact O-N 2.96Å; V693-T697 PolarHBondContact O-N 3.02Å; V693-T697 VanDerWaalsContact O-N 3.17Å
694	L	90.7	Very high	81.2	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-63.9	-35	173.8	-74.5	171.7	0	0	0	113	A586 L587 T590 L645 V649 I665 L690 K692 T697 T698	A586-L694 HydrophobicContact CB-CD2 4.21Å; L587-L694 HydrophobicContact CB-CD2 4.38Å; L587-L694 HydrophobicContact CD1-CD1 3.99Å; T590-L694 HydrophobicContact CG2-CD1 4.22Å; L645-L694 HydrophobicContact CD1-CB 4.05Å; L645-L694 HydrophobicContact CD2-CB 3.84Å; L645-L694 HydrophobicContact CD2-CD1 4.12Å; V649-L694 HydrophobicContact CG1-CD1 3.84Å; I665-L694 HydrophobicContact CD1-CD2 4.26Å; L690-L694 WeakPolarHBondContact O-CB 3.42Å; L690-L694 WeakPolarHBondContact O-CG 3.43Å; L690-L694 PolarHBondContact O-N 3.02Å; K692-L694 VanDerWaalsContact C-N 3.31Å; K692-L694 PolarHBondContact O-N 3.1Å; L694-T697 HydrophobicContact CD2-CG2 4.42Å; L694-T697 WeakPolarHBondContact O-CG2 3.44Å; L694-T698 WeakPolarHBondContact O-CB 3.43Å; L694-T698 WeakPolarHBondContact O-CG2 3.4Å; L694-T698 PolarHBondContact O-N 3.46Å; L694-T698 VanDerWaalsContact O-N 3.17Å; L694-T698 PolarHBondContact O-OG1 3.32Å
695	R	90.6	Very high	81	Confident	3 Å²	3	35.7 Å²	35.7	1%	0.011	19%	0.191	C	C	.	.	H	α-helix	trans	-69.2	-32.3	174.4	-178.8	58.1	-169.6	82.4	2	112.3	S638 E642 L645 W691 K692 V693 A699 S705 V707	S638-R695 PolarHBondContact OG-NH2 2.98Å; E642-R695 HydrophobicContact CG-CG 3.9Å; L645-R695 HydrophobicContact CD1-CB 3.85Å; W691-R695 WeakPolarHBondContact O-CB 3.39Å; W691-R695 PolarHBondContact O-N 3.2Å; K692-R695 WeakPolarHBondContact O-CB 3.38Å; K692-R695 PolarHBondContact O-N 2.89Å; K692-R695 VanDerWaalsContact O-N 3.09Å; V693-R695 VanDerWaalsContact C-N 3.34Å; V693-R695 PolarHBondContact O-N 3.47Å; R695-A699 PolarHBondContact O-N 2.72Å; R695-S705 PolarHBondContact NH2-O 3.49Å; R695-V707 HydrophobicContact CG-CG2 3.85Å
696	C	90.8	Very high	81.3	Confident	4 Å²	4	33.5 Å²	33.5	3%	0.027	18%	0.18	C	C	.	.	H	α-helix	trans	-66.8	-47	173.9	-67.5	0	0	0	0	112.3	S667 F680 K692 V693 T698 A699 Y711 V712	S667-C696 PolarHBondContact OG-O 2.9Å; F680-C696 HydrophobicContact CE2-CB 3.89Å; F680-C696 HydrophobicContact CZ-CB 4.11Å; K692-C696 PolarHBondContact O-N 3.4Å; K692-C696 PolarHBondContact O-SG 3.49Å; K692-C696 VanDerWaalsContact O-SG 3.34Å; V693-C696 WeakPolarHBondContact O-CB 3.44Å; V693-C696 PolarHBondContact O-N 2.96Å; C696-T698 VanDerWaalsContact C-N 3.32Å; C696-T698 PolarHBondContact O-N 3.01Å; C696-A699 VanDerWaalsContact O-CB 3.29Å; C696-A699 WeakPolarHBondContact O-CB 3.3Å; C696-A699 PolarHBondContact O-N 3.38Å; C696-Y711 HydrophobicContact CB-CG 4.19Å; C696-V712 CarbonylContact O-C 3.56Å
697	T	90.8	Very high	81.7	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-71.9	-23.2	-179.9	-168.4	0	0	0	0	113.6	S583 A586 I665 T666 V693 L694 D713	S583-T697 WeakPolarHBondContact CA-O 3.37Å; S583-T697 WeakPolarHBondContact CB-O 3.47Å; S583-T697 PolarHBondContact N-OG1 3.21Å; A586-T697 HydrophobicContact CB-CG2 3.59Å; I665-T697 HydrophobicContact CG2-CG2 3.65Å; T666-T697 WeakPolarHBondContact O-CB 3.43Å; T666-T697 PolarHBondContact O-OG1 3.37Å; V693-T697 PolarHBondContact O-N 3.02Å; V693-T697 VanDerWaalsContact O-N 3.17Å; L694-T697 HydrophobicContact CD2-CG2 4.42Å; L694-T697 WeakPolarHBondContact O-CG2 3.44Å; T697-D713 VanDerWaalsContact O-CA 3.3Å; T697-D713 WeakPolarHBondContact O-CA 3.33Å; T697-D713 WeakPolarHBondContact O-CB 3.31Å
698	T	85.4	Confident	81.6	Confident	8 Å²	8	26.8 Å²	26.8	5%	0.049	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	8.2	176.5	53.6	0	0	0	0	114.1	M641 L694 C696 A700	M641-T698 HydrophobicContact CE-CG2 3.75Å; M641-T698 WeakPolarHBondContact CE-OG1 3.44Å; L694-T698 WeakPolarHBondContact O-CB 3.43Å; L694-T698 WeakPolarHBondContact O-CG2 3.4Å; L694-T698 PolarHBondContact O-N 3.46Å; L694-T698 VanDerWaalsContact O-N 3.17Å; L694-T698 PolarHBondContact O-OG1 3.32Å; C696-T698 VanDerWaalsContact C-N 3.32Å; C696-T698 PolarHBondContact O-N 3.01Å; T698-A700 PolarHBondContact O-N 3.46Å
699	A	79.7	Confident	80.8	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.149	C	C	.	.			trans	-77.9	59	-177.4	0	0	0	0	0	113.1	R695 C696 P701 V707 D713	R695-A699 PolarHBondContact O-N 2.72Å; C696-A699 VanDerWaalsContact O-CB 3.29Å; C696-A699 WeakPolarHBondContact O-CB 3.3Å; C696-A699 PolarHBondContact O-N 3.38Å; A699-P701 WeakPolarHBondContact O-CD 3.34Å; A699-V707 HydrophobicContact CB-CG2 4.06Å; A699-D713 PolarHBondContact O-N 2.91Å
700	A	76.7	Confident	80.3	Confident	13 Å²	13	27.3 Å²	27.3	11%	0.107	15%	0.149	C	C	.	.			trans	-67.1	113.6	-177	0	0	0	0	0	109.7	T698 T702 Y703 F704 D713	T698-A700 PolarHBondContact O-N 3.46Å; A700-T702 PolarHBondContact O-N 2.97Å; A700-Y703 HydrophobicContact CB-CD2 4.09Å; A700-Y703 WeakPolarHBondContact O-CA 3.41Å; A700-Y703 PolarHBondContact O-N 3.33Å; A700-F704 PolarHBondContact O-N 3.09Å; A700-D713 HydrophobicContact CB-CB 4.19Å
701	P	66.1	Low	80.1	Confident	44 Å²	44	29 Å²	29	29%	0.286	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-14.5	-162.5	26.1	-35.3	0	0	0	114.6	A699 Y703 L716	A699-P701 WeakPolarHBondContact O-CD 3.34Å; P701-Y703 VanDerWaalsContact C-N 3.33Å; P701-L716 HydrophobicContact CG-CD1 4.24Å
702	T	63	Low	79.8	Confident	60 Å²	60	27.5 Å²	27.5	37%	0.368	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	0.3	172.3	43.1	0	0	0	0	113.7	A700	A700-T702 PolarHBondContact O-N 2.97Å
703	Y	68.5	Low	79.6	Confident	21 Å²	21	24.9 Å²	24.9	8%	0.082	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.1	-40.1	-175.9	-66	-97.4	0	0	0	112.7	R634 P635 Y636 A700 P701 L826 D827	R634-Y703 VanDerWaalsContact CZ-CE1 3.43Å; P635-Y703 CarbonylContact C-O 3.5Å; P635-Y703 WeakPolarHBondContact CA-O 3.46Å; Y636-Y703 HydrophobicContact CD2-CD1 4.41Å; Y636-Y703 WeakPolarHBondContact CD2-O 3.02Å; Y636-Y703 HydrophobicContact CE2-CD1 4.11Å; Y636-Y703 PolarHBondContact N-O 3.12Å; A700-Y703 HydrophobicContact CB-CD2 4.09Å; A700-Y703 WeakPolarHBondContact O-CA 3.41Å; A700-Y703 PolarHBondContact O-N 3.33Å; P701-Y703 VanDerWaalsContact C-N 3.33Å; Y703-L826 HydrophobicContact CD2-CD1 4.19Å; Y703-L826 HydrophobicContact CE1-CB 4.09Å; Y703-L826 HydrophobicContact CE2-CB 4.25Å; Y703-L826 HydrophobicContact CE2-CD1 3.66Å; Y703-L826 HydrophobicContact CE2-CG 4.22Å; Y703-D827 HydrophobicContact CD1-CB 4.01Å; Y703-D827 HydrophobicContact CE1-CB 3.87Å; Y703-D827 VanDerWaalsContact CE1-CG 3.45Å
704	F	75.4	Confident	79.2	Confident	13 Å²	13	24.7 Å²	24.7	6%	0.057	14%	0.138	C	C	.	.	S	Bend	trans	-133	158.7	-176.5	-64.1	-80.2	0	0	0	111.6	I628 F629 Y636 M641 A700	I628-F704 HydrophobicContact CG2-CE1 4.24Å; I628-F704 HydrophobicContact CG2-CZ 3.76Å; F629-F704 HydrophobicContact CD1-CZ 4.42Å; F629-F704 AromaticContact CE1-CE2 3.88Å; F629-F704 HydrophobicContact CE1-CE2 3.88Å; F629-F704 AromaticContact CE1-CZ 3.58Å; F629-F704 HydrophobicContact CE1-CZ 3.58Å; F629-F704 HydrophobicContact CZ-CE2 4.24Å; F629-F704 HydrophobicContact CZ-CZ 4.13Å; Y636-F704 VanDerWaalsContact CB-CE1 3.5Å; Y636-F704 HydrophobicContact CG-CE1 4.44Å; M641-F704 HydrophobicContact CB-CE1 4.1Å; M641-F704 HydrophobicContact CB-CZ 4.46Å; A700-F704 PolarHBondContact O-N 3.09Å
705	S	71.1	Confident	78.8	Confident	50 Å²	50	25 Å²	25	35%	0.35	14%	0.141	S	C	.	.	P	Polyproline II helix	trans	-65.9	157.1	170.7	71	0	0	0	0	112.2	S638 R695	S638-S705 PolarHBondContact OG-OG 3.3Å; S638-S705 VanDerWaalsContact OG-OG 3.05Å; R695-S705 PolarHBondContact NH2-O 3.49Å
706	S	73.9	Confident	78.2	Confident	9 Å²	9	25.8 Å²	25.8	6%	0.063	15%	0.145	C	C	.	.	P	Polyproline II helix	trans	-65.1	154.4	168.6	71.1	0	0	0	0	111.2	Y711 N1529	S706-Y711 WeakPolarHBondContact CA-O 3.49Å; S706-Y711 WeakPolarHBondContact CB-O 3.19Å; S706-N1529 PolarHBondContact N-OD1 2.83Å; S706-N1529 VanDerWaalsContact N-OD1 3.15Å; S706-N1529 PolarHBondContact OG-ND2 2.73Å; S706-N1529 VanDerWaalsContact OG-ND2 3.09Å; S706-N1529 PolarHBondContact OG-OD1 3.07Å
707	V	75.5	Confident	77.8	Confident	12 Å²	12	27.3 Å²	27.3	7%	0.073	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-93.3	130.5	176.9	-170.7	0	0	0	0	109.3	R695 A699 N709 M710 Y711	R695-V707 HydrophobicContact CG-CG2 3.85Å; A699-V707 HydrophobicContact CB-CG2 4.06Å; V707-N709 PolarHBondContact O-N 3.43Å; V707-M710 PolarHBondContact O-N 2.82Å; V707-Y711 PolarHBondContact N-O 3.11Å; V707-Y711 PolarHBondContact O-N 3.41Å
708	D	75.7	Confident	77.6	Confident	87 Å²	87	27.5 Å²	27.5	47%	0.465	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	17.5	-178.9	-52.3	-33.3	0	0	0	115.5	K692 M710	K692-D708 WeakPolarHBondContact CE-OD1 3.29Å; K692-D708 WeakPolarHBondContact CE-OD2 3.39Å; K692-D708 IonicContact NZ-OD1 2.62Å; K692-D708 PolarHBondContact NZ-OD1 2.72Å; K692-D708 IonicContact NZ-OD2 3.85Å; K692-D708 PolarHBondContact NZ-OD2 3.32Å; D708-M710 HydrophobicContact CB-CB 4.49Å; D708-M710 PolarHBondContact O-N 3.5Å
709	N	70.3	Confident	77.7	Confident	78 Å²	78	27.8 Å²	27.8	42%	0.417	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	11	-164	-49.9	-73	0	0	0	114.6	V707 N1529	V707-N709 PolarHBondContact O-N 3.43Å; N709-N1529 VanDerWaalsContact OD1-CB 3.32Å; N709-N1529 WeakPolarHBondContact OD1-CB 3.29Å; N709-N1529 PolarHBondContact OD1-ND2 2.9Å
710	M	80.4	Confident	78.3	Confident	66 Å²	66	28.1 Å²	28.1	33%	0.325	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	-27.6	-170.8	-73.8	-176.3	60.5	0	0	114.3	L669 I670 V707 D708	L669-M710 CarbonylContact C-O 3.57Å; L669-M710 WeakPolarHBondContact CA-O 3.15Å; L669-M710 HydrophobicContact CD1-CB 4.24Å; L669-M710 HydrophobicContact CD1-CE 3.78Å; I670-M710 WeakPolarHBondContact CG1-O 3.48Å; I670-M710 PolarHBondContact N-O 3.33Å; V707-M710 PolarHBondContact O-N 2.82Å; D708-M710 HydrophobicContact CB-CB 4.49Å; D708-M710 PolarHBondContact O-N 3.5Å
711	Y	85.5	Confident	79.1	Confident	35 Å²	35	27.6 Å²	27.6	14%	0.137	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	138	-171.8	-62.5	-82.9	0	0	0	114	V668 L669 H678 F680 C696 S706 V707	V668-Y711 WeakPolarHBondContact O-CA 3.31Å; L669-Y711 HydrophobicContact CD1-CE1 4.13Å; H678-Y711 HydrophobicContact CB-CE1 4.19Å; H678-Y711 AromaticContact CD2-CE1 3.95Å; H678-Y711 AromaticContact CG-CE1 3.9Å; F680-Y711 HydrophobicContact CE1-CE1 4.42Å; F680-Y711 HydrophobicContact CE2-CD1 4.41Å; F680-Y711 HydrophobicContact CE2-CE1 4.44Å; F680-Y711 AromaticContact CZ-CD1 3.96Å; F680-Y711 HydrophobicContact CZ-CD1 3.96Å; F680-Y711 AromaticContact CZ-CE1 3.71Å; F680-Y711 HydrophobicContact CZ-CE1 3.71Å; C696-Y711 HydrophobicContact CB-CG 4.19Å; S706-Y711 WeakPolarHBondContact CA-O 3.49Å; S706-Y711 WeakPolarHBondContact CB-O 3.19Å; V707-Y711 PolarHBondContact N-O 3.11Å; V707-Y711 PolarHBondContact O-N 3.41Å
712	V	84.3	Confident	80.5	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.012	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	171.5	170	-57.6	0	0	0	0	111.4	S667 V668 I670 C696 L716	S667-V712 PolarHBondContact OG-O 3.37Å; V668-V712 HydrophobicContact CB-CG2 3.79Å; V668-V712 HydrophobicContact CG1-CG2 4.26Å; V668-V712 PolarHBondContact N-O 3.46Å; V668-V712 PolarHBondContact O-N 3.27Å; I670-V712 HydrophobicContact CD1-CG1 4.08Å; I670-V712 HydrophobicContact CG2-CB 4.45Å; I670-V712 HydrophobicContact CG2-CG1 4Å; I670-V712 HydrophobicContact CG2-CG2 3.67Å; C696-V712 CarbonylContact O-C 3.56Å; V712-L716 HydrophobicContact CG2-CD1 3.75Å
713	D	85.4	Confident	81.9	Confident	14 Å²	14	22.9 Å²	22.9	8%	0.075	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.4	135.4	-177.6	-167.6	-49.5	0	0	0	113.1	S583 T697 A699 A700 G715 L716	S583-D713 WeakPolarHBondContact CB-OD1 3.22Å; S583-D713 WeakPolarHBondContact CB-OD2 3.24Å; S583-D713 PolarHBondContact OG-OD2 2.99Å; T697-D713 VanDerWaalsContact O-CA 3.3Å; T697-D713 WeakPolarHBondContact O-CA 3.33Å; T697-D713 WeakPolarHBondContact O-CB 3.31Å; A699-D713 PolarHBondContact O-N 2.91Å; A700-D713 HydrophobicContact CB-CB 4.19Å; D713-G715 PolarHBondContact O-N 3.46Å; D713-G715 WeakPolarHBondContact OD1-CA 3.47Å; D713-G715 PolarHBondContact OD1-N 2.76Å; D713-L716 PolarHBondContact O-N 3.36Å
714	G	83.2	Confident	83.1	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-65	-18.3	179.5	0	0	0	0	0	113.8	L716 M717 A718	G714-L716 PolarHBondContact O-N 3.44Å; G714-M717 PolarHBondContact O-N 3.44Å; G714-A718 PolarHBondContact O-N 3.44Å
715	G	83.6	Confident	83.9	Confident	5 Å²	5	21.3 Å²	21.3	5%	0.052	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-65.2	-2.4	177.8	0	0	0	0	0	115.5	T582 D713 L791 T792	T582-G715 VanDerWaalsContact CG2-N 3.34Å; D713-G715 PolarHBondContact O-N 3.46Å; D713-G715 WeakPolarHBondContact OD1-CA 3.47Å; D713-G715 PolarHBondContact OD1-N 2.76Å; G715-L791 VanDerWaalsContact O-O 3.05Å; G715-T792 WeakPolarHBondContact O-CA 3.34Å; G715-T792 WeakPolarHBondContact O-CG2 3.39Å
716	L	78.1	Confident	85	Confident	20 Å²	20	19.4 Å²	19.4	11%	0.105	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-82	-15.1	166.8	-63	177.7	0	0	0	114	V668 P701 V712 D713 G714 L791	V668-L716 HydrophobicContact CG2-CB 4.18Å; P701-L716 HydrophobicContact CG-CD1 4.24Å; V712-L716 HydrophobicContact CG2-CD1 3.75Å; D713-L716 PolarHBondContact O-N 3.36Å; G714-L716 PolarHBondContact O-N 3.44Å; L716-L791 HydrophobicContact CD2-CD1 4.4Å; L716-L791 WeakPolarHBondContact O-CD2 3.48Å
717	M	81.1	Confident	85.9	Confident	37 Å²	37	19 Å²	19	18%	0.182	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.9	-22.1	-176.4	-70.8	-177.7	76.2	0	0	114.5	V668 L677 G714 Q1552 R1559 R1563	V668-M717 HydrophobicContact CB-SD 4.48Å; V668-M717 HydrophobicContact CG1-SD 3.93Å; V668-M717 HydrophobicContact CG2-CB 4.07Å; V668-M717 HydrophobicContact CG2-CG 3.82Å; V668-M717 HydrophobicContact CG2-SD 3.83Å; L677-M717 HydrophobicContact CB-CB 4.3Å; L677-M717 HydrophobicContact CB-CE 3.76Å; L677-M717 HydrophobicContact CB-SD 3.83Å; L677-M717 HydrophobicContact CD1-CB 4.15Å; G714-M717 PolarHBondContact O-N 3.44Å; M717-Q1552 PolarHBondContact SD-OE1 3.07Å; M717-R1559 HydrophobicContact CE-CG 4.3Å; M717-R1563 PolarHBondContact O-NH2 2.85Å
718	A	86.6	Confident	86.8	Confident	3 Å²	3	18.8 Å²	18.8	3%	0.025	10%	0.097	C	C	.	.			trans	-149	48.6	-174.1	0	0	0	0	0	111.9	T582 T666 L677 G714 N720 D724	T582-A718 WeakPolarHBondContact CG2-O 3.3Å; T582-A718 PolarHBondContact OG1-O 3.47Å; T666-A718 HydrophobicContact CG2-CB 4Å; L677-A718 HydrophobicContact CD1-CB 4.09Å; L677-A718 HydrophobicContact CD2-CB 3.58Å; G714-A718 PolarHBondContact O-N 3.44Å; A718-N720 VanDerWaalsContact C-N 3.26Å; A718-N720 CarbonylContact O-C 3.58Å; A718-N720 PolarHBondContact O-N 2.8Å; A718-D724 VanDerWaalsContact CB-OD2 3.31Å; A718-D724 WeakPolarHBondContact CB-OD2 3.49Å
719	N	88.7	Confident	87.6	Confident	14 Å²	14	14.9 Å²	14.9	8%	0.075	8%	0.077	C	C	.	.	S	Bend	trans	-62.7	-33.1	-176.2	-157.6	29.7	0	0	0	113.4	D548 G549 T792 T794	D548-N719 VanDerWaalsContact CA-O 3.26Å; D548-N719 WeakPolarHBondContact CA-O 3.44Å; G549-N719 WeakPolarHBondContact CA-OD1 3.41Å; G549-N719 PolarHBondContact N-O 3.09Å; G549-N719 PolarHBondContact N-OD1 3.04Å; N719-T792 PolarHBondContact ND2-O 2.86Å; N719-T794 HydrophobicContact CB-CG2 4.42Å; N719-T794 WeakPolarHBondContact ND2-CG2 3.48Å
720	N	91.7	Very high	88.6	Confident	8 Å²	8	11.9 Å²	11.9	4%	0.043	6%	0.06	C	C	.	.	S	Bend	trans	-102.3	110.7	158.5	175	-26.9	0	0	0	107.9	A718 S722 T794 V799 R815	A718-N720 VanDerWaalsContact C-N 3.26Å; A718-N720 CarbonylContact O-C 3.58Å; A718-N720 PolarHBondContact O-N 2.8Å; N720-S722 VanDerWaalsContact C-N 3.26Å; N720-S722 PolarHBondContact O-N 3.24Å; N720-S722 VanDerWaalsContact OD1-CB 3.29Å; N720-S722 WeakPolarHBondContact OD1-CB 3.22Å; N720-S722 PolarHBondContact OD1-N 3.2Å; N720-S722 VanDerWaalsContact OD1-N 3.09Å; N720-S722 PolarHBondContact OD1-OG 2.96Å; N720-T794 PolarHBondContact ND2-O 3.25Å; N720-V799 WeakPolarHBondContact ND2-CG2 3.29Å; N720-R815 PolarHBondContact ND2-NH1 2.76Å
721	P	94.1	Very high	89	Confident	1 Å²	1	12.9 Å²	12.9	1%	0.006	6%	0.06	C	C	.	.			trans	-81.3	7	-172	30.4	-33.6	0	0	0	114.5	A546 A580 T666 L723 D724 T725	A546-P721 HydrophobicContact CB-CG 4.21Å; A580-P721 HydrophobicContact CB-CB 4.41Å; A580-P721 HydrophobicContact CB-CG 4.4Å; T666-P721 HydrophobicContact CG2-CB 4.12Å; P721-L723 PolarHBondContact O-N 2.95Å; P721-D724 PolarHBondContact O-N 3.26Å; P721-T725 WeakPolarHBondContact O-CB 3.47Å; P721-T725 PolarHBondContact O-N 3.41Å; P721-T725 PolarHBondContact O-OG1 3.24Å
722	S	93.9	Very high	89.3	Confident	0 Å²	0	13 Å²	13	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-56.3	-51	-170.4	-54.5	0	0	0	0	113.2	N720 D724 T725 L726 S752	N720-S722 VanDerWaalsContact C-N 3.26Å; N720-S722 PolarHBondContact O-N 3.24Å; N720-S722 VanDerWaalsContact OD1-CB 3.29Å; N720-S722 WeakPolarHBondContact OD1-CB 3.22Å; N720-S722 PolarHBondContact OD1-N 3.2Å; N720-S722 VanDerWaalsContact OD1-N 3.09Å; N720-S722 PolarHBondContact OD1-OG 2.96Å; S722-D724 PolarHBondContact O-N 2.92Å; S722-T725 WeakPolarHBondContact O-CB 3.31Å; S722-T725 PolarHBondContact O-N 3.46Å; S722-L726 PolarHBondContact O-N 3.02Å; S722-L726 VanDerWaalsContact O-N 3.1Å; S722-S752 PolarHBondContact OG-OG 3.23Å
723	L	92.3	Very high	89.6	Confident	5 Å²	5	13.6 Å²	13.6	3%	0.026	6%	0.064	C	C	.	.	H	α-helix	trans	-63.6	-38.8	179.4	-69.9	172.4	0	0	0	113	P721 T725 T727 R801 A802 W805 R1563	P721-L723 PolarHBondContact O-N 2.95Å; L723-T725 VanDerWaalsContact C-N 3.3Å; L723-T727 WeakPolarHBondContact O-CB 3.16Å; L723-T727 PolarHBondContact O-N 3.44Å; L723-T727 PolarHBondContact O-OG1 3.11Å; L723-R801 HydrophobicContact CD1-CB 4.02Å; L723-R801 HydrophobicContact CD2-CB 3.96Å; L723-A802 HydrophobicContact CD2-CB 4.01Å; L723-A802 HydrophobicContact CG-CB 4.24Å; L723-W805 HydrophobicContact CD2-CE3 3.9Å; L723-W805 HydrophobicContact CD2-CZ3 4.32Å; L723-R1563 HydrophobicContact CB-CG 4.3Å
724	D	93.4	Very high	89.7	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.005	7%	0.071	C	C	.	.	H	α-helix	trans	-73.2	-25.8	178	-65.7	-68.7	0	0	0	112.1	L677 I679 A718 P721 S722 E728 R1559 R1563	L677-D724 HydrophobicContact CD2-CB 4.48Å; I679-D724 HydrophobicContact CD1-CB 4.34Å; A718-D724 VanDerWaalsContact CB-OD2 3.31Å; A718-D724 WeakPolarHBondContact CB-OD2 3.49Å; P721-D724 PolarHBondContact O-N 3.26Å; S722-D724 PolarHBondContact O-N 2.92Å; D724-E728 WeakPolarHBondContact O-CB 3.32Å; D724-E728 PolarHBondContact O-N 3.47Å; D724-R1559 WeakPolarHBondContact OD1-CD 3.48Å; D724-R1559 IonicContact OD1-CZ 3.56Å; D724-R1559 IonicContact OD1-NE 3.29Å; D724-R1559 IonicContact OD1-NH1 3.4Å; D724-R1559 PolarHBondContact OD1-NH1 3.42Å; D724-R1563 IonicContact OD1-CZ 2.65Å; D724-R1563 IonicContact OD1-NE 2.73Å; D724-R1563 PolarHBondContact OD1-NE 2.94Å; D724-R1563 IonicContact OD1-NH2 2.7Å; D724-R1563 PolarHBondContact OD1-NH2 3.43Å; D724-R1563 IonicContact OD2-CZ 2.84Å; D724-R1563 IonicContact OD2-NE 3.27Å; D724-R1563 IonicContact OD2-NH2 3.03Å; D724-R1563 PolarHBondContact OD2-NH2 3.37Å
725	T	93.8	Very high	89.9	Confident	1 Å²	1	17.3 Å²	17.3	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-70.5	-45	173.4	-49.5	0	0	0	0	111	V544 A580 P721 S722 L723 E728 I729 F750	V544-T725 HydrophobicContact CG1-CG2 3.67Å; A580-T725 HydrophobicContact CB-CG2 3.81Å; A580-T725 WeakPolarHBondContact CB-OG1 3.19Å; P721-T725 WeakPolarHBondContact O-CB 3.47Å; P721-T725 PolarHBondContact O-N 3.41Å; P721-T725 PolarHBondContact O-OG1 3.24Å; S722-T725 WeakPolarHBondContact O-CB 3.31Å; S722-T725 PolarHBondContact O-N 3.46Å; L723-T725 VanDerWaalsContact C-N 3.3Å; T725-E728 PolarHBondContact O-N 3.05Å; T725-I729 HydrophobicContact CG2-CD1 4.08Å; T725-I729 WeakPolarHBondContact O-CG1 3.46Å; T725-I729 PolarHBondContact O-N 2.82Å; T725-F750 HydrophobicContact CG2-CE2 4.22Å; T725-F750 HydrophobicContact CG2-CZ 4.25Å
726	L	93.7	Very high	90.1	Very high	10 Å²	10	17.8 Å²	17.8	5%	0.052	10%	0.095	C	C	.	.	H	α-helix	trans	-60.3	-46.1	173.1	-66.7	168.7	0	0	0	111.1	S722 E728 I729 H730 F750 W805	S722-L726 PolarHBondContact O-N 3.02Å; S722-L726 VanDerWaalsContact O-N 3.1Å; L726-E728 VanDerWaalsContact C-N 3.25Å; L726-E728 PolarHBondContact O-N 3.04Å; L726-I729 PolarHBondContact O-N 2.69Å; L726-H730 PolarHBondContact O-N 2.68Å; L726-F750 HydrophobicContact CD2-CD2 3.81Å; L726-F750 HydrophobicContact CD2-CE2 3.67Å; L726-F750 HydrophobicContact CG-CD2 4.38Å; L726-F750 HydrophobicContact CG-CE2 3.82Å; L726-F750 HydrophobicContact CG-CZ 4.46Å; L726-W805 HydrophobicContact CB-CD2 4.09Å; L726-W805 HydrophobicContact CB-CE3 3.86Å; L726-W805 HydrophobicContact CB-CH2 3.69Å; L726-W805 HydrophobicContact CB-CZ2 3.92Å; L726-W805 HydrophobicContact CB-CZ3 3.66Å; L726-W805 HydrophobicContact CD1-CB 4.24Å; L726-W805 HydrophobicContact CD1-CD2 3.78Å; L726-W805 HydrophobicContact CD1-CE3 3.68Å; L726-W805 HydrophobicContact CD1-CG 4.06Å; L726-W805 HydrophobicContact CD1-CZ3 4.31Å; L726-W805 HydrophobicContact CG-CE3 4.42Å
727	T	93.1	Very high	90.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.1	-35.6	175.2	-53.5	0	0	0	0	112.4	L723 R731 D1562 R1563 A1566	L723-T727 WeakPolarHBondContact O-CB 3.16Å; L723-T727 PolarHBondContact O-N 3.44Å; L723-T727 PolarHBondContact O-OG1 3.11Å; T727-R731 VanDerWaalsContact O-CG 3.3Å; T727-R731 WeakPolarHBondContact O-CG 3.47Å; T727-R731 PolarHBondContact O-N 3.25Å; T727-D1562 HydrophobicContact CG2-CB 4.38Å; T727-R1563 WeakPolarHBondContact OG1-CG 3.4Å; T727-A1566 HydrophobicContact CG2-CB 4.02Å
728	E	93.3	Very high	90.6	Very high	7 Å²	7	26.9 Å²	26.9	3%	0.033	14%	0.141	C	C	.	.	H	α-helix	trans	-79.7	-35.7	-179.4	-170.3	59.8	-137.7	0	0	112.8	W578 V664 R681 Y683 D724 T725 L726 R731 Y732	W578-E728 HydrophobicContact CZ3-CG 4.47Å; V664-E728 HydrophobicContact CG2-CG 4.45Å; R681-E728 IonicContact CZ-OE1 2.71Å; R681-E728 IonicContact CZ-OE2 3.76Å; R681-E728 IonicContact NE-OE1 3.4Å; R681-E728 PolarHBondContact NE-OE1 2.67Å; R681-E728 IonicContact NE-OE2 2.77Å; R681-E728 PolarHBondContact NE-OE2 3.17Å; R681-E728 IonicContact NH2-OE1 2.68Å; R681-E728 PolarHBondContact NH2-OE1 2.89Å; R681-E728 IonicContact NH2-OE2 2.87Å; R681-E728 PolarHBondContact NH2-OE2 2.89Å; Y683-E728 WeakPolarHBondContact OH-CG 3.46Å; Y683-E728 PolarHBondContact OH-OE1 3.09Å; D724-E728 WeakPolarHBondContact O-CB 3.32Å; D724-E728 PolarHBondContact O-N 3.47Å; T725-E728 PolarHBondContact O-N 3.05Å; L726-E728 VanDerWaalsContact C-N 3.25Å; L726-E728 PolarHBondContact O-N 3.04Å; E728-R731 PolarHBondContact O-N 3.14Å; E728-Y732 WeakPolarHBondContact O-CB 3.47Å; E728-Y732 PolarHBondContact O-N 2.79Å
729	I	92.4	Very high	90.5	Very high	6 Å²	6	29.5 Å²	29.5	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-44	172.1	-70.7	167.2	0	0	0	110.3	V544 W578 T725 L726 R731 Y732 N733 V745 V747	V544-I729 HydrophobicContact CG1-CD1 4.24Å; V544-I729 HydrophobicContact CG2-CD1 3.75Å; W578-I729 HydrophobicContact CD2-CD1 4.21Å; W578-I729 HydrophobicContact CD2-CG1 3.89Å; W578-I729 HydrophobicContact CE3-CD1 4.3Å; W578-I729 HydrophobicContact CE3-CG1 3.77Å; W578-I729 HydrophobicContact CG-CD1 4.43Å; W578-I729 HydrophobicContact CH2-CG1 4.08Å; W578-I729 HydrophobicContact CZ2-CG1 4.19Å; W578-I729 HydrophobicContact CZ3-CG1 3.86Å; T725-I729 HydrophobicContact CG2-CD1 4.08Å; T725-I729 WeakPolarHBondContact O-CG1 3.46Å; T725-I729 PolarHBondContact O-N 2.82Å; L726-I729 PolarHBondContact O-N 2.69Å; I729-R731 PolarHBondContact O-N 3.32Å; I729-Y732 WeakPolarHBondContact O-CB 3.26Å; I729-Y732 PolarHBondContact O-N 2.94Å; I729-N733 PolarHBondContact O-N 2.85Å; I729-V745 HydrophobicContact CG2-CB 4.07Å; I729-V745 HydrophobicContact CG2-CG1 3.86Å; I729-V747 HydrophobicContact CD1-CG2 4.07Å; I729-V747 HydrophobicContact CG2-CG2 4.23Å
730	H	91.1	Very high	90.2	Very high	14 Å²	14	36.2 Å²	36.2	7%	0.065	20%	0.199	C	C	.	.	H	α-helix	trans	-55.5	-50.6	172	171.7	57.9	0	0	0	111.8	L726 Y732 N733 C734 A1566 N1569 E1570	L726-H730 PolarHBondContact O-N 2.68Å; H730-Y732 VanDerWaalsContact C-N 3.29Å; H730-Y732 PolarHBondContact O-N 3.31Å; H730-N733 PolarHBondContact O-N 3.26Å; H730-N733 VanDerWaalsContact O-N 3.15Å; H730-C734 PolarHBondContact CE1-SG 2.82Å; H730-C734 PolarHBondContact O-N 3.27Å; H730-A1566 HydrophobicContact CB-CB 4.15Å; H730-A1566 VanDerWaalsContact CD2-CB 3.47Å; H730-A1566 WeakPolarHBondContact CD2-CB 3.37Å; H730-N1569 WeakPolarHBondContact CE1-CB 3.5Å; H730-N1569 WeakPolarHBondContact NE2-CB 3.1Å; H730-N1569 PolarHBondContact NE2-ND2 3.24Å; H730-E1570 WeakPolarHBondContact CA-OE1 3.41Å; H730-E1570 HydrophobicContact CB-CG 4.02Å; H730-E1570 WeakPolarHBondContact CB-OE1 3.2Å; H730-E1570 IonicContact CE1-OE1 2.7Å; H730-E1570 IonicContact CG-OE1 3.74Å; H730-E1570 IonicContact ND1-OE1 3.71Å; H730-E1570 PolarHBondContact ND1-OE1 2.82Å
731	R	89.8	Confident	89.4	Confident	87 Å²	87	43.1 Å²	43.1	33%	0.328	23%	0.231	S	C	.	.	H	α-helix	trans	-60.4	-37	177.8	-77.7	171.2	168.1	170.1	-3.9	113	T727 E728 I729 A735 D1562	T727-R731 VanDerWaalsContact O-CG 3.3Å; T727-R731 WeakPolarHBondContact O-CG 3.47Å; T727-R731 PolarHBondContact O-N 3.25Å; E728-R731 PolarHBondContact O-N 3.14Å; I729-R731 PolarHBondContact O-N 3.32Å; R731-A735 WeakPolarHBondContact O-CB 3.15Å; R731-A735 PolarHBondContact O-N 3.16Å; R731-D1562 IonicContact CZ-OD2 3.48Å; R731-D1562 IonicContact NH1-OD2 2.82Å; R731-D1562 IonicContact NH2-OD1 3.75Å; R731-D1562 PolarHBondContact NH2-OD1 2.82Å; R731-D1562 IonicContact NH2-OD2 3.52Å; R731-D1562 PolarHBondContact NH2-OD2 2.96Å
732	Y	91.2	Very high	88.5	Confident	38 Å²	38	46.2 Å²	46.2	15%	0.149	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-45.3	173.9	178.2	-89.9	0	0	0	111.5	W578 K662 Y683 E728 I729 H730 A735 V736 V745	W578-Y732 HydrophobicContact CH2-CD1 4.47Å; W578-Y732 HydrophobicContact CH2-CD2 4.27Å; W578-Y732 AromaticContact CH2-CG 3.96Å; W578-Y732 HydrophobicContact CH2-CG 3.96Å; W578-Y732 AromaticContact CZ2-CD1 4Å; W578-Y732 HydrophobicContact CZ2-CD1 4Å; W578-Y732 HydrophobicContact CZ2-CD2 4.35Å; W578-Y732 HydrophobicContact CZ2-CE1 4.46Å; W578-Y732 AromaticContact CZ2-CG 3.94Å; W578-Y732 HydrophobicContact CZ2-CG 3.94Å; K662-Y732 VanDerWaalsContact NZ-CE2 3.3Å; K662-Y732 PolarHBondContact NZ-OH 3.07Å; Y683-Y732 HydrophobicContact CD2-CD2 4.15Å; Y683-Y732 HydrophobicContact CD2-CE2 4.34Å; Y683-Y732 AromaticContact CE2-CD2 3.86Å; Y683-Y732 HydrophobicContact CE2-CD2 3.86Å; Y683-Y732 HydrophobicContact CE2-CE2 4.49Å; E728-Y732 WeakPolarHBondContact O-CB 3.47Å; E728-Y732 PolarHBondContact O-N 2.79Å; I729-Y732 WeakPolarHBondContact O-CB 3.26Å; I729-Y732 PolarHBondContact O-N 2.94Å; H730-Y732 VanDerWaalsContact C-N 3.29Å; H730-Y732 PolarHBondContact O-N 3.31Å; Y732-A735 PolarHBondContact O-N 2.95Å; Y732-V736 HydrophobicContact CD1-CG2 4.24Å; Y732-V736 HydrophobicContact CE1-CG2 3.78Å; Y732-V736 WeakPolarHBondContact O-CG2 3.21Å; Y732-V736 PolarHBondContact O-N 3.48Å; Y732-V745 HydrophobicContact CD1-CG2 3.81Å; Y732-V745 HydrophobicContact CE1-CG2 3.71Å
733	N	91.4	Very high	87.9	Confident	15 Å²	15	51.5 Å²	51.5	8%	0.08	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-46.9	177.6	-75.3	-13.5	0	0	0	111.7	I729 H730 A735 V736 E737 V745	I729-N733 PolarHBondContact O-N 2.85Å; H730-N733 PolarHBondContact O-N 3.26Å; H730-N733 VanDerWaalsContact O-N 3.15Å; N733-A735 VanDerWaalsContact C-N 3.32Å; N733-A735 PolarHBondContact O-N 3.02Å; N733-V736 PolarHBondContact O-N 3.42Å; N733-E737 WeakPolarHBondContact O-CG 3.27Å; N733-E737 PolarHBondContact O-N 2.94Å; N733-V745 PolarHBondContact ND2-O 3.21Å; N733-V745 VanDerWaalsContact ND2-O 3.17Å; N733-V745 PolarHBondContact OD1-N 3.3Å
734	C	86.6	Confident	87.6	Confident	35 Å²	35	57 Å²	57	24%	0.236	31%	0.311	C	S	.	.	H	α-helix	trans	-67.1	-29.3	175.5	-69.1	0	0	0	0	113.8	H730 E737 L738	H730-C734 PolarHBondContact CE1-SG 2.82Å; H730-C734 PolarHBondContact O-N 3.27Å; C734-E737 WeakPolarHBondContact CA-OE2 3.21Å; C734-E737 PolarHBondContact SG-OE2 3.18Å; C734-E737 VanDerWaalsContact SG-OE2 3.41Å; C734-L738 WeakPolarHBondContact O-CB 3.28Å; C734-L738 VanDerWaalsContact O-CG 3.24Å; C734-L738 WeakPolarHBondContact O-CG 3.47Å; C734-L738 PolarHBondContact O-N 3.19Å
735	A	87.2	Confident	87.3	Confident	56 Å²	56	57.6 Å²	57.6	46%	0.463	32%	0.315	S	S	.	.	H	α-helix	trans	-68.4	-39.6	172.7	0	0	0	0	0	111.8	R731 Y732 N733 L738 A739	R731-A735 WeakPolarHBondContact O-CB 3.15Å; R731-A735 PolarHBondContact O-N 3.16Å; Y732-A735 PolarHBondContact O-N 2.95Å; N733-A735 VanDerWaalsContact C-N 3.32Å; N733-A735 PolarHBondContact O-N 3.02Å; A735-L738 PolarHBondContact O-N 2.89Å; A735-A739 VanDerWaalsContact O-CB 3.29Å; A735-A739 WeakPolarHBondContact O-CB 3.3Å; A735-A739 PolarHBondContact O-N 3.18Å
736	V	88.1	Confident	86.9	Confident	15 Å²	15	61.6 Å²	61.6	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-42	173.3	167.9	0	0	0	0	111.2	Y732 N733 N740 E741 G742 K744	Y732-V736 HydrophobicContact CD1-CG2 4.24Å; Y732-V736 HydrophobicContact CE1-CG2 3.78Å; Y732-V736 WeakPolarHBondContact O-CG2 3.21Å; Y732-V736 PolarHBondContact O-N 3.48Å; N733-V736 PolarHBondContact O-N 3.42Å; V736-N740 WeakPolarHBondContact O-CA 3.47Å; V736-N740 PolarHBondContact O-N 2.72Å; V736-E741 PolarHBondContact O-N 3.34Å; V736-G742 WeakPolarHBondContact CG1-O 3.12Å; V736-K744 HydrophobicContact CG1-CG 4.29Å
737	E	84.8	Confident	86.6	Confident	91 Å²	91	62.1 Å²	62.1	43%	0.425	34%	0.337	S	S	.	.	H	α-helix	trans	-61	-49.9	174.3	-70.2	173.5	145.9	0	0	112.5	N733 C734 A739 N740 K744	N733-E737 WeakPolarHBondContact O-CG 3.27Å; N733-E737 PolarHBondContact O-N 2.94Å; C734-E737 WeakPolarHBondContact CA-OE2 3.21Å; C734-E737 PolarHBondContact SG-OE2 3.18Å; C734-E737 VanDerWaalsContact SG-OE2 3.41Å; E737-A739 VanDerWaalsContact C-N 3.29Å; E737-A739 PolarHBondContact O-N 3.44Å; E737-N740 PolarHBondContact O-N 3.23Å; E737-K744 WeakPolarHBondContact OE1-CE 3.38Å; E737-K744 IonicContact OE1-NZ 3.2Å; E737-K744 PolarHBondContact OE1-NZ 2.98Å
738	L	85.3	Confident	85.9	Confident	158 Å²	158	62.8 Å²	62.8	83%	0.827	34%	0.344	S	S	*	.	H	α-helix	trans	-68.8	-26.9	-177.5	-71.5	168.8	0	0	0	113.1	C734 A735	C734-L738 WeakPolarHBondContact O-CB 3.28Å; C734-L738 VanDerWaalsContact O-CG 3.24Å; C734-L738 WeakPolarHBondContact O-CG 3.47Å; C734-L738 PolarHBondContact O-N 3.19Å; A735-L738 PolarHBondContact O-N 2.89Å
739	A	85.7	Confident	85.4	Confident	57 Å²	57	63.8 Å²	63.8	47%	0.471	35%	0.351	S	S	.	.	H	α-helix	trans	-86.3	-19.8	175	0	0	0	0	0	113.6	A735 E737 E741	A735-A739 VanDerWaalsContact O-CB 3.29Å; A735-A739 WeakPolarHBondContact O-CB 3.3Å; A735-A739 PolarHBondContact O-N 3.18Å; E737-A739 VanDerWaalsContact C-N 3.29Å; E737-A739 PolarHBondContact O-N 3.44Å; A739-E741 HydrophobicContact CB-CB 4.16Å; A739-E741 PolarHBondContact O-N 3.32Å
740	N	81.1	Confident	85.2	Confident	156 Å²	156	63.5 Å²	63.5	83%	0.834	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	21.7	-161.4	-87	-35.6	0	0	0	114	V736 E737	V736-N740 WeakPolarHBondContact O-CA 3.47Å; V736-N740 PolarHBondContact O-N 2.72Å; E737-N740 PolarHBondContact O-N 3.23Å
741	E	75.9	Confident	85.2	Confident	153 Å²	153	64 Å²	64	72%	0.715	35%	0.353	S	S	*	.			trans	-128.1	122.5	-176.1	-72.2	-173.3	176	0	0	111.6	V736 A739	V736-E741 PolarHBondContact O-N 3.34Å; A739-E741 HydrophobicContact CB-CB 4.16Å; A739-E741 PolarHBondContact O-N 3.32Å
742	G	74.7	Confident	85.2	Confident	66 Å²	66	59.9 Å²	59.9	68%	0.68	34%	0.337	S	S	*	.	S	Bend	trans	117.3	175.8	175	0	0	0	0	0	114.5	V736	V736-G742 WeakPolarHBondContact CG1-O 3.12Å
743	E	81.3	Confident	85.1	Confident	111 Å²	111	58.1 Å²	58.1	52%	0.519	33%	0.33	S	S	.	.			trans	-99.5	126.7	176.1	-173.5	179.5	-149.4	0	0	109.6	K540	K540-E743 WeakPolarHBondContact CE-OE1 3.24Å; K540-E743 IonicContact NZ-OE1 3.58Å; K540-E743 PolarHBondContact NZ-OE1 3.27Å; K540-E743 IonicContact NZ-OE2 2.72Å; K540-E743 PolarHBondContact NZ-OE2 3.19Å
744	K	85.6	Confident	85	Confident	119 Å²	119	57.4 Å²	57.4	52%	0.517	33%	0.327	S	S	.	.			trans	-63.8	144	171.5	-78.2	-175.3	169.5	-171.3	0	110.8	V736 E737	V736-K744 HydrophobicContact CG1-CG 4.29Å; E737-K744 WeakPolarHBondContact OE1-CE 3.38Å; E737-K744 IonicContact OE1-NZ 3.2Å; E737-K744 PolarHBondContact OE1-NZ 2.98Å
745	V	86.9	Confident	84.9	Confident	14 Å²	14	55.7 Å²	55.7	9%	0.085	32%	0.315	C	S	.	.			trans	-95.4	103.9	179.5	176.8	0	0	0	0	109.7	W578 I729 Y732 N733 V747	W578-V745 HydrophobicContact CZ2-CG2 3.91Å; I729-V745 HydrophobicContact CG2-CB 4.07Å; I729-V745 HydrophobicContact CG2-CG1 3.86Å; Y732-V745 HydrophobicContact CD1-CG2 3.81Å; Y732-V745 HydrophobicContact CE1-CG2 3.71Å; N733-V745 PolarHBondContact ND2-O 3.21Å; N733-V745 VanDerWaalsContact ND2-O 3.17Å; N733-V745 PolarHBondContact OD1-N 3.3Å; V745-V747 HydrophobicContact CG1-CG2 4.14Å
746	E	86.5	Confident	84.5	Confident	86 Å²	86	53.1 Å²	53.1	40%	0.402	29%	0.294	S	S	.	.			trans	-90.8	119	167	-166.1	160.9	166.7	0	0	108.9	K539 V541 S542	K539-E746 WeakPolarHBondContact CD-OE1 3.48Å; K539-E746 WeakPolarHBondContact CD-OE2 3.34Å; K539-E746 IonicContact NZ-OE1 2.71Å; K539-E746 PolarHBondContact NZ-OE1 2.87Å; K539-E746 IonicContact NZ-OE2 3.31Å; K539-E746 PolarHBondContact NZ-OE2 3.5Å; V541-E746 WeakPolarHBondContact CA-O 3.39Å; V541-E746 HydrophobicContact CG1-CG 4.29Å; S542-E746 PolarHBondContact N-O 3.19Å
747	V	85.7	Confident	84.1	Confident	20 Å²	20	57 Å²	57	12%	0.121	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	115.6	-173	177.7	0	0	0	0	110.3	V544 I729 V745 I811	V544-V747 HydrophobicContact CB-CG1 4.5Å; V544-V747 HydrophobicContact CG2-CB 4.43Å; V544-V747 HydrophobicContact CG2-CG1 3.69Å; V544-V747 HydrophobicContact CG2-CG2 3.9Å; I729-V747 HydrophobicContact CD1-CG2 4.07Å; I729-V747 HydrophobicContact CG2-CG2 4.23Å; V745-V747 HydrophobicContact CG1-CG2 4.14Å; V747-I811 HydrophobicContact CB-CD1 3.91Å; V747-I811 HydrophobicContact CB-CG1 4.36Å; V747-I811 HydrophobicContact CG1-CD1 4.12Å; V747-I811 HydrophobicContact CG1-CG1 4.44Å; V747-I811 HydrophobicContact CG1-CG2 3.75Å
748	G	78.8	Confident	83.5	Confident	14 Å²	14	53.9 Å²	53.9	14%	0.144	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-25.6	-179.7	0	0	0	0	0	114.2	S542 P812	S542-G748 PolarHBondContact O-N 3.3Å; G748-P812 WeakPolarHBondContact O-CD 3.3Å
749	C	83.5	Confident	82.7	Confident	28 Å²	28	49 Å²	49	19%	0.189	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	140.5	-178.8	-176.7	0	0	0	0	110.4	V544 L751	V544-C749 PolarHBondContact N-O 3.13Å; C749-L751 VanDerWaalsContact SG-CD1 3.59Å
750	F	88	Confident	82.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	115.4	178.6	-160.1	-68.3	0	0	0	110.5	V544 A546 T725 L726 I811 P812 Y813 F814	V544-F750 HydrophobicContact CB-CD2 3.84Å; V544-F750 HydrophobicContact CB-CE2 4.12Å; V544-F750 HydrophobicContact CB-CG 4.31Å; V544-F750 HydrophobicContact CG1-CD2 3.75Å; V544-F750 HydrophobicContact CG1-CE2 3.49Å; V544-F750 VanDerWaalsContact CG1-CE2 3.49Å; V544-F750 HydrophobicContact CG1-CG 4.41Å; V544-F750 HydrophobicContact CG1-CZ 3.93Å; V544-F750 HydrophobicContact CG2-CD2 4.37Å; A546-F750 HydrophobicContact CB-CE1 3.71Å; A546-F750 HydrophobicContact CB-CZ 4.01Å; T725-F750 HydrophobicContact CG2-CE2 4.22Å; T725-F750 HydrophobicContact CG2-CZ 4.25Å; L726-F750 HydrophobicContact CD2-CD2 3.81Å; L726-F750 HydrophobicContact CD2-CE2 3.67Å; L726-F750 HydrophobicContact CG-CD2 4.38Å; L726-F750 HydrophobicContact CG-CE2 3.82Å; L726-F750 HydrophobicContact CG-CZ 4.46Å; F750-I811 HydrophobicContact CB-CG2 3.97Å; F750-P812 PolarHBondContact N-O 2.87Å; F750-Y813 HydrophobicContact CB-CD2 4.15Å; F750-Y813 AromaticContact CD1-CD2 3.61Å; F750-Y813 HydrophobicContact CD1-CD2 3.61Å; F750-Y813 AromaticContact CD1-CE2 3.65Å; F750-Y813 HydrophobicContact CD1-CE2 3.65Å; F750-Y813 HydrophobicContact CE1-CD2 4.36Å; F750-Y813 AromaticContact CE1-CE2 3.98Å; F750-Y813 HydrophobicContact CE1-CE2 3.98Å; F750-Y813 HydrophobicContact CG-CD2 4.08Å; F750-Y813 WeakPolarHBondContact O-CA 3.14Å; F750-F814 PolarHBondContact O-N 2.72Å
751	L	90.1	Very high	81.6	Confident	26 Å²	26	48.1 Å²	48.1	14%	0.136	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.4	176.4	-65.2	89.7	0	0	0	110	V543 V544 L545 A546 I564 C749 F816	V543-L751 HydrophobicContact CG1-CD1 3.74Å; V544-L751 PolarHBondContact O-N 3.16Å; L545-L751 CarbonylContact C-O 3.56Å; L545-L751 WeakPolarHBondContact CA-O 3.39Å; L545-L751 HydrophobicContact CD1-CB 3.8Å; A546-L751 PolarHBondContact N-O 2.64Å; I564-L751 HydrophobicContact CD1-CD2 4.32Å; C749-L751 VanDerWaalsContact SG-CD1 3.59Å; L751-F816 HydrophobicContact CD2-CE2 4.33Å
752	S	91.2	Very high	81.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	122.5	175.2	-172.9	0	0	0	0	109.3	A546 S722 Y813 F814 R815 F816	A546-S752 WeakPolarHBondContact O-CA 3.3Å; S722-S752 PolarHBondContact OG-OG 3.23Å; S752-Y813 WeakPolarHBondContact CB-OH 3.32Å; S752-Y813 PolarHBondContact OG-OH 3.29Å; S752-F814 PolarHBondContact N-O 3.01Å; S752-R815 WeakPolarHBondContact O-CA 3.42Å; S752-R815 PolarHBondContact OG-NH1 3.46Å; S752-F816 PolarHBondContact O-N 3.5Å
753	V	89.5	Confident	80.8	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	121	-173.1	-168.6	0	0	0	0	111.3	L545 A546 L547 D548 I557 T560 L561 F816	L545-V753 HydrophobicContact CD1-CG2 4.02Å; A546-V753 PolarHBondContact O-N 3.14Å; L547-V753 HydrophobicContact CD2-CB 3.87Å; L547-V753 HydrophobicContact CD2-CG2 4.23Å; D548-V753 PolarHBondContact N-O 3.27Å; D548-V753 VanDerWaalsContact N-O 3.14Å; I557-V753 HydrophobicContact CB-CG1 4.27Å; I557-V753 WeakPolarHBondContact CD1-O 3.48Å; I557-V753 HydrophobicContact CG1-CG1 4.16Å; I557-V753 HydrophobicContact CG2-CB 4.38Å; I557-V753 HydrophobicContact CG2-CG1 4.01Å; T560-V753 HydrophobicContact CG2-CG1 3.72Å; L561-V753 HydrophobicContact CD2-CG2 4.03Å; V753-F816 WeakPolarHBondContact CA-O 3.46Å; V753-F816 HydrophobicContact CG1-CB 4.41Å; V753-F816 HydrophobicContact CG2-CD2 4.34Å
754	G	88.2	Confident	80	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.			trans	-103.8	159.1	-171.9	0	0	0	0	0	115.7	D548 G756 F816	D548-G754 WeakPolarHBondContact OD2-CA 3.44Å; G754-G756 PolarHBondContact O-N 3.02Å; G754-G756 VanDerWaalsContact O-N 3.13Å; G754-F816 PolarHBondContact N-O 2.7Å
755	T	85.6	Confident	78.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.218	C	C	.	.	S	Bend	trans	-80.6	21.3	178.5	57.3	0	0	0	0	114.4	G549 R553 I557	G549-T755 WeakPolarHBondContact O-CG2 3.46Å; G549-T755 PolarHBondContact O-OG1 3.32Å; R553-T755 HydrophobicContact CB-CG2 4.5Å; R553-T755 WeakPolarHBondContact CB-O 3.49Å; I557-T755 HydrophobicContact CD1-CG2 3.57Å; I557-T755 HydrophobicContact CG1-CG2 3.97Å
756	G	78	Confident	77.7	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.01	22%	0.217	C	C	.	.			trans	86	139.7	177.9	0	0	0	0	0	115	R553 G754 C817 T818	R553-G756 PolarHBondContact NH1-O 3.25Å; G754-G756 PolarHBondContact O-N 3.02Å; G754-G756 VanDerWaalsContact O-N 3.13Å; G756-C817 VanDerWaalsContact CA-SG 3.58Å; G756-T818 CarbonylContact C-O 3.56Å; G756-T818 WeakPolarHBondContact CA-O 3.23Å
757	R	78.8	Confident	76.6	Confident	97 Å²	97	38.4 Å²	38.4	37%	0.366	21%	0.21	S	C	.	.	B	Isolated β-bridge	trans	-85.9	126.1	-178.2	177.8	173	175.6	168.8	-3.9	110.1	E760 E795 C817 T818 L820	R757-E760 IonicContact CZ-OE1 3.64Å; R757-E760 IonicContact NH2-OE1 3.74Å; R757-E760 PolarHBondContact NH2-OE1 2.89Å; R757-E795 HydrophobicContact CB-CG 4.45Å; R757-C817 PolarHBondContact N-SG 3.24Å; R757-T818 PolarHBondContact N-O 3.48Å; R757-L820 WeakPolarHBondContact O-CB 3.46Å; R757-L820 PolarHBondContact O-N 3.11Å
758	T	72.4	Confident	75.4	Confident	25 Å²	25	38.6 Å²	38.6	15%	0.153	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-71.2	152.5	175.2	53	0	0	0	0	111.5
759	P	69.5	Low	74.6	Confident	57 Å²	57	42.7 Å²	42.7	37%	0.37	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-55.4	145.4	173.7	-23.4	31.9	0	0	0	112.5	L820	P759-L820 VanDerWaalsContact CD-O 3.3Å; P759-L820 WeakPolarHBondContact CD-O 3.48Å; P759-L820 VanDerWaalsContact CG-O 3.23Å; P759-L820 WeakPolarHBondContact CG-O 3.35Å
760	E	73.3	Confident	73.4	Confident	73 Å²	73	42.8 Å²	42.8	34%	0.341	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-73.4	140.2	170.5	-60.3	-166.6	177.3	0	0	110.4	R757 H1405 R1408	R757-E760 IonicContact CZ-OE1 3.64Å; R757-E760 IonicContact NH2-OE1 3.74Å; R757-E760 PolarHBondContact NH2-OE1 2.89Å; E760-H1405 VanDerWaalsContact CA-O 3.29Å; E760-H1405 WeakPolarHBondContact CA-O 3.28Å; E760-R1408 IonicContact OE1-CZ 3.24Å; E760-R1408 IonicContact OE1-NE 2.9Å; E760-R1408 IonicContact OE1-NH2 2.72Å; E760-R1408 PolarHBondContact OE1-NH2 2.95Å; E760-R1408 IonicContact OE2-NH2 3.6Å; E760-R1408 PolarHBondContact OE2-NH2 3.14Å
761	R	69.4	Low	71.7	Confident	121 Å²	121	48.8 Å²	48.8	46%	0.457	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	148.6	176.1	62.5	-178.2	170	142.2	6.5	110.3	K1404 H1405	R761-K1404 CarbonylContact O-C 3.54Å; R761-K1404 WeakPolarHBondContact O-CA 3.47Å; R761-H1405 HydrophobicContact CG-CB 3.76Å; R761-H1405 PolarHBondContact N-O 3.2Å; R761-H1405 PolarHBondContact NE-ND1 3.03Å; R761-H1405 PolarHBondContact NH2-CD2 3.32Å; R761-H1405 PolarHBondContact NH2-CE1 3.45Å; R761-H1405 VanDerWaalsContact NH2-CE1 3.29Å; R761-H1405 PolarHBondContact NH2-ND1 2.69Å; R761-H1405 PolarHBondContact NH2-NE2 2.96Å; R761-H1405 PolarHBondContact O-N 3.06Å
762	P	68.6	Low	69.8	Low	113 Å²	113	50.4 Å²	50.4	73%	0.734	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.3	143.9	172.1	27.6	-34.4	0	0	0	110.6	Q1403	P762-Q1403 WeakPolarHBondContact CA-O 3.47Å
763	L	66.6	Low	67.7	Low	20 Å²	20	53.4 Å²	53.4	11%	0.105	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-98.3	132.3	169.2	-78.9	169.4	0	0	0	109.7	V786 A1402 Q1403 H1405 V1407	L763-V786 HydrophobicContact CD1-CG2 3.69Å; L763-A1402 WeakPolarHBondContact CB-O 3.39Å; L763-A1402 WeakPolarHBondContact CD1-O 3.35Å; L763-Q1403 PolarHBondContact N-O 3.38Å; L763-H1405 HydrophobicContact CD1-CB 3.96Å; L763-H1405 HydrophobicContact CD2-CB 3.91Å; L763-H1405 HydrophobicContact CG-CB 3.73Å; L763-V1407 HydrophobicContact CD1-CG1 3.55Å
764	P	63.7	Low	65.9	Low	85 Å²	85	58.7 Å²	58.7	55%	0.552	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-65.8	144	166	-9.6	23.6	0	0	0	109.9	I766 N782	P764-I766 PolarHBondContact O-N 3.35Å; P764-N782 WeakPolarHBondContact CB-ND2 3.44Å; P764-N782 PolarHBondContact O-ND2 3.38Å
765	V	60.7	Low	64.4	Low	69 Å²	69	64.3 Å²	64.3	42%	0.418	35%	0.353	S	S	.	.			trans	-45.3	131.1	-173.9	-179.3	0	0	0	0	113	N767 N1455	V765-N767 HydrophobicContact CG1-CB 3.78Å; V765-N767 PolarHBondContact O-N 2.78Å; V765-N1455 HydrophobicContact CB-CB 4.39Å; V765-N1455 HydrophobicContact CG1-CB 3.7Å; V765-N1455 VanDerWaalsContact CG1-OD1 3.23Å; V765-N1455 WeakPolarHBondContact CG1-OD1 3.45Å; V765-N1455 HydrophobicContact CG2-CB 3.8Å
766	I	63.2	Low	63.3	Low	12 Å²	12	65.4 Å²	65.4	6%	0.062	36%	0.359	C	S	.	.			trans	-92.4	79.5	173.1	-57.6	172	0	0	0	108.2	P764 F768 N782 Y783 V786 S1452	P764-I766 PolarHBondContact O-N 3.35Å; I766-F768 HydrophobicContact CG2-CD2 4.48Å; I766-F768 HydrophobicContact CG2-CE2 3.66Å; I766-F768 HydrophobicContact CG2-CZ 4.23Å; I766-N782 HydrophobicContact CD1-CB 4.39Å; I766-N782 HydrophobicContact CG1-CB 3.88Å; I766-Y783 HydrophobicContact CG2-CD2 4.32Å; I766-Y783 HydrophobicContact CG2-CG 4.37Å; I766-V786 HydrophobicContact CD1-CB 4.39Å; I766-V786 HydrophobicContact CD1-CG2 3.7Å; I766-S1452 PolarHBondContact O-OG 3.45Å
767	N	64	Low	62.2	Low	46 Å²	46	68.9 Å²	68.9	25%	0.246	38%	0.376	C	S	.	.			trans	-121.6	138.2	175	-169	0.8	0	0	0	110.8	V765 D769 A779	V765-N767 HydrophobicContact CG1-CB 3.78Å; V765-N767 PolarHBondContact O-N 2.78Å; N767-D769 PolarHBondContact ND2-OD2 3.49Å; N767-D769 PolarHBondContact OD1-N 3.16Å; N767-D769 VanDerWaalsContact OD1-N 3.15Å; N767-D769 PolarHBondContact OD1-OD2 3.12Å; N767-A779 WeakPolarHBondContact O-CB 3.34Å
768	F	61.4	Low	61.4	Low	23 Å²	23	67.8 Å²	67.8	10%	0.101	38%	0.382	C	S	.	.			trans	-111.1	17.5	-176.7	-65.8	-86	0	0	0	113.1	I766 S770 L776 A779 A780 Y783 P1367 P1447 T1448	I766-F768 HydrophobicContact CG2-CD2 4.48Å; I766-F768 HydrophobicContact CG2-CE2 3.66Å; I766-F768 HydrophobicContact CG2-CZ 4.23Å; F768-S770 PolarHBondContact O-N 2.93Å; F768-S770 VanDerWaalsContact O-N 3.15Å; F768-L776 HydrophobicContact CB-CD2 4.11Å; F768-L776 HydrophobicContact CD1-CD2 4.19Å; F768-L776 WeakPolarHBondContact O-CD2 3.37Å; F768-A779 HydrophobicContact CE1-CB 4.35Å; F768-A780 HydrophobicContact CE1-CB 4.16Å; F768-Y783 HydrophobicContact CZ-CD1 4.17Å; F768-Y783 HydrophobicContact CZ-CG 4.21Å; F768-P1367 WeakPolarHBondContact O-CG 3.14Å; F768-P1447 HydrophobicContact CE2-CB 4.26Å; F768-T1448 HydrophobicContact CE1-CG2 4.35Å; F768-T1448 HydrophobicContact CE2-CG2 4.23Å; F768-T1448 HydrophobicContact CZ-CG2 4.15Å
769	D	62.1	Low	60.9	Low	100 Å²	100	66.9 Å²	66.9	54%	0.535	38%	0.377	S	S	.	.			trans	-66	-8.6	-175.7	-80	-24.5	0	0	0	116.4	N767 T1451	N767-D769 PolarHBondContact ND2-OD2 3.49Å; N767-D769 PolarHBondContact OD1-N 3.16Å; N767-D769 VanDerWaalsContact OD1-N 3.15Å; N767-D769 PolarHBondContact OD1-OD2 3.12Å; D769-T1451 WeakPolarHBondContact OD1-CG2 3.46Å; D769-T1451 WeakPolarHBondContact OD2-CG2 3.38Å
770	S	56.9	Low	60.6	Low	30 Å²	30	64.8 Å²	64.8	21%	0.21	37%	0.365	C	S	.	.			trans	-83.7	134.8	177.9	-171.8	0	0	0	0	112.7	F768 N772 E775 L776	F768-S770 PolarHBondContact O-N 2.93Å; F768-S770 VanDerWaalsContact O-N 3.15Å; S770-N772 PolarHBondContact O-N 2.8Å; S770-N772 WeakPolarHBondContact OG-CB 3.45Å; S770-N772 PolarHBondContact OG-N 3.41Å; S770-E775 WeakPolarHBondContact CB-OE2 3.06Å; S770-E775 PolarHBondContact OG-OE2 3.04Å; S770-L776 WeakPolarHBondContact O-CD1 3.34Å; S770-L776 WeakPolarHBondContact O-CD2 3.34Å; S770-L776 WeakPolarHBondContact O-CG 3.44Å
771	S	53.3	Low	60	Low	127 Å²	127	64 Å²	64	89%	0.888	36%	0.362	S	S	*	.	S	Bend	trans	-77.3	-5.4	166.9	56.3	0	0	0	0	113.4	P773	S771-P773 WeakPolarHBondContact O-CD 3.12Å
772	N	49.9	Very low	59.8	Low	59 Å²	59	59.7 Å²	59.7	32%	0.316	35%	0.347	S	S	.	.	S	Bend	trans	-92.3	117.1	177.8	179.9	-1	0	0	0	111.5	S770 L774 E775 L776	S770-N772 PolarHBondContact O-N 2.8Å; S770-N772 WeakPolarHBondContact OG-CB 3.45Å; S770-N772 PolarHBondContact OG-N 3.41Å; N772-L774 PolarHBondContact O-N 2.71Å; N772-L774 PolarHBondContact OD1-N 2.8Å; N772-L774 VanDerWaalsContact OD1-N 3.08Å; N772-E775 HydrophobicContact CB-CB 4.24Å; N772-E775 HydrophobicContact CB-CG 4.16Å; N772-E775 PolarHBondContact ND2-OE1 3.19Å; N772-E775 PolarHBondContact O-N 2.93Å; N772-E775 VanDerWaalsContact O-N 3.07Å; N772-L776 PolarHBondContact O-N 3.07Å
773	P	47.3	Very low	59.8	Low	63 Å²	63	55.4 Å²	55.4	41%	0.409	32%	0.317	S	S	.	.	H	α-helix	trans	-49.2	-34.4	177	-31.9	37.4	0	0	0	116	Y38 S771 L777	Y38-P773 HydrophobicContact CE1-CB 3.99Å; Y38-P773 WeakPolarHBondContact OH-CA 3.45Å; Y38-P773 WeakPolarHBondContact OH-CB 3.45Å; Y38-P773 WeakPolarHBondContact OH-CG 3.24Å; S771-P773 WeakPolarHBondContact O-CD 3.12Å; P773-L777 PolarHBondContact O-N 2.62Å
774	L	50.3	Low	59.8	Low	111 Å²	111	56.1 Å²	56.1	58%	0.581	32%	0.32	S	S	*	.	H	α-helix	trans	-77.9	-27.8	-176.3	-64.2	174.1	0	0	0	112.8	N772	N772-L774 PolarHBondContact O-N 2.71Å; N772-L774 PolarHBondContact OD1-N 2.8Å; N772-L774 VanDerWaalsContact OD1-N 3.08Å
775	E	58.2	Low	59.8	Low	119 Å²	119	53.5 Å²	53.5	56%	0.556	30%	0.304	S	S	*	.	H	α-helix	trans	-78.9	-25	175.2	-72.1	162.4	-143	0	0	111.9	S770 N772 P778	S770-E775 WeakPolarHBondContact CB-OE2 3.06Å; S770-E775 PolarHBondContact OG-OE2 3.04Å; N772-E775 HydrophobicContact CB-CB 4.24Å; N772-E775 HydrophobicContact CB-CG 4.16Å; N772-E775 PolarHBondContact ND2-OE1 3.19Å; N772-E775 PolarHBondContact O-N 2.93Å; N772-E775 VanDerWaalsContact O-N 3.07Å; E775-P778 WeakPolarHBondContact O-CD 3.3Å
776	L	61	Low	60.3	Low	23 Å²	23	50.3 Å²	50.3	12%	0.12	29%	0.285	C	S	.	.	H	α-helix	trans	-74.5	-22.5	173.2	-63.5	179.1	0	0	0	113.5	Y38 F768 S770 N772 A779 A780	Y38-L776 HydrophobicContact CE2-CD1 4.35Å; F768-L776 HydrophobicContact CB-CD2 4.11Å; F768-L776 HydrophobicContact CD1-CD2 4.19Å; F768-L776 WeakPolarHBondContact O-CD2 3.37Å; S770-L776 WeakPolarHBondContact O-CD1 3.34Å; S770-L776 WeakPolarHBondContact O-CD2 3.34Å; S770-L776 WeakPolarHBondContact O-CG 3.44Å; N772-L776 PolarHBondContact O-N 3.07Å; L776-A779 PolarHBondContact O-N 2.91Å; L776-A780 WeakPolarHBondContact O-CB 3.25Å; L776-A780 PolarHBondContact O-N 3.3Å
777	L	55.9	Low	60.8	Low	73 Å²	73	50.1 Å²	50.1	38%	0.382	28%	0.284	S	S	.	.	H	α-helix	trans	-57.4	-44.2	-173	-163.8	82.6	0	0	0	113.7	P773 A780 M781	P773-L777 PolarHBondContact O-N 2.62Å; L777-A780 PolarHBondContact O-N 3.47Å; L777-M781 WeakPolarHBondContact O-CB 3.46Å; L777-M781 WeakPolarHBondContact O-CG 3.44Å; L777-M781 PolarHBondContact O-N 3.08Å
778	P	61.8	Low	61	Low	74 Å²	74	50.6 Å²	50.6	48%	0.481	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-41	177.4	-19.8	34.4	0	0	0	112.7	E775 M781 N782	E775-P778 WeakPolarHBondContact O-CD 3.3Å; P778-M781 PolarHBondContact O-N 3.43Å; P778-N782 WeakPolarHBondContact O-CB 3.47Å; P778-N782 PolarHBondContact O-N 3.27Å; P778-N782 PolarHBondContact O-ND2 3Å
779	A	63.1	Low	61.5	Low	6 Å²	6	51.3 Å²	51.3	5%	0.05	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-41.5	177.5	0	0	0	0	0	111.6	N767 F768 L776 N782 Y783	N767-A779 WeakPolarHBondContact O-CB 3.34Å; F768-A779 HydrophobicContact CE1-CB 4.35Å; L776-A779 PolarHBondContact O-N 2.91Å; A779-N782 PolarHBondContact O-N 3.31Å; A779-Y783 WeakPolarHBondContact O-CB 3.45Å; A779-Y783 PolarHBondContact O-N 3.43Å
780	A	61.6	Low	62.1	Low	14 Å²	14	48.3 Å²	48.3	12%	0.116	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-44.8	173.2	0	0	0	0	0	112	F768 L776 L777 Y783 I784	F768-A780 HydrophobicContact CE1-CB 4.16Å; L776-A780 WeakPolarHBondContact O-CB 3.25Å; L776-A780 PolarHBondContact O-N 3.3Å; L777-A780 PolarHBondContact O-N 3.47Å; A780-Y783 PolarHBondContact O-N 2.88Å; A780-I784 WeakPolarHBondContact O-CB 3.16Å; A780-I784 WeakPolarHBondContact O-CD1 3.41Å; A780-I784 VanDerWaalsContact O-CG1 3.27Å; A780-I784 WeakPolarHBondContact O-CG1 3.45Å; A780-I784 PolarHBondContact O-N 3.23Å
781	M	61.2	Low	62.9	Low	56 Å²	56	47.6 Å²	47.6	28%	0.276	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-42	175.1	-78.3	179.8	58.5	0	0	112.6	I25 M27 L34 L777 P778 S785	I25-M781 HydrophobicContact CD1-CE 4.35Å; M27-M781 HydrophobicContact CE-CE 4.31Å; M27-M781 HydrophobicContact CE-SD 4.37Å; L34-M781 HydrophobicContact CD1-CG 3.93Å; L34-M781 HydrophobicContact CD1-SD 4.11Å; L34-M781 HydrophobicContact CD2-CG 3.67Å; L34-M781 HydrophobicContact CG-CG 4.49Å; L777-M781 WeakPolarHBondContact O-CB 3.46Å; L777-M781 WeakPolarHBondContact O-CG 3.44Å; L777-M781 PolarHBondContact O-N 3.08Å; P778-M781 PolarHBondContact O-N 3.43Å; M781-S785 WeakPolarHBondContact O-CB 3.15Å; M781-S785 PolarHBondContact O-N 3.06Å
782	N	66	Low	64.1	Low	30 Å²	30	44 Å²	44	16%	0.16	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-41	176.5	-69.6	-16	0	0	0	111.5	P764 I766 P778 A779 S785 V786	P764-N782 WeakPolarHBondContact CB-ND2 3.44Å; P764-N782 PolarHBondContact O-ND2 3.38Å; I766-N782 HydrophobicContact CD1-CB 4.39Å; I766-N782 HydrophobicContact CG1-CB 3.88Å; P778-N782 WeakPolarHBondContact O-CB 3.47Å; P778-N782 PolarHBondContact O-N 3.27Å; P778-N782 PolarHBondContact O-ND2 3Å; A779-N782 PolarHBondContact O-N 3.31Å; N782-S785 WeakPolarHBondContact O-CB 3.35Å; N782-S785 PolarHBondContact O-N 3.23Å; N782-V786 WeakPolarHBondContact O-CG2 3.48Å; N782-V786 PolarHBondContact O-N 2.85Å
783	Y	68.7	Low	65.5	Low	24 Å²	24	41.9 Å²	41.9	9%	0.094	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-49.2	176.4	-177.9	-125.3	0	0	0	112.5	I766 F768 A779 A780 S785 V786 V787 P1447 L1462 M1550	I766-Y783 HydrophobicContact CG2-CD2 4.32Å; I766-Y783 HydrophobicContact CG2-CG 4.37Å; F768-Y783 HydrophobicContact CZ-CD1 4.17Å; F768-Y783 HydrophobicContact CZ-CG 4.21Å; A779-Y783 WeakPolarHBondContact O-CB 3.45Å; A779-Y783 PolarHBondContact O-N 3.43Å; A780-Y783 PolarHBondContact O-N 2.88Å; Y783-S785 PolarHBondContact O-N 3.35Å; Y783-V786 WeakPolarHBondContact O-CB 3.45Å; Y783-V786 PolarHBondContact O-N 3.43Å; Y783-V787 HydrophobicContact CD1-CG2 4.49Å; Y783-V787 HydrophobicContact CD2-CG2 4.06Å; Y783-V787 HydrophobicContact CE1-CG2 4.14Å; Y783-V787 HydrophobicContact CE2-CG2 3.64Å; Y783-V787 HydrophobicContact CG-CG2 4.46Å; Y783-V787 WeakPolarHBondContact O-CG2 3.43Å; Y783-V787 PolarHBondContact O-N 3.22Å; Y783-P1447 HydrophobicContact CD2-CB 3.98Å; Y783-P1447 HydrophobicContact CD2-CG 4.22Å; Y783-P1447 HydrophobicContact CE1-CB 4.29Å; Y783-P1447 HydrophobicContact CE2-CB 3.57Å; Y783-P1447 HydrophobicContact CE2-CG 3.64Å; Y783-L1462 HydrophobicContact CE2-CD1 4.06Å; Y783-L1462 HydrophobicContact CE2-CD2 4.29Å; Y783-M1550 VanDerWaalsContact OH-CE 3.27Å; Y783-M1550 WeakPolarHBondContact OH-CE 3.32Å; Y783-M1550 PolarHBondContact OH-SD 2.98Å; Y783-M1550 VanDerWaalsContact OH-SD 3.37Å
784	I	64.7	Low	67.2	Low	34 Å²	34	39.7 Å²	39.7	17%	0.174	22%	0.216	C	C	.	.	H	α-helix	trans	-59.4	-38.4	175.6	-69.1	161.9	0	0	0	110.6	L34 I37 A780 M788	L34-I784 HydrophobicContact CD2-CD1 3.6Å; I37-I784 HydrophobicContact CB-CD1 4.45Å; I37-I784 HydrophobicContact CD1-CD1 3.89Å; I37-I784 HydrophobicContact CD1-CG1 4.1Å; I37-I784 HydrophobicContact CG2-CD1 4.14Å; A780-I784 WeakPolarHBondContact O-CB 3.16Å; A780-I784 WeakPolarHBondContact O-CD1 3.41Å; A780-I784 VanDerWaalsContact O-CG1 3.27Å; A780-I784 WeakPolarHBondContact O-CG1 3.45Å; A780-I784 PolarHBondContact O-N 3.23Å; I784-M788 HydrophobicContact CG2-CG 4.44Å; I784-M788 WeakPolarHBondContact O-CB 3.47Å; I784-M788 VanDerWaalsContact O-CG 3.28Å; I784-M788 WeakPolarHBondContact O-CG 3.39Å; I784-M788 PolarHBondContact O-N 3.35Å
785	S	65.3	Low	68.8	Low	31 Å²	31	36.5 Å²	36.5	22%	0.217	20%	0.198	C	C	.	.	H	α-helix	trans	-56.3	-59.8	168.6	164	0	0	0	0	110.4	M781 N782 Y783 V787 M788 N789	M781-S785 WeakPolarHBondContact O-CB 3.15Å; M781-S785 PolarHBondContact O-N 3.06Å; N782-S785 WeakPolarHBondContact O-CB 3.35Å; N782-S785 PolarHBondContact O-N 3.23Å; Y783-S785 PolarHBondContact O-N 3.35Å; S785-V787 VanDerWaalsContact C-N 3.32Å; S785-V787 PolarHBondContact O-N 2.78Å; S785-M788 PolarHBondContact O-N 2.68Å; S785-M788 VanDerWaalsContact O-N 3.1Å; S785-N789 PolarHBondContact O-N 3.41Å; S785-N789 PolarHBondContact O-ND2 3.44Å; S785-N789 PolarHBondContact OG-ND2 3.07Å
786	V	71.7	Confident	69.8	Low	2 Å²	2	32.4 Å²	32.4	1%	0.012	19%	0.188	C	C	.	.	H	α-helix	trans	-49.9	-49.6	-179.5	166.7	0	0	0	0	112.5	L763 I766 N782 Y783 N789 Q790 V1407	L763-V786 HydrophobicContact CD1-CG2 3.69Å; I766-V786 HydrophobicContact CD1-CB 4.39Å; I766-V786 HydrophobicContact CD1-CG2 3.7Å; N782-V786 WeakPolarHBondContact O-CG2 3.48Å; N782-V786 PolarHBondContact O-N 2.85Å; Y783-V786 WeakPolarHBondContact O-CB 3.45Å; Y783-V786 PolarHBondContact O-N 3.43Å; V786-N789 PolarHBondContact O-N 2.99Å; V786-Q790 PolarHBondContact O-N 3.31Å; V786-Q790 VanDerWaalsContact O-N 3.16Å; V786-V1407 HydrophobicContact CG1-CG1 4.08Å; V786-V1407 HydrophobicContact CG1-CG2 3.76Å; V786-V1407 HydrophobicContact CG2-CG1 3.68Å
787	V	71.9	Confident	70.8	Confident	8 Å²	8	32 Å²	32	5%	0.048	19%	0.188	C	C	.	.	H	α-helix	trans	-57	-50.3	177.4	170	0	0	0	0	111.4	Y783 S785 N789 Q790 L791 I1549 V1553	Y783-V787 HydrophobicContact CD1-CG2 4.49Å; Y783-V787 HydrophobicContact CD2-CG2 4.06Å; Y783-V787 HydrophobicContact CE1-CG2 4.14Å; Y783-V787 HydrophobicContact CE2-CG2 3.64Å; Y783-V787 HydrophobicContact CG-CG2 4.46Å; Y783-V787 WeakPolarHBondContact O-CG2 3.43Å; Y783-V787 PolarHBondContact O-N 3.22Å; S785-V787 VanDerWaalsContact C-N 3.32Å; S785-V787 PolarHBondContact O-N 2.78Å; V787-N789 VanDerWaalsContact C-N 3.32Å; V787-N789 PolarHBondContact O-N 2.91Å; V787-Q790 PolarHBondContact O-N 3.49Å; V787-L791 PolarHBondContact O-N 3.48Å; V787-I1549 HydrophobicContact CG1-CG2 3.34Å; V787-V1553 HydrophobicContact CG1-CG2 3.75Å
788	M	69.1	Low	72.3	Confident	55 Å²	55	29.6 Å²	29.6	27%	0.271	18%	0.177	S	C	.	.	H	α-helix	trans	-63.5	-33.9	178.4	-75.4	-61.5	-58.1	0	0	113.6	I784 S785 Q790 T792 I1549	I784-M788 HydrophobicContact CG2-CG 4.44Å; I784-M788 WeakPolarHBondContact O-CB 3.47Å; I784-M788 VanDerWaalsContact O-CG 3.28Å; I784-M788 WeakPolarHBondContact O-CG 3.39Å; I784-M788 PolarHBondContact O-N 3.35Å; S785-M788 PolarHBondContact O-N 2.68Å; S785-M788 VanDerWaalsContact O-N 3.1Å; M788-Q790 VanDerWaalsContact C-N 3.34Å; M788-T792 PolarHBondContact O-N 3.39Å; M788-T792 PolarHBondContact O-OG1 3.21Å; M788-I1549 HydrophobicContact SD-CD1 3.71Å; M788-I1549 HydrophobicContact SD-CG1 4.36Å; M788-I1549 HydrophobicContact SD-CG2 4.44Å
789	N	71.4	Confident	73.5	Confident	38 Å²	38	26.4 Å²	26.4	20%	0.203	16%	0.156	C	C	.	.	H	α-helix	trans	-69.4	-31.9	176.3	-65.4	-72	0	0	0	112.2	S785 V786 V787 T792 A793 H1405	S785-N789 PolarHBondContact O-N 3.41Å; S785-N789 PolarHBondContact O-ND2 3.44Å; S785-N789 PolarHBondContact OG-ND2 3.07Å; V786-N789 PolarHBondContact O-N 2.99Å; V787-N789 VanDerWaalsContact C-N 3.32Å; V787-N789 PolarHBondContact O-N 2.91Å; N789-T792 CarbonylContact O-C 3.58Å; N789-A793 WeakPolarHBondContact O-CA 3.42Å; N789-A793 WeakPolarHBondContact O-CB 3.41Å; N789-A793 PolarHBondContact O-N 3.37Å; N789-H1405 PolarHBondContact ND2-CD2 2.91Å; N789-H1405 PolarHBondContact ND2-NE2 3.48Å; N789-H1405 PolarHBondContact OD1-NE2 3.31Å
790	Q	75.3	Confident	74.5	Confident	37 Å²	37	30.2 Å²	30.2	17%	0.173	18%	0.175	C	C	.	.	H	α-helix	trans	-76.1	-40.6	178.4	-68.5	-56.5	-29	0	0	112.5	V786 V787 M788 T792 A793 V1407 I1463	V786-Q790 PolarHBondContact O-N 3.31Å; V786-Q790 VanDerWaalsContact O-N 3.16Å; V787-Q790 PolarHBondContact O-N 3.49Å; M788-Q790 VanDerWaalsContact C-N 3.34Å; Q790-T792 VanDerWaalsContact C-N 3.26Å; Q790-T792 PolarHBondContact O-N 3.12Å; Q790-A793 WeakPolarHBondContact O-CB 3.19Å; Q790-A793 PolarHBondContact O-N 3.23Å; Q790-V1407 HydrophobicContact CG-CG2 4.28Å; Q790-V1407 PolarHBondContact NE2-O 3.17Å; Q790-V1407 VanDerWaalsContact NE2-O 3.12Å; Q790-I1463 HydrophobicContact CG-CD1 4.39Å; Q790-I1463 HydrophobicContact CG-CG1 4.02Å
791	L	74.4	Confident	75.8	Confident	15 Å²	15	30.9 Å²	30.9	8%	0.079	18%	0.175	C	C	.	.	H	α-helix	trans	-57.1	-41.9	171	-68.8	-177.2	0	0	0	112.3	G715 L716 V787 I1549 Q1552 V1553	G715-L791 VanDerWaalsContact O-O 3.05Å; L716-L791 HydrophobicContact CD2-CD1 4.4Å; L716-L791 WeakPolarHBondContact O-CD2 3.48Å; V787-L791 PolarHBondContact O-N 3.48Å; L791-I1549 HydrophobicContact CD1-CB 4.09Å; L791-I1549 HydrophobicContact CD1-CG1 3.87Å; L791-I1549 HydrophobicContact CD1-CG2 3.82Å; L791-Q1552 HydrophobicContact CD2-CB 3.71Å; L791-V1553 HydrophobicContact CD1-CG2 4.33Å; L791-V1553 HydrophobicContact CD2-CB 4.4Å; L791-V1553 HydrophobicContact CD2-CG2 3.4Å; L791-V1553 VanDerWaalsContact CD2-CG2 3.4Å; L791-V1553 HydrophobicContact CG-CG2 3.51Å
792	T	76.7	Confident	77.1	Confident	51 Å²	51	28.2 Å²	28.2	31%	0.313	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	13.7	-176.6	61.7	0	0	0	0	113.6	G715 N719 M788 N789 Q790 T794	G715-T792 WeakPolarHBondContact O-CA 3.34Å; G715-T792 WeakPolarHBondContact O-CG2 3.39Å; N719-T792 PolarHBondContact ND2-O 2.86Å; M788-T792 PolarHBondContact O-N 3.39Å; M788-T792 PolarHBondContact O-OG1 3.21Å; N789-T792 CarbonylContact O-C 3.58Å; Q790-T792 VanDerWaalsContact C-N 3.26Å; Q790-T792 PolarHBondContact O-N 3.12Å; T792-T794 PolarHBondContact O-N 3.27Å
793	A	79.9	Confident	78.2	Confident	15 Å²	15	30 Å²	30	12%	0.124	17%	0.166	C	C	.	.			trans	-63	124.1	-173.6	0	0	0	0	0	112.5	N789 Q790 P798	N789-A793 WeakPolarHBondContact O-CA 3.42Å; N789-A793 WeakPolarHBondContact O-CB 3.41Å; N789-A793 PolarHBondContact O-N 3.37Å; Q790-A793 WeakPolarHBondContact O-CB 3.19Å; Q790-A793 PolarHBondContact O-N 3.23Å; A793-P798 HydrophobicContact CB-CG 4.25Å
794	T	83.5	Confident	79	Confident	18 Å²	18	29.5 Å²	29.5	11%	0.11	17%	0.166	C	C	.	.			trans	-100.9	-17.6	172.5	48.5	0	0	0	0	113.3	D548 N719 N720 T792 V799 R815	D548-T794 HydrophobicContact CB-CG2 3.97Å; D548-T794 WeakPolarHBondContact OD2-CB 3.46Å; D548-T794 VanDerWaalsContact OD2-CG2 3.25Å; D548-T794 WeakPolarHBondContact OD2-CG2 3.47Å; N719-T794 HydrophobicContact CB-CG2 4.42Å; N719-T794 WeakPolarHBondContact ND2-CG2 3.48Å; N720-T794 PolarHBondContact ND2-O 3.25Å; T792-T794 PolarHBondContact O-N 3.27Å; T794-V799 VanDerWaalsContact O-CG2 3.3Å; T794-V799 WeakPolarHBondContact O-CG2 3.36Å; T794-R815 PolarHBondContact O-NH2 3.31Å
795	E	83.2	Confident	80.2	Confident	43 Å²	43	27.9 Å²	27.9	20%	0.201	16%	0.158	C	C	.	.	S	Bend	trans	-131.8	165.1	-169.8	-69.5	-65	134.5	0	0	111	R757 R815 C817	R757-E795 HydrophobicContact CB-CG 4.45Å; E795-R815 IonicContact OE1-CZ 2.95Å; E795-R815 VanDerWaalsContact OE1-CZ 3.27Å; E795-R815 IonicContact OE1-NE 3.27Å; E795-R815 PolarHBondContact OE1-NE 2.7Å; E795-R815 IonicContact OE1-NH2 2.76Å; E795-R815 PolarHBondContact OE1-NH2 2.86Å; E795-C817 WeakPolarHBondContact OE1-CB 3.49Å; E795-C817 PolarHBondContact OE1-SG 3.29Å
796	G	80.4	Confident	81.2	Confident	34 Å²	34	26.4 Å²	26.4	35%	0.351	15%	0.148	S	C	.	.	S	Bend	trans	75.1	-139.6	-173.7	0	0	0	0	0	111.3	P798 V799 D800	G796-P798 VanDerWaalsContact C-N 3.31Å; G796-P798 WeakPolarHBondContact O-CD 3.38Å; G796-V799 WeakPolarHBondContact O-CA 3.46Å; G796-V799 WeakPolarHBondContact O-CB 3.11Å; G796-V799 PolarHBondContact O-N 3.43Å; G796-D800 WeakPolarHBondContact CA-OD2 3.13Å; G796-D800 PolarHBondContact O-N 2.65Å; G796-D800 VanDerWaalsContact O-N 3.1Å
797	A	81.8	Confident	81.7	Confident	13 Å²	13	28.6 Å²	28.6	11%	0.107	16%	0.158	C	C	.	.	H	α-helix	trans	-45.1	-39.1	-168.4	0	0	0	0	0	116.3	V799 D800 R801 I1463	A797-V799 VanDerWaalsContact C-N 3.33Å; A797-V799 PolarHBondContact O-N 3.05Å; A797-D800 PolarHBondContact N-OD2 3.02Å; A797-D800 PolarHBondContact O-N 2.97Å; A797-R801 WeakPolarHBondContact O-CB 3.33Å; A797-R801 VanDerWaalsContact O-CD 3.26Å; A797-R801 WeakPolarHBondContact O-CD 3.36Å; A797-R801 WeakPolarHBondContact O-CG 2.84Å; A797-R801 PolarHBondContact O-N 3.48Å; A797-I1463 HydrophobicContact CB-CG2 3.9Å
798	P	86.5	Confident	82.1	Confident	24 Å²	24	29.6 Å²	29.6	16%	0.156	16%	0.163	C	C	.	.	H	α-helix	trans	-61.7	-35.1	174.1	-23.2	35	0	0	0	114.7	A793 G796 A802	A793-P798 HydrophobicContact CB-CG 4.25Å; G796-P798 VanDerWaalsContact C-N 3.31Å; G796-P798 WeakPolarHBondContact O-CD 3.38Å; P798-A802 VanDerWaalsContact O-CB 3.32Å; P798-A802 WeakPolarHBondContact O-CB 3.29Å; P798-A802 PolarHBondContact O-N 3.39Å
799	V	87.8	Confident	82.7	Confident	6 Å²	6	29.3 Å²	29.3	4%	0.036	16%	0.162	C	C	.	.	H	α-helix	trans	-76.4	-44.5	176	174.2	0	0	0	0	110.4	N720 T794 G796 A797 A802 R803 Y813 R815	N720-V799 WeakPolarHBondContact ND2-CG2 3.29Å; T794-V799 VanDerWaalsContact O-CG2 3.3Å; T794-V799 WeakPolarHBondContact O-CG2 3.36Å; G796-V799 WeakPolarHBondContact O-CA 3.46Å; G796-V799 WeakPolarHBondContact O-CB 3.11Å; G796-V799 PolarHBondContact O-N 3.43Å; A797-V799 VanDerWaalsContact C-N 3.33Å; A797-V799 PolarHBondContact O-N 3.05Å; V799-A802 PolarHBondContact O-N 3.44Å; V799-R803 WeakPolarHBondContact O-CB 3.48Å; V799-R803 PolarHBondContact O-N 3.19Å; V799-Y813 HydrophobicContact CG1-CE1 4.13Å; V799-R815 HydrophobicContact CG1-CB 4.13Å; V799-R815 HydrophobicContact CG1-CG 3.83Å; V799-R815 HydrophobicContact CG2-CG 4.31Å
800	D	83.7	Confident	83.1	Confident	86 Å²	86	33.4 Å²	33.4	46%	0.46	18%	0.184	S	C	.	.	H	α-helix	trans	-65.4	-46.1	-177	-54	-41.3	0	0	0	110.7	G796 A797 A802 R803 S804	G796-D800 WeakPolarHBondContact CA-OD2 3.13Å; G796-D800 PolarHBondContact O-N 2.65Å; G796-D800 VanDerWaalsContact O-N 3.1Å; A797-D800 PolarHBondContact N-OD2 3.02Å; A797-D800 PolarHBondContact O-N 2.97Å; D800-A802 PolarHBondContact O-N 3.2Å; D800-R803 WeakPolarHBondContact O-CB 3.11Å; D800-R803 PolarHBondContact O-N 3.02Å; D800-S804 PolarHBondContact O-N 3.35Å; D800-S804 PolarHBondContact O-OG 2.91Å
801	R	88.6	Confident	83.3	Confident	29 Å²	29	32.4 Å²	32.4	11%	0.109	18%	0.18	C	C	.	.	H	α-helix	trans	-59.9	-41.3	173.7	-66.2	164.2	180	162.6	-8.6	112.7	L723 A797 W805 I1463 V1469 D1470 S1473	L723-R801 HydrophobicContact CD1-CB 4.02Å; L723-R801 HydrophobicContact CD2-CB 3.96Å; A797-R801 WeakPolarHBondContact O-CB 3.33Å; A797-R801 VanDerWaalsContact O-CD 3.26Å; A797-R801 WeakPolarHBondContact O-CD 3.36Å; A797-R801 WeakPolarHBondContact O-CG 2.84Å; A797-R801 PolarHBondContact O-N 3.48Å; R801-W805 PolarHBondContact O-N 3.49Å; R801-W805 VanDerWaalsContact O-N 3.17Å; R801-I1463 PolarHBondContact NH2-O 2.75Å; R801-V1469 HydrophobicContact CB-CG1 3.98Å; R801-V1469 HydrophobicContact CG-CG1 3.86Å; R801-D1470 IonicContact CZ-OD1 3.85Å; R801-D1470 IonicContact CZ-OD2 2.78Å; R801-D1470 IonicContact NE-OD1 2.77Å; R801-D1470 PolarHBondContact NE-OD1 3.41Å; R801-D1470 IonicContact NE-OD2 3.57Å; R801-D1470 IonicContact NH2-OD1 3.79Å; R801-D1470 PolarHBondContact NH2-OD1 2.98Å; R801-D1470 IonicContact NH2-OD2 2.71Å; R801-D1470 PolarHBondContact NH2-OD2 3.4Å; R801-S1473 WeakPolarHBondContact CA-OG 3.14Å
802	A	89.2	Confident	83.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-68.5	-37.6	177.6	0	0	0	0	0	112.1	L723 P798 V799 D800 C806 Y813	L723-A802 HydrophobicContact CD2-CB 4.01Å; L723-A802 HydrophobicContact CG-CB 4.24Å; P798-A802 VanDerWaalsContact O-CB 3.32Å; P798-A802 WeakPolarHBondContact O-CB 3.29Å; P798-A802 PolarHBondContact O-N 3.39Å; V799-A802 PolarHBondContact O-N 3.44Å; D800-A802 PolarHBondContact O-N 3.2Å; A802-C806 WeakPolarHBondContact O-CB 3.49Å; A802-C806 PolarHBondContact O-N 2.89Å; A802-C806 PolarHBondContact O-SG 3.49Å; A802-Y813 HydrophobicContact CB-CE2 3.86Å
803	R	88.7	Confident	83.8	Confident	67 Å²	67	32.6 Å²	32.6	25%	0.253	18%	0.181	S	C	.	.	H	α-helix	trans	-61.8	-50.7	174.9	-172.3	-169.3	-72.1	-97	5.7	110.7	V799 D800 W805 C806 Q807 Y813 G1493	V799-R803 WeakPolarHBondContact O-CB 3.48Å; V799-R803 PolarHBondContact O-N 3.19Å; D800-R803 WeakPolarHBondContact O-CB 3.11Å; D800-R803 PolarHBondContact O-N 3.02Å; R803-W805 PolarHBondContact O-N 3.24Å; R803-C806 PolarHBondContact O-N 3.07Å; R803-Q807 HydrophobicContact CG-CG 4.49Å; R803-Q807 VanDerWaalsContact O-CG 3.25Å; R803-Q807 WeakPolarHBondContact O-CG 3.44Å; R803-Q807 PolarHBondContact O-N 3.36Å; R803-Q807 PolarHBondContact O-OE1 3.12Å; R803-Y813 HydrophobicContact CB-CD1 3.81Å; R803-Y813 HydrophobicContact CB-CE1 4.09Å; R803-Y813 HydrophobicContact CG-CD1 4.06Å; R803-G1493 PolarHBondContact NH1-O 3.25Å
804	S	84.8	Confident	84	Confident	13 Å²	13	34.8 Å²	34.8	9%	0.091	19%	0.188	C	C	.	.	H	α-helix	trans	-57.3	-47.9	178.5	-57.5	0	0	0	0	112.7	D800 C806 Q807 D808 S1473	D800-S804 PolarHBondContact O-N 3.35Å; D800-S804 PolarHBondContact O-OG 2.91Å; S804-C806 PolarHBondContact O-N 3.35Å; S804-Q807 WeakPolarHBondContact O-CB 3.45Å; S804-Q807 PolarHBondContact O-N 3.04Å; S804-Q807 VanDerWaalsContact O-N 3.07Å; S804-D808 PolarHBondContact O-N 3.36Å; S804-S1473 WeakPolarHBondContact CB-OG 3.46Å; S804-S1473 WeakPolarHBondContact OG-CA 3.28Å; S804-S1473 WeakPolarHBondContact OG-CB 3.5Å; S804-S1473 PolarHBondContact OG-OG 3Å
805	W	90.8	Very high	84.3	Confident	1 Å²	1	35.8 Å²	35.8	0%	0.004	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-41.1	-179.7	-172.5	2.1	0	0	0	111.7	L723 L726 R801 R803 Q807 L809 R1563 A1566 W1567	L723-W805 HydrophobicContact CD2-CE3 3.9Å; L723-W805 HydrophobicContact CD2-CZ3 4.32Å; L726-W805 HydrophobicContact CB-CD2 4.09Å; L726-W805 HydrophobicContact CB-CE3 3.86Å; L726-W805 HydrophobicContact CB-CH2 3.69Å; L726-W805 HydrophobicContact CB-CZ2 3.92Å; L726-W805 HydrophobicContact CB-CZ3 3.66Å; L726-W805 HydrophobicContact CD1-CB 4.24Å; L726-W805 HydrophobicContact CD1-CD2 3.78Å; L726-W805 HydrophobicContact CD1-CE3 3.68Å; L726-W805 HydrophobicContact CD1-CG 4.06Å; L726-W805 HydrophobicContact CD1-CZ3 4.31Å; L726-W805 HydrophobicContact CG-CE3 4.42Å; R801-W805 PolarHBondContact O-N 3.49Å; R801-W805 VanDerWaalsContact O-N 3.17Å; R803-W805 PolarHBondContact O-N 3.24Å; W805-Q807 VanDerWaalsContact C-N 3.31Å; W805-Q807 PolarHBondContact O-N 3.2Å; W805-L809 WeakPolarHBondContact O-CG 3.06Å; W805-L809 PolarHBondContact O-N 2.81Å; W805-R1563 HydrophobicContact CZ3-CB 4.43Å; W805-A1566 HydrophobicContact CH2-CB 3.78Å; W805-A1566 HydrophobicContact CZ2-CB 3.96Å; W805-W1567 HydrophobicContact CB-CD2 3.75Å; W805-W1567 HydrophobicContact CB-CE3 3.96Å; W805-W1567 HydrophobicContact CB-CG 4.34Å; W805-W1567 HydrophobicContact CB-CH2 4.09Å; W805-W1567 HydrophobicContact CB-CZ2 3.88Å; W805-W1567 HydrophobicContact CB-CZ3 4.13Å; W805-W1567 AromaticContact CD1-CD1 3.33Å; W805-W1567 AromaticContact CD1-CD2 3.86Å; W805-W1567 AromaticContact CD1-CE2 3.96Å; W805-W1567 AromaticContact CD1-CG 3.51Å; W805-W1567 AromaticContact CD1-NE1 3.64Å; W805-W1567 HydrophobicContact CD2-CB 3.88Å; W805-W1567 AromaticContact CD2-CD2 3.95Å; W805-W1567 HydrophobicContact CD2-CD2 3.95Å; W805-W1567 HydrophobicContact CD2-CE3 4.2Å; W805-W1567 AromaticContact CD2-CG 3.82Å; W805-W1567 HydrophobicContact CD2-CG 3.82Å; W805-W1567 AromaticContact CE2-CG 3.84Å; W805-W1567 HydrophobicContact CE3-CB 4.39Å; W805-W1567 HydrophobicContact CE3-CD2 4.5Å; W805-W1567 HydrophobicContact CE3-CE3 4.3Å; W805-W1567 HydrophobicContact CG-CB 4.26Å; W805-W1567 AromaticContact CG-CD1 3.88Å; W805-W1567 AromaticContact CG-CD2 3.59Å; W805-W1567 HydrophobicContact CG-CD2 3.59Å; W805-W1567 AromaticContact CG-CE2 3.85Å; W805-W1567 HydrophobicContact CG-CE3 4.07Å; W805-W1567 AromaticContact CG-CG 3.66Å; W805-W1567 HydrophobicContact CG-CG 3.66Å; W805-W1567 HydrophobicContact CH2-CB 4.39Å; W805-W1567 HydrophobicContact CZ2-CB 3.89Å; W805-W1567 AromaticContact NE1-CD1 3.63Å; W805-W1567 AromaticContact NE1-CG 3.64Å
806	C	86.7	Confident	84.4	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-62.9	-36.4	171.5	-75.1	0	0	0	0	112.6	A802 R803 S804 L809 N810 I811 Y813	A802-C806 WeakPolarHBondContact O-CB 3.49Å; A802-C806 PolarHBondContact O-N 2.89Å; A802-C806 PolarHBondContact O-SG 3.49Å; R803-C806 PolarHBondContact O-N 3.07Å; S804-C806 PolarHBondContact O-N 3.35Å; C806-L809 CarbonylContact O-C 3.58Å; C806-L809 PolarHBondContact O-N 3.29Å; C806-N810 PolarHBondContact O-N 3.19Å; C806-I811 CarbonylContact C-O 3.59Å; C806-I811 HydrophobicContact CB-CB 3.99Å; C806-I811 HydrophobicContact CB-CG2 4.32Å; C806-I811 WeakPolarHBondContact O-CA 3.23Å; C806-I811 WeakPolarHBondContact O-CB 3.37Å; C806-I811 PolarHBondContact O-N 2.92Å; C806-Y813 HydrophobicContact CB-CD2 4.43Å; C806-Y813 HydrophobicContact CB-CG 4.36Å
807	Q	81.5	Confident	84.4	Confident	48 Å²	48	37.3 Å²	37.3	22%	0.224	19%	0.189	C	C	.	.	H	α-helix	trans	-68.2	-44.3	178.1	-72.2	167.6	-52.9	0	0	112.8	R803 S804 W805 L809 N810 Q1476 M1480	R803-Q807 HydrophobicContact CG-CG 4.49Å; R803-Q807 VanDerWaalsContact O-CG 3.25Å; R803-Q807 WeakPolarHBondContact O-CG 3.44Å; R803-Q807 PolarHBondContact O-N 3.36Å; R803-Q807 PolarHBondContact O-OE1 3.12Å; S804-Q807 WeakPolarHBondContact O-CB 3.45Å; S804-Q807 PolarHBondContact O-N 3.04Å; S804-Q807 VanDerWaalsContact O-N 3.07Å; W805-Q807 VanDerWaalsContact C-N 3.31Å; W805-Q807 PolarHBondContact O-N 3.2Å; Q807-L809 PolarHBondContact O-N 3.38Å; Q807-N810 PolarHBondContact O-N 3.14Å; Q807-Q1476 HydrophobicContact CB-CG 4.26Å; Q807-M1480 PolarHBondContact NE2-SD 2.96Å
808	D	80.2	Confident	84.1	Confident	28 Å²	28	39.9 Å²	39.9	15%	0.15	20%	0.204	C	C	.	.	H	α-helix	trans	-53.6	-39.1	172.4	-91.5	-42.1	0	0	0	111.5	S804 N810 Q1476 K1479 W1567 M1571	S804-D808 PolarHBondContact O-N 3.36Å; D808-N810 VanDerWaalsContact C-N 3.33Å; D808-N810 PolarHBondContact O-N 3.08Å; D808-Q1476 PolarHBondContact OD1-OE1 3.14Å; D808-Q1476 VanDerWaalsContact OD1-OE1 3.07Å; D808-K1479 IonicContact OD1-NZ 2.86Å; D808-K1479 PolarHBondContact OD1-NZ 3.47Å; D808-W1567 VanDerWaalsContact OD2-CZ2 3.31Å; D808-W1567 WeakPolarHBondContact OD2-CZ2 3.08Å; D808-W1567 PolarHBondContact OD2-NE1 3.19Å; D808-M1571 HydrophobicContact CB-SD 4.22Å
809	L	82.3	Confident	83.4	Confident	49 Å²	49	44 Å²	44	26%	0.257	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	6.7	-179.3	-60.6	-179.9	0	0	0	114.2	W805 C806 Q807 I811 E1570	W805-L809 WeakPolarHBondContact O-CG 3.06Å; W805-L809 PolarHBondContact O-N 2.81Å; C806-L809 CarbonylContact O-C 3.58Å; C806-L809 PolarHBondContact O-N 3.29Å; Q807-L809 PolarHBondContact O-N 3.38Å; L809-I811 HydrophobicContact CB-CD1 3.65Å; L809-I811 HydrophobicContact CB-CG1 3.86Å; L809-I811 HydrophobicContact CD1-CD1 3.97Å; L809-I811 HydrophobicContact CG-CD1 4.48Å; L809-I811 PolarHBondContact O-N 2.82Å; L809-E1570 HydrophobicContact CD1-CB 4.37Å; L809-E1570 HydrophobicContact CD2-CB 4.08Å
810	N	78.4	Confident	82.7	Confident	125 Å²	125	45 Å²	45	67%	0.668	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.7	34.2	-176.5	-68.5	-90.2	0	0	0	114.1	K536 C806 Q807 D808	K536-N810 PolarHBondContact NZ-O 3.17Å; C806-N810 PolarHBondContact O-N 3.19Å; Q807-N810 PolarHBondContact O-N 3.14Å; D808-N810 VanDerWaalsContact C-N 3.33Å; D808-N810 PolarHBondContact O-N 3.08Å
811	I	80.6	Confident	81.8	Confident	16 Å²	16	46.2 Å²	46.2	8%	0.082	25%	0.25	C	S	.	.			trans	-96.8	122.2	176.5	-57.7	168.5	0	0	0	109.4	V747 F750 C806 L809 Y813	V747-I811 HydrophobicContact CB-CD1 3.91Å; V747-I811 HydrophobicContact CB-CG1 4.36Å; V747-I811 HydrophobicContact CG1-CD1 4.12Å; V747-I811 HydrophobicContact CG1-CG1 4.44Å; V747-I811 HydrophobicContact CG1-CG2 3.75Å; F750-I811 HydrophobicContact CB-CG2 3.97Å; C806-I811 CarbonylContact C-O 3.59Å; C806-I811 HydrophobicContact CB-CB 3.99Å; C806-I811 HydrophobicContact CB-CG2 4.32Å; C806-I811 WeakPolarHBondContact O-CA 3.23Å; C806-I811 WeakPolarHBondContact O-CB 3.37Å; C806-I811 PolarHBondContact O-N 2.92Å; L809-I811 HydrophobicContact CB-CD1 3.65Å; L809-I811 HydrophobicContact CB-CG1 3.86Å; L809-I811 HydrophobicContact CD1-CD1 3.97Å; L809-I811 HydrophobicContact CG-CD1 4.48Å; L809-I811 PolarHBondContact O-N 2.82Å; I811-Y813 PolarHBondContact O-N 3.08Å
812	P	77.6	Confident	80.7	Confident	53 Å²	53	46.8 Å²	46.8	34%	0.344	25%	0.254	S	S	.	.			trans	-61.7	115.8	169	-23.5	34.9	0	0	0	111.7	G748 F750 F814	G748-P812 WeakPolarHBondContact O-CD 3.3Å; F750-P812 PolarHBondContact N-O 2.87Å; P812-F814 HydrophobicContact CB-CD2 4.43Å; P812-F814 HydrophobicContact CB-CE2 3.63Å; P812-F814 HydrophobicContact CB-CZ 4.13Å
813	Y	82.8	Confident	79.7	Confident	17 Å²	17	51.3 Å²	51.3	7%	0.067	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	116.3	177.5	178.7	-96	0	0	0	111.4	F750 S752 V799 A802 R803 C806 I811 R815	F750-Y813 HydrophobicContact CB-CD2 4.15Å; F750-Y813 AromaticContact CD1-CD2 3.61Å; F750-Y813 HydrophobicContact CD1-CD2 3.61Å; F750-Y813 AromaticContact CD1-CE2 3.65Å; F750-Y813 HydrophobicContact CD1-CE2 3.65Å; F750-Y813 HydrophobicContact CE1-CD2 4.36Å; F750-Y813 AromaticContact CE1-CE2 3.98Å; F750-Y813 HydrophobicContact CE1-CE2 3.98Å; F750-Y813 HydrophobicContact CG-CD2 4.08Å; F750-Y813 WeakPolarHBondContact O-CA 3.14Å; S752-Y813 WeakPolarHBondContact CB-OH 3.32Å; S752-Y813 PolarHBondContact OG-OH 3.29Å; V799-Y813 HydrophobicContact CG1-CE1 4.13Å; A802-Y813 HydrophobicContact CB-CE2 3.86Å; R803-Y813 HydrophobicContact CB-CD1 3.81Å; R803-Y813 HydrophobicContact CB-CE1 4.09Å; R803-Y813 HydrophobicContact CG-CD1 4.06Å; C806-Y813 HydrophobicContact CB-CD2 4.43Å; C806-Y813 HydrophobicContact CB-CG 4.36Å; I811-Y813 PolarHBondContact O-N 3.08Å; Y813-R815 HydrophobicContact CE1-CB 3.93Å
814	F	85.8	Confident	78.9	Confident	61 Å²	61	50.4 Å²	50.4	27%	0.268	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	114.4	179.9	-62	-81.6	0	0	0	110.9	F750 S752 P812 F816	F750-F814 PolarHBondContact O-N 2.72Å; S752-F814 PolarHBondContact N-O 3.01Å; P812-F814 HydrophobicContact CB-CD2 4.43Å; P812-F814 HydrophobicContact CB-CE2 3.63Å; P812-F814 HydrophobicContact CB-CZ 4.13Å; F814-F816 HydrophobicContact CB-CD2 4.36Å; F814-F816 HydrophobicContact CB-CE2 3.63Å; F814-F816 HydrophobicContact CB-CZ 4.11Å
815	R	88.9	Confident	78.3	Confident	38 Å²	38	54.2 Å²	54.2	14%	0.143	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	119.5	172.6	-179.2	65.3	-179.3	170.8	3.4	110.7	D548 N720 S752 T794 E795 V799 Y813	D548-R815 IonicContact OD1-CZ 2.99Å; D548-R815 IonicContact OD1-NH1 2.71Å; D548-R815 PolarHBondContact OD1-NH1 3.22Å; D548-R815 IonicContact OD1-NH2 2.68Å; D548-R815 IonicContact OD2-CZ 3.33Å; D548-R815 IonicContact OD2-NH1 2.73Å; D548-R815 PolarHBondContact OD2-NH1 3.45Å; D548-R815 VanDerWaalsContact OD2-NH1 3.17Å; D548-R815 IonicContact OD2-NH2 3.73Å; D548-R815 PolarHBondContact OD2-NH2 3.29Å; N720-R815 PolarHBondContact ND2-NH1 2.76Å; S752-R815 WeakPolarHBondContact O-CA 3.42Å; S752-R815 PolarHBondContact OG-NH1 3.46Å; T794-R815 PolarHBondContact O-NH2 3.31Å; E795-R815 IonicContact OE1-CZ 2.95Å; E795-R815 VanDerWaalsContact OE1-CZ 3.27Å; E795-R815 IonicContact OE1-NE 3.27Å; E795-R815 PolarHBondContact OE1-NE 2.7Å; E795-R815 IonicContact OE1-NH2 2.76Å; E795-R815 PolarHBondContact OE1-NH2 2.86Å; V799-R815 HydrophobicContact CG1-CB 4.13Å; V799-R815 HydrophobicContact CG1-CG 3.83Å; V799-R815 HydrophobicContact CG2-CG 4.31Å; Y813-R815 HydrophobicContact CE1-CB 3.93Å
816	F	85	Confident	77.6	Confident	78 Å²	78	56.6 Å²	56.6	34%	0.342	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	114.2	173.6	-60	-83.8	0	0	0	110.4	T560 I564 L751 S752 V753 G754 F814	T560-F816 HydrophobicContact CG2-CB 3.68Å; T560-F816 HydrophobicContact CG2-CG 4.08Å; I564-F816 HydrophobicContact CD1-CD2 4.35Å; I564-F816 HydrophobicContact CD1-CE2 4.12Å; I564-F816 HydrophobicContact CD1-CZ 4.45Å; L751-F816 HydrophobicContact CD2-CE2 4.33Å; S752-F816 PolarHBondContact O-N 3.5Å; V753-F816 WeakPolarHBondContact CA-O 3.46Å; V753-F816 HydrophobicContact CG1-CB 4.41Å; V753-F816 HydrophobicContact CG2-CD2 4.34Å; G754-F816 PolarHBondContact N-O 2.7Å; F814-F816 HydrophobicContact CB-CD2 4.36Å; F814-F816 HydrophobicContact CB-CE2 3.63Å; F814-F816 HydrophobicContact CB-CZ 4.11Å
817	C	81.7	Confident	77	Confident	31 Å²	31	57.3 Å²	57.3	21%	0.209	30%	0.304	C	S	.	.			trans	-149.7	114.1	177.5	-167.3	0	0	0	0	110.4	G756 R757 E795	G756-C817 VanDerWaalsContact CA-SG 3.58Å; R757-C817 PolarHBondContact N-SG 3.24Å; E795-C817 WeakPolarHBondContact OE1-CB 3.49Å; E795-C817 PolarHBondContact OE1-SG 3.29Å
818	T	74.5	Confident	76.5	Confident	67 Å²	67	56 Å²	56	41%	0.411	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-77.4	133.6	-174.3	-47.3	0	0	0	0	111.6	G756 R757 L820	G756-T818 CarbonylContact C-O 3.56Å; G756-T818 WeakPolarHBondContact CA-O 3.23Å; R757-T818 PolarHBondContact N-O 3.48Å; T818-L820 PolarHBondContact O-N 3.42Å
819	P	72.4	Confident	75.9	Confident	110 Å²	110	56.7 Å²	56.7	71%	0.714	31%	0.305	S	S	*	.	B	Isolated β-bridge	trans	-66.7	126.2	169.5	27.5	-33.2	0	0	0	110.6
820	L	72.5	Confident	75	Confident	28 Å²	28	56.1 Å²	56.1	15%	0.147	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-93	147.4	-179.7	-57.8	177.9	0	0	0	110.5	V556 R757 P759 T818 K822 F824	V556-L820 HydrophobicContact CG2-CD2 4.36Å; R757-L820 WeakPolarHBondContact O-CB 3.46Å; R757-L820 PolarHBondContact O-N 3.11Å; P759-L820 VanDerWaalsContact CD-O 3.3Å; P759-L820 WeakPolarHBondContact CD-O 3.48Å; P759-L820 VanDerWaalsContact CG-O 3.23Å; P759-L820 WeakPolarHBondContact CG-O 3.35Å; T818-L820 PolarHBondContact O-N 3.42Å; L820-K822 VanDerWaalsContact C-N 3.33Å; L820-K822 PolarHBondContact O-N 3.22Å; L820-F824 HydrophobicContact CB-CD2 4.49Å; L820-F824 HydrophobicContact CB-CE2 4.28Å; L820-F824 HydrophobicContact CD1-CD2 4.1Å
821	S	65.6	Low	74	Confident	111 Å²	111	52.7 Å²	52.7	78%	0.776	29%	0.287	S	S	*	.	S	Bend	trans	-76.1	-15.3	-178.4	58.2	0	0	0	0	114.9
822	K	65	Low	72.3	Confident	42 Å²	42	59.3 Å²	59.3	18%	0.183	32%	0.317	C	S	.	.	S	Bend	trans	-157.5	173.6	175	58.1	-177.6	170.9	-178.8	0	110.7	L820 F824 M834	L820-K822 VanDerWaalsContact C-N 3.33Å; L820-K822 PolarHBondContact O-N 3.22Å; K822-F824 HydrophobicContact CG-CD2 4.4Å; K822-F824 HydrophobicContact CG-CE2 3.95Å; K822-F824 HydrophobicContact CG-CZ 4.3Å; K822-F824 VanDerWaalsContact O-CD2 3.26Å; K822-F824 WeakPolarHBondContact O-CD2 3.4Å; K822-M834 VanDerWaalsContact NZ-CB 3.26Å; K822-M834 VanDerWaalsContact NZ-CE 3.32Å
823	H	68.6	Low	70.5	Confident	95 Å²	95	61.3 Å²	61.3	44%	0.44	33%	0.325	S	S	.	.			trans	-72	133.1	168.6	-164.6	-73.6	0	0	0	110.3
824	F	71.3	Confident	68.8	Low	48 Å²	48	63.7 Å²	63.7	21%	0.211	34%	0.337	C	S	.	.			trans	-114.7	141.2	172.2	-67.4	-105.9	0	0	0	108.3	R553 L820 K822 M834	R553-F824 HydrophobicContact CG-CB 4.07Å; L820-F824 HydrophobicContact CB-CD2 4.49Å; L820-F824 HydrophobicContact CB-CE2 4.28Å; L820-F824 HydrophobicContact CD1-CD2 4.1Å; K822-F824 HydrophobicContact CG-CD2 4.4Å; K822-F824 HydrophobicContact CG-CE2 3.95Å; K822-F824 HydrophobicContact CG-CZ 4.3Å; K822-F824 VanDerWaalsContact O-CD2 3.26Å; K822-F824 WeakPolarHBondContact O-CD2 3.4Å; F824-M834 HydrophobicContact CD1-SD 4.16Å; F824-M834 HydrophobicContact CE1-CE 3.65Å; F824-M834 HydrophobicContact CE1-CG 4.47Å; F824-M834 HydrophobicContact CE1-SD 3.71Å; F824-M834 HydrophobicContact CZ-CE 4.06Å
825	F	71.9	Confident	66.4	Low	92 Å²	92	64.7 Å²	64.7	40%	0.404	34%	0.342	S	S	.	.			trans	-85.8	160.2	177.4	-64.8	-72.7	0	0	0	111.4	D827 T828	F825-D827 WeakPolarHBondContact CB-OD1 3.45Å; F825-D827 PolarHBondContact O-N 3.06Å; F825-T828 PolarHBondContact N-OG1 2.73Å; F825-T828 PolarHBondContact O-N 3.04Å; F825-T828 PolarHBondContact O-OG1 2.97Å
826	L	75.7	Confident	63.7	Low	52 Å²	52	65.2 Å²	65.2	27%	0.272	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-21	-176.7	-55.5	-176.1	0	0	0	113.1	G550 G551 T552 Y703	G550-L826 VanDerWaalsContact C-CD2 3.43Å; G550-L826 WeakPolarHBondContact O-CD2 3.45Å; G551-L826 CarbonylContact C-O 3.42Å; G551-L826 WeakPolarHBondContact CA-O 3.46Å; T552-L826 PolarHBondContact N-O 3.33Å; Y703-L826 HydrophobicContact CD2-CD1 4.19Å; Y703-L826 HydrophobicContact CE1-CB 4.09Å; Y703-L826 HydrophobicContact CE2-CB 4.25Å; Y703-L826 HydrophobicContact CE2-CD1 3.66Å; Y703-L826 HydrophobicContact CE2-CG 4.22Å
827	D	74.5	Confident	61.1	Low	14 Å²	14	65.6 Å²	65.6	8%	0.075	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.3	29.3	-179.5	64	-22.5	0	0	0	112.3	F629 R634 Y636 Y703 F825 T829	F629-D827 HydrophobicContact CD1-CB 3.84Å; F629-D827 HydrophobicContact CD2-CB 4.33Å; F629-D827 HydrophobicContact CE1-CB 3.86Å; F629-D827 HydrophobicContact CE2-CB 4.36Å; F629-D827 HydrophobicContact CG-CB 4.08Å; F629-D827 HydrophobicContact CZ-CB 4.13Å; R634-D827 IonicContact CZ-OD1 2.74Å; R634-D827 IonicContact CZ-OD2 2.64Å; R634-D827 IonicContact NE-OD2 2.96Å; R634-D827 PolarHBondContact NE-OD2 3.14Å; R634-D827 IonicContact NH2-OD1 2.68Å; R634-D827 PolarHBondContact NH2-OD1 2.74Å; R634-D827 IonicContact NH2-OD2 3.95Å; R634-D827 PolarHBondContact NH2-OD2 2.92Å; Y636-D827 HydrophobicContact CE2-CB 4.07Å; Y636-D827 PolarHBondContact OH-OD2 3.43Å; Y703-D827 HydrophobicContact CD1-CB 4.01Å; Y703-D827 HydrophobicContact CE1-CB 3.87Å; Y703-D827 VanDerWaalsContact CE1-CG 3.45Å; F825-D827 WeakPolarHBondContact CB-OD1 3.45Å; F825-D827 PolarHBondContact O-N 3.06Å; D827-T829 PolarHBondContact O-N 3.49Å
828	T	71.8	Confident	58.6	Low	22 Å²	22	66.3 Å²	66.3	14%	0.135	37%	0.366	C	S	.	.			trans	-64.5	103.9	177.1	-49.7	0	0	0	0	109	T552 F825 M834	T552-T828 PolarHBondContact OG1-N 3.34Å; T552-T828 PolarHBondContact OG1-O 3.3Å; F825-T828 PolarHBondContact N-OG1 2.73Å; F825-T828 PolarHBondContact O-N 3.04Å; F825-T828 PolarHBondContact O-OG1 2.97Å; T828-M834 HydrophobicContact CG2-CG 4.4Å; T828-M834 HydrophobicContact CG2-SD 4.34Å
829	T	67.5	Low	56.5	Low	41 Å²	41	70.2 Å²	70.2	25%	0.252	38%	0.379	S	S	.	.			trans	-93.5	-47.3	-179.2	41.5	0	0	0	0	112.7	K625 F629 D827	K625-T829 PolarHBondContact NZ-O 2.94Å; F629-T829 HydrophobicContact CB-CG2 3.28Å; F629-T829 HydrophobicContact CD2-CG2 4.36Å; F629-T829 HydrophobicContact CG-CG2 4.25Å; D827-T829 PolarHBondContact O-N 3.49Å
830	S	62.2	Low	54.3	Low	38 Å²	38	70.3 Å²	70.3	27%	0.266	38%	0.378	S	S	.	.			trans	-57.8	136	-177.2	54.3	0	0	0	0	111	E832 D833	S830-E832 PolarHBondContact O-N 2.75Å; S830-D833 WeakPolarHBondContact CB-O 3.48Å; S830-D833 WeakPolarHBondContact OG-CA 3.22Å; S830-D833 PolarHBondContact OG-N 2.76Å; S830-D833 VanDerWaalsContact OG-N 3.13Å; S830-D833 PolarHBondContact OG-O 2.98Å
831	D	57.2	Low	52.2	Low	53 Å²	53	75.6 Å²	75.6	28%	0.283	40%	0.396	S	S	.	.	S	Bend	trans	-75.1	-10.6	172.3	-50.4	-53.6	0	0	0	110.9	L464 K625	L464-D831 HydrophobicContact CD2-CB 3.95Å; K625-D831 WeakPolarHBondContact CE-OD1 3.42Å; K625-D831 IonicContact NZ-OD1 3.27Å; K625-D831 PolarHBondContact NZ-OD1 2.78Å; K625-D831 IonicContact NZ-OD2 3.91Å
832	E	45.5	Very low	50.3	Low	155 Å²	155	77.5 Å²	77.5	72%	0.724	39%	0.387	S	S	*	.	S	Bend	trans	-121	-35.9	-177.2	-60.6	-173	165.7	0	0	116.6	S830 M834	S830-E832 PolarHBondContact O-N 2.75Å; E832-M834 WeakPolarHBondContact O-CB 3.45Å
833	D	41.2	Very low	48.7	Very low	94 Å²	94	82 Å²	82	50%	0.503	41%	0.412	S	S	.	.			trans	-131.9	97.3	-153.5	176.4	36	0	0	0	116.9	S830 K835	S830-D833 WeakPolarHBondContact CB-O 3.48Å; S830-D833 WeakPolarHBondContact OG-CA 3.22Å; S830-D833 PolarHBondContact OG-N 2.76Å; S830-D833 VanDerWaalsContact OG-N 3.13Å; S830-D833 PolarHBondContact OG-O 2.98Å; D833-K835 WeakPolarHBondContact OD1-CA 3.3Å; D833-K835 PolarHBondContact OD1-N 2.9Å
834	M	46.9	Very low	47	Very low	67 Å²	67	82.8 Å²	82.8	33%	0.33	43%	0.426	S	S	.	.			cis	80.7	3.1	2.6	-82.7	154.5	84.7	0	0	118.9	K822 F824 T828 E832	K822-M834 VanDerWaalsContact NZ-CB 3.26Å; K822-M834 VanDerWaalsContact NZ-CE 3.32Å; F824-M834 HydrophobicContact CD1-SD 4.16Å; F824-M834 HydrophobicContact CE1-CE 3.65Å; F824-M834 HydrophobicContact CE1-CG 4.47Å; F824-M834 HydrophobicContact CE1-SD 3.71Å; F824-M834 HydrophobicContact CZ-CE 4.06Å; T828-M834 HydrophobicContact CG2-CG 4.4Å; T828-M834 HydrophobicContact CG2-SD 4.34Å; E832-M834 WeakPolarHBondContact O-CB 3.45Å
835	K	34.3	Very low	45.2	Very low	82 Å²	82	85.2 Å²	85.2	36%	0.357	45%	0.448	S	S	.	.			trans	153.7	137.5	145.1	-81.4	151.6	-168.9	177	0	117.7	Y18 H21 D833	Y18-K835 HydrophobicContact CE1-CD 4.27Å; H21-K835 HydrophobicContact CB-CB 4.45Å; D833-K835 WeakPolarHBondContact OD1-CA 3.3Å; D833-K835 PolarHBondContact OD1-N 2.9Å
836	V	33.1	Very low	44.3	Very low	49 Å²	49	83.5 Å²	83.5	30%	0.297	45%	0.448	S	S	.	.			cis	135.4	0	-7.2	159.8	0	0	0	0	115.2	H21 N23	H21-V836 PolarHBondContact ND1-O 3.48Å; N23-V836 WeakPolarHBondContact O-CG1 3.36Å
837	M	29.7	Very low	43.8	Very low	86 Å²	86	84.2 Å²	84.2	42%	0.424	46%	0.456	S	S	.	.				0	0	0	-85.9	-171.2	-129.9	0	0	114.9	N23 W24 P26	N23-M837 VanDerWaalsContact CB-C 3.48Å; N23-M837 HydrophobicContact CB-CB 3.96Å; N23-M837 WeakPolarHBondContact CB-O 3.09Å; N23-M837 PolarHBondContact ND2-O 2.65Å; W24-M837 HydrophobicContact CB-CB 4.12Å; W24-M837 HydrophobicContact CB-SD 3.74Å; W24-M837 HydrophobicContact CD2-CB 4.26Å; W24-M837 HydrophobicContact CD2-SD 4.42Å; W24-M837 HydrophobicContact CE3-SD 4.09Å; W24-M837 HydrophobicContact CG-CB 3.93Å; W24-M837 HydrophobicContact CG-SD 4.26Å; W24-M837 VanDerWaalsContact O-CE 3.22Å; W24-M837 WeakPolarHBondContact O-CE 3.21Å; P26-M837 HydrophobicContact CG-CE 4.14Å
838	G	28.7	Very low	43.6	Very low	47 Å²	47	91.4 Å²	91.4	49%	0.485	49%	0.486	S	S	.	.				0	0	0	0	0	0	0	0	126.4	N23	N23-G838 WeakPolarHBondContact ND2-CA 3.26Å
839	E	31.4	Very low	43.4	Very low	148 Å²	148	96 Å²	96	69%	0.692	51%	0.506	S	S	*	.				0	0	0	-54.7	175.9	-164.6	0	0	120.6	W24	W24-E839 HydrophobicContact CH2-CB 3.77Å; W24-E839 HydrophobicContact CH2-CG 3.47Å; W24-E839 VanDerWaalsContact CH2-CG 3.47Å; W24-E839 WeakPolarHBondContact CH2-OE1 3.38Å; W24-E839 HydrophobicContact CZ2-CB 3.59Å; W24-E839 HydrophobicContact CZ2-CG 3.71Å; W24-E839 HydrophobicContact CZ3-CG 4.35Å
840	T	24.8	Very low	43.9	Very low	112 Å²	112	94.9 Å²	94.9	69%	0.687	50%	0.498	S	S	*	.				0	174.7	0	84.9	0	0	0	0	122.2	K61	K61-T840 PolarHBondContact NZ-OG1 3.27Å
841	W	28.7	Very low	44.4	Very low	139 Å²	139	95.6 Å²	95.6	53%	0.527	50%	0.501	S	S	.	.			trans	-126.4	-148.1	-157.1	-33.6	-58.2	0	0	0	124.4	A60 K61	A60-W841 HydrophobicContact CB-CB 4.07Å; A60-W841 HydrophobicContact CB-CD2 3.92Å; A60-W841 HydrophobicContact CB-CE3 3.71Å; A60-W841 HydrophobicContact CB-CG 4.09Å; A60-W841 HydrophobicContact CB-CZ3 4.45Å; A60-W841 WeakPolarHBondContact O-CB 3.43Å; K61-W841 HydrophobicContact CB-CB 4.37Å; K61-W841 VanDerWaalsContact CD-O 3.25Å; K61-W841 WeakPolarHBondContact CD-O 3.35Å; K61-W841 WeakPolarHBondContact CE-O 3.46Å; K61-W841 HydrophobicContact CG-CB 4.09Å; K61-W841 HydrophobicContact CG-CE3 4.38Å; K61-W841 VanDerWaalsContact NZ-N 3.19Å; K61-W841 PolarHBondContact NZ-O 2.79Å
842	W	26.5	Very low	45.3	Very low	152 Å²	152	96.7 Å²	96.7	58%	0.576	50%	0.504	S	S	*	.			trans	-136.3	-125.1	-165.9	61.3	99.1	0	0	0	125.2	Y59 A60 K61	Y59-W842 WeakPolarHBondContact O-CZ2 3.25Å; Y59-W842 PolarHBondContact O-NE1 2.88Å; A60-W842 PolarHBondContact O-N 3.23Å; K61-W842 WeakPolarHBondContact CB-O 3.27Å
843	L	32	Very low	46.5	Very low	136 Å²	136	90 Å²	90	71%	0.712	47%	0.473	S	S	*	.			trans	-121.2	177.4	-157.7	-93.1	172.9	0	0	0	118.5
844	P	32	Very low	47.6	Very low	112 Å²	112	89.1 Å²	89.1	73%	0.727	47%	0.473	S	S	*	.			trans	-116	-177.8	-174.4	43.9	-34.2	0	0	0	118.9
845	S	33.7	Very low	48.5	Very low	99 Å²	99	91 Å²	91	69%	0.692	49%	0.49	S	S	*	.			trans	-125.9	-3.3	-143.8	57.1	0	0	0	0	123.9
846	S	52.7	Low	49.8	Very low	55 Å²	55	90.5 Å²	90.5	39%	0.385	49%	0.488	S	S	.	.			trans	-104.1	132.9	-171.1	-176.2	0	0	0	0	115.8	R902	S846-R902 PolarHBondContact O-NH1 2.76Å; S846-R902 PolarHBondContact O-NH2 3.17Å
847	P	64.6	Low	51.1	Low	68 Å²	68	90.1 Å²	90.1	44%	0.442	49%	0.49	S	S	.	.	S	Bend	trans	-84.5	-24	-178.4	31.8	-35.1	0	0	0	115.6	R902	P847-R902 HydrophobicContact CB-CB 4.26Å; P847-R902 PolarHBondContact O-N 3.5Å; P847-R902 VanDerWaalsContact O-N 3.16Å; P847-R902 PolarHBondContact O-NE 3.41Å; P847-R902 PolarHBondContact O-NH2 3.2Å
848	K	70.4	Confident	52.8	Low	164 Å²	164	88.1 Å²	88.1	71%	0.713	48%	0.481	S	S	*	.	S	Bend	trans	-87.7	-9.5	-177.2	-69	-173.7	178.4	-178.2	0	114.2
849	E	67.6	Low	54.8	Low	120 Å²	120	92.6 Å²	92.6	56%	0.561	49%	0.487	S	S	*	.	S	Bend	trans	-69.3	140.6	177.5	-173.9	174.6	179.9	0	0	111.4	V851 R902	E849-V851 HydrophobicContact CB-CG2 4.39Å; E849-V851 HydrophobicContact CG-CG2 4.3Å; E849-V851 PolarHBondContact O-N 3.37Å; E849-V851 VanDerWaalsContact O-N 3.12Å; E849-R902 PolarHBondContact O-NH2 3Å
850	I	79.1	Confident	56.4	Low	16 Å²	16	90.6 Å²	90.6	8%	0.082	49%	0.485	C	S	.	.			trans	-77.4	97.2	174.2	-54.7	-179.1	0	0	0	109.3	L898 S899 L900 R929 D933 L936	I850-L898 HydrophobicContact CG2-CB 4.07Å; I850-L898 HydrophobicContact CG2-CD1 4.35Å; I850-S899 VanDerWaalsContact CA-O 3.26Å; I850-S899 WeakPolarHBondContact CA-O 3.42Å; I850-L900 HydrophobicContact CG2-CD2 4.14Å; I850-R929 PolarHBondContact O-NH2 2.96Å; I850-D933 HydrophobicContact CD1-CB 3.77Å; I850-L936 HydrophobicContact CD1-CD1 3.62Å
851	V	73.2	Confident	58.6	Low	53 Å²	53	86.4 Å²	86.4	32%	0.321	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.6	179.2	-177.2	0	0	0	0	109.6	E849 S899	E849-V851 HydrophobicContact CB-CG2 4.39Å; E849-V851 HydrophobicContact CG-CG2 4.3Å; E849-V851 PolarHBondContact O-N 3.37Å; E849-V851 VanDerWaalsContact O-N 3.12Å; V851-S899 PolarHBondContact N-O 2.99Å; V851-S899 VanDerWaalsContact N-O 3.17Å; V851-S899 PolarHBondContact O-N 3.19Å
852	E	75.3	Confident	61.1	Low	77 Å²	77	86.3 Å²	86.3	36%	0.36	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.9	170.5	176.3	170.5	173.1	0	0	106.7	P854 H896 L898 R929	E852-P854 WeakPolarHBondContact O-CD 3.23Å; E852-H896 IonicContact OE1-CE1 3.49Å; E852-H896 IonicContact OE1-CG 3.38Å; E852-H896 IonicContact OE1-ND1 3.24Å; E852-H896 PolarHBondContact OE1-ND1 3.3Å; E852-L898 HydrophobicContact CB-CD2 3.74Å; E852-L898 HydrophobicContact CG-CD2 4.06Å; E852-R929 IonicContact OE2-NH1 3.84Å; E852-R929 PolarHBondContact OE2-NH1 3.45Å
853	I	69.6	Low	63.9	Low	13 Å²	13	82.7 Å²	82.7	7%	0.067	45%	0.453	C	S	.	.			trans	-71.5	116.4	-173.7	-56.1	165.6	0	0	0	106.7	A857 L858 L861 T888 I897	I853-A857 HydrophobicContact CG2-CB 4.01Å; I853-L858 HydrophobicContact CB-CD1 3.77Å; I853-L858 HydrophobicContact CD1-CD1 4.11Å; I853-L858 HydrophobicContact CG2-CB 3.98Å; I853-L858 HydrophobicContact CG2-CD1 3.82Å; I853-L861 HydrophobicContact CD1-CD1 3.91Å; I853-L861 HydrophobicContact CG2-CD1 4.06Å; I853-T888 HydrophobicContact CD1-CG2 3.82Å; I853-I897 HydrophobicContact CD1-CG2 4.44Å; I853-I897 PolarHBondContact N-O 2.77Å; I853-I897 VanDerWaalsContact N-O 3.12Å
854	P	65.3	Low	66.5	Low	77 Å²	77	79.3 Å²	79.3	50%	0.5	44%	0.435	S	S	.	.			trans	-59	142	179.8	-23.6	34.5	0	0	0	110	E852 K856 A857 L858	E852-P854 WeakPolarHBondContact O-CD 3.23Å; P854-K856 CarbonylContact O-C 3.54Å; P854-K856 PolarHBondContact O-N 3.39Å; P854-A857 PolarHBondContact O-N 2.82Å; P854-L858 PolarHBondContact O-N 3.42Å
855	P	65.9	Low	69.2	Low	106 Å²	106	75.6 Å²	75.6	69%	0.688	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-18.9	-175.8	-30.7	36.2	0	0	0	115.9
856	K	61.1	Low	71.8	Confident	71 Å²	71	76 Å²	76	31%	0.309	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-59	167.9	-71.6	-170.9	169.8	-144.5	0	113.2	N68 S70 D71 P854 L858 K859	N68-K856 PolarHBondContact O-NZ 2.8Å; S70-K856 WeakPolarHBondContact O-CD 3.13Å; S70-K856 WeakPolarHBondContact O-CE 3.31Å; S70-K856 PolarHBondContact O-NZ 2.82Å; S70-K856 PolarHBondContact OG-NZ 3Å; D71-K856 WeakPolarHBondContact OD2-CE 3.31Å; D71-K856 WeakPolarHBondContact OD2-CG 3.45Å; P854-K856 CarbonylContact O-C 3.54Å; P854-K856 PolarHBondContact O-N 3.39Å; K856-L858 PolarHBondContact O-N 3.5Å; K856-K859 WeakPolarHBondContact O-CB 3.29Å; K856-K859 PolarHBondContact O-N 2.91Å; K856-K859 VanDerWaalsContact O-N 3.09Å
857	A	61.3	Low	73.3	Confident	41 Å²	41	77.5 Å²	77.5	34%	0.339	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-66	-19.8	178.6	0	0	0	0	0	112.3	I853 P854 K859 T860 L861	I853-A857 HydrophobicContact CG2-CB 4.01Å; P854-A857 PolarHBondContact O-N 2.82Å; A857-K859 PolarHBondContact O-N 3.11Å; A857-T860 PolarHBondContact O-N 3.32Å; A857-T860 PolarHBondContact O-OG1 3.39Å; A857-L861 WeakPolarHBondContact O-CG 3.47Å
858	L	65.3	Low	74.2	Confident	44 Å²	44	79.3 Å²	79.3	23%	0.23	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-63.9	-29.2	173	-161.5	85.1	0	0	0	112.5	I853 P854 K856 R873 I897	I853-L858 HydrophobicContact CB-CD1 3.77Å; I853-L858 HydrophobicContact CD1-CD1 4.11Å; I853-L858 HydrophobicContact CG2-CB 3.98Å; I853-L858 HydrophobicContact CG2-CD1 3.82Å; P854-L858 PolarHBondContact O-N 3.42Å; K856-L858 PolarHBondContact O-N 3.5Å; L858-R873 VanDerWaalsContact CD1-NH1 3.32Å; L858-I897 HydrophobicContact CD1-CB 3.79Å; L858-I897 HydrophobicContact CD1-CD1 4.1Å; L858-I897 HydrophobicContact CD1-CG2 3.79Å; L858-I897 HydrophobicContact CD2-CD1 3.82Å
859	K	70	Confident	75	Confident	142 Å²	142	73.6 Å²	73.6	62%	0.617	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-77.9	-21.1	177.8	-62.7	175.7	-179.9	-179.4	0	113.2	D71 K856 A857 L861	D71-K859 IonicContact OD1-NZ 3.17Å; D71-K859 PolarHBondContact OD1-NZ 3.17Å; K856-K859 WeakPolarHBondContact O-CB 3.29Å; K856-K859 PolarHBondContact O-N 2.91Å; K856-K859 VanDerWaalsContact O-N 3.09Å; A857-K859 PolarHBondContact O-N 3.11Å; K859-L861 VanDerWaalsContact C-N 3.33Å
860	T	64.5	Low	76.1	Confident	106 Å²	106	68 Å²	68	65%	0.65	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-96.3	17.7	-177.9	57.9	0	0	0	0	112.3	A857	A857-T860 PolarHBondContact O-N 3.32Å; A857-T860 PolarHBondContact O-OG1 3.39Å
861	L	71.4	Confident	76.5	Confident	23 Å²	23	67.2 Å²	67.2	12%	0.12	35%	0.348	C	S	.	.	S	Bend	trans	-126.3	117.6	177.8	-63.6	175	0	0	0	109.8	I853 A857 K859 R873 H874 G875	I853-L861 HydrophobicContact CD1-CD1 3.91Å; I853-L861 HydrophobicContact CG2-CD1 4.06Å; A857-L861 WeakPolarHBondContact O-CG 3.47Å; K859-L861 VanDerWaalsContact C-N 3.33Å; L861-R873 HydrophobicContact CB-CB 4.06Å; L861-H874 CarbonylContact C-O 3.57Å; L861-H874 WeakPolarHBondContact CA-O 3.21Å; L861-G875 VanDerWaalsContact CD2-CA 3.42Å
862	Q	82.3	Confident	77.3	Confident	137 Å²	137	64.7 Å²	64.7	64%	0.64	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	126.3	-178.4	176.3	176.5	-16.5	0	0	111	R873 H874	Q862-R873 CarbonylContact O-C 3.58Å; Q862-R873 WeakPolarHBondContact O-CA 3.37Å; Q862-R873 WeakPolarHBondContact O-CB 3.48Å; Q862-H874 PolarHBondContact N-O 3.48Å; Q862-H874 PolarHBondContact O-N 3.24Å
863	E	84.5	Confident	77.9	Confident	77 Å²	77	62.2 Å²	62.2	36%	0.36	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	136.6	174.4	-167.4	158.8	106.4	0	0	111.8	R866 R873	E863-R866 WeakPolarHBondContact OE1-CD 3.24Å; E863-R873 HydrophobicContact CB-CG 4.1Å; E863-R873 HydrophobicContact CG-CG 4.23Å; E863-R873 IonicContact OE2-CZ 2.73Å; E863-R873 IonicContact OE2-NE 2.68Å; E863-R873 PolarHBondContact OE2-NE 2.99Å; E863-R873 IonicContact OE2-NH2 3.63Å; E863-R873 PolarHBondContact OE2-NH2 2.8Å
864	I	86.4	Confident	78.7	Confident	64 Å²	64	63.2 Å²	63.2	33%	0.328	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	-51.8	-172.7	-66	162.6	0	0	0	111.8	I872 H874 F885 L906	I864-I872 HydrophobicContact CB-CB 4.5Å; I864-I872 HydrophobicContact CB-CG2 4.49Å; I864-I872 HydrophobicContact CD1-CG2 4.18Å; I864-I872 PolarHBondContact N-O 2.65Å; I864-H874 HydrophobicContact CD1-CB 3.45Å; I864-H874 VanDerWaalsContact CD1-CB 3.45Å; I864-H874 HydrophobicContact CG1-CB 4.3Å; I864-F885 HydrophobicContact CD1-CD1 3.7Å; I864-F885 HydrophobicContact CD1-CE1 3.8Å; I864-L906 HydrophobicContact CD1-CD1 4.11Å; I864-L906 HydrophobicContact CG2-CD1 4.23Å
865	D	88.7	Confident	78.9	Confident	35 Å²	35	59.8 Å²	59.8	19%	0.187	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.6	174.3	-173.6	13.5	0	0	0	108.5	K867 G871 I872 Y910 F913	D865-K867 WeakPolarHBondContact OD2-CE 3.48Å; D865-K867 IonicContact OD2-NZ 3.84Å; D865-K867 PolarHBondContact OD2-NZ 3.18Å; D865-G871 CarbonylContact O-C 3.59Å; D865-G871 WeakPolarHBondContact O-CA 3.41Å; D865-I872 PolarHBondContact O-N 3.17Å; D865-Y910 HydrophobicContact CB-CE1 3.88Å; D865-Y910 WeakPolarHBondContact OD2-CE1 3.02Å; D865-F913 HydrophobicContact CB-CE1 4.44Å; D865-F913 VanDerWaalsContact OD2-CE1 3.23Å; D865-F913 WeakPolarHBondContact OD2-CE1 3.49Å
866	R	88	Confident	78.6	Confident	107 Å²	107	58.7 Å²	58.7	40%	0.404	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	126.9	178.4	-167	-169.2	160.3	130.9	7.6	110.8	E863 D868 F870 D890	E863-R866 WeakPolarHBondContact OE1-CD 3.24Å; R866-D868 PolarHBondContact NE-O 3.05Å; R866-D868 PolarHBondContact NH2-O 3.1Å; R866-D868 VanDerWaalsContact NH2-O 3.08Å; R866-F870 CarbonylContact C-O 3.54Å; R866-F870 WeakPolarHBondContact CA-O 3.48Å; R866-F870 WeakPolarHBondContact CG-O 3.36Å; R866-D890 IonicContact CZ-OD2 3.62Å; R866-D890 VanDerWaalsContact CZ-OD2 3.24Å; R866-D890 IonicContact NH1-OD1 3.32Å; R866-D890 IonicContact NH1-OD2 3.77Å; R866-D890 PolarHBondContact NH1-OD2 2.95Å; R866-D890 IonicContact NH2-OD2 2.78Å; R866-D890 PolarHBondContact NH2-OD2 3.26Å
867	K	84.2	Confident	78.1	Confident	87 Å²	87	59.9 Å²	59.9	38%	0.378	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	115.1	178.1	-66.4	176.3	-177.5	129	0	108.8	D865 I869 F870 F913 I917	D865-K867 WeakPolarHBondContact OD2-CE 3.48Å; D865-K867 IonicContact OD2-NZ 3.84Å; D865-K867 PolarHBondContact OD2-NZ 3.18Å; K867-I869 PolarHBondContact O-N 3.39Å; K867-F870 CarbonylContact C-O 3.54Å; K867-F870 PolarHBondContact N-O 3.18Å; K867-F870 PolarHBondContact O-N 2.82Å; K867-F870 VanDerWaalsContact O-O 3.12Å; K867-F913 HydrophobicContact CB-CE1 4.34Å; K867-F913 HydrophobicContact CB-CE2 4.5Å; K867-F913 HydrophobicContact CB-CZ 3.73Å; K867-F913 HydrophobicContact CD-CE1 3.71Å; K867-F913 HydrophobicContact CD-CZ 3.97Å; K867-F913 HydrophobicContact CG-CE1 4.07Å; K867-F913 HydrophobicContact CG-CZ 3.82Å; K867-I917 HydrophobicContact CB-CD1 3.77Å; K867-I917 HydrophobicContact CD-CD1 3.6Å; K867-I917 HydrophobicContact CG-CD1 4.28Å
868	D	83.4	Confident	77.3	Confident	105 Å²	105	67.4 Å²	67.4	56%	0.561	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	-130	-177.1	-156.2	-53.3	0	0	0	111.7	R866 F870 L920	R866-D868 PolarHBondContact NE-O 3.05Å; R866-D868 PolarHBondContact NH2-O 3.1Å; R866-D868 VanDerWaalsContact NH2-O 3.08Å; D868-F870 VanDerWaalsContact C-N 3.26Å; D868-F870 PolarHBondContact O-N 3.37Å; D868-L920 HydrophobicContact CB-CD1 4.4Å; D868-L920 HydrophobicContact CB-CD2 4.48Å
869	I	87.8	Confident	76.2	Confident	45 Å²	45	74.4 Å²	74.4	23%	0.231	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-5.9	174.3	60.4	-172.3	0	0	0	115	K867 M889 D890 L920 F923	K867-I869 PolarHBondContact O-N 3.39Å; I869-M889 HydrophobicContact CD1-CE 3.62Å; I869-M889 HydrophobicContact CG1-CE 4.31Å; I869-M889 CarbonylContact O-C 3.59Å; I869-M889 VanDerWaalsContact O-CA 3.27Å; I869-M889 WeakPolarHBondContact O-CA 3.11Å; I869-D890 PolarHBondContact O-N 3.41Å; I869-L920 HydrophobicContact CD1-CD1 3.99Å; I869-L920 HydrophobicContact CG1-CD1 4.14Å; I869-F923 HydrophobicContact CD1-CB 3.91Å; I869-F923 HydrophobicContact CD1-CG 4.5Å
870	F	90.2	Very high	74.7	Confident	1 Å²	1	71.4 Å²	71.4	0%	0.004	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	151.5	-178	-57.3	-67.1	0	0	0	112.6	R866 K867 D868 T888 M889 L900 F913 L916 I917 L920 F923	R866-F870 CarbonylContact C-O 3.54Å; R866-F870 WeakPolarHBondContact CA-O 3.48Å; R866-F870 WeakPolarHBondContact CG-O 3.36Å; K867-F870 CarbonylContact C-O 3.54Å; K867-F870 PolarHBondContact N-O 3.18Å; K867-F870 PolarHBondContact O-N 2.82Å; K867-F870 VanDerWaalsContact O-O 3.12Å; D868-F870 VanDerWaalsContact C-N 3.26Å; D868-F870 PolarHBondContact O-N 3.37Å; F870-T888 WeakPolarHBondContact CA-O 3.48Å; F870-M889 HydrophobicContact CD1-CB 4Å; F870-M889 HydrophobicContact CD1-CG 3.89Å; F870-M889 HydrophobicContact CE1-CB 4.21Å; F870-M889 HydrophobicContact CE1-CE 4.19Å; F870-M889 HydrophobicContact CE1-CG 3.77Å; F870-M889 HydrophobicContact CE1-SD 3.96Å; F870-M889 HydrophobicContact CZ-CE 4.48Å; F870-L900 HydrophobicContact CD1-CD1 4.16Å; F870-L900 HydrophobicContact CE1-CD1 3.93Å; F870-F913 HydrophobicContact CB-CD2 3.94Å; F870-F913 HydrophobicContact CB-CE2 3.61Å; F870-L916 HydrophobicContact CD1-CD1 4.3Å; F870-L916 HydrophobicContact CD2-CB 4.33Å; F870-L916 HydrophobicContact CE1-CB 4.38Å; F870-L916 HydrophobicContact CE1-CD1 4.27Å; F870-L916 HydrophobicContact CE2-CB 4.04Å; F870-L916 HydrophobicContact CZ-CB 4.07Å; F870-I917 HydrophobicContact CD2-CG1 4.36Å; F870-L920 HydrophobicContact CE2-CD1 4.2Å; F870-F923 HydrophobicContact CE1-CD1 4.36Å; F870-F923 HydrophobicContact CE1-CE1 4.13Å; F870-F923 HydrophobicContact CE1-CZ 4.4Å; F870-F923 HydrophobicContact CE2-CD2 4.36Å; F870-F923 HydrophobicContact CE2-CE2 4.34Å; F870-F923 AromaticContact CZ-CD1 3.82Å; F870-F923 HydrophobicContact CZ-CD1 3.82Å; F870-F923 AromaticContact CZ-CD2 3.89Å; F870-F923 HydrophobicContact CZ-CD2 3.89Å; F870-F923 AromaticContact CZ-CE1 3.72Å; F870-F923 HydrophobicContact CZ-CE1 3.72Å; F870-F923 AromaticContact CZ-CE2 3.78Å; F870-F923 HydrophobicContact CZ-CE2 3.78Å; F870-F923 AromaticContact CZ-CG 3.9Å; F870-F923 HydrophobicContact CZ-CG 3.9Å; F870-F923 AromaticContact CZ-CZ 3.71Å; F870-F923 HydrophobicContact CZ-CZ 3.71Å
871	G	88.8	Confident	73.6	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	159	167.9	0	0	0	0	0	113.4	D865 T888	D865-G871 CarbonylContact O-C 3.59Å; D865-G871 WeakPolarHBondContact O-CA 3.41Å; G871-T888 PolarHBondContact N-O 3.37Å; G871-T888 WeakPolarHBondContact O-CA 3.47Å; G871-T888 PolarHBondContact O-N 3.16Å; G871-T888 PolarHBondContact O-OG1 3.43Å
872	I	90.3	Very high	72.7	Confident	0 Å²	0	76.2 Å²	76.2	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.8	175	-56.7	175.2	0	0	0	108.3	I864 D865 F885 L906 A909 Y910 F913	I864-I872 HydrophobicContact CB-CB 4.5Å; I864-I872 HydrophobicContact CB-CG2 4.49Å; I864-I872 HydrophobicContact CD1-CG2 4.18Å; I864-I872 PolarHBondContact N-O 2.65Å; D865-I872 PolarHBondContact O-N 3.17Å; I872-F885 HydrophobicContact CG2-CB 4.49Å; I872-L906 HydrophobicContact CG2-CD1 4.24Å; I872-A909 HydrophobicContact CD1-CB 4.19Å; I872-A909 HydrophobicContact CG2-CB 4.1Å; I872-Y910 HydrophobicContact CD1-CD1 3.65Å; I872-Y910 HydrophobicContact CD1-CD2 4.49Å; I872-Y910 HydrophobicContact CD1-CE1 3.8Å; I872-Y910 HydrophobicContact CD1-CG 4.01Å; I872-F913 HydrophobicContact CD1-CB 3.96Å; I872-F913 HydrophobicContact CD1-CD1 4.03Å; I872-F913 HydrophobicContact CD1-CG 3.97Å; I872-F913 HydrophobicContact CG1-CB 4.14Å; I872-F913 HydrophobicContact CG1-CD1 4.37Å; I872-F913 HydrophobicContact CG1-CD2 4.02Å; I872-F913 HydrophobicContact CG1-CE2 4.45Å; I872-F913 HydrophobicContact CG1-CG 3.97Å
873	R	87	Confident	72.1	Confident	24 Å²	24	73.5 Å²	73.5	9%	0.091	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.7	173.8	-52.4	-161.9	176.9	155.1	6.2	112.3	L858 L861 Q862 E863 F885 H886 T888	L858-R873 VanDerWaalsContact CD1-NH1 3.32Å; L861-R873 HydrophobicContact CB-CB 4.06Å; Q862-R873 CarbonylContact O-C 3.58Å; Q862-R873 WeakPolarHBondContact O-CA 3.37Å; Q862-R873 WeakPolarHBondContact O-CB 3.48Å; E863-R873 HydrophobicContact CB-CG 4.1Å; E863-R873 HydrophobicContact CG-CG 4.23Å; E863-R873 IonicContact OE2-CZ 2.73Å; E863-R873 IonicContact OE2-NE 2.68Å; E863-R873 PolarHBondContact OE2-NE 2.99Å; E863-R873 IonicContact OE2-NH2 3.63Å; E863-R873 PolarHBondContact OE2-NH2 2.8Å; R873-F885 CarbonylContact O-C 3.53Å; R873-H886 PolarHBondContact N-O 3.03Å; R873-H886 WeakPolarHBondContact O-CA 3.25Å; R873-H886 WeakPolarHBondContact O-CB 3.42Å; R873-H886 PolarHBondContact O-N 2.81Å; R873-T888 HydrophobicContact CB-CG2 4.34Å; R873-T888 HydrophobicContact CG-CG2 3.94Å
874	H	86.7	Confident	71.8	Confident	34 Å²	34	72.3 Å²	72.3	16%	0.157	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	143.5	177.3	160.2	-94.8	0	0	0	111.6	L861 Q862 I864 D883 T884 F885	L861-H874 CarbonylContact C-O 3.57Å; L861-H874 WeakPolarHBondContact CA-O 3.21Å; Q862-H874 PolarHBondContact N-O 3.48Å; Q862-H874 PolarHBondContact O-N 3.24Å; I864-H874 HydrophobicContact CD1-CB 3.45Å; I864-H874 VanDerWaalsContact CD1-CB 3.45Å; I864-H874 HydrophobicContact CG1-CB 4.3Å; H874-D883 IonicContact CD2-OD1 3.41Å; H874-D883 IonicContact CE1-OD1 3.4Å; H874-D883 VanDerWaalsContact NE2-CG 3.32Å; H874-D883 IonicContact NE2-OD1 2.73Å; H874-D883 PolarHBondContact NE2-OD1 2.66Å; H874-T884 CarbonylContact C-O 3.47Å; H874-T884 WeakPolarHBondContact CA-O 3.31Å; H874-F885 HydrophobicContact CB-CD1 3.97Å; H874-F885 HydrophobicContact CB-CE1 3.95Å; H874-F885 AromaticContact CD2-CE1 3.76Å; H874-F885 AromaticContact CD2-CZ 3.85Å
875	G	68.6	Low	71.8	Confident	5 Å²	5	70.1 Å²	70.1	5%	0.052	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	126	168.6	0	0	0	0	0	110.6	L861 T884	L861-G875 VanDerWaalsContact CD2-CA 3.42Å; G875-T884 PolarHBondContact N-O 3.19Å; G875-T884 PolarHBondContact O-N 3.32Å; G875-T884 PolarHBondContact O-OG1 2.95Å
876	S	60.2	Low	71.7	Confident	84 Å²	84	69.8 Å²	69.8	59%	0.587	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.7	121.3	164.1	52.2	0	0	0	0	109.1
877	D	50.8	Low	71.7	Confident	96 Å²	96	64.7 Å²	64.7	51%	0.513	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	118.4	169.3	-168.5	-39.2	0	0	0	108.5	K879 T880	D877-K879 PolarHBondContact O-N 3.07Å; D877-K879 PolarHBondContact OD1-N 3.4Å; D877-T880 PolarHBondContact O-N 2.76Å; D877-T880 VanDerWaalsContact O-N 3.09Å
878	E	44.9	Very low	72	Confident	199 Å²	199	60.7 Å²	60.7	93%	0.93	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-7.3	-178	-63.6	-176.5	152	0	0	114
879	K	42.1	Very low	72.3	Confident	191 Å²	191	55.9 Å²	55.9	83%	0.83	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.9	-12.3	179.3	-64.1	-179.8	-180	177.5	0	115	D877	D877-K879 PolarHBondContact O-N 3.07Å; D877-K879 PolarHBondContact OD1-N 3.4Å
880	T	37.9	Very low	72.3	Confident	79 Å²	79	55.2 Å²	55.2	49%	0.485	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	124.9	177.4	53.4	0	0	0	0	109.6	D877 D882	D877-T880 PolarHBondContact O-N 2.76Å; D877-T880 VanDerWaalsContact O-N 3.09Å; T880-D882 PolarHBondContact O-N 2.63Å
881	S	41.4	Very low	72	Confident	122 Å²	122	56.1 Å²	56.1	85%	0.853	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.7	11.9	-172.9	51.4	0	0	0	0	116.9
882	D	52	Low	71.5	Confident	108 Å²	108	62.1 Å²	62.1	58%	0.578	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.2	112.9	-164.1	-64.8	9	0	0	0	109.4	T880	T880-D882 PolarHBondContact O-N 2.63Å
883	D	71.3	Confident	70.7	Confident	80 Å²	80	70.4 Å²	70.4	43%	0.428	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	134.7	177.2	-73.2	-37.2	0	0	0	111.7	H874 F885 S904	H874-D883 IonicContact CD2-OD1 3.41Å; H874-D883 IonicContact CE1-OD1 3.4Å; H874-D883 VanDerWaalsContact NE2-CG 3.32Å; H874-D883 IonicContact NE2-OD1 2.73Å; H874-D883 PolarHBondContact NE2-OD1 2.66Å; D883-F885 HydrophobicContact CB-CD2 4.48Å; D883-F885 HydrophobicContact CB-CE2 3.61Å; D883-F885 HydrophobicContact CB-CZ 3.93Å; D883-S904 WeakPolarHBondContact O-CA 3.43Å
884	T	77.7	Confident	69.9	Low	52 Å²	52	70.9 Å²	70.9	32%	0.319	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	114.7	176.5	51.1	0	0	0	0	113.2	H874 G875	H874-T884 CarbonylContact C-O 3.47Å; H874-T884 WeakPolarHBondContact CA-O 3.31Å; G875-T884 PolarHBondContact N-O 3.19Å; G875-T884 PolarHBondContact O-N 3.32Å; G875-T884 PolarHBondContact O-OG1 2.95Å
885	F	86.3	Confident	69.4	Low	18 Å²	18	77.4 Å²	77.4	8%	0.079	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	99.7	-179.3	-58.4	-87.2	0	0	0	109.9	I864 I872 R873 H874 D883 R902 C903 N905 L906 A909	I864-F885 HydrophobicContact CD1-CD1 3.7Å; I864-F885 HydrophobicContact CD1-CE1 3.8Å; I872-F885 HydrophobicContact CG2-CB 4.49Å; R873-F885 CarbonylContact O-C 3.53Å; H874-F885 HydrophobicContact CB-CD1 3.97Å; H874-F885 HydrophobicContact CB-CE1 3.95Å; H874-F885 AromaticContact CD2-CE1 3.76Å; H874-F885 AromaticContact CD2-CZ 3.85Å; D883-F885 HydrophobicContact CB-CD2 4.48Å; D883-F885 HydrophobicContact CB-CE2 3.61Å; D883-F885 HydrophobicContact CB-CZ 3.93Å; F885-R902 WeakPolarHBondContact O-CA 3.49Å; F885-C903 HydrophobicContact CB-CB 4.47Å; F885-C903 PolarHBondContact N-O 2.76Å; F885-C903 PolarHBondContact O-N 3.3Å; F885-N905 WeakPolarHBondContact CD2-O 3.43Å; F885-L906 HydrophobicContact CD1-CB 4.19Å; F885-L906 HydrophobicContact CD1-CD1 3.8Å; F885-L906 HydrophobicContact CE1-CB 3.88Å; F885-L906 HydrophobicContact CE1-CD1 3.97Å; F885-L906 HydrophobicContact CE1-CG 4.34Å; F885-L906 HydrophobicContact CE2-CB 4.41Å; F885-L906 HydrophobicContact CZ-CB 4.01Å; F885-A909 HydrophobicContact CB-CB 3.92Å
886	H	86.1	Confident	70	Confident	28 Å²	28	80.1 Å²	80.1	13%	0.13	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	119.9	171.8	-67.9	-109.3	0	0	0	110.6	R873 T888 S899 C901 R902	R873-H886 PolarHBondContact N-O 3.03Å; R873-H886 WeakPolarHBondContact O-CA 3.25Å; R873-H886 WeakPolarHBondContact O-CB 3.42Å; R873-H886 PolarHBondContact O-N 2.81Å; H886-T888 HydrophobicContact CB-CG2 4.07Å; H886-S899 PolarHBondContact ND1-OG 2.85Å; H886-C901 WeakPolarHBondContact CA-O 3.45Å; H886-R902 HydrophobicContact CB-CG 4.48Å; H886-R902 VanDerWaalsContact CE1-CD 3.49Å; H886-R902 WeakPolarHBondContact CE1-CD 3.49Å; H886-R902 WeakPolarHBondContact ND1-CG 3.4Å
887	I	89.1	Confident	71.1	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	123.7	162.2	-53.8	-175.6	0	0	0	107.3	S899 L900 C901 A909 H912 L916	I887-S899 CarbonylContact O-C 3.27Å; I887-S899 WeakPolarHBondContact O-CA 3.44Å; I887-L900 PolarHBondContact O-N 2.79Å; I887-C901 PolarHBondContact N-O 2.8Å; I887-A909 VanDerWaalsContact CD1-O 3.31Å; I887-A909 WeakPolarHBondContact CD1-O 3.48Å; I887-A909 HydrophobicContact CG1-CB 4.39Å; I887-H912 HydrophobicContact CD1-CB 3.31Å; I887-L916 HydrophobicContact CG2-CD1 4.01Å
888	T	89.3	Confident	72.8	Confident	2 Å²	2	72.9 Å²	72.9	1%	0.012	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	155.7	-172.3	64.2	0	0	0	0	112.4	I853 F870 G871 R873 H886 I897 L898	I853-T888 HydrophobicContact CD1-CG2 3.82Å; F870-T888 WeakPolarHBondContact CA-O 3.48Å; G871-T888 PolarHBondContact N-O 3.37Å; G871-T888 WeakPolarHBondContact O-CA 3.47Å; G871-T888 PolarHBondContact O-N 3.16Å; G871-T888 PolarHBondContact O-OG1 3.43Å; R873-T888 HydrophobicContact CB-CG2 4.34Å; R873-T888 HydrophobicContact CG-CG2 3.94Å; H886-T888 HydrophobicContact CB-CG2 4.07Å; T888-I897 HydrophobicContact CG2-CG2 4.41Å; T888-L898 CarbonylContact C-O 3.17Å; T888-L898 VanDerWaalsContact CA-O 3.24Å; T888-L898 WeakPolarHBondContact CA-O 3.31Å
889	M	89.9	Confident	74.8	Confident	5 Å²	5	63.4 Å²	63.4	3%	0.025	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131.2	175.9	-174.7	-168.4	-174	0	0	111.6	I869 F870 W891 I897 L898 L900 F923 L932	I869-M889 HydrophobicContact CD1-CE 3.62Å; I869-M889 HydrophobicContact CG1-CE 4.31Å; I869-M889 CarbonylContact O-C 3.59Å; I869-M889 VanDerWaalsContact O-CA 3.27Å; I869-M889 WeakPolarHBondContact O-CA 3.11Å; F870-M889 HydrophobicContact CD1-CB 4Å; F870-M889 HydrophobicContact CD1-CG 3.89Å; F870-M889 HydrophobicContact CE1-CB 4.21Å; F870-M889 HydrophobicContact CE1-CE 4.19Å; F870-M889 HydrophobicContact CE1-CG 3.77Å; F870-M889 HydrophobicContact CE1-SD 3.96Å; F870-M889 HydrophobicContact CZ-CE 4.48Å; M889-W891 HydrophobicContact CE-CE3 3.85Å; M889-W891 HydrophobicContact CE-CZ3 4.03Å; M889-W891 PolarHBondContact O-N 2.77Å; M889-W891 HydrophobicContact SD-CE3 3.95Å; M889-W891 HydrophobicContact SD-CZ3 4.41Å; M889-I897 WeakPolarHBondContact O-CA 3.42Å; M889-L898 PolarHBondContact N-O 3.1Å; M889-L898 PolarHBondContact O-N 3.39Å; M889-L900 HydrophobicContact CB-CD1 3.83Å; M889-L900 HydrophobicContact CB-CD2 3.93Å; M889-L900 HydrophobicContact CB-CG 3.94Å; M889-L900 HydrophobicContact SD-CD1 4.3Å; M889-L900 HydrophobicContact SD-CD2 4.36Å; M889-F923 HydrophobicContact CE-CB 4.31Å; M889-F923 HydrophobicContact CE-CD1 3.72Å; M889-F923 HydrophobicContact CE-CG 4.37Å; M889-F923 HydrophobicContact SD-CD1 4.48Å; M889-L932 HydrophobicContact CE-CD1 4.15Å; M889-L932 HydrophobicContact SD-CD1 3.75Å; M889-L932 HydrophobicContact SD-CD2 3.76Å; M889-L932 HydrophobicContact SD-CG 4.41Å
890	D	87.4	Confident	76.9	Confident	30 Å²	30	54.3 Å²	54.3	16%	0.16	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	103.1	169.9	-85.5	12.4	0	0	0	109.7	R866 I869 I897	R866-D890 IonicContact CZ-OD2 3.62Å; R866-D890 VanDerWaalsContact CZ-OD2 3.24Å; R866-D890 IonicContact NH1-OD1 3.32Å; R866-D890 IonicContact NH1-OD2 3.77Å; R866-D890 PolarHBondContact NH1-OD2 2.95Å; R866-D890 IonicContact NH2-OD2 2.78Å; R866-D890 PolarHBondContact NH2-OD2 3.26Å; I869-D890 PolarHBondContact O-N 3.41Å; D890-I897 WeakPolarHBondContact OD1-CG1 3.38Å
891	W	83.5	Confident	79.1	Confident	21 Å²	21	50.9 Å²	50.9	8%	0.08	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	132.6	-174.5	-175.8	-107.5	0	0	0	111.8	M889 K895 H896 L898 I926 L932	M889-W891 HydrophobicContact CE-CE3 3.85Å; M889-W891 HydrophobicContact CE-CZ3 4.03Å; M889-W891 PolarHBondContact O-N 2.77Å; M889-W891 HydrophobicContact SD-CE3 3.95Å; M889-W891 HydrophobicContact SD-CZ3 4.41Å; W891-K895 PolarHBondContact O-N 3.14Å; W891-H896 WeakPolarHBondContact CA-O 3.31Å; W891-H896 HydrophobicContact CB-CB 4.28Å; W891-H896 WeakPolarHBondContact CB-O 3.35Å; W891-H896 PolarHBondContact N-O 2.72Å; W891-H896 PolarHBondContact O-N 2.83Å; W891-H896 VanDerWaalsContact O-N 3.08Å; W891-L898 HydrophobicContact CB-CD1 3.78Å; W891-L898 HydrophobicContact CB-CG 3.91Å; W891-L898 HydrophobicContact CD2-CD1 4.02Å; W891-L898 HydrophobicContact CE3-CD1 4.5Å; W891-L898 HydrophobicContact CG-CD1 3.68Å; W891-L898 HydrophobicContact CG-CG 4.29Å; W891-I926 HydrophobicContact CH2-CB 4.23Å; W891-I926 HydrophobicContact CH2-CG2 3.82Å; W891-I926 WeakPolarHBondContact CH2-O 3.27Å; W891-I926 HydrophobicContact CZ3-CG2 4.38Å; W891-L932 HydrophobicContact CD2-CD2 4.44Å; W891-L932 HydrophobicContact CE3-CD2 3.84Å; W891-L932 HydrophobicContact CH2-CB 4.13Å; W891-L932 HydrophobicContact CH2-CD2 4.42Å; W891-L932 HydrophobicContact CZ3-CB 4.17Å; W891-L932 HydrophobicContact CZ3-CD1 4.11Å; W891-L932 HydrophobicContact CZ3-CD2 3.83Å; W891-L932 HydrophobicContact CZ3-CG 4.26Å
892	K	79	Confident	81.1	Confident	126 Å²	126	48 Å²	48	55%	0.548	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	64.5	-174	-65.7	-178.9	173.5	-174.5	0	112.2	G894 K895	K892-G894 PolarHBondContact O-N 3.45Å; K892-K895 HydrophobicContact CB-CB 4.44Å; K892-K895 WeakPolarHBondContact O-CB 3.45Å; K892-K895 PolarHBondContact O-N 2.93Å
893	N	73.6	Confident	82.6	Confident	175 Å²	175	43.6 Å²	43.6	94%	0.936	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.8	50.9	178.4	-56.6	14.6	0	0	0	112.1	K895	N893-K895 PolarHBondContact O-N 3.34Å
894	G	70.7	Confident	83	Confident	34 Å²	34	44.3 Å²	44.3	35%	0.351	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	2.6	179.1	0	0	0	0	0	115.8	K892 H896	K892-G894 PolarHBondContact O-N 3.45Å; G894-H896 VanDerWaalsContact C-N 3.29Å; G894-H896 PolarHBondContact O-N 2.96Å
895	K	76.3	Confident	83.3	Confident	170 Å²	170	44.7 Å²	44.7	74%	0.739	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-24.8	-176.6	-169.5	168.7	-174.8	171.6	0	113.9	W891 K892 N893	W891-K895 PolarHBondContact O-N 3.14Å; K892-K895 HydrophobicContact CB-CB 4.44Å; K892-K895 WeakPolarHBondContact O-CB 3.45Å; K892-K895 PolarHBondContact O-N 2.93Å; N893-K895 PolarHBondContact O-N 3.34Å
896	H	80.7	Confident	83.3	Confident	62 Å²	62	46.7 Å²	46.7	29%	0.287	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	144	171.6	-52.2	-100	0	0	0	108.4	E852 W891 G894	E852-H896 IonicContact OE1-CE1 3.49Å; E852-H896 IonicContact OE1-CG 3.38Å; E852-H896 IonicContact OE1-ND1 3.24Å; E852-H896 PolarHBondContact OE1-ND1 3.3Å; W891-H896 WeakPolarHBondContact CA-O 3.31Å; W891-H896 HydrophobicContact CB-CB 4.28Å; W891-H896 WeakPolarHBondContact CB-O 3.35Å; W891-H896 PolarHBondContact N-O 2.72Å; W891-H896 PolarHBondContact O-N 2.83Å; W891-H896 VanDerWaalsContact O-N 3.08Å; G894-H896 VanDerWaalsContact C-N 3.29Å; G894-H896 PolarHBondContact O-N 2.96Å
897	I	83.8	Confident	83.3	Confident	28 Å²	28	52.9 Å²	52.9	14%	0.144	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.5	173.1	-64.5	168.1	0	0	0	108.7	I853 L858 T888 M889 D890	I853-I897 HydrophobicContact CD1-CG2 4.44Å; I853-I897 PolarHBondContact N-O 2.77Å; I853-I897 VanDerWaalsContact N-O 3.12Å; L858-I897 HydrophobicContact CD1-CB 3.79Å; L858-I897 HydrophobicContact CD1-CD1 4.1Å; L858-I897 HydrophobicContact CD1-CG2 3.79Å; L858-I897 HydrophobicContact CD2-CD1 3.82Å; T888-I897 HydrophobicContact CG2-CG2 4.41Å; M889-I897 WeakPolarHBondContact O-CA 3.42Å; D890-I897 WeakPolarHBondContact OD1-CG1 3.38Å
898	L	86.6	Confident	83.1	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	124.6	-173.3	-57.5	-177.9	0	0	0	109.8	I850 E852 T888 M889 W891 L900 R929 L932	I850-L898 HydrophobicContact CG2-CB 4.07Å; I850-L898 HydrophobicContact CG2-CD1 4.35Å; E852-L898 HydrophobicContact CB-CD2 3.74Å; E852-L898 HydrophobicContact CG-CD2 4.06Å; T888-L898 CarbonylContact C-O 3.17Å; T888-L898 VanDerWaalsContact CA-O 3.24Å; T888-L898 WeakPolarHBondContact CA-O 3.31Å; M889-L898 PolarHBondContact N-O 3.1Å; M889-L898 PolarHBondContact O-N 3.39Å; W891-L898 HydrophobicContact CB-CD1 3.78Å; W891-L898 HydrophobicContact CB-CG 3.91Å; W891-L898 HydrophobicContact CD2-CD1 4.02Å; W891-L898 HydrophobicContact CE3-CD1 4.5Å; W891-L898 HydrophobicContact CG-CD1 3.68Å; W891-L898 HydrophobicContact CG-CG 4.29Å; L898-L900 HydrophobicContact CB-CD2 3.97Å; L898-L900 PolarHBondContact O-N 3.23Å; L898-R929 HydrophobicContact CD1-CG 4.35Å; L898-L932 HydrophobicContact CD1-CD2 3.72Å
899	S	86	Confident	82.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	111	163.4	-176.1	0	0	0	0	108.2	I850 V851 H886 I887 C901	I850-S899 VanDerWaalsContact CA-O 3.26Å; I850-S899 WeakPolarHBondContact CA-O 3.42Å; V851-S899 PolarHBondContact N-O 2.99Å; V851-S899 VanDerWaalsContact N-O 3.17Å; V851-S899 PolarHBondContact O-N 3.19Å; H886-S899 PolarHBondContact ND1-OG 2.85Å; I887-S899 CarbonylContact O-C 3.27Å; I887-S899 WeakPolarHBondContact O-CA 3.44Å; S899-C901 PolarHBondContact OG-O 2.83Å
900	L	85.7	Confident	82.8	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-23.5	-177.9	-55.6	-168.6	0	0	0	113.1	I850 F870 I887 M889 L898 L916 L932 L936 R940	I850-L900 HydrophobicContact CG2-CD2 4.14Å; F870-L900 HydrophobicContact CD1-CD1 4.16Å; F870-L900 HydrophobicContact CE1-CD1 3.93Å; I887-L900 PolarHBondContact O-N 2.79Å; M889-L900 HydrophobicContact CB-CD1 3.83Å; M889-L900 HydrophobicContact CB-CD2 3.93Å; M889-L900 HydrophobicContact CB-CG 3.94Å; M889-L900 HydrophobicContact SD-CD1 4.3Å; M889-L900 HydrophobicContact SD-CD2 4.36Å; L898-L900 HydrophobicContact CB-CD2 3.97Å; L898-L900 PolarHBondContact O-N 3.23Å; L900-L916 HydrophobicContact CD1-CD1 4.02Å; L900-L932 HydrophobicContact CD2-CD2 4.04Å; L900-L936 HydrophobicContact CB-CD1 4.19Å; L900-L936 HydrophobicContact CD1-CD1 4Å; L900-L936 HydrophobicContact CD1-CD2 4.02Å; L900-L936 HydrophobicContact CD2-CD1 3.9Å; L900-L936 HydrophobicContact CG-CD1 4.25Å; L900-R940 PolarHBondContact O-NH2 3.26Å
901	C	84	Confident	82.7	Confident	7 Å²	7	63.6 Å²	63.6	5%	0.047	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	166.4	168	43	0	0	0	0	109.5	H886 I887 S899 R940	H886-C901 WeakPolarHBondContact CA-O 3.45Å; I887-C901 PolarHBondContact N-O 2.8Å; S899-C901 PolarHBondContact OG-O 2.83Å; C901-R940 PolarHBondContact SG-NH2 3.23Å
902	R	85	Confident	82.7	Confident	61 Å²	61	66 Å²	66	23%	0.23	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.8	166.6	-74.3	142.8	-81.6	165.3	1.8	109.3	S846 P847 E849 F885 H886	S846-R902 PolarHBondContact O-NH1 2.76Å; S846-R902 PolarHBondContact O-NH2 3.17Å; P847-R902 HydrophobicContact CB-CB 4.26Å; P847-R902 PolarHBondContact O-N 3.5Å; P847-R902 VanDerWaalsContact O-N 3.16Å; P847-R902 PolarHBondContact O-NE 3.41Å; P847-R902 PolarHBondContact O-NH2 3.2Å; E849-R902 PolarHBondContact O-NH2 3Å; F885-R902 WeakPolarHBondContact O-CA 3.49Å; H886-R902 HydrophobicContact CB-CG 4.48Å; H886-R902 VanDerWaalsContact CE1-CD 3.49Å; H886-R902 WeakPolarHBondContact CE1-CD 3.49Å; H886-R902 WeakPolarHBondContact ND1-CG 3.4Å
903	C	82.7	Confident	83.1	Confident	16 Å²	16	60 Å²	60	11%	0.108	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	153.2	173.6	-64.1	0	0	0	0	109.3	F885 D908 A909	F885-C903 HydrophobicContact CB-CB 4.47Å; F885-C903 PolarHBondContact N-O 2.76Å; F885-C903 PolarHBondContact O-N 3.3Å; C903-D908 HydrophobicContact CB-CB 4.02Å; C903-A909 HydrophobicContact CB-CB 4.34Å
904	S	79.5	Confident	83.7	Confident	94 Å²	94	55.3 Å²	55.3	66%	0.657	29%	0.285	S	S	*	.	S	Bend	trans	-95.9	-1.9	177.6	53.9	0	0	0	0	113.8	D883	D883-S904 WeakPolarHBondContact O-CA 3.43Å
905	N	84.1	Confident	84.4	Confident	60 Å²	60	56.1 Å²	56.1	32%	0.321	28%	0.281	S	S	.	.	S	Bend	trans	-135.4	162.7	169.8	82.6	62.4	0	0	0	110	F885 E907 D908	F885-N905 WeakPolarHBondContact CD2-O 3.43Å; N905-E907 WeakPolarHBondContact OD1-CA 3.39Å; N905-E907 WeakPolarHBondContact OD1-CB 3.48Å; N905-E907 PolarHBondContact OD1-N 2.95Å; N905-D908 PolarHBondContact ND2-OD1 2.91Å; N905-D908 WeakPolarHBondContact OD1-CB 3.24Å; N905-D908 PolarHBondContact OD1-N 2.93Å; N905-D908 PolarHBondContact OD1-OD1 3.07Å
906	L	86.7	Confident	84.9	Confident	60 Å²	60	48.5 Å²	48.5	31%	0.314	25%	0.249	S	C	.	.	H	α-helix	trans	-81.5	-25.4	-175.5	-178.7	56.5	0	0	0	113.5	I864 I872 F885 A909 Y910	I864-L906 HydrophobicContact CD1-CD1 4.11Å; I864-L906 HydrophobicContact CG2-CD1 4.23Å; I872-L906 HydrophobicContact CG2-CD1 4.24Å; F885-L906 HydrophobicContact CD1-CB 4.19Å; F885-L906 HydrophobicContact CD1-CD1 3.8Å; F885-L906 HydrophobicContact CE1-CB 3.88Å; F885-L906 HydrophobicContact CE1-CD1 3.97Å; F885-L906 HydrophobicContact CE1-CG 4.34Å; F885-L906 HydrophobicContact CE2-CB 4.41Å; F885-L906 HydrophobicContact CZ-CB 4.01Å; L906-A909 WeakPolarHBondContact O-CB 3.47Å; L906-A909 PolarHBondContact O-N 3.19Å; L906-Y910 HydrophobicContact CD1-CD2 3.97Å; L906-Y910 HydrophobicContact CD1-CE2 3.65Å; L906-Y910 HydrophobicContact CD2-CE2 4.05Å; L906-Y910 HydrophobicContact CG-CD2 3.86Å; L906-Y910 HydrophobicContact CG-CE2 3.64Å; L906-Y910 VanDerWaalsContact O-CD2 3.25Å; L906-Y910 WeakPolarHBondContact O-CD2 3.47Å; L906-Y910 PolarHBondContact O-N 3.34Å
907	E	86.8	Confident	85.2	Confident	159 Å²	159	48 Å²	48	74%	0.743	25%	0.248	S	C	*	.	H	α-helix	trans	-74.3	-48.5	-176.5	-155.5	161	-140.1	0	0	110.5	N905 A909 Y910 D911	N905-E907 WeakPolarHBondContact OD1-CA 3.39Å; N905-E907 WeakPolarHBondContact OD1-CB 3.48Å; N905-E907 PolarHBondContact OD1-N 2.95Å; E907-A909 PolarHBondContact O-N 3.19Å; E907-Y910 PolarHBondContact O-N 2.69Å; E907-Y910 VanDerWaalsContact O-N 3.09Å; E907-D911 PolarHBondContact O-N 3.36Å
908	D	83.6	Confident	85.3	Confident	75 Å²	75	53.2 Å²	53.2	40%	0.401	27%	0.266	S	S	.	.	H	α-helix	trans	-48.9	-40.1	164.5	-86.8	45.8	0	0	0	112	C903 N905 H912	C903-D908 HydrophobicContact CB-CB 4.02Å; N905-D908 PolarHBondContact ND2-OD1 2.91Å; N905-D908 WeakPolarHBondContact OD1-CB 3.24Å; N905-D908 PolarHBondContact OD1-N 2.93Å; N905-D908 PolarHBondContact OD1-OD1 3.07Å; D908-H912 PolarHBondContact O-N 2.86Å; D908-H912 PolarHBondContact O-ND1 2.67Å
909	A	85.3	Confident	85.3	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-70.3	-41.4	-178.6	0	0	0	0	0	111.3	I872 F885 I887 C903 L906 E907 F913	I872-A909 HydrophobicContact CD1-CB 4.19Å; I872-A909 HydrophobicContact CG2-CB 4.1Å; F885-A909 HydrophobicContact CB-CB 3.92Å; I887-A909 VanDerWaalsContact CD1-O 3.31Å; I887-A909 WeakPolarHBondContact CD1-O 3.48Å; I887-A909 HydrophobicContact CG1-CB 4.39Å; C903-A909 HydrophobicContact CB-CB 4.34Å; L906-A909 WeakPolarHBondContact O-CB 3.47Å; L906-A909 PolarHBondContact O-N 3.19Å; E907-A909 PolarHBondContact O-N 3.19Å; A909-F913 WeakPolarHBondContact O-CB 3.08Å; A909-F913 PolarHBondContact O-N 3.26Å
910	Y	88.8	Confident	85.4	Confident	70 Å²	70	55.6 Å²	55.6	28%	0.275	28%	0.279	S	S	.	.	H	α-helix	trans	-65.8	-42	174.3	-85.1	-62.4	0	0	0	113.2	D865 I872 L906 E907 F913 N914	D865-Y910 HydrophobicContact CB-CE1 3.88Å; D865-Y910 WeakPolarHBondContact OD2-CE1 3.02Å; I872-Y910 HydrophobicContact CD1-CD1 3.65Å; I872-Y910 HydrophobicContact CD1-CD2 4.49Å; I872-Y910 HydrophobicContact CD1-CE1 3.8Å; I872-Y910 HydrophobicContact CD1-CG 4.01Å; L906-Y910 HydrophobicContact CD1-CD2 3.97Å; L906-Y910 HydrophobicContact CD1-CE2 3.65Å; L906-Y910 HydrophobicContact CD2-CE2 4.05Å; L906-Y910 HydrophobicContact CG-CD2 3.86Å; L906-Y910 HydrophobicContact CG-CE2 3.64Å; L906-Y910 VanDerWaalsContact O-CD2 3.25Å; L906-Y910 WeakPolarHBondContact O-CD2 3.47Å; L906-Y910 PolarHBondContact O-N 3.34Å; E907-Y910 PolarHBondContact O-N 2.69Å; E907-Y910 VanDerWaalsContact O-N 3.09Å; Y910-F913 HydrophobicContact CD1-CD1 4.23Å; Y910-F913 PolarHBondContact O-N 3.03Å; Y910-N914 WeakPolarHBondContact O-CB 3.33Å; Y910-N914 VanDerWaalsContact O-CG 3.28Å; Y910-N914 PolarHBondContact O-N 2.97Å; Y910-N914 PolarHBondContact O-ND2 3.39Å; Y910-N914 VanDerWaalsContact O-ND2 3.1Å
911	D	85.2	Confident	85.4	Confident	117 Å²	117	58.9 Å²	58.9	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-62.3	-48	179.2	-95.1	2.5	0	0	0	112.1	E907 F913 N915	E907-D911 PolarHBondContact O-N 3.36Å; D911-F913 VanDerWaalsContact C-N 3.33Å; D911-F913 PolarHBondContact O-N 3.48Å; D911-N915 WeakPolarHBondContact O-CB 3.48Å; D911-N915 PolarHBondContact O-N 2.87Å; D911-N915 VanDerWaalsContact O-N 3.08Å
912	H	83.7	Confident	85.6	Confident	70 Å²	70	58.6 Å²	58.6	32%	0.324	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-41.5	174.1	-76.3	94.3	0	0	0	111.6	I887 D908 N915 L916	I887-H912 HydrophobicContact CD1-CB 3.31Å; D908-H912 PolarHBondContact O-N 2.86Å; D908-H912 PolarHBondContact O-ND1 2.67Å; H912-N915 PolarHBondContact O-N 3.45Å; H912-L916 VanDerWaalsContact O-CG 3.3Å; H912-L916 WeakPolarHBondContact O-CG 3.14Å; H912-L916 PolarHBondContact O-N 2.99Å; H912-L916 VanDerWaalsContact O-N 3.12Å
913	F	86.4	Confident	85.7	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-45.4	179.7	173.5	-109	0	0	0	112.7	D865 K867 F870 I872 A909 Y910 D911 N915 L916 I917	D865-F913 HydrophobicContact CB-CE1 4.44Å; D865-F913 VanDerWaalsContact OD2-CE1 3.23Å; D865-F913 WeakPolarHBondContact OD2-CE1 3.49Å; K867-F913 HydrophobicContact CB-CE1 4.34Å; K867-F913 HydrophobicContact CB-CE2 4.5Å; K867-F913 HydrophobicContact CB-CZ 3.73Å; K867-F913 HydrophobicContact CD-CE1 3.71Å; K867-F913 HydrophobicContact CD-CZ 3.97Å; K867-F913 HydrophobicContact CG-CE1 4.07Å; K867-F913 HydrophobicContact CG-CZ 3.82Å; F870-F913 HydrophobicContact CB-CD2 3.94Å; F870-F913 HydrophobicContact CB-CE2 3.61Å; I872-F913 HydrophobicContact CD1-CB 3.96Å; I872-F913 HydrophobicContact CD1-CD1 4.03Å; I872-F913 HydrophobicContact CD1-CG 3.97Å; I872-F913 HydrophobicContact CG1-CB 4.14Å; I872-F913 HydrophobicContact CG1-CD1 4.37Å; I872-F913 HydrophobicContact CG1-CD2 4.02Å; I872-F913 HydrophobicContact CG1-CE2 4.45Å; I872-F913 HydrophobicContact CG1-CG 3.97Å; A909-F913 WeakPolarHBondContact O-CB 3.08Å; A909-F913 PolarHBondContact O-N 3.26Å; Y910-F913 HydrophobicContact CD1-CD1 4.23Å; Y910-F913 PolarHBondContact O-N 3.03Å; D911-F913 VanDerWaalsContact C-N 3.33Å; D911-F913 PolarHBondContact O-N 3.48Å; F913-N915 PolarHBondContact O-N 3.3Å; F913-L916 PolarHBondContact O-N 2.77Å; F913-I917 HydrophobicContact CD1-CD1 4.16Å; F913-I917 HydrophobicContact CE1-CD1 3.96Å; F913-I917 HydrophobicContact CE2-CD1 4.48Å; F913-I917 HydrophobicContact CZ-CD1 4.15Å; F913-I917 WeakPolarHBondContact O-CG1 3.36Å; F913-I917 PolarHBondContact O-N 2.87Å
914	N	86.4	Confident	85.7	Confident	77 Å²	77	59.6 Å²	59.6	41%	0.412	31%	0.314	S	S	.	.	H	α-helix	trans	-63.9	-39	176.2	-71.1	-37.6	0	0	0	111.9	Y910 L916 I917 Y918	Y910-N914 WeakPolarHBondContact O-CB 3.33Å; Y910-N914 VanDerWaalsContact O-CG 3.28Å; Y910-N914 PolarHBondContact O-N 2.97Å; Y910-N914 PolarHBondContact O-ND2 3.39Å; Y910-N914 VanDerWaalsContact O-ND2 3.1Å; N914-L916 PolarHBondContact O-N 3.19Å; N914-I917 PolarHBondContact O-N 3.08Å; N914-Y918 PolarHBondContact O-N 3.11Å
915	N	84.8	Confident	86	Confident	51 Å²	51	57.1 Å²	57.1	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-61.3	-41.9	174.6	-172.3	-0.6	0	0	0	111.9	D911 H912 F913 I917 Y918 F919 I939	D911-N915 WeakPolarHBondContact O-CB 3.48Å; D911-N915 PolarHBondContact O-N 2.87Å; D911-N915 VanDerWaalsContact O-N 3.08Å; H912-N915 PolarHBondContact O-N 3.45Å; F913-N915 PolarHBondContact O-N 3.3Å; N915-I917 VanDerWaalsContact C-N 3.28Å; N915-I917 PolarHBondContact O-N 3.17Å; N915-Y918 PolarHBondContact O-N 2.82Å; N915-F919 WeakPolarHBondContact O-CD2 3.06Å; N915-F919 WeakPolarHBondContact OD1-CE2 3.45Å; N915-I939 WeakPolarHBondContact OD1-CG2 3.48Å
916	L	87.7	Confident	85.9	Confident	10 Å²	10	55 Å²	55	5%	0.052	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-35.1	176.5	-66.6	172.9	0	0	0	113.1	F870 I887 L900 H912 F913 N914 F919 L920 F923 L936 I939	F870-L916 HydrophobicContact CD1-CD1 4.3Å; F870-L916 HydrophobicContact CD2-CB 4.33Å; F870-L916 HydrophobicContact CE1-CB 4.38Å; F870-L916 HydrophobicContact CE1-CD1 4.27Å; F870-L916 HydrophobicContact CE2-CB 4.04Å; F870-L916 HydrophobicContact CZ-CB 4.07Å; I887-L916 HydrophobicContact CG2-CD1 4.01Å; L900-L916 HydrophobicContact CD1-CD1 4.02Å; H912-L916 VanDerWaalsContact O-CG 3.3Å; H912-L916 WeakPolarHBondContact O-CG 3.14Å; H912-L916 PolarHBondContact O-N 2.99Å; H912-L916 VanDerWaalsContact O-N 3.12Å; F913-L916 PolarHBondContact O-N 2.77Å; N914-L916 PolarHBondContact O-N 3.19Å; L916-F919 PolarHBondContact O-N 2.94Å; L916-L920 PolarHBondContact O-N 3.27Å; L916-F923 HydrophobicContact CD2-CZ 3.88Å; L916-L936 HydrophobicContact CD2-CD2 3.22Å; L916-L936 HydrophobicContact CG-CD2 4.49Å; L916-I939 HydrophobicContact CD2-CD1 4.37Å
917	I	85.7	Confident	85.7	Confident	52 Å²	52	57.2 Å²	57.2	27%	0.267	29%	0.288	S	S	.	.	H	α-helix	trans	-67.8	-35.3	179.6	-65.5	164.4	0	0	0	111.5	K867 F870 F913 N914 N915 F919 L920	K867-I917 HydrophobicContact CB-CD1 3.77Å; K867-I917 HydrophobicContact CD-CD1 3.6Å; K867-I917 HydrophobicContact CG-CD1 4.28Å; F870-I917 HydrophobicContact CD2-CG1 4.36Å; F913-I917 HydrophobicContact CD1-CD1 4.16Å; F913-I917 HydrophobicContact CE1-CD1 3.96Å; F913-I917 HydrophobicContact CE2-CD1 4.48Å; F913-I917 HydrophobicContact CZ-CD1 4.15Å; F913-I917 WeakPolarHBondContact O-CG1 3.36Å; F913-I917 PolarHBondContact O-N 2.87Å; N914-I917 PolarHBondContact O-N 3.08Å; N915-I917 VanDerWaalsContact C-N 3.28Å; N915-I917 PolarHBondContact O-N 3.17Å; I917-F919 PolarHBondContact O-N 3.42Å; I917-L920 WeakPolarHBondContact O-CB 3.47Å; I917-L920 PolarHBondContact O-N 3.16Å; I917-L920 VanDerWaalsContact O-N 3.13Å
918	Y	85.8	Confident	85.5	Confident	137 Å²	137	52 Å²	52	54%	0.537	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-32	175.1	-179.9	-106.2	0	0	0	112.7	N914 N915 P947	N914-Y918 PolarHBondContact O-N 3.11Å; N915-Y918 PolarHBondContact O-N 2.82Å; Y918-P947 HydrophobicContact CE1-CG 4.3Å
919	F	88.1	Confident	85.2	Confident	1 Å²	1	52.7 Å²	52.7	0%	0.004	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	7.9	178.3	-68.1	-76.4	0	0	0	114.4	N915 L916 I917 P921 L922 F923 I939 W945 P947 I950	N915-F919 WeakPolarHBondContact O-CD2 3.06Å; N915-F919 WeakPolarHBondContact OD1-CE2 3.45Å; L916-F919 PolarHBondContact O-N 2.94Å; I917-F919 PolarHBondContact O-N 3.42Å; F919-P921 VanDerWaalsContact C-N 3.3Å; F919-P921 VanDerWaalsContact O-N 3.09Å; F919-L922 HydrophobicContact CD1-CD1 3.95Å; F919-L922 WeakPolarHBondContact O-CB 3.24Å; F919-L922 PolarHBondContact O-N 3.21Å; F919-F923 HydrophobicContact CB-CE2 3.98Å; F919-F923 VanDerWaalsContact O-CD2 3.32Å; F919-F923 WeakPolarHBondContact O-CD2 3.42Å; F919-I939 HydrophobicContact CB-CD1 3.58Å; F919-I939 HydrophobicContact CB-CG1 4.15Å; F919-I939 HydrophobicContact CD1-CG1 4.28Å; F919-I939 HydrophobicContact CD2-CB 4.26Å; F919-I939 HydrophobicContact CD2-CD1 3.86Å; F919-I939 HydrophobicContact CD2-CG1 3.65Å; F919-I939 HydrophobicContact CD2-CG2 3.67Å; F919-I939 HydrophobicContact CE2-CB 4.4Å; F919-I939 HydrophobicContact CE2-CG1 4.08Å; F919-I939 HydrophobicContact CE2-CG2 3.78Å; F919-I939 HydrophobicContact CG-CD1 3.77Å; F919-I939 HydrophobicContact CG-CG1 3.76Å; F919-W945 VanDerWaalsContact CE1-O 3.3Å; F919-W945 WeakPolarHBondContact CE1-O 3.31Å; F919-W945 VanDerWaalsContact CZ-O 3.32Å; F919-W945 WeakPolarHBondContact CZ-O 3.46Å; F919-P947 HydrophobicContact CD1-CG 4.13Å; F919-P947 HydrophobicContact CE1-CG 4.27Å; F919-I950 HydrophobicContact CD1-CG1 4.4Å; F919-I950 HydrophobicContact CE1-CG1 3.77Å; F919-I950 HydrophobicContact CZ-CG1 4.44Å
920	L	86.5	Confident	85	Confident	51 Å²	51	61 Å²	61	27%	0.267	30%	0.303	S	S	.	.	H	α-helix	trans	-43.6	-42.5	-179.8	-177.5	68.3	0	0	0	114.7	D868 I869 F870 L916 I917 L922 F923	D868-L920 HydrophobicContact CB-CD1 4.4Å; D868-L920 HydrophobicContact CB-CD2 4.48Å; I869-L920 HydrophobicContact CD1-CD1 3.99Å; I869-L920 HydrophobicContact CG1-CD1 4.14Å; F870-L920 HydrophobicContact CE2-CD1 4.2Å; L916-L920 PolarHBondContact O-N 3.27Å; I917-L920 WeakPolarHBondContact O-CB 3.47Å; I917-L920 PolarHBondContact O-N 3.16Å; I917-L920 VanDerWaalsContact O-N 3.13Å; L920-L922 PolarHBondContact O-N 2.84Å; L920-F923 PolarHBondContact O-N 3.19Å; L920-F923 VanDerWaalsContact O-N 3.15Å
921	P	85.8	Confident	84.7	Confident	69 Å²	69	63.7 Å²	63.7	45%	0.448	31%	0.313	S	S	.	.	H	α-helix	trans	-62.4	-10.2	179.2	-24.5	36.1	0	0	0	116	F919 S924 F925	F919-P921 VanDerWaalsContact C-N 3.3Å; F919-P921 VanDerWaalsContact O-N 3.09Å; P921-S924 PolarHBondContact O-OG 2.85Å; P921-F925 WeakPolarHBondContact O-CD2 3.45Å; P921-F925 VanDerWaalsContact O-CE2 3.27Å; P921-F925 WeakPolarHBondContact O-CE2 3.39Å
922	L	88.3	Confident	84.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-92.7	-30.7	177.2	-56.5	-176.8	0	0	0	112.6	F919 L920 S924 F925 I926 L935 P947 I950 A951 I956 Y959	F919-L922 HydrophobicContact CD1-CD1 3.95Å; F919-L922 WeakPolarHBondContact O-CB 3.24Å; F919-L922 PolarHBondContact O-N 3.21Å; L920-L922 PolarHBondContact O-N 2.84Å; L922-S924 VanDerWaalsContact C-N 3.29Å; L922-S924 PolarHBondContact O-N 3.34Å; L922-F925 PolarHBondContact O-N 2.82Å; L922-I926 WeakPolarHBondContact O-CG1 3.33Å; L922-L935 HydrophobicContact CB-CD1 4.2Å; L922-L935 HydrophobicContact CB-CD2 4.28Å; L922-L935 HydrophobicContact CD1-CD1 4.02Å; L922-P947 HydrophobicContact CD1-CB 4.37Å; L922-P947 HydrophobicContact CD2-CB 4.34Å; L922-P947 HydrophobicContact CG-CB 4.41Å; L922-I950 HydrophobicContact CD1-CB 3.78Å; L922-I950 HydrophobicContact CD1-CG2 3.54Å; L922-A951 HydrophobicContact CD2-CB 3.97Å; L922-I956 HydrophobicContact CB-CD1 4.46Å; L922-I956 HydrophobicContact CD2-CD1 4.46Å; L922-Y959 HydrophobicContact CD2-CD2 3.7Å; L922-Y959 HydrophobicContact CD2-CE2 3.93Å; L922-Y959 HydrophobicContact CD2-CG 4.26Å
923	F	87.4	Confident	84.8	Confident	7 Å²	7	57.4 Å²	57.4	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-66.3	-30.6	-173.9	-71.6	-90.6	0	0	0	112.9	I869 F870 M889 L916 F919 L920 F925 I926 L932 L935 L936 I939	I869-F923 HydrophobicContact CD1-CB 3.91Å; I869-F923 HydrophobicContact CD1-CG 4.5Å; F870-F923 HydrophobicContact CE1-CD1 4.36Å; F870-F923 HydrophobicContact CE1-CE1 4.13Å; F870-F923 HydrophobicContact CE1-CZ 4.4Å; F870-F923 HydrophobicContact CE2-CD2 4.36Å; F870-F923 HydrophobicContact CE2-CE2 4.34Å; F870-F923 AromaticContact CZ-CD1 3.82Å; F870-F923 HydrophobicContact CZ-CD1 3.82Å; F870-F923 AromaticContact CZ-CD2 3.89Å; F870-F923 HydrophobicContact CZ-CD2 3.89Å; F870-F923 AromaticContact CZ-CE1 3.72Å; F870-F923 HydrophobicContact CZ-CE1 3.72Å; F870-F923 AromaticContact CZ-CE2 3.78Å; F870-F923 HydrophobicContact CZ-CE2 3.78Å; F870-F923 AromaticContact CZ-CG 3.9Å; F870-F923 HydrophobicContact CZ-CG 3.9Å; F870-F923 AromaticContact CZ-CZ 3.71Å; F870-F923 HydrophobicContact CZ-CZ 3.71Å; M889-F923 HydrophobicContact CE-CB 4.31Å; M889-F923 HydrophobicContact CE-CD1 3.72Å; M889-F923 HydrophobicContact CE-CG 4.37Å; M889-F923 HydrophobicContact SD-CD1 4.48Å; L916-F923 HydrophobicContact CD2-CZ 3.88Å; F919-F923 HydrophobicContact CB-CE2 3.98Å; F919-F923 VanDerWaalsContact O-CD2 3.32Å; F919-F923 WeakPolarHBondContact O-CD2 3.42Å; L920-F923 PolarHBondContact O-N 3.19Å; L920-F923 VanDerWaalsContact O-N 3.15Å; F923-F925 PolarHBondContact O-N 3.43Å; F923-F925 VanDerWaalsContact O-N 3.16Å; F923-I926 PolarHBondContact O-N 3.03Å; F923-I926 VanDerWaalsContact O-N 3.16Å; F923-L932 HydrophobicContact CD1-CD1 3.75Å; F923-L932 HydrophobicContact CE1-CD1 3.71Å; F923-L935 HydrophobicContact CD1-CD2 3.55Å; F923-L935 HydrophobicContact CD2-CD2 4.02Å; F923-L935 HydrophobicContact CE1-CD2 3.48Å; F923-L935 VanDerWaalsContact CE1-CD2 3.48Å; F923-L935 HydrophobicContact CE1-CG 4.17Å; F923-L935 HydrophobicContact CE2-CD2 3.97Å; F923-L935 HydrophobicContact CG-CD2 3.82Å; F923-L935 HydrophobicContact CZ-CD2 3.7Å; F923-L935 HydrophobicContact CZ-CG 4.14Å; F923-L936 HydrophobicContact CE1-CD2 3.98Å; F923-L936 HydrophobicContact CZ-CD2 4.07Å; F923-I939 HydrophobicContact CE2-CD1 3.99Å; F923-I939 HydrophobicContact CZ-CD1 3.72Å
924	S	82.6	Confident	84.7	Confident	91 Å²	91	59.7 Å²	59.7	64%	0.636	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.9	175	56.7	0	0	0	0	114.4	P921 L922	P921-S924 PolarHBondContact O-OG 2.85Å; L922-S924 VanDerWaalsContact C-N 3.29Å; L922-S924 PolarHBondContact O-N 3.34Å
925	F	85.9	Confident	84.8	Confident	43 Å²	43	56 Å²	56	19%	0.189	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	4.3	179.5	-56.4	-66.5	0	0	0	113.8	P921 L922 F923 I956 K958 Y959 N962	P921-F925 WeakPolarHBondContact O-CD2 3.45Å; P921-F925 VanDerWaalsContact O-CE2 3.27Å; P921-F925 WeakPolarHBondContact O-CE2 3.39Å; L922-F925 PolarHBondContact O-N 2.82Å; F923-F925 PolarHBondContact O-N 3.43Å; F923-F925 VanDerWaalsContact O-N 3.16Å; F925-I956 HydrophobicContact CB-CG2 3.45Å; F925-I956 VanDerWaalsContact CB-CG2 3.45Å; F925-I956 HydrophobicContact CD2-CG2 3.87Å; F925-I956 HydrophobicContact CG-CG2 3.76Å; F925-K958 HydrophobicContact CD1-CB 3.51Å; F925-K958 HydrophobicContact CD1-CD 4.08Å; F925-K958 HydrophobicContact CD1-CG 4.44Å; F925-K958 HydrophobicContact CE1-CB 3.7Å; F925-K958 HydrophobicContact CG-CB 4.23Å; F925-Y959 HydrophobicContact CE2-CD2 4.26Å; F925-N962 HydrophobicContact CZ-CB 4.25Å
926	I	83.2	Confident	85	Confident	16 Å²	16	53.6 Å²	53.6	8%	0.082	27%	0.265	C	S	.	.			trans	-94.6	107.6	-176.1	-51.4	-56	0	0	0	110.8	W891 L922 F923 R931 L932 L935 I956	W891-I926 HydrophobicContact CH2-CB 4.23Å; W891-I926 HydrophobicContact CH2-CG2 3.82Å; W891-I926 WeakPolarHBondContact CH2-O 3.27Å; W891-I926 HydrophobicContact CZ3-CG2 4.38Å; L922-I926 WeakPolarHBondContact O-CG1 3.33Å; F923-I926 PolarHBondContact O-N 3.03Å; F923-I926 VanDerWaalsContact O-N 3.16Å; I926-R931 HydrophobicContact CG2-CB 3.68Å; I926-L932 HydrophobicContact CG2-CB 3.98Å; I926-L932 VanDerWaalsContact CG2-N 3.32Å; I926-L935 HydrophobicContact CD1-CB 4.44Å; I926-L935 HydrophobicContact CD1-CD2 3.98Å; I926-L935 HydrophobicContact CG1-CD2 3.68Å; I926-I956 HydrophobicContact CD1-CD1 3.99Å
927	E	80.8	Confident	84.8	Confident	105 Å²	105	56.5 Å²	56.5	49%	0.491	28%	0.278	S	S	.	.			trans	-89.1	-14.3	-173	-66.3	155.7	175.3	0	0	114.1	R931 K958	E927-R931 IonicContact OE2-NH1 3.5Å; E927-R931 PolarHBondContact OE2-NH1 3.24Å; E927-K958 IonicContact OE1-NZ 3.68Å; E927-K958 PolarHBondContact OE1-NZ 2.84Å
928	S	82.6	Confident	84.7	Confident	50 Å²	50	54.7 Å²	54.7	35%	0.35	27%	0.27	S	S	.	.	S	Bend	trans	-141.7	148.6	-174.5	79.9	0	0	0	0	114	K930 R931 L932	S928-K930 PolarHBondContact O-N 3.35Å; S928-R931 PolarHBondContact O-N 2.98Å; S928-R931 PolarHBondContact OG-N 3.41Å; S928-L932 PolarHBondContact O-N 3.26Å
929	R	78.6	Confident	84.8	Confident	90 Å²	90	48.3 Å²	48.3	34%	0.34	25%	0.245	S	C	.	.	H	α-helix	trans	-60.4	-26.7	179.6	-174.2	170.7	173.1	174.5	-3.4	113.4	I850 E852 L898 L932 D933	I850-R929 PolarHBondContact O-NH2 2.96Å; E852-R929 IonicContact OE2-NH1 3.84Å; E852-R929 PolarHBondContact OE2-NH1 3.45Å; L898-R929 HydrophobicContact CD1-CG 4.35Å; R929-L932 PolarHBondContact O-N 2.96Å; R929-D933 PolarHBondContact O-N 2.91Å
930	K	79.7	Confident	84.5	Confident	173 Å²	173	52.6 Å²	52.6	75%	0.752	26%	0.261	S	S	*	.	H	α-helix	trans	-72.7	-38.6	173.1	-171.1	176.2	-179.4	179.7	0	112.2	S928 L932 S934	S928-K930 PolarHBondContact O-N 3.35Å; K930-L932 VanDerWaalsContact C-N 3.34Å; K930-S934 PolarHBondContact O-N 3.07Å; K930-S934 VanDerWaalsContact O-N 3.1Å; K930-S934 PolarHBondContact O-OG 3.4Å
931	R	83.3	Confident	84.2	Confident	128 Å²	128	58.5 Å²	58.5	48%	0.483	28%	0.28	S	S	.	.	H	α-helix	trans	-69.7	-31.8	170	-79.2	-175.1	163.2	163.1	-5.3	111.7	I926 E927 S928 S934 L935	I926-R931 HydrophobicContact CG2-CB 3.68Å; E927-R931 IonicContact OE2-NH1 3.5Å; E927-R931 PolarHBondContact OE2-NH1 3.24Å; S928-R931 PolarHBondContact O-N 2.98Å; S928-R931 PolarHBondContact OG-N 3.41Å; R931-S934 WeakPolarHBondContact O-CB 3.42Å; R931-S934 PolarHBondContact O-N 3.48Å; R931-L935 PolarHBondContact O-N 3.13Å
932	L	87.3	Confident	84.1	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-63.7	-50.1	173.9	-179.8	64.9	0	0	0	111.5	M889 W891 L898 L900 F923 I926 S928 R929 K930 S934 L935 L936	M889-L932 HydrophobicContact CE-CD1 4.15Å; M889-L932 HydrophobicContact SD-CD1 3.75Å; M889-L932 HydrophobicContact SD-CD2 3.76Å; M889-L932 HydrophobicContact SD-CG 4.41Å; W891-L932 HydrophobicContact CD2-CD2 4.44Å; W891-L932 HydrophobicContact CE3-CD2 3.84Å; W891-L932 HydrophobicContact CH2-CB 4.13Å; W891-L932 HydrophobicContact CH2-CD2 4.42Å; W891-L932 HydrophobicContact CZ3-CB 4.17Å; W891-L932 HydrophobicContact CZ3-CD1 4.11Å; W891-L932 HydrophobicContact CZ3-CD2 3.83Å; W891-L932 HydrophobicContact CZ3-CG 4.26Å; L898-L932 HydrophobicContact CD1-CD2 3.72Å; L900-L932 HydrophobicContact CD2-CD2 4.04Å; F923-L932 HydrophobicContact CD1-CD1 3.75Å; F923-L932 HydrophobicContact CE1-CD1 3.71Å; I926-L932 HydrophobicContact CG2-CB 3.98Å; I926-L932 VanDerWaalsContact CG2-N 3.32Å; S928-L932 PolarHBondContact O-N 3.26Å; R929-L932 PolarHBondContact O-N 2.96Å; K930-L932 VanDerWaalsContact C-N 3.34Å; L932-S934 VanDerWaalsContact C-N 3.26Å; L932-S934 PolarHBondContact O-N 3.1Å; L932-L935 PolarHBondContact O-N 2.82Å; L932-L936 HydrophobicContact CD1-CD1 4.06Å; L932-L936 HydrophobicContact CD1-CG 4.24Å; L932-L936 HydrophobicContact CG-CD1 3.83Å; L932-L936 HydrophobicContact CG-CG 4.42Å; L932-L936 WeakPolarHBondContact O-CB 3.32Å; L932-L936 VanDerWaalsContact O-CG 3.25Å; L932-L936 WeakPolarHBondContact O-CG 3.25Å; L932-L936 PolarHBondContact O-N 3.32Å
933	D	83.9	Confident	83.5	Confident	55 Å²	55	61.3 Å²	61.3	29%	0.294	30%	0.296	S	S	.	.	H	α-helix	trans	-56.1	-41.9	172.9	-178.7	40.8	0	0	0	111.7	I850 R929 L936 Q937	I850-D933 HydrophobicContact CD1-CB 3.77Å; R929-D933 PolarHBondContact O-N 2.91Å; D933-L936 PolarHBondContact O-N 3.31Å; D933-Q937 WeakPolarHBondContact O-CB 3.19Å; D933-Q937 VanDerWaalsContact O-CG 3.3Å; D933-Q937 WeakPolarHBondContact O-CG 3.39Å; D933-Q937 PolarHBondContact O-N 2.98Å; D933-Q937 PolarHBondContact OD1-NE2 2.73Å; D933-Q937 PolarHBondContact OD2-NE2 3.48Å
934	S	84.3	Confident	83.4	Confident	47 Å²	47	67.2 Å²	67.2	33%	0.329	33%	0.327	S	S	.	.	H	α-helix	trans	-61.1	-46.4	175.2	-53.1	0	0	0	0	112.4	K930 R931 L932 Q937 C938	K930-S934 PolarHBondContact O-N 3.07Å; K930-S934 VanDerWaalsContact O-N 3.1Å; K930-S934 PolarHBondContact O-OG 3.4Å; R931-S934 WeakPolarHBondContact O-CB 3.42Å; R931-S934 PolarHBondContact O-N 3.48Å; L932-S934 VanDerWaalsContact C-N 3.26Å; L932-S934 PolarHBondContact O-N 3.1Å; S934-Q937 PolarHBondContact O-N 3.05Å; S934-C938 PolarHBondContact O-N 3.37Å; S934-C938 PolarHBondContact O-SG 2.86Å
935	L	88.8	Confident	83.7	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-61	-47.6	176.3	172.2	61.8	0	0	0	111.4	L922 F923 I926 R931 L932 Q937 C938 I939 I950 L954	L922-L935 HydrophobicContact CB-CD1 4.2Å; L922-L935 HydrophobicContact CB-CD2 4.28Å; L922-L935 HydrophobicContact CD1-CD1 4.02Å; F923-L935 HydrophobicContact CD1-CD2 3.55Å; F923-L935 HydrophobicContact CD2-CD2 4.02Å; F923-L935 HydrophobicContact CE1-CD2 3.48Å; F923-L935 VanDerWaalsContact CE1-CD2 3.48Å; F923-L935 HydrophobicContact CE1-CG 4.17Å; F923-L935 HydrophobicContact CE2-CD2 3.97Å; F923-L935 HydrophobicContact CG-CD2 3.82Å; F923-L935 HydrophobicContact CZ-CD2 3.7Å; F923-L935 HydrophobicContact CZ-CG 4.14Å; I926-L935 HydrophobicContact CD1-CB 4.44Å; I926-L935 HydrophobicContact CD1-CD2 3.98Å; I926-L935 HydrophobicContact CG1-CD2 3.68Å; R931-L935 PolarHBondContact O-N 3.13Å; L932-L935 PolarHBondContact O-N 2.82Å; L935-Q937 VanDerWaalsContact C-N 3.32Å; L935-Q937 PolarHBondContact O-N 3.3Å; L935-C938 PolarHBondContact O-N 3.1Å; L935-C938 VanDerWaalsContact O-N 3.14Å; L935-I939 HydrophobicContact CD1-CD1 3.74Å; L935-I939 HydrophobicContact CD1-CG1 4.07Å; L935-I939 HydrophobicContact CG-CD1 3.85Å; L935-I939 WeakPolarHBondContact O-CG1 3.41Å; L935-I939 PolarHBondContact O-N 3.24Å; L935-I950 HydrophobicContact CD1-CG2 3.82Å; L935-L954 HydrophobicContact CB-CD1 3.89Å; L935-L954 HydrophobicContact CD1-CD1 3.45Å; L935-L954 VanDerWaalsContact CD1-CD1 3.45Å; L935-L954 HydrophobicContact CG-CD1 4.25Å
936	L	87.6	Confident	83.8	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-37.5	179.7	-66.4	169.1	0	0	0	111.9	I850 L900 L916 F923 L932 D933 R940	I850-L936 HydrophobicContact CD1-CD1 3.62Å; L900-L936 HydrophobicContact CB-CD1 4.19Å; L900-L936 HydrophobicContact CD1-CD1 4Å; L900-L936 HydrophobicContact CD1-CD2 4.02Å; L900-L936 HydrophobicContact CD2-CD1 3.9Å; L900-L936 HydrophobicContact CG-CD1 4.25Å; L916-L936 HydrophobicContact CD2-CD2 3.22Å; L916-L936 HydrophobicContact CG-CD2 4.49Å; F923-L936 HydrophobicContact CE1-CD2 3.98Å; F923-L936 HydrophobicContact CZ-CD2 4.07Å; L932-L936 HydrophobicContact CD1-CD1 4.06Å; L932-L936 HydrophobicContact CD1-CG 4.24Å; L932-L936 HydrophobicContact CG-CD1 3.83Å; L932-L936 HydrophobicContact CG-CG 4.42Å; L932-L936 WeakPolarHBondContact O-CB 3.32Å; L932-L936 VanDerWaalsContact O-CG 3.25Å; L932-L936 WeakPolarHBondContact O-CG 3.25Å; L932-L936 PolarHBondContact O-N 3.32Å; D933-L936 PolarHBondContact O-N 3.31Å; L936-R940 VanDerWaalsContact O-CB 3.31Å; L936-R940 WeakPolarHBondContact O-CB 3.12Å; L936-R940 WeakPolarHBondContact O-CD 3.2Å; L936-R940 WeakPolarHBondContact O-CG 3.49Å; L936-R940 PolarHBondContact O-N 2.97Å
937	Q	84.2	Confident	84.1	Confident	71 Å²	71	65.8 Å²	65.8	33%	0.332	31%	0.311	S	S	.	.	H	α-helix	trans	-70	-34.9	173	-71.9	-177.2	40.9	0	0	112.7	D933 S934 L935 R941	D933-Q937 WeakPolarHBondContact O-CB 3.19Å; D933-Q937 VanDerWaalsContact O-CG 3.3Å; D933-Q937 WeakPolarHBondContact O-CG 3.39Å; D933-Q937 PolarHBondContact O-N 2.98Å; D933-Q937 PolarHBondContact OD1-NE2 2.73Å; D933-Q937 PolarHBondContact OD2-NE2 3.48Å; S934-Q937 PolarHBondContact O-N 3.05Å; L935-Q937 VanDerWaalsContact C-N 3.32Å; L935-Q937 PolarHBondContact O-N 3.3Å; Q937-R941 WeakPolarHBondContact O-CB 3.46Å; Q937-R941 VanDerWaalsContact O-CG 3.24Å; Q937-R941 WeakPolarHBondContact O-CG 3.22Å; Q937-R941 PolarHBondContact O-N 3.49Å; Q937-R941 VanDerWaalsContact O-N 3.1Å
938	C	84.4	Confident	84.6	Confident	14 Å²	14	60.9 Å²	60.9	10%	0.095	29%	0.288	C	S	.	.	H	α-helix	trans	-66.7	-47.2	174.7	-66.5	0	0	0	0	111.4	S934 L935 R940 R941 H942 I950 M953	S934-C938 PolarHBondContact O-N 3.37Å; S934-C938 PolarHBondContact O-SG 2.86Å; L935-C938 PolarHBondContact O-N 3.1Å; L935-C938 VanDerWaalsContact O-N 3.14Å; C938-R940 VanDerWaalsContact C-N 3.33Å; C938-R940 PolarHBondContact O-N 3.35Å; C938-R941 PolarHBondContact O-N 3.32Å; C938-R941 VanDerWaalsContact O-N 3.09Å; C938-H942 PolarHBondContact O-N 2.75Å; C938-I950 HydrophobicContact CB-CD1 4.19Å; C938-I950 HydrophobicContact CB-CG2 4.38Å; C938-M953 HydrophobicContact CB-SD 4.11Å; C938-M953 VanDerWaalsContact SG-SD 3.65Å
939	I	86.8	Confident	85.1	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-45.4	174.8	-67.5	167.3	0	0	0	111	N915 L916 F919 F923 L935 R941	N915-I939 WeakPolarHBondContact OD1-CG2 3.48Å; L916-I939 HydrophobicContact CD2-CD1 4.37Å; F919-I939 HydrophobicContact CB-CD1 3.58Å; F919-I939 HydrophobicContact CB-CG1 4.15Å; F919-I939 HydrophobicContact CD1-CG1 4.28Å; F919-I939 HydrophobicContact CD2-CB 4.26Å; F919-I939 HydrophobicContact CD2-CD1 3.86Å; F919-I939 HydrophobicContact CD2-CG1 3.65Å; F919-I939 HydrophobicContact CD2-CG2 3.67Å; F919-I939 HydrophobicContact CE2-CB 4.4Å; F919-I939 HydrophobicContact CE2-CG1 4.08Å; F919-I939 HydrophobicContact CE2-CG2 3.78Å; F919-I939 HydrophobicContact CG-CD1 3.77Å; F919-I939 HydrophobicContact CG-CG1 3.76Å; F923-I939 HydrophobicContact CE2-CD1 3.99Å; F923-I939 HydrophobicContact CZ-CD1 3.72Å; L935-I939 HydrophobicContact CD1-CD1 3.74Å; L935-I939 HydrophobicContact CD1-CG1 4.07Å; L935-I939 HydrophobicContact CG-CD1 3.85Å; L935-I939 WeakPolarHBondContact O-CG1 3.41Å; L935-I939 PolarHBondContact O-N 3.24Å; I939-R941 VanDerWaalsContact C-N 3.26Å; I939-R941 PolarHBondContact O-N 3.31Å
940	R	82.2	Confident	85.7	Confident	91 Å²	91	54.4 Å²	54.4	34%	0.343	26%	0.256	S	S	.	.	H	α-helix	trans	-68.5	-17.3	177.8	-72.8	169.3	179.7	157.6	1.2	114.3	L900 C901 L936 C938	L900-R940 PolarHBondContact O-NH2 3.26Å; C901-R940 PolarHBondContact SG-NH2 3.23Å; L936-R940 VanDerWaalsContact O-CB 3.31Å; L936-R940 WeakPolarHBondContact O-CB 3.12Å; L936-R940 WeakPolarHBondContact O-CD 3.2Å; L936-R940 WeakPolarHBondContact O-CG 3.49Å; L936-R940 PolarHBondContact O-N 2.97Å; C938-R940 VanDerWaalsContact C-N 3.33Å; C938-R940 PolarHBondContact O-N 3.35Å
941	R	81.4	Confident	86.3	Confident	176 Å²	176	46.2 Å²	46.2	66%	0.664	22%	0.22	S	C	*	.	H	α-helix	trans	-100.2	-34.7	179.4	-75.8	177.5	-172.4	-177.5	7.4	113.7	Q937 C938 I939	Q937-R941 WeakPolarHBondContact O-CB 3.46Å; Q937-R941 VanDerWaalsContact O-CG 3.24Å; Q937-R941 WeakPolarHBondContact O-CG 3.22Å; Q937-R941 PolarHBondContact O-N 3.49Å; Q937-R941 VanDerWaalsContact O-N 3.1Å; C938-R941 PolarHBondContact O-N 3.32Å; C938-R941 VanDerWaalsContact O-N 3.09Å; I939-R941 VanDerWaalsContact C-N 3.26Å; I939-R941 PolarHBondContact O-N 3.31Å
942	H	82.3	Confident	86.8	Confident	43 Å²	43	40.1 Å²	40.1	20%	0.199	20%	0.197	C	C	.	.			trans	-121.8	58.9	-170.9	-59.9	-85.9	0	0	0	110.7	C938 L944 W945 I950 E982	C938-H942 PolarHBondContact O-N 2.75Å; H942-L944 PolarHBondContact O-N 2.85Å; H942-L944 VanDerWaalsContact O-N 3.1Å; H942-W945 HydrophobicContact CB-CB 3.99Å; H942-W945 HydrophobicContact CB-CD2 3.7Å; H942-W945 HydrophobicContact CB-CE3 4.14Å; H942-W945 HydrophobicContact CB-CG 3.65Å; H942-W945 AromaticContact CE1-CZ2 3.81Å; H942-W945 AromaticContact CG-CD2 3.93Å; H942-W945 AromaticContact CG-CE2 3.92Å; H942-W945 AromaticContact ND1-CD2 3.94Å; H942-W945 AromaticContact ND1-CE2 3.43Å; H942-W945 AromaticContact ND1-CH2 3.95Å; H942-W945 AromaticContact ND1-CZ2 3.44Å; H942-W945 WeakPolarHBondContact ND1-CZ2 3.35Å; H942-W945 AromaticContact ND1-NE1 3.8Å; H942-W945 WeakPolarHBondContact O-CB 3.3Å; H942-W945 PolarHBondContact O-N 2.89Å; H942-I950 HydrophobicContact CB-CD1 4.13Å; H942-E982 IonicContact ND1-OE1 2.72Å
943	S	76.8	Confident	87	Confident	84 Å²	84	41.6 Å²	41.6	59%	0.587	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.8	-174.8	52.3	0	0	0	0	115
944	L	83.7	Confident	87.3	Confident	132 Å²	132	40.3 Å²	40.3	69%	0.691	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	-5.9	176.8	-60	179.5	0	0	0	113.9	H942 K946	H942-L944 PolarHBondContact O-N 2.85Å; H942-L944 VanDerWaalsContact O-N 3.1Å; L944-K946 PolarHBondContact O-N 3.24Å
945	W	89	Confident	87.6	Confident	8 Å²	8	39 Å²	39	3%	0.03	19%	0.191	C	C	.	.			trans	-82.5	119.9	-176.2	-79.5	22.7	0	0	0	112.1	F919 H942 H949 I950 M953 E982 I989	F919-W945 VanDerWaalsContact CE1-O 3.3Å; F919-W945 WeakPolarHBondContact CE1-O 3.31Å; F919-W945 VanDerWaalsContact CZ-O 3.32Å; F919-W945 WeakPolarHBondContact CZ-O 3.46Å; H942-W945 HydrophobicContact CB-CB 3.99Å; H942-W945 HydrophobicContact CB-CD2 3.7Å; H942-W945 HydrophobicContact CB-CE3 4.14Å; H942-W945 HydrophobicContact CB-CG 3.65Å; H942-W945 AromaticContact CE1-CZ2 3.81Å; H942-W945 AromaticContact CG-CD2 3.93Å; H942-W945 AromaticContact CG-CE2 3.92Å; H942-W945 AromaticContact ND1-CD2 3.94Å; H942-W945 AromaticContact ND1-CE2 3.43Å; H942-W945 AromaticContact ND1-CH2 3.95Å; H942-W945 AromaticContact ND1-CZ2 3.44Å; H942-W945 WeakPolarHBondContact ND1-CZ2 3.35Å; H942-W945 AromaticContact ND1-NE1 3.8Å; H942-W945 WeakPolarHBondContact O-CB 3.3Å; H942-W945 PolarHBondContact O-N 2.89Å; W945-H949 HydrophobicContact CB-CB 4.18Å; W945-H949 HydrophobicContact CD2-CB 3.97Å; W945-H949 HydrophobicContact CE3-CB 3.63Å; W945-H949 HydrophobicContact CG-CB 4.22Å; W945-H949 HydrophobicContact CZ3-CB 4.37Å; W945-I950 HydrophobicContact CB-CD1 3.99Å; W945-I950 HydrophobicContact CB-CG1 4.13Å; W945-I950 HydrophobicContact CD2-CD1 4.49Å; W945-I950 HydrophobicContact CE3-CD1 3.85Å; W945-M953 HydrophobicContact CE3-SD 4.34Å; W945-M953 HydrophobicContact CH2-SD 4.22Å; W945-M953 HydrophobicContact CZ3-CB 4.04Å; W945-M953 HydrophobicContact CZ3-CG 4.15Å; W945-M953 HydrophobicContact CZ3-SD 3.59Å; W945-M953 VanDerWaalsContact CZ3-SD 3.59Å; W945-E982 WeakPolarHBondContact CZ2-OE1 3.45Å; W945-E982 PolarHBondContact NE1-OE1 2.91Å; W945-E982 PolarHBondContact NE1-OE2 3.29Å; W945-I989 HydrophobicContact CH2-CD1 4.41Å; W945-I989 HydrophobicContact CH2-CG2 4.49Å; W945-I989 HydrophobicContact CZ3-CD1 4.39Å; W945-I989 HydrophobicContact CZ3-CG2 4.25Å
946	K	89.3	Confident	87.7	Confident	94 Å²	94	39.8 Å²	39.8	41%	0.409	20%	0.195	S	C	.	.			trans	-56.8	152.9	170.5	-58.6	-179.1	-178.3	-177.2	0	112.1	L944 V948 H949 Q977	L944-K946 PolarHBondContact O-N 3.24Å; K946-V948 HydrophobicContact CB-CG1 4.42Å; K946-V948 PolarHBondContact O-N 3.49Å; K946-H949 PolarHBondContact N-ND1 2.65Å; K946-H949 PolarHBondContact O-N 3.36Å; K946-H949 PolarHBondContact O-ND1 3.5Å; K946-Q977 VanDerWaalsContact NZ-CD 3.34Å
947	P	88.8	Confident	87.9	Confident	18 Å²	18	44.5 Å²	44.5	12%	0.117	21%	0.213	C	C	.	.	H	α-helix	trans	-51.4	-32.5	-177.1	-31.4	36.8	0	0	0	116.2	Y918 F919 L922 H949 I950 A951	Y918-P947 HydrophobicContact CE1-CG 4.3Å; F919-P947 HydrophobicContact CD1-CG 4.13Å; F919-P947 HydrophobicContact CE1-CG 4.27Å; L922-P947 HydrophobicContact CD1-CB 4.37Å; L922-P947 HydrophobicContact CD2-CB 4.34Å; L922-P947 HydrophobicContact CG-CB 4.41Å; P947-H949 VanDerWaalsContact C-N 3.32Å; P947-H949 PolarHBondContact O-N 2.68Å; P947-I950 PolarHBondContact O-N 2.98Å; P947-A951 VanDerWaalsContact O-CB 3.28Å; P947-A951 WeakPolarHBondContact O-CB 3.4Å; P947-A951 PolarHBondContact O-N 3.11Å
948	V	92.1	Very high	88.2	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-37.4	175.6	65.3	0	0	0	0	113.2	K946 A951 A952 Y959 F960 Q974 P986	K946-V948 HydrophobicContact CB-CG1 4.42Å; K946-V948 PolarHBondContact O-N 3.49Å; V948-A951 PolarHBondContact O-N 3.18Å; V948-A952 WeakPolarHBondContact O-CB 3.43Å; V948-A952 PolarHBondContact O-N 2.89Å; V948-Y959 HydrophobicContact CB-CE1 4.22Å; V948-Y959 HydrophobicContact CG2-CE1 4.41Å; V948-F960 HydrophobicContact CG2-CE1 3.59Å; V948-F960 HydrophobicContact CG2-CZ 3.96Å; V948-Q974 HydrophobicContact CB-CB 4.35Å; V948-Q974 HydrophobicContact CG1-CB 4.46Å; V948-Q974 HydrophobicContact CG2-CB 4.12Å; V948-P986 HydrophobicContact CG2-CB 4.32Å; V948-P986 HydrophobicContact CG2-CG 3.92Å
949	H	93.5	Very high	88.5	Confident	4 Å²	4	46.6 Å²	46.6	2%	0.019	22%	0.219	C	C	.	.	H	α-helix	trans	-73.7	-41	179.5	-49	108.7	0	0	0	111.2	W945 K946 P947 A951 A952 M953 C979 I989	W945-H949 HydrophobicContact CB-CB 4.18Å; W945-H949 HydrophobicContact CD2-CB 3.97Å; W945-H949 HydrophobicContact CE3-CB 3.63Å; W945-H949 HydrophobicContact CG-CB 4.22Å; W945-H949 HydrophobicContact CZ3-CB 4.37Å; K946-H949 PolarHBondContact N-ND1 2.65Å; K946-H949 PolarHBondContact O-N 3.36Å; K946-H949 PolarHBondContact O-ND1 3.5Å; P947-H949 VanDerWaalsContact C-N 3.32Å; P947-H949 PolarHBondContact O-N 2.68Å; H949-A951 VanDerWaalsContact C-N 3.33Å; H949-A952 PolarHBondContact O-N 3.22Å; H949-M953 WeakPolarHBondContact O-CB 3.09Å; H949-M953 PolarHBondContact O-N 3.46Å; H949-C979 PolarHBondContact NE2-N 2.91Å; H949-I989 HydrophobicContact CB-CD1 3.93Å
950	I	90.8	Very high	88.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-37.7	173.8	-57.2	-68.8	0	0	0	110.6	F919 L922 L935 C938 H942 W945 P947 M953 L954	F919-I950 HydrophobicContact CD1-CG1 4.4Å; F919-I950 HydrophobicContact CE1-CG1 3.77Å; F919-I950 HydrophobicContact CZ-CG1 4.44Å; L922-I950 HydrophobicContact CD1-CB 3.78Å; L922-I950 HydrophobicContact CD1-CG2 3.54Å; L935-I950 HydrophobicContact CD1-CG2 3.82Å; C938-I950 HydrophobicContact CB-CD1 4.19Å; C938-I950 HydrophobicContact CB-CG2 4.38Å; H942-I950 HydrophobicContact CB-CD1 4.13Å; W945-I950 HydrophobicContact CB-CD1 3.99Å; W945-I950 HydrophobicContact CB-CG1 4.13Å; W945-I950 HydrophobicContact CD2-CD1 4.49Å; W945-I950 HydrophobicContact CE3-CD1 3.85Å; P947-I950 PolarHBondContact O-N 2.98Å; I950-M953 PolarHBondContact O-N 3.43Å; I950-L954 HydrophobicContact CG2-CD1 3.67Å; I950-L954 HydrophobicContact CG2-CG 4.34Å; I950-L954 WeakPolarHBondContact O-CB 3.42Å; I950-L954 WeakPolarHBondContact O-CG 3.46Å; I950-L954 PolarHBondContact O-N 2.68Å
951	A	92.4	Very high	89.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-39.5	173.5	0	0	0	0	0	112.5	L922 P947 V948 H949 G955 I956 Y959 F960	L922-A951 HydrophobicContact CD2-CB 3.97Å; P947-A951 VanDerWaalsContact O-CB 3.28Å; P947-A951 WeakPolarHBondContact O-CB 3.4Å; P947-A951 PolarHBondContact O-N 3.11Å; V948-A951 PolarHBondContact O-N 3.18Å; H949-A951 VanDerWaalsContact C-N 3.33Å; A951-G955 PolarHBondContact O-N 3.34Å; A951-G955 VanDerWaalsContact O-N 3.07Å; A951-I956 HydrophobicContact CB-CB 4.35Å; A951-I956 PolarHBondContact O-N 3.09Å; A951-Y959 HydrophobicContact CB-CD1 3.5Å; A951-Y959 VanDerWaalsContact CB-CD1 3.5Å; A951-Y959 HydrophobicContact CB-CE1 4.03Å; A951-Y959 HydrophobicContact CB-CG 3.8Å; A951-F960 HydrophobicContact CB-CE2 3.71Å; A951-F960 HydrophobicContact CB-CZ 4.08Å
952	A	93.6	Very high	89.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-44.8	172.7	0	0	0	0	0	111.8	V948 H949 L954 G955 F960 P986 I989 A990 H995	V948-A952 WeakPolarHBondContact O-CB 3.43Å; V948-A952 PolarHBondContact O-N 2.89Å; H949-A952 PolarHBondContact O-N 3.22Å; A952-L954 VanDerWaalsContact C-N 3.32Å; A952-L954 PolarHBondContact O-N 3.29Å; A952-G955 PolarHBondContact O-N 2.89Å; A952-F960 HydrophobicContact CB-CZ 4.03Å; A952-P986 HydrophobicContact CB-CB 4.17Å; A952-P986 WeakPolarHBondContact CB-O 3.48Å; A952-I989 HydrophobicContact CB-CB 4.06Å; A952-I989 HydrophobicContact CB-CG2 3.88Å; A952-A990 HydrophobicContact CB-CB 4.49Å; A952-H995 PolarHBondContact O-CD2 2.72Å
953	M	90.9	Very high	89.8	Confident	32 Å²	32	37 Å²	37	16%	0.158	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-34.9	179.2	-168.8	-173.6	-172.3	0	0	113.1	C938 W945 H949 I950 I989 N993 H995	C938-M953 HydrophobicContact CB-SD 4.11Å; C938-M953 VanDerWaalsContact SG-SD 3.65Å; W945-M953 HydrophobicContact CE3-SD 4.34Å; W945-M953 HydrophobicContact CH2-SD 4.22Å; W945-M953 HydrophobicContact CZ3-CB 4.04Å; W945-M953 HydrophobicContact CZ3-CG 4.15Å; W945-M953 HydrophobicContact CZ3-SD 3.59Å; W945-M953 VanDerWaalsContact CZ3-SD 3.59Å; H949-M953 WeakPolarHBondContact O-CB 3.09Å; H949-M953 PolarHBondContact O-N 3.46Å; I950-M953 PolarHBondContact O-N 3.43Å; M953-I989 HydrophobicContact CB-CG2 3.98Å; M953-N993 WeakPolarHBondContact CG-OD1 3.25Å; M953-N993 WeakPolarHBondContact O-CB 3.46Å; M953-H995 PolarHBondContact O-NE2 3.5Å
954	L	89.5	Confident	90.4	Very high	28 Å²	28	34.1 Å²	34.1	15%	0.147	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-1.1	179.8	-66.2	172.6	0	0	0	113.8	L935 I950 A952 I956	L935-L954 HydrophobicContact CB-CD1 3.89Å; L935-L954 HydrophobicContact CD1-CD1 3.45Å; L935-L954 VanDerWaalsContact CD1-CD1 3.45Å; L935-L954 HydrophobicContact CG-CD1 4.25Å; I950-L954 HydrophobicContact CG2-CD1 3.67Å; I950-L954 HydrophobicContact CG2-CG 4.34Å; I950-L954 WeakPolarHBondContact O-CB 3.42Å; I950-L954 WeakPolarHBondContact O-CG 3.46Å; I950-L954 PolarHBondContact O-N 2.68Å; A952-L954 VanDerWaalsContact C-N 3.32Å; A952-L954 PolarHBondContact O-N 3.29Å; L954-I956 VanDerWaalsContact C-N 3.34Å; L954-I956 HydrophobicContact CB-CD1 3.89Å; L954-I956 HydrophobicContact CB-CG1 3.72Å; L954-I956 HydrophobicContact CD1-CD1 4.1Å; L954-I956 PolarHBondContact O-N 3.45Å
955	G	90.9	Very high	90.6	Very high	19 Å²	19	36.1 Å²	36.1	20%	0.196	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	26.8	177.6	0	0	0	0	0	114.3	A951 A952 R957 H995	A951-G955 PolarHBondContact O-N 3.34Å; A951-G955 VanDerWaalsContact O-N 3.07Å; A952-G955 PolarHBondContact O-N 2.89Å; G955-R957 PolarHBondContact O-N 2.87Å; G955-H995 WeakPolarHBondContact CA-ND1 3.26Å; G955-H995 PolarHBondContact N-CD2 2.92Å; G955-H995 PolarHBondContact N-NE2 2.73Å
956	I	90.9	Very high	90.4	Very high	16 Å²	16	41.9 Å²	41.9	8%	0.082	20%	0.195	C	C	.	.			trans	-79.5	68.9	-172.3	-48.4	-179.1	0	0	0	109.9	L922 F925 I926 A951 L954 K958 Y959 F960	L922-I956 HydrophobicContact CB-CD1 4.46Å; L922-I956 HydrophobicContact CD2-CD1 4.46Å; F925-I956 HydrophobicContact CB-CG2 3.45Å; F925-I956 VanDerWaalsContact CB-CG2 3.45Å; F925-I956 HydrophobicContact CD2-CG2 3.87Å; F925-I956 HydrophobicContact CG-CG2 3.76Å; I926-I956 HydrophobicContact CD1-CD1 3.99Å; A951-I956 HydrophobicContact CB-CB 4.35Å; A951-I956 PolarHBondContact O-N 3.09Å; L954-I956 VanDerWaalsContact C-N 3.34Å; L954-I956 HydrophobicContact CB-CD1 3.89Å; L954-I956 HydrophobicContact CB-CG1 3.72Å; L954-I956 HydrophobicContact CD1-CD1 4.1Å; L954-I956 PolarHBondContact O-N 3.45Å; I956-K958 PolarHBondContact O-N 2.79Å; I956-K958 VanDerWaalsContact O-N 3.11Å; I956-Y959 VanDerWaalsContact O-CB 3.27Å; I956-Y959 WeakPolarHBondContact O-CB 3Å; I956-Y959 PolarHBondContact O-N 2.97Å; I956-F960 WeakPolarHBondContact O-CD2 3.47Å
957	R	91.8	Very high	90.1	Very high	101 Å²	101	41.3 Å²	41.3	38%	0.381	19%	0.194	S	C	.	.	H	α-helix	trans	-53	-34.4	179.1	-179.3	175.5	149.7	172.2	-7.8	113.2	G955 Y959 F960 E961 L998 Y1001	G955-R957 PolarHBondContact O-N 2.87Å; R957-Y959 PolarHBondContact O-N 3.29Å; R957-F960 PolarHBondContact O-N 2.94Å; R957-F960 VanDerWaalsContact O-N 3.14Å; R957-E961 HydrophobicContact CG-CG 4.22Å; R957-E961 IonicContact CZ-OE1 3.23Å; R957-E961 VanDerWaalsContact CZ-OE1 3.23Å; R957-E961 IonicContact NE-OE1 2.75Å; R957-E961 PolarHBondContact NE-OE1 3.45Å; R957-E961 IonicContact NH2-OE1 2.81Å; R957-E961 PolarHBondContact NH2-OE1 3.41Å; R957-E961 WeakPolarHBondContact O-CG 3.4Å; R957-E961 PolarHBondContact O-N 3.03Å; R957-L998 HydrophobicContact CB-CD1 4.09Å; R957-L998 HydrophobicContact CG-CD1 4.25Å; R957-Y1001 HydrophobicContact CG-CD1 4.19Å; R957-Y1001 HydrophobicContact CG-CG 4.34Å
958	K	90.3	Very high	89.7	Confident	105 Å²	105	44.7 Å²	44.7	46%	0.457	22%	0.216	S	C	.	.	H	α-helix	trans	-57.1	-30.6	173.8	-65.2	-178.9	179.3	178	0	113.7	F925 E927 I956 N962	F925-K958 HydrophobicContact CD1-CB 3.51Å; F925-K958 HydrophobicContact CD1-CD 4.08Å; F925-K958 HydrophobicContact CD1-CG 4.44Å; F925-K958 HydrophobicContact CE1-CB 3.7Å; F925-K958 HydrophobicContact CG-CB 4.23Å; E927-K958 IonicContact OE1-NZ 3.68Å; E927-K958 PolarHBondContact OE1-NZ 2.84Å; I956-K958 PolarHBondContact O-N 2.79Å; I956-K958 VanDerWaalsContact O-N 3.11Å; K958-N962 VanDerWaalsContact O-CB 3.24Å; K958-N962 WeakPolarHBondContact O-CB 3.45Å; K958-N962 PolarHBondContact O-N 2.83Å
959	Y	91.5	Very high	89.2	Confident	23 Å²	23	49.4 Å²	49.4	9%	0.09	25%	0.249	C	C	.	.	H	α-helix	trans	-67.2	-51.3	174.3	174	-92.5	0	0	0	110.5	L922 F925 V948 A951 I956 R957 E961 N962 V963 Q974	L922-Y959 HydrophobicContact CD2-CD2 3.7Å; L922-Y959 HydrophobicContact CD2-CE2 3.93Å; L922-Y959 HydrophobicContact CD2-CG 4.26Å; F925-Y959 HydrophobicContact CE2-CD2 4.26Å; V948-Y959 HydrophobicContact CB-CE1 4.22Å; V948-Y959 HydrophobicContact CG2-CE1 4.41Å; A951-Y959 HydrophobicContact CB-CD1 3.5Å; A951-Y959 VanDerWaalsContact CB-CD1 3.5Å; A951-Y959 HydrophobicContact CB-CE1 4.03Å; A951-Y959 HydrophobicContact CB-CG 3.8Å; I956-Y959 VanDerWaalsContact O-CB 3.27Å; I956-Y959 WeakPolarHBondContact O-CB 3Å; I956-Y959 PolarHBondContact O-N 2.97Å; R957-Y959 PolarHBondContact O-N 3.29Å; Y959-E961 PolarHBondContact O-N 2.98Å; Y959-N962 PolarHBondContact O-N 3.01Å; Y959-N962 VanDerWaalsContact O-N 3.12Å; Y959-V963 HydrophobicContact CD1-CG2 4.34Å; Y959-V963 HydrophobicContact CD2-CG2 4.39Å; Y959-V963 HydrophobicContact CE1-CG2 4.02Å; Y959-V963 HydrophobicContact CE2-CG2 4.08Å; Y959-V963 WeakPolarHBondContact O-CG2 3.27Å; Y959-V963 PolarHBondContact O-N 3.09Å; Y959-Q974 PolarHBondContact OH-OE1 3.29Å
960	F	92.4	Very high	88.8	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.5	-43.4	178.1	-63.7	-92.2	0	0	0	111.6	V948 A951 A952 I956 R957 N962 A964 I971 L975 P986 L998 Y1001 M1002	V948-F960 HydrophobicContact CG2-CE1 3.59Å; V948-F960 HydrophobicContact CG2-CZ 3.96Å; A951-F960 HydrophobicContact CB-CE2 3.71Å; A951-F960 HydrophobicContact CB-CZ 4.08Å; A952-F960 HydrophobicContact CB-CZ 4.03Å; I956-F960 WeakPolarHBondContact O-CD2 3.47Å; R957-F960 PolarHBondContact O-N 2.94Å; R957-F960 VanDerWaalsContact O-N 3.14Å; F960-N962 VanDerWaalsContact C-N 3.3Å; F960-N962 PolarHBondContact O-N 2.96Å; F960-A964 WeakPolarHBondContact O-CB 3.44Å; F960-A964 PolarHBondContact O-N 3.19Å; F960-I971 HydrophobicContact CD1-CD1 4.06Å; F960-L975 HydrophobicContact CD1-CD2 4.28Å; F960-L975 HydrophobicContact CE1-CD2 4.21Å; F960-P986 HydrophobicContact CE1-CB 4.49Å; F960-L998 HydrophobicContact CD2-CD1 3.68Å; F960-L998 HydrophobicContact CD2-CD2 4.15Å; F960-L998 HydrophobicContact CE2-CD1 4.11Å; F960-L998 HydrophobicContact CE2-CD2 3.78Å; F960-L998 HydrophobicContact CG-CD1 4.09Å; F960-L998 HydrophobicContact CZ-CD2 4.48Å; F960-Y1001 HydrophobicContact CB-CE1 4.32Å; F960-M1002 HydrophobicContact CD1-CE 3.81Å; F960-M1002 HydrophobicContact CE1-CE 3.32Å; F960-M1002 HydrophobicContact CE2-CE 4.14Å; F960-M1002 HydrophobicContact CG-CE 4.41Å; F960-M1002 HydrophobicContact CZ-CE 3.53Å
961	E	91.3	Very high	88.7	Confident	51 Å²	51	53.5 Å²	53.5	24%	0.238	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-33.7	174.2	-73.9	175.5	162.9	0	0	113.1	R957 Y959 R965 Y1001	R957-E961 HydrophobicContact CG-CG 4.22Å; R957-E961 IonicContact CZ-OE1 3.23Å; R957-E961 VanDerWaalsContact CZ-OE1 3.23Å; R957-E961 IonicContact NE-OE1 2.75Å; R957-E961 PolarHBondContact NE-OE1 3.45Å; R957-E961 IonicContact NH2-OE1 2.81Å; R957-E961 PolarHBondContact NH2-OE1 3.41Å; R957-E961 WeakPolarHBondContact O-CG 3.4Å; R957-E961 PolarHBondContact O-N 3.03Å; Y959-E961 PolarHBondContact O-N 2.98Å; E961-R965 WeakPolarHBondContact O-CB 3.4Å; E961-R965 PolarHBondContact O-N 2.86Å; E961-Y1001 HydrophobicContact CG-CE1 3.94Å; E961-Y1001 HydrophobicContact CG-CE2 4.21Å; E961-Y1001 WeakPolarHBondContact CG-OH 3.48Å
962	N	89.4	Confident	88.3	Confident	46 Å²	46	56.3 Å²	56.3	25%	0.246	29%	0.286	C	S	.	.	H	α-helix	trans	-79.2	-44.4	178.8	-166.6	57.8	0	0	0	112.3	F925 K958 Y959 F960 R965 Q966	F925-N962 HydrophobicContact CZ-CB 4.25Å; K958-N962 VanDerWaalsContact O-CB 3.24Å; K958-N962 WeakPolarHBondContact O-CB 3.45Å; K958-N962 PolarHBondContact O-N 2.83Å; Y959-N962 PolarHBondContact O-N 3.01Å; Y959-N962 VanDerWaalsContact O-N 3.12Å; F960-N962 VanDerWaalsContact C-N 3.3Å; F960-N962 PolarHBondContact O-N 2.96Å; N962-R965 PolarHBondContact O-N 3.3Å; N962-R965 VanDerWaalsContact O-N 3.16Å; N962-Q966 VanDerWaalsContact ND2-CD 3.3Å; N962-Q966 PolarHBondContact ND2-NE2 3.45Å; N962-Q966 PolarHBondContact ND2-OE1 2.82Å; N962-Q966 WeakPolarHBondContact O-CB 3.35Å; N962-Q966 WeakPolarHBondContact O-CG 3.33Å; N962-Q966 PolarHBondContact O-N 2.87Å
963	V	87.9	Confident	88	Confident	13 Å²	13	61.6 Å²	61.6	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-63.4	-41.8	175.1	177.1	0	0	0	0	110.6	Y959 R965 Q966 E967 I971	Y959-V963 HydrophobicContact CD1-CG2 4.34Å; Y959-V963 HydrophobicContact CD2-CG2 4.39Å; Y959-V963 HydrophobicContact CE1-CG2 4.02Å; Y959-V963 HydrophobicContact CE2-CG2 4.08Å; Y959-V963 WeakPolarHBondContact O-CG2 3.27Å; Y959-V963 PolarHBondContact O-N 3.09Å; V963-R965 VanDerWaalsContact C-N 3.25Å; V963-R965 PolarHBondContact O-N 2.99Å; V963-Q966 PolarHBondContact O-N 2.78Å; V963-E967 CarbonylContact O-C 3.44Å; V963-E967 PolarHBondContact O-N 2.75Å; V963-I971 HydrophobicContact CB-CD1 4.21Å; V963-I971 HydrophobicContact CG1-CB 4.15Å; V963-I971 HydrophobicContact CG1-CD1 4.03Å
964	A	88.6	Confident	87.9	Confident	25 Å²	25	61.2 Å²	61.2	21%	0.207	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-28.3	174.6	0	0	0	0	0	113.6	F960 I971 L1006	F960-A964 WeakPolarHBondContact O-CB 3.44Å; F960-A964 PolarHBondContact O-N 3.19Å; A964-I971 HydrophobicContact CB-CB 4.33Å; A964-I971 HydrophobicContact CB-CG1 4.13Å; A964-I971 HydrophobicContact CB-CG2 4.12Å; A964-L1006 HydrophobicContact CB-CD2 4.46Å
965	R	87.6	Confident	87.9	Confident	174 Å²	174	60.5 Å²	60.5	66%	0.657	31%	0.306	S	S	*	.	H	α-helix	trans	-82.6	-37.2	176.3	-172.4	-174.5	-61.9	111.1	2.1	112.8	E961 N962 V963	E961-R965 WeakPolarHBondContact O-CB 3.4Å; E961-R965 PolarHBondContact O-N 2.86Å; N962-R965 PolarHBondContact O-N 3.3Å; N962-R965 VanDerWaalsContact O-N 3.16Å; V963-R965 VanDerWaalsContact C-N 3.25Å; V963-R965 PolarHBondContact O-N 2.99Å
966	Q	84.8	Confident	87.8	Confident	128 Å²	128	64.8 Å²	64.8	60%	0.598	32%	0.324	S	S	*	.	H	α-helix	trans	-85.9	-41.8	-175.4	-70.5	-178.3	-25.6	0	0	112.7	N962 V963	N962-Q966 VanDerWaalsContact ND2-CD 3.3Å; N962-Q966 PolarHBondContact ND2-NE2 3.45Å; N962-Q966 PolarHBondContact ND2-OE1 2.82Å; N962-Q966 WeakPolarHBondContact O-CB 3.35Å; N962-Q966 WeakPolarHBondContact O-CG 3.33Å; N962-Q966 PolarHBondContact O-N 2.87Å; V963-Q966 PolarHBondContact O-N 2.78Å
967	E	83.1	Confident	87.7	Confident	82 Å²	82	65.7 Å²	65.7	38%	0.383	33%	0.328	S	S	.	.			trans	-138.3	74.4	-174.2	-61.2	-177.7	101.6	0	0	110.9	V963 S969 K970 I971	V963-E967 CarbonylContact O-C 3.44Å; V963-E967 PolarHBondContact O-N 2.75Å; E967-S969 PolarHBondContact O-N 3.48Å; E967-S969 VanDerWaalsContact O-N 3.14Å; E967-K970 HydrophobicContact CB-CB 3.7Å; E967-K970 HydrophobicContact CB-CD 3.94Å; E967-K970 HydrophobicContact CG-CD 4.25Å; E967-K970 WeakPolarHBondContact O-CB 3.49Å; E967-K970 PolarHBondContact O-N 2.72Å; E967-K970 WeakPolarHBondContact OE1-CD 3.45Å; E967-K970 IonicContact OE1-NZ 2.73Å; E967-K970 PolarHBondContact OE1-NZ 2.99Å; E967-K970 WeakPolarHBondContact OE2-CD 3.34Å; E967-K970 WeakPolarHBondContact OE2-CE 3.29Å; E967-K970 IonicContact OE2-NZ 2.65Å; E967-K970 PolarHBondContact OE2-NZ 3.42Å; E967-I971 PolarHBondContact O-N 3.01Å
968	P	80.7	Confident	87.5	Confident	90 Å²	90	63.6 Å²	63.6	58%	0.584	32%	0.323	S	S	*	.	H	α-helix	trans	-61.3	-24.4	-173.1	-23	32.6	0	0	0	115.4	K970 I971	P968-K970 VanDerWaalsContact C-N 3.34Å; P968-I971 WeakPolarHBondContact O-CG2 3.3Å
969	S	82	Confident	87.4	Confident	100 Å²	100	58.6 Å²	58.6	70%	0.699	30%	0.302	S	S	*	.	H	α-helix	trans	-75.6	-22.6	173.1	49	0	0	0	0	113.4	E967 S972	E967-S969 PolarHBondContact O-N 3.48Å; E967-S969 VanDerWaalsContact O-N 3.14Å; S969-S972 PolarHBondContact O-OG 2.89Å; S969-S972 VanDerWaalsContact O-OG 3.08Å
970	K	84	Confident	86.8	Confident	76 Å²	76	63 Å²	63	33%	0.33	32%	0.323	S	S	.	.	H	α-helix	trans	-96.7	-23.3	-172	-156.9	-177.6	-167.6	173.6	0	112.2	E967 P968 E973 Q974	E967-K970 HydrophobicContact CB-CB 3.7Å; E967-K970 HydrophobicContact CB-CD 3.94Å; E967-K970 HydrophobicContact CG-CD 4.25Å; E967-K970 WeakPolarHBondContact O-CB 3.49Å; E967-K970 PolarHBondContact O-N 2.72Å; E967-K970 WeakPolarHBondContact OE1-CD 3.45Å; E967-K970 IonicContact OE1-NZ 2.73Å; E967-K970 PolarHBondContact OE1-NZ 2.99Å; E967-K970 WeakPolarHBondContact OE2-CD 3.34Å; E967-K970 WeakPolarHBondContact OE2-CE 3.29Å; E967-K970 IonicContact OE2-NZ 2.65Å; E967-K970 PolarHBondContact OE2-NZ 3.42Å; P968-K970 VanDerWaalsContact C-N 3.34Å; K970-E973 PolarHBondContact O-N 2.95Å; K970-Q974 WeakPolarHBondContact O-CB 3.34Å; K970-Q974 VanDerWaalsContact O-CG 3.29Å; K970-Q974 WeakPolarHBondContact O-CG 3.46Å; K970-Q974 PolarHBondContact O-N 3.31Å
971	I	88.8	Confident	86.1	Confident	14 Å²	14	67.9 Å²	67.9	7%	0.072	36%	0.355	C	S	.	.	H	α-helix	trans	-66.6	-39.5	172.4	-171.7	63.4	0	0	0	111.6	F960 V963 A964 E967 P968 Q974 L975	F960-I971 HydrophobicContact CD1-CD1 4.06Å; V963-I971 HydrophobicContact CB-CD1 4.21Å; V963-I971 HydrophobicContact CG1-CB 4.15Å; V963-I971 HydrophobicContact CG1-CD1 4.03Å; A964-I971 HydrophobicContact CB-CB 4.33Å; A964-I971 HydrophobicContact CB-CG1 4.13Å; A964-I971 HydrophobicContact CB-CG2 4.12Å; E967-I971 PolarHBondContact O-N 3.01Å; P968-I971 WeakPolarHBondContact O-CG2 3.3Å; I971-Q974 PolarHBondContact O-N 3.37Å; I971-L975 HydrophobicContact CD1-CG 4.38Å; I971-L975 HydrophobicContact CG1-CD1 4.05Å; I971-L975 HydrophobicContact CG1-CG 4.34Å; I971-L975 WeakPolarHBondContact O-CB 3.26Å; I971-L975 VanDerWaalsContact O-CG 3.22Å; I971-L975 WeakPolarHBondContact O-CG 3.27Å; I971-L975 PolarHBondContact O-N 2.9Å
972	S	84.5	Confident	85.4	Confident	59 Å²	59	68.5 Å²	68.5	41%	0.413	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-38.5	175.6	54	0	0	0	0	111.9	S969 N976	S969-S972 PolarHBondContact O-OG 2.89Å; S969-S972 VanDerWaalsContact O-OG 3.08Å; S972-N976 WeakPolarHBondContact O-CB 3.42Å; S972-N976 PolarHBondContact O-N 3.35Å; S972-N976 VanDerWaalsContact O-N 3.16Å; S972-N976 PolarHBondContact O-ND2 3.48Å
973	E	87.2	Confident	85.2	Confident	112 Å²	112	66.4 Å²	66.4	52%	0.523	35%	0.347	S	S	.	.	H	α-helix	trans	-59.5	-51.6	170.3	-161.7	-151.9	133.9	0	0	111	K970 L975 N976 Q977	K970-E973 PolarHBondContact O-N 2.95Å; E973-L975 VanDerWaalsContact C-N 3.35Å; E973-L975 PolarHBondContact O-N 2.95Å; E973-N976 CarbonylContact O-C 3.41Å; E973-N976 PolarHBondContact O-N 3.27Å; E973-N976 VanDerWaalsContact O-N 3.14Å; E973-Q977 WeakPolarHBondContact O-CG 3.37Å; E973-Q977 PolarHBondContact O-N 3.37Å; E973-Q977 VanDerWaalsContact O-N 3.09Å; E973-Q977 PolarHBondContact OE1-NE2 3.36Å
974	Q	88.6	Confident	85.3	Confident	23 Å²	23	67.1 Å²	67.1	11%	0.107	35%	0.348	C	S	.	.	H	α-helix	trans	-64	-33	-179.9	-75.2	179.5	35.5	0	0	114	V948 Y959 K970 I971 N976 Q977	V948-Q974 HydrophobicContact CB-CB 4.35Å; V948-Q974 HydrophobicContact CG1-CB 4.46Å; V948-Q974 HydrophobicContact CG2-CB 4.12Å; Y959-Q974 PolarHBondContact OH-OE1 3.29Å; K970-Q974 WeakPolarHBondContact O-CB 3.34Å; K970-Q974 VanDerWaalsContact O-CG 3.29Å; K970-Q974 WeakPolarHBondContact O-CG 3.46Å; K970-Q974 PolarHBondContact O-N 3.31Å; I971-Q974 PolarHBondContact O-N 3.37Å; Q974-N976 VanDerWaalsContact C-N 3.33Å; Q974-Q977 PolarHBondContact O-N 3.29Å
975	L	90	Very high	85.5	Confident	14 Å²	14	68.2 Å²	68.2	7%	0.073	35%	0.347	C	S	.	.	H	α-helix	trans	-71.4	-28.1	174.7	-73.2	169.6	0	0	0	112.8	F960 I971 E973 P986 M1002 L1006 V1008	F960-L975 HydrophobicContact CD1-CD2 4.28Å; F960-L975 HydrophobicContact CE1-CD2 4.21Å; I971-L975 HydrophobicContact CD1-CG 4.38Å; I971-L975 HydrophobicContact CG1-CD1 4.05Å; I971-L975 HydrophobicContact CG1-CG 4.34Å; I971-L975 WeakPolarHBondContact O-CB 3.26Å; I971-L975 VanDerWaalsContact O-CG 3.22Å; I971-L975 WeakPolarHBondContact O-CG 3.27Å; I971-L975 PolarHBondContact O-N 2.9Å; E973-L975 VanDerWaalsContact C-N 3.35Å; E973-L975 PolarHBondContact O-N 2.95Å; L975-P986 HydrophobicContact CD2-CB 4.38Å; L975-P986 WeakPolarHBondContact O-CD 3.37Å; L975-M1002 HydrophobicContact CD2-CE 4.06Å; L975-M1002 HydrophobicContact CD2-CG 4.34Å; L975-L1006 HydrophobicContact CD1-CB 4.06Å; L975-L1006 HydrophobicContact CD1-CD1 3.9Å; L975-V1008 HydrophobicContact CD1-CG2 3.98Å; L975-V1008 HydrophobicContact CD2-CG2 4.41Å
976	N	88.7	Confident	85.8	Confident	108 Å²	108	59.9 Å²	59.9	58%	0.578	32%	0.316	S	S	*	.	S	Bend	trans	-90.4	-1.8	176.1	-69	-28.6	0	0	0	113.3	S972 E973 Q974	S972-N976 WeakPolarHBondContact O-CB 3.42Å; S972-N976 PolarHBondContact O-N 3.35Å; S972-N976 VanDerWaalsContact O-N 3.16Å; S972-N976 PolarHBondContact O-ND2 3.48Å; E973-N976 CarbonylContact O-C 3.41Å; E973-N976 PolarHBondContact O-N 3.27Å; E973-N976 VanDerWaalsContact O-N 3.14Å; Q974-N976 VanDerWaalsContact C-N 3.33Å
977	Q	87.7	Confident	86.3	Confident	35 Å²	35	54 Å²	54	16%	0.164	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-77	132.4	172.9	-76.4	175.3	27	0	0	110.7	K946 E973 Q974 P986	K946-Q977 VanDerWaalsContact NZ-CD 3.34Å; E973-Q977 WeakPolarHBondContact O-CG 3.37Å; E973-Q977 PolarHBondContact O-N 3.37Å; E973-Q977 VanDerWaalsContact O-N 3.09Å; E973-Q977 PolarHBondContact OE1-NE2 3.36Å; Q974-Q977 PolarHBondContact O-N 3.29Å; Q977-P986 WeakPolarHBondContact O-CD 3.11Å
978	I	88.5	Confident	86.8	Confident	57 Å²	57	50 Å²	50	29%	0.292	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-93.9	134.7	-178.6	-48.1	176.7	0	0	0	109	G983 Y985	I978-G983 VanDerWaalsContact CG2-CA 3.44Å; I978-Y985 HydrophobicContact CD1-CE1 4.29Å; I978-Y985 HydrophobicContact CG1-CD1 4.2Å; I978-Y985 HydrophobicContact CG1-CE1 3.64Å
979	C	87.3	Confident	87.3	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-68.3	145.5	175.1	83.7	0	0	0	0	111.3	H949 E982 G983 R984 I989	H949-C979 PolarHBondContact NE2-N 2.91Å; C979-E982 PolarHBondContact O-N 3.26Å; C979-E982 PolarHBondContact SG-OE2 3.17Å; C979-G983 PolarHBondContact O-N 3.04Å; C979-R984 PolarHBondContact N-O 3.28Å; C979-I989 HydrophobicContact CB-CD1 4.04Å
980	Q	80.1	Confident	87.9	Confident	117 Å²	117	41 Å²	41	55%	0.547	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.1	132.7	179	-66.7	-64.5	-32.1	0	0	109.1
981	P	77	Confident	88.4	Confident	101 Å²	101	37.4 Å²	37.4	66%	0.656	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	cis	-86.9	-3	5.4	34.8	-36.7	0	0	0	115.6	G983	P981-G983 PolarHBondContact O-N 2.8Å
982	E	77.7	Confident	88.5	Confident	64 Å²	64	40.3 Å²	40.3	30%	0.299	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-2.2	-157.1	-44.7	95	140.2	0	0	116.6	H942 W945 C979 R984	H942-E982 IonicContact ND1-OE1 2.72Å; W945-E982 WeakPolarHBondContact CZ2-OE1 3.45Å; W945-E982 PolarHBondContact NE1-OE1 2.91Å; W945-E982 PolarHBondContact NE1-OE2 3.29Å; C979-E982 PolarHBondContact O-N 3.26Å; C979-E982 PolarHBondContact SG-OE2 3.17Å; E982-R984 PolarHBondContact O-N 2.91Å; E982-R984 IonicContact OE1-NH2 2.71Å; E982-R984 PolarHBondContact OE1-NH2 2.9Å
983	G	84.2	Confident	88.7	Confident	2 Å²	2	39.9 Å²	39.9	2%	0.021	20%	0.2	C	C	.	.			trans	76.7	18.5	167.9	0	0	0	0	0	116.1	I978 C979 P981	I978-G983 VanDerWaalsContact CG2-CA 3.44Å; C979-G983 PolarHBondContact O-N 3.04Å; P981-G983 PolarHBondContact O-N 2.8Å
984	R	90.7	Very high	88.9	Confident	29 Å²	29	37.1 Å²	37.1	11%	0.109	19%	0.192	C	C	.	.			trans	-107.2	144.2	-173.8	-64.1	173.3	-68.3	-165.9	-6.5	113.1	C979 E982 H988 I989 E992 Y1023	C979-R984 PolarHBondContact N-O 3.28Å; E982-R984 PolarHBondContact O-N 2.91Å; E982-R984 IonicContact OE1-NH2 2.71Å; E982-R984 PolarHBondContact OE1-NH2 2.9Å; R984-H988 HydrophobicContact CB-CB 4.29Å; R984-I989 HydrophobicContact CB-CD1 4.44Å; R984-I989 HydrophobicContact CB-CG1 4.03Å; R984-E992 IonicContact CZ-OE2 2.95Å; R984-E992 IonicContact NE-OE2 3.19Å; R984-E992 IonicContact NH1-OE1 2.71Å; R984-E992 PolarHBondContact NH1-OE1 3.32Å; R984-E992 IonicContact NH1-OE2 3.78Å; R984-E992 PolarHBondContact NH1-OE2 2.92Å; R984-Y1023 HydrophobicContact CG-CE1 4.23Å; R984-Y1023 WeakPolarHBondContact CG-OH 3.42Å
985	Y	93.4	Very high	89.1	Confident	47 Å²	47	38.4 Å²	38.4	18%	0.184	20%	0.198	C	C	.	.			trans	-83.7	157.9	169.3	-63.5	-82.4	0	0	0	111.5	I978 L987 H988 I989 L1012	I978-Y985 HydrophobicContact CD1-CE1 4.29Å; I978-Y985 HydrophobicContact CG1-CD1 4.2Å; I978-Y985 HydrophobicContact CG1-CE1 3.64Å; Y985-L987 PolarHBondContact O-N 2.76Å; Y985-L987 VanDerWaalsContact O-N 3.11Å; Y985-H988 AromaticContact CD2-CE1 3.86Å; Y985-H988 AromaticContact CD2-ND1 3.92Å; Y985-H988 PolarHBondContact O-N 2.63Å; Y985-I989 PolarHBondContact O-N 2.67Å; Y985-I989 VanDerWaalsContact O-N 3.14Å; Y985-L1012 HydrophobicContact CD1-CD2 4.43Å; Y985-L1012 HydrophobicContact CD2-CD2 3.74Å; Y985-L1012 HydrophobicContact CD2-CG 4.11Å; Y985-L1012 HydrophobicContact CE2-CD1 4.25Å; Y985-L1012 HydrophobicContact CE2-CD2 4.18Å; Y985-L1012 HydrophobicContact CE2-CG 4.2Å; Y985-L1012 HydrophobicContact CG-CD2 3.88Å
986	P	93.2	Very high	89.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-52.4	-31.1	176.1	-30.4	37.2	0	0	0	115.2	V948 A952 F960 L975 Q977 I989 A990 M1002	V948-P986 HydrophobicContact CG2-CB 4.32Å; V948-P986 HydrophobicContact CG2-CG 3.92Å; A952-P986 HydrophobicContact CB-CB 4.17Å; A952-P986 WeakPolarHBondContact CB-O 3.48Å; F960-P986 HydrophobicContact CE1-CB 4.49Å; L975-P986 HydrophobicContact CD2-CB 4.38Å; L975-P986 WeakPolarHBondContact O-CD 3.37Å; Q977-P986 WeakPolarHBondContact O-CD 3.11Å; P986-I989 PolarHBondContact O-N 2.74Å; P986-A990 WeakPolarHBondContact O-CB 3.3Å; P986-A990 PolarHBondContact O-N 3.2Å; P986-M1002 HydrophobicContact CB-CE 3.96Å
987	L	94.2	Very high	89.3	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-45.2	174.2	177.5	58.7	0	0	0	112.2	Y985 I989 A990 V991 A999 M1002 I1003 V1008 V1020	Y985-L987 PolarHBondContact O-N 2.76Å; Y985-L987 VanDerWaalsContact O-N 3.11Å; L987-I989 VanDerWaalsContact C-N 3.32Å; L987-I989 PolarHBondContact O-N 3.04Å; L987-A990 PolarHBondContact O-N 2.72Å; L987-V991 HydrophobicContact CD1-CG2 4.18Å; L987-V991 WeakPolarHBondContact O-CB 3.43Å; L987-V991 WeakPolarHBondContact O-CG2 3.3Å; L987-V991 PolarHBondContact O-N 2.65Å; L987-A999 HydrophobicContact CD1-CB 4.04Å; L987-M1002 HydrophobicContact CB-SD 4.13Å; L987-M1002 HydrophobicContact CD1-CB 4.02Å; L987-M1002 HydrophobicContact CD1-SD 4.07Å; L987-I1003 HydrophobicContact CD1-CD1 4.19Å; L987-I1003 HydrophobicContact CD1-CG1 4.04Å; L987-I1003 HydrophobicContact CD2-CD1 4.38Å; L987-I1003 HydrophobicContact CD2-CG1 3.95Å; L987-V1008 HydrophobicContact CB-CG1 4.21Å; L987-V1008 HydrophobicContact CD2-CB 4.12Å; L987-V1008 HydrophobicContact CD2-CG1 3.56Å; L987-V1020 HydrophobicContact CD2-CG1 3.83Å; L987-V1020 HydrophobicContact CG-CG1 3.99Å
988	H	94.3	Very high	89.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-42.8	175.9	-59.3	150.1	0	0	0	110.9	R984 Y985 A990 V991 E992 L1012 Y1023	R984-H988 HydrophobicContact CB-CB 4.29Å; Y985-H988 AromaticContact CD2-CE1 3.86Å; Y985-H988 AromaticContact CD2-ND1 3.92Å; Y985-H988 PolarHBondContact O-N 2.63Å; H988-A990 PolarHBondContact O-N 2.92Å; H988-V991 PolarHBondContact O-N 3.28Å; H988-E992 VanDerWaalsContact O-CB 3.25Å; H988-E992 WeakPolarHBondContact O-CB 3.25Å; H988-E992 PolarHBondContact O-N 3.05Å; H988-L1012 PolarHBondContact NE2-O 3.49Å; H988-L1012 VanDerWaalsContact NE2-O 3.12Å; H988-Y1023 HydrophobicContact CB-CD1 4.13Å; H988-Y1023 HydrophobicContact CB-CD2 4.15Å; H988-Y1023 HydrophobicContact CB-CE1 4.08Å; H988-Y1023 HydrophobicContact CB-CE2 4.11Å; H988-Y1023 HydrophobicContact CB-CG 4.19Å; H988-Y1023 AromaticContact CD2-CD2 3.97Å; H988-Y1023 AromaticContact CG-CE2 3.92Å
989	I	92.2	Very high	89.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63	-41.4	176.7	-60.2	173.9	0	0	0	111.3	W945 H949 A952 M953 C979 R984 Y985 P986 L987 N993	W945-I989 HydrophobicContact CH2-CD1 4.41Å; W945-I989 HydrophobicContact CH2-CG2 4.49Å; W945-I989 HydrophobicContact CZ3-CD1 4.39Å; W945-I989 HydrophobicContact CZ3-CG2 4.25Å; H949-I989 HydrophobicContact CB-CD1 3.93Å; A952-I989 HydrophobicContact CB-CB 4.06Å; A952-I989 HydrophobicContact CB-CG2 3.88Å; M953-I989 HydrophobicContact CB-CG2 3.98Å; C979-I989 HydrophobicContact CB-CD1 4.04Å; R984-I989 HydrophobicContact CB-CD1 4.44Å; R984-I989 HydrophobicContact CB-CG1 4.03Å; Y985-I989 PolarHBondContact O-N 2.67Å; Y985-I989 VanDerWaalsContact O-N 3.14Å; P986-I989 PolarHBondContact O-N 2.74Å; L987-I989 VanDerWaalsContact C-N 3.32Å; L987-I989 PolarHBondContact O-N 3.04Å; I989-N993 WeakPolarHBondContact O-CB 3.29Å; I989-N993 PolarHBondContact O-N 3.12Å; I989-N993 PolarHBondContact O-ND2 3.1Å
990	A	93.9	Very high	90.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.5	-40.2	177.4	0	0	0	0	0	112.6	A952 P986 L987 H988 C994 H995 L998 M1002	A952-A990 HydrophobicContact CB-CB 4.49Å; P986-A990 WeakPolarHBondContact O-CB 3.3Å; P986-A990 PolarHBondContact O-N 3.2Å; L987-A990 PolarHBondContact O-N 2.72Å; H988-A990 PolarHBondContact O-N 2.92Å; A990-C994 PolarHBondContact O-N 3.03Å; A990-H995 PolarHBondContact O-N 3.09Å; A990-L998 HydrophobicContact CB-CD2 4.1Å; A990-L998 HydrophobicContact CB-CG 4.14Å; A990-M1002 HydrophobicContact CB-CE 4.42Å; A990-M1002 HydrophobicContact CB-SD 4.09Å
991	V	93.8	Very high	90.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.2	-49.2	174.5	166.7	0	0	0	0	111	L987 H988 N993 C994 A999 V1020 A1024 A1027 V1031 L1035	L987-V991 HydrophobicContact CD1-CG2 4.18Å; L987-V991 WeakPolarHBondContact O-CB 3.43Å; L987-V991 WeakPolarHBondContact O-CG2 3.3Å; L987-V991 PolarHBondContact O-N 2.65Å; H988-V991 PolarHBondContact O-N 3.28Å; V991-N993 PolarHBondContact O-N 2.71Å; V991-C994 PolarHBondContact O-N 3.43Å; V991-A999 HydrophobicContact CG2-CB 3.81Å; V991-V1020 HydrophobicContact CG2-CB 4.4Å; V991-V1020 HydrophobicContact CG2-CG1 4.48Å; V991-A1024 HydrophobicContact CG1-CB 4Å; V991-A1027 VanDerWaalsContact O-CB 3.23Å; V991-A1027 WeakPolarHBondContact O-CB 3.19Å; V991-V1031 HydrophobicContact CB-CG1 4.49Å; V991-V1031 HydrophobicContact CG1-CG1 3.93Å; V991-V1031 HydrophobicContact CG2-CG1 4.45Å; V991-L1035 HydrophobicContact CG1-CD1 4.45Å; V991-L1035 HydrophobicContact CG2-CD1 4.44Å
992	E	90.6	Very high	91.6	Very high	75 Å²	75	28.7 Å²	28.7	35%	0.35	15%	0.145	S	C	.	.	H	α-helix	trans	-58.7	-44.8	179.1	-172.1	-178.3	149.3	0	0	112.1	R984 H988 C994 Y1023	R984-E992 IonicContact CZ-OE2 2.95Å; R984-E992 IonicContact NE-OE2 3.19Å; R984-E992 IonicContact NH1-OE1 2.71Å; R984-E992 PolarHBondContact NH1-OE1 3.32Å; R984-E992 IonicContact NH1-OE2 3.78Å; R984-E992 PolarHBondContact NH1-OE2 2.92Å; H988-E992 VanDerWaalsContact O-CB 3.25Å; H988-E992 WeakPolarHBondContact O-CB 3.25Å; H988-E992 PolarHBondContact O-N 3.05Å; E992-C994 PolarHBondContact O-N 2.87Å; E992-Y1023 HydrophobicContact CB-CD1 4.23Å
993	N	90	Very high	92.3	Very high	51 Å²	51	26.5 Å²	26.5	27%	0.273	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	12.3	177.8	-68.5	-90.7	0	0	0	113.4	M953 I989 V991 H995	M953-N993 WeakPolarHBondContact CG-OD1 3.25Å; M953-N993 WeakPolarHBondContact O-CB 3.46Å; I989-N993 WeakPolarHBondContact O-CB 3.29Å; I989-N993 PolarHBondContact O-N 3.12Å; I989-N993 PolarHBondContact O-ND2 3.1Å; V991-N993 PolarHBondContact O-N 2.71Å; N993-H995 VanDerWaalsContact C-N 3.32Å; N993-H995 PolarHBondContact O-CD2 3.1Å; N993-H995 PolarHBondContact O-N 2.97Å; N993-H995 PolarHBondContact O-NE2 3.25Å
994	C	90.2	Very high	92.6	Very high	53 Å²	53	30.2 Å²	30.2	36%	0.358	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	22.4	171.8	-55.8	0	0	0	0	116.1	A990 V991 E992 V996 S1028 V1031	A990-C994 PolarHBondContact O-N 3.03Å; V991-C994 PolarHBondContact O-N 3.43Å; E992-C994 PolarHBondContact O-N 2.87Å; C994-V996 VanDerWaalsContact C-N 3.31Å; C994-V996 PolarHBondContact O-N 3.36Å; C994-S1028 VanDerWaalsContact SG-CB 3.54Å; C994-V1031 HydrophobicContact CB-CG2 4.31Å
995	H	93.2	Very high	92.7	Very high	51 Å²	51	33 Å²	33	24%	0.236	18%	0.175	C	C	.	.			trans	-83.6	70.6	-179.2	-60	-62.1	0	0	0	111.7	A952 M953 G955 A990 N993 D997 L998 A999	A952-H995 PolarHBondContact O-CD2 2.72Å; M953-H995 PolarHBondContact O-NE2 3.5Å; G955-H995 WeakPolarHBondContact CA-ND1 3.26Å; G955-H995 PolarHBondContact N-CD2 2.92Å; G955-H995 PolarHBondContact N-NE2 2.73Å; A990-H995 PolarHBondContact O-N 3.09Å; N993-H995 VanDerWaalsContact C-N 3.32Å; N993-H995 PolarHBondContact O-CD2 3.1Å; N993-H995 PolarHBondContact O-N 2.97Å; N993-H995 PolarHBondContact O-NE2 3.25Å; H995-D997 VanDerWaalsContact C-N 3.32Å; H995-D997 PolarHBondContact O-N 3.07Å; H995-L998 HydrophobicContact CB-CB 3.94Å; H995-L998 WeakPolarHBondContact O-CB 3.48Å; H995-L998 PolarHBondContact O-N 2.69Å; H995-A999 PolarHBondContact O-N 2.9Å
996	V	91.7	Very high	92.6	Very high	31 Å²	31	32.7 Å²	32.7	19%	0.188	18%	0.176	C	C	.	.	H	α-helix	trans	-46.3	-52.9	-177.4	-177.7	0	0	0	0	111.8	C994 L998 A999 L1000 V1031 A1034	C994-V996 VanDerWaalsContact C-N 3.31Å; C994-V996 PolarHBondContact O-N 3.36Å; V996-L998 PolarHBondContact O-N 3.48Å; V996-A999 PolarHBondContact O-N 3.03Å; V996-L1000 HydrophobicContact CG1-CD1 3.83Å; V996-L1000 HydrophobicContact CG1-CG 4.23Å; V996-L1000 WeakPolarHBondContact O-CB 3.48Å; V996-L1000 WeakPolarHBondContact O-CG 3.4Å; V996-L1000 PolarHBondContact O-N 3.37Å; V996-V1031 HydrophobicContact CG2-CB 4.43Å; V996-V1031 HydrophobicContact CG2-CG2 3.68Å; V996-A1034 HydrophobicContact CG1-CB 3.76Å
997	D	92.2	Very high	92.5	Very high	117 Å²	117	40.2 Å²	40.2	63%	0.626	21%	0.209	S	C	*	.	H	α-helix	trans	-62.5	-26.7	-177.7	-57.3	-23.4	0	0	0	113.9	H995 Y1001	H995-D997 VanDerWaalsContact C-N 3.32Å; H995-D997 PolarHBondContact O-N 3.07Å; D997-Y1001 VanDerWaalsContact O-CB 3.22Å; D997-Y1001 WeakPolarHBondContact O-CB 3.19Å; D997-Y1001 PolarHBondContact O-N 3.46Å
998	L	94	Very high	92.4	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-84.1	-42.5	177.4	-179.8	55.9	0	0	0	111.1	R957 F960 A990 H995 V996 Y1001 M1002	R957-L998 HydrophobicContact CB-CD1 4.09Å; R957-L998 HydrophobicContact CG-CD1 4.25Å; F960-L998 HydrophobicContact CD2-CD1 3.68Å; F960-L998 HydrophobicContact CD2-CD2 4.15Å; F960-L998 HydrophobicContact CE2-CD1 4.11Å; F960-L998 HydrophobicContact CE2-CD2 3.78Å; F960-L998 HydrophobicContact CG-CD1 4.09Å; F960-L998 HydrophobicContact CZ-CD2 4.48Å; A990-L998 HydrophobicContact CB-CD2 4.1Å; A990-L998 HydrophobicContact CB-CG 4.14Å; H995-L998 HydrophobicContact CB-CB 3.94Å; H995-L998 WeakPolarHBondContact O-CB 3.48Å; H995-L998 PolarHBondContact O-N 2.69Å; V996-L998 PolarHBondContact O-N 3.48Å; L998-Y1001 HydrophobicContact CD1-CD1 4.45Å; L998-Y1001 PolarHBondContact O-N 2.76Å; L998-M1002 HydrophobicContact CD1-CE 4.02Å; L998-M1002 HydrophobicContact CD1-CG 4.39Å; L998-M1002 HydrophobicContact CD2-CE 4.23Å; L998-M1002 HydrophobicContact CG-CE 3.97Å; L998-M1002 HydrophobicContact CG-SD 4.3Å; L998-M1002 WeakPolarHBondContact O-CB 3.16Å; L998-M1002 WeakPolarHBondContact O-CG 3.32Å; L998-M1002 PolarHBondContact O-N 2.97Å
999	A	93.1	Very high	92.2	Very high	2 Å²	2	44.3 Å²	44.3	2%	0.017	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-45.2	174.5	0	0	0	0	0	111.2	L987 V991 H995 V996 Y1001 M1002 I1003	L987-A999 HydrophobicContact CD1-CB 4.04Å; V991-A999 HydrophobicContact CG2-CB 3.81Å; H995-A999 PolarHBondContact O-N 2.9Å; V996-A999 PolarHBondContact O-N 3.03Å; A999-Y1001 VanDerWaalsContact C-N 3.34Å; A999-Y1001 PolarHBondContact O-N 3.41Å; A999-M1002 PolarHBondContact O-N 3.31Å; A999-I1003 WeakPolarHBondContact O-CG1 3.42Å; A999-I1003 PolarHBondContact O-N 3.37Å
1000	L	93.3	Very high	92.1	Very high	46 Å²	46	45.1 Å²	45.1	24%	0.241	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-36.4	173.7	-68.9	178.9	0	0	0	112.3	V996 N1004 A1034 C1038	V996-L1000 HydrophobicContact CG1-CD1 3.83Å; V996-L1000 HydrophobicContact CG1-CG 4.23Å; V996-L1000 WeakPolarHBondContact O-CB 3.48Å; V996-L1000 WeakPolarHBondContact O-CG 3.4Å; V996-L1000 PolarHBondContact O-N 3.37Å; L1000-N1004 VanDerWaalsContact O-CB 3.23Å; L1000-N1004 WeakPolarHBondContact O-CB 3.21Å; L1000-N1004 PolarHBondContact O-N 3.1Å; L1000-A1034 HydrophobicContact CD1-CB 4.27Å; L1000-A1034 HydrophobicContact CD2-CB 4.38Å; L1000-C1038 VanDerWaalsContact CD2-SG 3.57Å
1001	Y	93.6	Very high	91.9	Very high	29 Å²	29	48.2 Å²	48.2	11%	0.114	26%	0.261	C	S	.	.	H	α-helix	trans	-66.4	-43.4	174.3	-179.1	-105.9	0	0	0	111.9	R957 F960 E961 D997 L998 A999 V1005 L1006	R957-Y1001 HydrophobicContact CG-CD1 4.19Å; R957-Y1001 HydrophobicContact CG-CG 4.34Å; F960-Y1001 HydrophobicContact CB-CE1 4.32Å; E961-Y1001 HydrophobicContact CG-CE1 3.94Å; E961-Y1001 HydrophobicContact CG-CE2 4.21Å; E961-Y1001 WeakPolarHBondContact CG-OH 3.48Å; D997-Y1001 VanDerWaalsContact O-CB 3.22Å; D997-Y1001 WeakPolarHBondContact O-CB 3.19Å; D997-Y1001 PolarHBondContact O-N 3.46Å; L998-Y1001 HydrophobicContact CD1-CD1 4.45Å; L998-Y1001 PolarHBondContact O-N 2.76Å; A999-Y1001 VanDerWaalsContact C-N 3.34Å; A999-Y1001 PolarHBondContact O-N 3.41Å; Y1001-V1005 HydrophobicContact CD2-CB 3.77Å; Y1001-V1005 HydrophobicContact CD2-CG1 4.24Å; Y1001-V1005 HydrophobicContact CD2-CG2 3.68Å; Y1001-V1005 HydrophobicContact CE2-CB 3.77Å; Y1001-V1005 HydrophobicContact CE2-CG1 3.71Å; Y1001-V1005 HydrophobicContact CE2-CG2 3.98Å; Y1001-V1005 HydrophobicContact CG-CB 4.47Å; Y1001-V1005 WeakPolarHBondContact O-CA 3.38Å; Y1001-V1005 VanDerWaalsContact O-CB 3.31Å; Y1001-V1005 WeakPolarHBondContact O-CB 3.41Å; Y1001-V1005 PolarHBondContact O-N 2.83Å; Y1001-L1006 HydrophobicContact CD1-CD1 3.98Å; Y1001-L1006 HydrophobicContact CD1-CG 4.08Å; Y1001-L1006 HydrophobicContact CE1-CD1 3.72Å; Y1001-L1006 HydrophobicContact CE1-CD2 3.83Å; Y1001-L1006 HydrophobicContact CE1-CG 3.78Å; Y1001-L1006 PolarHBondContact O-N 3.39Å
1002	M	93.6	Very high	91.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-45.5	175.6	-74.6	170.8	170.6	0	0	112.2	F960 L975 P986 L987 A990 L998 A999 L1006 K1007 V1008	F960-M1002 HydrophobicContact CD1-CE 3.81Å; F960-M1002 HydrophobicContact CE1-CE 3.32Å; F960-M1002 HydrophobicContact CE2-CE 4.14Å; F960-M1002 HydrophobicContact CG-CE 4.41Å; F960-M1002 HydrophobicContact CZ-CE 3.53Å; L975-M1002 HydrophobicContact CD2-CE 4.06Å; L975-M1002 HydrophobicContact CD2-CG 4.34Å; P986-M1002 HydrophobicContact CB-CE 3.96Å; L987-M1002 HydrophobicContact CB-SD 4.13Å; L987-M1002 HydrophobicContact CD1-CB 4.02Å; L987-M1002 HydrophobicContact CD1-SD 4.07Å; A990-M1002 HydrophobicContact CB-CE 4.42Å; A990-M1002 HydrophobicContact CB-SD 4.09Å; L998-M1002 HydrophobicContact CD1-CE 4.02Å; L998-M1002 HydrophobicContact CD1-CG 4.39Å; L998-M1002 HydrophobicContact CD2-CE 4.23Å; L998-M1002 HydrophobicContact CG-CE 3.97Å; L998-M1002 HydrophobicContact CG-SD 4.3Å; L998-M1002 WeakPolarHBondContact O-CB 3.16Å; L998-M1002 WeakPolarHBondContact O-CG 3.32Å; L998-M1002 PolarHBondContact O-N 2.97Å; A999-M1002 PolarHBondContact O-N 3.31Å; M1002-L1006 HydrophobicContact CG-CD1 4.33Å; M1002-L1006 CarbonylContact O-C 3.29Å; M1002-L1006 VanDerWaalsContact O-C 3.29Å; M1002-L1006 WeakPolarHBondContact O-CB 3.35Å; M1002-L1006 PolarHBondContact O-N 2.87Å; M1002-K1007 PolarHBondContact O-N 3.1Å; M1002-V1008 HydrophobicContact CB-CG2 4.21Å; M1002-V1008 WeakPolarHBondContact O-CG2 3.41Å; M1002-V1008 PolarHBondContact O-N 3.43Å
1003	I	92.4	Very high	91.8	Very high	17 Å²	17	49.5 Å²	49.5	9%	0.087	27%	0.273	C	S	.	.	H	α-helix	trans	-72.9	-56.9	-179.7	-64.1	165.9	0	0	0	110.8	L987 A999 K1007 I1010 L1035	L987-I1003 HydrophobicContact CD1-CD1 4.19Å; L987-I1003 HydrophobicContact CD1-CG1 4.04Å; L987-I1003 HydrophobicContact CD2-CD1 4.38Å; L987-I1003 HydrophobicContact CD2-CG1 3.95Å; A999-I1003 WeakPolarHBondContact O-CG1 3.42Å; A999-I1003 PolarHBondContact O-N 3.37Å; I1003-K1007 VanDerWaalsContact O-CA 3.29Å; I1003-K1007 WeakPolarHBondContact O-CA 3.45Å; I1003-K1007 PolarHBondContact O-N 3.26Å; I1003-I1010 HydrophobicContact CD1-CG1 4.47Å; I1003-L1035 HydrophobicContact CD1-CD2 3.52Å
1004	N	91.8	Very high	91.8	Very high	81 Å²	81	47.5 Å²	47.5	43%	0.433	26%	0.263	S	S	.	.	H	α-helix	trans	-80.9	-30.8	-167.8	-63.9	-30	0	0	0	113.5	L1000 K1007	L1000-N1004 VanDerWaalsContact O-CB 3.23Å; L1000-N1004 WeakPolarHBondContact O-CB 3.21Å; L1000-N1004 PolarHBondContact O-N 3.1Å; N1004-K1007 WeakPolarHBondContact O-CE 3.24Å; N1004-K1007 PolarHBondContact O-NZ 2.96Å
1005	V	91.5	Very high	91.6	Very high	88 Å²	88	50.2 Å²	50.2	53%	0.533	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-49.9	-177	-170.9	0	0	0	0	112	Y1001 K1007	Y1001-V1005 HydrophobicContact CD2-CB 3.77Å; Y1001-V1005 HydrophobicContact CD2-CG1 4.24Å; Y1001-V1005 HydrophobicContact CD2-CG2 3.68Å; Y1001-V1005 HydrophobicContact CE2-CB 3.77Å; Y1001-V1005 HydrophobicContact CE2-CG1 3.71Å; Y1001-V1005 HydrophobicContact CE2-CG2 3.98Å; Y1001-V1005 HydrophobicContact CG-CB 4.47Å; Y1001-V1005 WeakPolarHBondContact O-CA 3.38Å; Y1001-V1005 VanDerWaalsContact O-CB 3.31Å; Y1001-V1005 WeakPolarHBondContact O-CB 3.41Å; Y1001-V1005 PolarHBondContact O-N 2.83Å; V1005-K1007 VanDerWaalsContact C-N 3.27Å; V1005-K1007 PolarHBondContact O-N 2.83Å
1006	L	91.8	Very high	91.1	Very high	40 Å²	40	51.5 Å²	51.5	21%	0.209	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-0.8	179.3	-48.8	-178.8	0	0	0	113.6	A964 L975 Y1001 M1002 V1008	A964-L1006 HydrophobicContact CB-CD2 4.46Å; L975-L1006 HydrophobicContact CD1-CB 4.06Å; L975-L1006 HydrophobicContact CD1-CD1 3.9Å; Y1001-L1006 HydrophobicContact CD1-CD1 3.98Å; Y1001-L1006 HydrophobicContact CD1-CG 4.08Å; Y1001-L1006 HydrophobicContact CE1-CD1 3.72Å; Y1001-L1006 HydrophobicContact CE1-CD2 3.83Å; Y1001-L1006 HydrophobicContact CE1-CG 3.78Å; Y1001-L1006 PolarHBondContact O-N 3.39Å; M1002-L1006 HydrophobicContact CG-CD1 4.33Å; M1002-L1006 CarbonylContact O-C 3.29Å; M1002-L1006 VanDerWaalsContact O-C 3.29Å; M1002-L1006 WeakPolarHBondContact O-CB 3.35Å; M1002-L1006 PolarHBondContact O-N 2.87Å; L1006-V1008 VanDerWaalsContact C-N 3.31Å; L1006-V1008 PolarHBondContact O-N 3.29Å
1007	K	90.6	Very high	91	Very high	157 Å²	157	51 Å²	51	68%	0.683	28%	0.282	S	S	*	.			trans	57.7	32.6	174.6	-56	-53	-170.2	-172.5	0	115.3	M1002 I1003 N1004 V1005	M1002-K1007 PolarHBondContact O-N 3.1Å; I1003-K1007 VanDerWaalsContact O-CA 3.29Å; I1003-K1007 WeakPolarHBondContact O-CA 3.45Å; I1003-K1007 PolarHBondContact O-N 3.26Å; N1004-K1007 WeakPolarHBondContact O-CE 3.24Å; N1004-K1007 PolarHBondContact O-NZ 2.96Å; V1005-K1007 VanDerWaalsContact C-N 3.27Å; V1005-K1007 PolarHBondContact O-N 2.83Å
1008	V	91.9	Very high	90.9	Very high	17 Å²	17	46.8 Å²	46.8	10%	0.103	26%	0.259	C	S	.	.			trans	-70.4	125.3	170.6	-173.5	0	0	0	0	109.4	L975 L987 M1002 L1006 I1010 L1012	L975-V1008 HydrophobicContact CD1-CG2 3.98Å; L975-V1008 HydrophobicContact CD2-CG2 4.41Å; L987-V1008 HydrophobicContact CB-CG1 4.21Å; L987-V1008 HydrophobicContact CD2-CB 4.12Å; L987-V1008 HydrophobicContact CD2-CG1 3.56Å; M1002-V1008 HydrophobicContact CB-CG2 4.21Å; M1002-V1008 WeakPolarHBondContact O-CG2 3.41Å; M1002-V1008 PolarHBondContact O-N 3.43Å; L1006-V1008 VanDerWaalsContact C-N 3.31Å; L1006-V1008 PolarHBondContact O-N 3.29Å; V1008-I1010 PolarHBondContact O-N 2.88Å; V1008-L1012 HydrophobicContact CG1-CD2 4.14Å
1009	P	90.8	Very high	90.8	Very high	72 Å²	72	46.9 Å²	46.9	47%	0.468	26%	0.259	S	S	.	.			trans	-63.5	133.3	-176	-24.8	34.9	0	0	0	113.9	S1011 L1012	P1009-S1011 PolarHBondContact O-N 3.24Å; P1009-L1012 VanDerWaalsContact O-CB 3.31Å; P1009-L1012 WeakPolarHBondContact O-CB 3.29Å; P1009-L1012 PolarHBondContact O-N 3.27Å
1010	I	91.2	Very high	90.8	Very high	18 Å²	18	46.8 Å²	46.8	9%	0.092	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.4	174.2	-162.5	174.4	0	0	0	112.9	I1003 V1008 V1020 F1021 C1038 A1041 Q1044	I1003-I1010 HydrophobicContact CD1-CG1 4.47Å; V1008-I1010 PolarHBondContact O-N 2.88Å; I1010-V1020 HydrophobicContact CD1-CG2 4.41Å; I1010-V1020 HydrophobicContact CG1-CG2 3.53Å; I1010-F1021 HydrophobicContact CD1-CE2 4Å; I1010-F1021 HydrophobicContact CG1-CE2 4.48Å; I1010-C1038 HydrophobicContact CD1-CB 3.89Å; I1010-A1041 HydrophobicContact CD1-CB 4.35Å; I1010-Q1044 HydrophobicContact CG2-CG 4.43Å
1011	S	89.5	Confident	90.9	Very high	64 Å²	64	44.6 Å²	44.6	45%	0.448	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.2	179	53.4	0	0	0	0	114.7	P1009 P1013	P1009-S1011 PolarHBondContact O-N 3.24Å; S1011-P1013 VanDerWaalsContact O-CD 3.26Å; S1011-P1013 WeakPolarHBondContact O-CD 3.48Å
1012	L	90.4	Very high	90.9	Very high	36 Å²	36	43.3 Å²	43.3	19%	0.188	24%	0.242	C	C	.	.			trans	-60.2	118.8	-177.4	-177	67.8	0	0	0	110.8	Y985 H988 V1008 P1009	Y985-L1012 HydrophobicContact CD1-CD2 4.43Å; Y985-L1012 HydrophobicContact CD2-CD2 3.74Å; Y985-L1012 HydrophobicContact CD2-CG 4.11Å; Y985-L1012 HydrophobicContact CE2-CD1 4.25Å; Y985-L1012 HydrophobicContact CE2-CD2 4.18Å; Y985-L1012 HydrophobicContact CE2-CG 4.2Å; Y985-L1012 HydrophobicContact CG-CD2 3.88Å; H988-L1012 PolarHBondContact NE2-O 3.49Å; H988-L1012 VanDerWaalsContact NE2-O 3.12Å; V1008-L1012 HydrophobicContact CG1-CD2 4.14Å; P1009-L1012 VanDerWaalsContact O-CB 3.31Å; P1009-L1012 WeakPolarHBondContact O-CB 3.29Å; P1009-L1012 PolarHBondContact O-N 3.27Å
1013	P	90.6	Very high	90.8	Very high	66 Å²	66	44.6 Å²	44.6	43%	0.429	25%	0.248	S	C	.	.			trans	-86.8	151.7	175.3	33.8	-32.3	0	0	0	111.6	S1011	S1011-P1013 VanDerWaalsContact O-CD 3.26Å; S1011-P1013 WeakPolarHBondContact O-CD 3.48Å
1014	D	89.9	Confident	90.8	Very high	10 Å²	10	43.8 Å²	43.8	5%	0.053	24%	0.243	C	C	.	.			trans	-79	-173.7	161.8	77.3	-10.2	0	0	0	112.2	N1016 G1017 Q1018 Y1023	D1014-N1016 PolarHBondContact O-N 3.49Å; D1014-N1016 VanDerWaalsContact O-N 3.16Å; D1014-N1016 VanDerWaalsContact OD1-C 3.27Å; D1014-N1016 VanDerWaalsContact OD1-CA 3.26Å; D1014-N1016 WeakPolarHBondContact OD1-CA 3.48Å; D1014-N1016 WeakPolarHBondContact OD1-CB 3.41Å; D1014-N1016 PolarHBondContact OD1-N 3.15Å; D1014-N1016 PolarHBondContact OD2-ND2 3.37Å; D1014-G1017 PolarHBondContact O-N 3.22Å; D1014-G1017 VanDerWaalsContact O-N 3.1Å; D1014-G1017 PolarHBondContact OD1-N 3.42Å; D1014-Q1018 PolarHBondContact N-O 2.94Å; D1014-Q1018 WeakPolarHBondContact OD1-CB 3.3Å; D1014-Q1018 PolarHBondContact OD1-N 2.98Å; D1014-Y1023 HydrophobicContact CB-CE2 4.24Å; D1014-Y1023 PolarHBondContact OD2-OH 3.48Å
1015	L	86	Confident	90.8	Very high	109 Å²	109	40 Å²	40	57%	0.571	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-21.1	175.5	-64.5	-178.6	0	0	0	113.8	K1050	L1015-K1050 PolarHBondContact O-NZ 3.03Å
1016	N	83.6	Confident	90.6	Very high	79 Å²	79	37 Å²	37	42%	0.422	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	2.5	179.4	-52.8	-52.2	0	0	0	113	D1014 Q1018 K1050	D1014-N1016 PolarHBondContact O-N 3.49Å; D1014-N1016 VanDerWaalsContact O-N 3.16Å; D1014-N1016 VanDerWaalsContact OD1-C 3.27Å; D1014-N1016 VanDerWaalsContact OD1-CA 3.26Å; D1014-N1016 WeakPolarHBondContact OD1-CA 3.48Å; D1014-N1016 WeakPolarHBondContact OD1-CB 3.41Å; D1014-N1016 PolarHBondContact OD1-N 3.15Å; D1014-N1016 PolarHBondContact OD2-ND2 3.37Å; N1016-Q1018 VanDerWaalsContact C-N 3.28Å; N1016-Q1018 HydrophobicContact CB-CG 4.19Å; N1016-K1050 VanDerWaalsContact O-CB 3.31Å; N1016-K1050 WeakPolarHBondContact O-CB 3.44Å; N1016-K1050 VanDerWaalsContact O-CG 3.23Å; N1016-K1050 WeakPolarHBondContact O-CG 3.38Å; N1016-K1050 PolarHBondContact O-N 2.95Å
1017	G	88.6	Confident	90.3	Very high	19 Å²	19	35.6 Å²	35.6	20%	0.196	21%	0.205	C	C	.	.	S	Bend	trans	75.9	13.1	-175.8	0	0	0	0	0	114.2	D1014	D1014-G1017 PolarHBondContact O-N 3.22Å; D1014-G1017 VanDerWaalsContact O-N 3.1Å; D1014-G1017 PolarHBondContact OD1-N 3.42Å
1018	Q	91.1	Very high	90.3	Very high	29 Å²	29	29.3 Å²	29.3	14%	0.136	18%	0.18	C	C	.	.			trans	-83	122.8	178.6	-64.3	-174.4	21.8	0	0	110	D1014 N1016 H1022 Y1023	D1014-Q1018 PolarHBondContact N-O 2.94Å; D1014-Q1018 WeakPolarHBondContact OD1-CB 3.3Å; D1014-Q1018 PolarHBondContact OD1-N 2.98Å; N1016-Q1018 VanDerWaalsContact C-N 3.28Å; N1016-Q1018 HydrophobicContact CB-CG 4.19Å; Q1018-H1022 HydrophobicContact CB-CB 3.77Å; Q1018-H1022 HydrophobicContact CG-CB 4.14Å; Q1018-Y1023 HydrophobicContact CB-CD2 4.33Å; Q1018-Y1023 HydrophobicContact CB-CE2 3.85Å
1019	N	92	Very high	90.3	Very high	5 Å²	5	30.3 Å²	30.3	3%	0.027	19%	0.187	C	C	.	.			trans	-86.5	178.5	172.5	74.5	6.1	0	0	0	111.4	F1021 H1022 Y1023 Q1044	N1019-F1021 PolarHBondContact O-N 3.03Å; N1019-F1021 VanDerWaalsContact O-N 3.07Å; N1019-F1021 PolarHBondContact OD1-N 3.31Å; N1019-H1022 WeakPolarHBondContact O-CB 3.48Å; N1019-H1022 PolarHBondContact O-N 3.15Å; N1019-H1022 PolarHBondContact OD1-N 2.97Å; N1019-H1022 PolarHBondContact OD1-ND1 3.39Å; N1019-Y1023 PolarHBondContact O-N 3.33Å; N1019-Q1044 PolarHBondContact ND2-O 2.95Å; N1019-Q1044 VanDerWaalsContact ND2-O 3.09Å; N1019-Q1044 PolarHBondContact ND2-OE1 2.89Å
1020	V	93.3	Very high	90.3	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.3	-25.5	-178.1	-58.8	0	0	0	0	114.7	L987 V991 I1010 Y1023 A1024 L1035	L987-V1020 HydrophobicContact CD2-CG1 3.83Å; L987-V1020 HydrophobicContact CG-CG1 3.99Å; V991-V1020 HydrophobicContact CG2-CB 4.4Å; V991-V1020 HydrophobicContact CG2-CG1 4.48Å; I1010-V1020 HydrophobicContact CD1-CG2 4.41Å; I1010-V1020 HydrophobicContact CG1-CG2 3.53Å; V1020-Y1023 PolarHBondContact O-N 3.45Å; V1020-A1024 VanDerWaalsContact O-CB 3.26Å; V1020-A1024 WeakPolarHBondContact O-CB 3.42Å; V1020-A1024 PolarHBondContact O-N 3.27Å; V1020-L1035 HydrophobicContact CB-CD1 4.1Å; V1020-L1035 HydrophobicContact CG2-CD1 3.91Å; V1020-L1035 HydrophobicContact CG2-CD2 4.17Å
1021	F	94.2	Very high	90.3	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-72.4	-31.7	177.4	-78.2	-81	0	0	0	112.7	I1010 N1019 A1024 A1025 L1035 A1036 A1041 Q1044 I1045 P1055	I1010-F1021 HydrophobicContact CD1-CE2 4Å; I1010-F1021 HydrophobicContact CG1-CE2 4.48Å; N1019-F1021 PolarHBondContact O-N 3.03Å; N1019-F1021 VanDerWaalsContact O-N 3.07Å; N1019-F1021 PolarHBondContact OD1-N 3.31Å; F1021-A1024 PolarHBondContact O-N 3.46Å; F1021-A1025 VanDerWaalsContact O-CB 3.3Å; F1021-A1025 WeakPolarHBondContact O-CB 3.36Å; F1021-A1025 PolarHBondContact O-N 3.01Å; F1021-L1035 HydrophobicContact CE1-CB 3.81Å; F1021-L1035 HydrophobicContact CE2-CB 4.45Å; F1021-L1035 HydrophobicContact CZ-CB 3.73Å; F1021-A1036 HydrophobicContact CE1-CB 4.33Å; F1021-A1041 HydrophobicContact CE2-CB 4.11Å; F1021-A1041 HydrophobicContact CZ-CB 3.78Å; F1021-Q1044 HydrophobicContact CD2-CB 3.76Å; F1021-Q1044 HydrophobicContact CE2-CB 3.83Å; F1021-I1045 HydrophobicContact CD1-CG1 4.31Å; F1021-P1055 HydrophobicContact CB-CB 3.99Å; F1021-P1055 HydrophobicContact CB-CG 3.62Å
1022	H	93.8	Very high	90.5	Very high	3 Å²	3	26 Å²	26	1%	0.014	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-45.3	173.1	-65.4	70.5	0	0	0	110.5	Q1018 N1019 A1025 G1026 I1047 S1049 Y1053	Q1018-H1022 HydrophobicContact CB-CB 3.77Å; Q1018-H1022 HydrophobicContact CG-CB 4.14Å; N1019-H1022 WeakPolarHBondContact O-CB 3.48Å; N1019-H1022 PolarHBondContact O-N 3.15Å; N1019-H1022 PolarHBondContact OD1-N 2.97Å; N1019-H1022 PolarHBondContact OD1-ND1 3.39Å; H1022-A1025 WeakPolarHBondContact O-CB 3.44Å; H1022-A1025 PolarHBondContact O-N 3.45Å; H1022-G1026 PolarHBondContact O-N 3.1Å; H1022-I1047 PolarHBondContact CE1-O 2.89Å; H1022-I1047 VanDerWaalsContact CE1-O 3.31Å; H1022-S1049 PolarHBondContact NE2-N 2.98Å; H1022-Y1053 PolarHBondContact NE2-O 3.2Å
1023	Y	92.1	Very high	90.6	Very high	27 Å²	27	26.8 Å²	26.8	11%	0.106	17%	0.166	C	C	.	.	H	α-helix	trans	-63.8	-41.3	173.3	-78.1	-88	0	0	0	112.2	R984 H988 E992 D1014 Q1018 N1019 V1020 G1026 A1027	R984-Y1023 HydrophobicContact CG-CE1 4.23Å; R984-Y1023 WeakPolarHBondContact CG-OH 3.42Å; H988-Y1023 HydrophobicContact CB-CD1 4.13Å; H988-Y1023 HydrophobicContact CB-CD2 4.15Å; H988-Y1023 HydrophobicContact CB-CE1 4.08Å; H988-Y1023 HydrophobicContact CB-CE2 4.11Å; H988-Y1023 HydrophobicContact CB-CG 4.19Å; H988-Y1023 AromaticContact CD2-CD2 3.97Å; H988-Y1023 AromaticContact CG-CE2 3.92Å; E992-Y1023 HydrophobicContact CB-CD1 4.23Å; D1014-Y1023 HydrophobicContact CB-CE2 4.24Å; D1014-Y1023 PolarHBondContact OD2-OH 3.48Å; Q1018-Y1023 HydrophobicContact CB-CD2 4.33Å; Q1018-Y1023 HydrophobicContact CB-CE2 3.85Å; N1019-Y1023 PolarHBondContact O-N 3.33Å; V1020-Y1023 PolarHBondContact O-N 3.45Å; Y1023-G1026 CarbonylContact O-C 3.53Å; Y1023-G1026 PolarHBondContact O-N 3.28Å; Y1023-A1027 VanDerWaalsContact O-CB 3.32Å; Y1023-A1027 WeakPolarHBondContact O-CB 3.35Å; Y1023-A1027 PolarHBondContact O-N 3.12Å
1024	A	92.8	Very high	90.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-37.4	178.9	0	0	0	0	0	113.1	V991 V1020 F1021 G1026 A1027 S1028 V1031 V1032 L1035	V991-A1024 HydrophobicContact CG1-CB 4Å; V1020-A1024 VanDerWaalsContact O-CB 3.26Å; V1020-A1024 WeakPolarHBondContact O-CB 3.42Å; V1020-A1024 PolarHBondContact O-N 3.27Å; F1021-A1024 PolarHBondContact O-N 3.46Å; A1024-G1026 VanDerWaalsContact C-N 3.26Å; A1024-G1026 PolarHBondContact O-N 2.85Å; A1024-A1027 PolarHBondContact O-N 2.94Å; A1024-S1028 PolarHBondContact O-N 3.4Å; A1024-V1031 HydrophobicContact CB-CB 4.41Å; A1024-V1031 HydrophobicContact CB-CG1 3.98Å; A1024-V1032 HydrophobicContact CB-CG2 3.87Å; A1024-L1035 HydrophobicContact CB-CD1 3.71Å
1025	A	92.2	Very high	90.8	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.5	-39.4	171.8	0	0	0	0	0	112	F1021 H1022 P1055 M1058 C1067 L1071	F1021-A1025 VanDerWaalsContact O-CB 3.3Å; F1021-A1025 WeakPolarHBondContact O-CB 3.36Å; F1021-A1025 PolarHBondContact O-N 3.01Å; H1022-A1025 WeakPolarHBondContact O-CB 3.44Å; H1022-A1025 PolarHBondContact O-N 3.45Å; A1025-P1055 HydrophobicContact CB-CB 4.41Å; A1025-P1055 WeakPolarHBondContact CB-O 3.34Å; A1025-M1058 HydrophobicContact CB-CB 4.24Å; A1025-C1067 WeakPolarHBondContact O-CB 3.16Å; A1025-C1067 PolarHBondContact O-SG 2.88Å; A1025-L1071 HydrophobicContact CB-CD1 3.96Å
1026	G	85.8	Confident	91.1	Very high	27 Å²	27	20.1 Å²	20.1	28%	0.278	13%	0.134	S	C	.	.	H	α-helix	trans	-74.1	-17.2	171.2	0	0	0	0	0	114.7	H1022 Y1023 A1024 K1064	H1022-G1026 PolarHBondContact O-N 3.1Å; Y1023-G1026 CarbonylContact O-C 3.53Å; Y1023-G1026 PolarHBondContact O-N 3.28Å; A1024-G1026 VanDerWaalsContact C-N 3.26Å; A1024-G1026 PolarHBondContact O-N 2.85Å; G1026-K1064 PolarHBondContact O-NZ 2.73Å
1027	A	86.8	Confident	91.4	Very high	10 Å²	10	22.9 Å²	22.9	8%	0.083	14%	0.144	C	C	.	.	H	α-helix	trans	-98.1	-90.8	-171.8	0	0	0	0	0	113.9	V991 Y1023 A1024 K1064	V991-A1027 VanDerWaalsContact O-CB 3.23Å; V991-A1027 WeakPolarHBondContact O-CB 3.19Å; Y1023-A1027 VanDerWaalsContact O-CB 3.32Å; Y1023-A1027 WeakPolarHBondContact O-CB 3.35Å; Y1023-A1027 PolarHBondContact O-N 3.12Å; A1024-A1027 PolarHBondContact O-N 2.94Å; A1027-K1064 PolarHBondContact O-NZ 2.99Å
1028	S	90.1	Very high	91.5	Very high	24 Å²	24	22.6 Å²	22.6	17%	0.168	14%	0.139	C	C	.	.			trans	-149.3	143.2	-169.9	169.5	0	0	0	0	112.2	C994 A1024 S1030 V1031 V1032 C1067	C994-S1028 VanDerWaalsContact SG-CB 3.54Å; A1024-S1028 PolarHBondContact O-N 3.4Å; S1028-S1030 PolarHBondContact O-N 3.33Å; S1028-S1030 PolarHBondContact OG-N 2.87Å; S1028-S1030 PolarHBondContact OG-OG 3.37Å; S1028-V1031 WeakPolarHBondContact O-CB 3.36Å; S1028-V1031 PolarHBondContact O-N 3.35Å; S1028-V1031 VanDerWaalsContact O-N 3.1Å; S1028-V1032 PolarHBondContact O-N 3.1Å; S1028-C1067 VanDerWaalsContact C-SG 3.56Å
1029	P	91.9	Very high	91.3	Very high	39 Å²	39	30.2 Å²	30.2	25%	0.253	18%	0.175	S	C	.	.	H	α-helix	trans	-60.8	-27.7	176.6	27.5	-38.3	0	0	0	113.7	V1031 V1032 T1033 A1070	P1029-V1031 VanDerWaalsContact C-N 3.34Å; P1029-V1032 PolarHBondContact O-N 3.06Å; P1029-T1033 WeakPolarHBondContact O-CB 3.43Å; P1029-T1033 PolarHBondContact O-N 3.36Å; P1029-T1033 PolarHBondContact O-OG1 3.41Å; P1029-A1070 HydrophobicContact CB-CB 3.71Å
1030	S	91.1	Very high	91	Very high	61 Å²	61	31.5 Å²	31.5	43%	0.427	19%	0.189	S	C	.	.	H	α-helix	trans	-64.9	-39.2	175.4	57.3	0	0	0	0	112	S1028 T1033 A1034	S1028-S1030 PolarHBondContact O-N 3.33Å; S1028-S1030 PolarHBondContact OG-N 2.87Å; S1028-S1030 PolarHBondContact OG-OG 3.37Å; S1030-T1033 PolarHBondContact O-N 2.93Å; S1030-A1034 WeakPolarHBondContact O-CB 3.18Å; S1030-A1034 PolarHBondContact O-N 3.03Å
1031	V	91.3	Very high	90.8	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-68.8	-44.1	176.9	-172.4	0	0	0	0	110.1	V991 C994 V996 A1024 S1028 P1029 T1033 A1034 L1035	V991-V1031 HydrophobicContact CB-CG1 4.49Å; V991-V1031 HydrophobicContact CG1-CG1 3.93Å; V991-V1031 HydrophobicContact CG2-CG1 4.45Å; C994-V1031 HydrophobicContact CB-CG2 4.31Å; V996-V1031 HydrophobicContact CG2-CB 4.43Å; V996-V1031 HydrophobicContact CG2-CG2 3.68Å; A1024-V1031 HydrophobicContact CB-CB 4.41Å; A1024-V1031 HydrophobicContact CB-CG1 3.98Å; S1028-V1031 WeakPolarHBondContact O-CB 3.36Å; S1028-V1031 PolarHBondContact O-N 3.35Å; S1028-V1031 VanDerWaalsContact O-N 3.1Å; P1029-V1031 VanDerWaalsContact C-N 3.34Å; V1031-T1033 VanDerWaalsContact C-N 3.3Å; V1031-T1033 PolarHBondContact O-N 2.83Å; V1031-A1034 PolarHBondContact O-N 2.95Å; V1031-L1035 HydrophobicContact CG1-CD1 3.78Å; V1031-L1035 HydrophobicContact CG1-CG 4.23Å; V1031-L1035 WeakPolarHBondContact O-CB 3.46Å; V1031-L1035 VanDerWaalsContact O-CG 3.28Å; V1031-L1035 WeakPolarHBondContact O-CG 3.49Å; V1031-L1035 PolarHBondContact O-N 3.09Å
1032	V	92.9	Very high	90.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-55.7	-46.2	172.8	172.3	0	0	0	0	111.2	A1024 S1028 P1029 A1036 A1070 L1071	A1024-V1032 HydrophobicContact CB-CG2 3.87Å; S1028-V1032 PolarHBondContact O-N 3.1Å; P1029-V1032 PolarHBondContact O-N 3.06Å; V1032-A1036 VanDerWaalsContact O-CB 3.28Å; V1032-A1036 WeakPolarHBondContact O-CB 3.25Å; V1032-A1036 PolarHBondContact O-N 2.87Å; V1032-A1070 HydrophobicContact CB-CB 4.36Å; V1032-A1070 HydrophobicContact CG1-CB 4.08Å; V1032-L1071 HydrophobicContact CG1-CD2 3.59Å; V1032-L1071 HydrophobicContact CG1-CG 3.83Å; V1032-L1071 HydrophobicContact CG2-CD2 4.41Å; V1032-L1071 HydrophobicContact CG2-CG 4.41Å
1033	T	93.5	Very high	90.1	Very high	52 Å²	52	44 Å²	44	32%	0.319	25%	0.249	S	C	.	.	H	α-helix	trans	-63.7	-47.3	-176.7	-58.5	0	0	0	0	111.4	P1029 S1030 V1031 A1036 K1074	P1029-T1033 WeakPolarHBondContact O-CB 3.43Å; P1029-T1033 PolarHBondContact O-N 3.36Å; P1029-T1033 PolarHBondContact O-OG1 3.41Å; S1030-T1033 PolarHBondContact O-N 2.93Å; V1031-T1033 VanDerWaalsContact C-N 3.3Å; V1031-T1033 PolarHBondContact O-N 2.83Å; T1033-A1036 PolarHBondContact O-N 2.95Å; T1033-K1074 PolarHBondContact O-NZ 3.38Å
1034	A	91.1	Very high	90.1	Very high	16 Å²	16	44.1 Å²	44.1	13%	0.132	25%	0.251	C	S	.	.	H	α-helix	trans	-71.9	-36.7	-179.2	0	0	0	0	0	113.5	V996 L1000 S1030 V1031 A1036 E1037 C1038	V996-A1034 HydrophobicContact CG1-CB 3.76Å; L1000-A1034 HydrophobicContact CD1-CB 4.27Å; L1000-A1034 HydrophobicContact CD2-CB 4.38Å; S1030-A1034 WeakPolarHBondContact O-CB 3.18Å; S1030-A1034 PolarHBondContact O-N 3.03Å; V1031-A1034 PolarHBondContact O-N 2.95Å; A1034-A1036 VanDerWaalsContact C-N 3.33Å; A1034-E1037 PolarHBondContact O-N 3.41Å; A1034-C1038 PolarHBondContact O-SG 3.32Å; A1034-C1038 VanDerWaalsContact O-SG 3.37Å
1035	L	93	Very high	90.1	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-67.4	-35.5	173.7	-71.5	173.8	0	0	0	111.5	V991 I1003 V1020 F1021 A1024 V1031 E1037 C1038 A1041	V991-L1035 HydrophobicContact CG1-CD1 4.45Å; V991-L1035 HydrophobicContact CG2-CD1 4.44Å; I1003-L1035 HydrophobicContact CD1-CD2 3.52Å; V1020-L1035 HydrophobicContact CB-CD1 4.1Å; V1020-L1035 HydrophobicContact CG2-CD1 3.91Å; V1020-L1035 HydrophobicContact CG2-CD2 4.17Å; F1021-L1035 HydrophobicContact CE1-CB 3.81Å; F1021-L1035 HydrophobicContact CE2-CB 4.45Å; F1021-L1035 HydrophobicContact CZ-CB 3.73Å; A1024-L1035 HydrophobicContact CB-CD1 3.71Å; V1031-L1035 HydrophobicContact CG1-CD1 3.78Å; V1031-L1035 HydrophobicContact CG1-CG 4.23Å; V1031-L1035 WeakPolarHBondContact O-CB 3.46Å; V1031-L1035 VanDerWaalsContact O-CG 3.28Å; V1031-L1035 WeakPolarHBondContact O-CG 3.49Å; V1031-L1035 PolarHBondContact O-N 3.09Å; L1035-E1037 PolarHBondContact O-N 3.01Å; L1035-E1037 VanDerWaalsContact O-N 3.16Å; L1035-C1038 WeakPolarHBondContact O-CB 3.46Å; L1035-C1038 PolarHBondContact O-N 3.35Å; L1035-C1038 VanDerWaalsContact O-N 3.1Å; L1035-A1041 VanDerWaalsContact O-CB 3.28Å; L1035-A1041 WeakPolarHBondContact O-CB 3.34Å
1036	A	91.3	Very high	90.1	Very high	27 Å²	27	46.9 Å²	46.9	22%	0.223	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-3	174.2	0	0	0	0	0	114.2	F1021 V1032 T1033 A1034 K1074	F1021-A1036 HydrophobicContact CE1-CB 4.33Å; V1032-A1036 VanDerWaalsContact O-CB 3.28Å; V1032-A1036 WeakPolarHBondContact O-CB 3.25Å; V1032-A1036 PolarHBondContact O-N 2.87Å; T1033-A1036 PolarHBondContact O-N 2.95Å; A1034-A1036 VanDerWaalsContact C-N 3.33Å; A1036-K1074 HydrophobicContact CB-CB 4.05Å; A1036-K1074 HydrophobicContact CB-CD 3.75Å; A1036-K1074 HydrophobicContact CB-CG 3.95Å
1037	E	90.1	Very high	90.3	Very high	136 Å²	136	48.7 Å²	48.7	64%	0.636	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	1.6	173.5	-73.3	157.2	-158.2	0	0	112.3	A1034 L1035 K1074	A1034-E1037 PolarHBondContact O-N 3.41Å; L1035-E1037 PolarHBondContact O-N 3.01Å; L1035-E1037 VanDerWaalsContact O-N 3.16Å; E1037-K1074 IonicContact OE1-NZ 2.64Å; E1037-K1074 PolarHBondContact OE1-NZ 2.92Å
1038	C	90.8	Very high	90.5	Very high	14 Å²	14	52.6 Å²	52.6	10%	0.095	29%	0.287	C	S	.	.	S	Bend	trans	-87.1	153.4	174.9	-63.9	0	0	0	0	112	L1000 I1010 A1034 L1035 G1040 A1041	L1000-C1038 VanDerWaalsContact CD2-SG 3.57Å; I1010-C1038 HydrophobicContact CD1-CB 3.89Å; A1034-C1038 PolarHBondContact O-SG 3.32Å; A1034-C1038 VanDerWaalsContact O-SG 3.37Å; L1035-C1038 WeakPolarHBondContact O-CB 3.46Å; L1035-C1038 PolarHBondContact O-N 3.35Å; L1035-C1038 VanDerWaalsContact O-N 3.1Å; C1038-G1040 PolarHBondContact O-N 3.01Å; C1038-A1041 WeakPolarHBondContact O-CB 3.21Å; C1038-A1041 PolarHBondContact O-N 3.44Å
1039	E	87.3	Confident	90.5	Very high	189 Å²	189	51.9 Å²	51.9	88%	0.883	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	132.7	179.2	-167.9	178.6	173.4	0	0	111.9	A1041	E1039-A1041 VanDerWaalsContact C-N 3.32Å; E1039-A1041 PolarHBondContact O-N 3.47Å
1040	G	85.7	Confident	90.3	Very high	31 Å²	31	57.4 Å²	57.4	32%	0.32	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	5.6	-179.2	0	0	0	0	0	115.9	C1038 D1042 K1043 Q1044	C1038-G1040 PolarHBondContact O-N 3.01Å; G1040-D1042 VanDerWaalsContact C-N 3.29Å; G1040-D1042 WeakPolarHBondContact CA-OD1 3.46Å; G1040-D1042 PolarHBondContact O-N 2.98Å; G1040-K1043 PolarHBondContact O-N 3.07Å; G1040-Q1044 WeakPolarHBondContact O-CG 3.39Å
1041	A	89.6	Confident	90	Very high	6 Å²	6	58.5 Å²	58.5	5%	0.05	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-61.7	-33.5	177.9	0	0	0	0	0	114.2	I1010 F1021 L1035 C1038 E1039 K1043 Q1044 I1045	I1010-A1041 HydrophobicContact CD1-CB 4.35Å; F1021-A1041 HydrophobicContact CE2-CB 4.11Å; F1021-A1041 HydrophobicContact CZ-CB 3.78Å; L1035-A1041 VanDerWaalsContact O-CB 3.28Å; L1035-A1041 WeakPolarHBondContact O-CB 3.34Å; C1038-A1041 WeakPolarHBondContact O-CB 3.21Å; C1038-A1041 PolarHBondContact O-N 3.44Å; E1039-A1041 VanDerWaalsContact C-N 3.32Å; E1039-A1041 PolarHBondContact O-N 3.47Å; A1041-K1043 PolarHBondContact O-N 3.2Å; A1041-Q1044 PolarHBondContact O-N 3.42Å; A1041-I1045 PolarHBondContact O-N 3.31Å
1042	D	87	Confident	89.8	Confident	106 Å²	106	59.2 Å²	59.2	57%	0.567	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-50	-43.3	177.1	64.8	-41.5	0	0	0	112.6	G1040 Q1044	G1040-D1042 VanDerWaalsContact C-N 3.29Å; G1040-D1042 WeakPolarHBondContact CA-OD1 3.46Å; G1040-D1042 PolarHBondContact O-N 2.98Å; D1042-Q1044 VanDerWaalsContact C-N 3.31Å; D1042-Q1044 PolarHBondContact O-N 2.9Å
1043	K	86.6	Confident	89.7	Confident	154 Å²	154	62.1 Å²	62.1	67%	0.67	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-82.4	-6.7	-178.5	-69.3	157.1	-165.9	171.3	0	113.5	G1040 A1041 I1047	G1040-K1043 PolarHBondContact O-N 3.07Å; A1041-K1043 PolarHBondContact O-N 3.2Å; K1043-I1047 VanDerWaalsContact O-CD1 3.31Å; K1043-I1047 WeakPolarHBondContact O-CD1 3.48Å; K1043-I1047 WeakPolarHBondContact O-CG1 3.28Å
1044	Q	91.2	Very high	89.7	Confident	29 Å²	29	59.8 Å²	59.8	14%	0.136	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-22.7	-170.4	-63.8	-62.4	-53.5	0	0	113.9	I1010 N1019 F1021 G1040 A1041 D1042 N1046	I1010-Q1044 HydrophobicContact CG2-CG 4.43Å; N1019-Q1044 PolarHBondContact ND2-O 2.95Å; N1019-Q1044 VanDerWaalsContact ND2-O 3.09Å; N1019-Q1044 PolarHBondContact ND2-OE1 2.89Å; F1021-Q1044 HydrophobicContact CD2-CB 3.76Å; F1021-Q1044 HydrophobicContact CE2-CB 3.83Å; G1040-Q1044 WeakPolarHBondContact O-CG 3.39Å; A1041-Q1044 PolarHBondContact O-N 3.42Å; D1042-Q1044 VanDerWaalsContact C-N 3.31Å; D1042-Q1044 PolarHBondContact O-N 2.9Å; Q1044-N1046 PolarHBondContact O-N 3.45Å
1045	I	92.6	Very high	89.8	Confident	9 Å²	9	59 Å²	59	5%	0.046	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-23.6	-173.9	-168.1	164.3	0	0	0	114.7	F1021 A1041 P1055 L1071 K1074 A1076	F1021-I1045 HydrophobicContact CD1-CG1 4.31Å; A1041-I1045 PolarHBondContact O-N 3.31Å; I1045-P1055 WeakPolarHBondContact O-CD 3.46Å; I1045-P1055 VanDerWaalsContact O-CG 3.27Å; I1045-P1055 WeakPolarHBondContact O-CG 3.45Å; I1045-L1071 HydrophobicContact CD1-CD2 4.13Å; I1045-L1071 HydrophobicContact CG1-CD2 4.11Å; I1045-K1074 HydrophobicContact CD1-CB 4.21Å; I1045-A1076 HydrophobicContact CD1-CB 4.25Å; I1045-A1076 HydrophobicContact CG1-CB 4.15Å
1046	N	91.7	Very high	89.8	Confident	49 Å²	49	59.1 Å²	59.1	26%	0.262	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	11.7	-179	-65.9	-51.7	0	0	0	113.7	Q1044 G1075 A1076 V1077 I1080	Q1044-N1046 PolarHBondContact O-N 3.45Å; N1046-G1075 PolarHBondContact ND2-O 3.39Å; N1046-A1076 WeakPolarHBondContact OD1-CA 3.37Å; N1046-V1077 PolarHBondContact OD1-N 2.68Å; N1046-I1080 HydrophobicContact CB-CD1 4.46Å
1047	I	91	Very high	89.9	Confident	65 Å²	65	58.1 Å²	58.1	33%	0.333	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-67.8	145.8	176.7	-72	-176.7	0	0	0	110.7	H1022 K1043 P1055	H1022-I1047 PolarHBondContact CE1-O 2.89Å; H1022-I1047 VanDerWaalsContact CE1-O 3.31Å; K1043-I1047 VanDerWaalsContact O-CD1 3.31Å; K1043-I1047 WeakPolarHBondContact O-CD1 3.48Å; K1043-I1047 WeakPolarHBondContact O-CG1 3.28Å; I1047-P1055 VanDerWaalsContact O-CD 3.27Å; I1047-P1055 WeakPolarHBondContact O-CD 3.26Å
1048	L	90.8	Very high	89.9	Confident	93 Å²	93	52.7 Å²	52.7	49%	0.487	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-88.7	137.4	173.6	-58.4	175.2	0	0	0	111.8	Y1053 T1054	L1048-Y1053 WeakPolarHBondContact CA-O 3.46Å; L1048-T1054 HydrophobicContact CD2-CG2 3.54Å
1049	S	90.1	Very high	90	Very high	8 Å²	8	52 Å²	52	6%	0.056	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-66.1	172.8	162.6	71.4	0	0	0	0	111.8	H1022 D1051 G1052 Y1053	H1022-S1049 PolarHBondContact NE2-N 2.98Å; S1049-D1051 PolarHBondContact O-N 2.81Å; S1049-D1051 VanDerWaalsContact O-N 3.12Å; S1049-D1051 PolarHBondContact OG-N 2.68Å; S1049-G1052 PolarHBondContact O-N 3.11Å; S1049-Y1053 PolarHBondContact N-O 3.31Å
1050	K	87.9	Confident	90.2	Very high	155 Å²	155	43 Å²	43	67%	0.674	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-22.9	173	-69.3	177.5	-173.4	177.9	0	113.5	L1015 N1016 G1052	L1015-K1050 PolarHBondContact O-NZ 3.03Å; N1016-K1050 VanDerWaalsContact O-CB 3.31Å; N1016-K1050 WeakPolarHBondContact O-CB 3.44Å; N1016-K1050 VanDerWaalsContact O-CG 3.23Å; N1016-K1050 WeakPolarHBondContact O-CG 3.38Å; N1016-K1050 PolarHBondContact O-N 2.95Å; K1050-G1052 VanDerWaalsContact C-N 3.31Å
1051	D	83.8	Confident	90.3	Very high	84 Å²	84	44.3 Å²	44.3	45%	0.449	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-2.5	178.6	-44.6	-64.9	0	0	0	113.4	S1049 Y1053 N1083	S1049-D1051 PolarHBondContact O-N 2.81Å; S1049-D1051 VanDerWaalsContact O-N 3.12Å; S1049-D1051 PolarHBondContact OG-N 2.68Å; D1051-Y1053 HydrophobicContact CB-CD2 3.68Å; D1051-Y1053 HydrophobicContact CB-CE2 3.77Å; D1051-N1083 PolarHBondContact O-ND2 2.68Å
1052	G	88.4	Confident	90.2	Very high	18 Å²	18	46.2 Å²	46.2	19%	0.186	23%	0.233	C	C	.	.	S	Bend	trans	81.5	27.8	179.4	0	0	0	0	0	114.8	S1049 K1050 C1082	S1049-G1052 PolarHBondContact O-N 3.11Å; K1050-G1052 VanDerWaalsContact C-N 3.31Å; G1052-C1082 WeakPolarHBondContact O-CB 3.47Å
1053	Y	90.7	Very high	90.2	Very high	61 Å²	61	41.3 Å²	41.3	24%	0.239	21%	0.207	C	C	.	.			trans	-113.2	137.3	-179.4	-59.2	-48	0	0	0	112.6	H1022 L1048 S1049 D1051 F1057 M1058 I1061 C1082	H1022-Y1053 PolarHBondContact NE2-O 3.2Å; L1048-Y1053 WeakPolarHBondContact CA-O 3.46Å; S1049-Y1053 PolarHBondContact N-O 3.31Å; D1051-Y1053 HydrophobicContact CB-CD2 3.68Å; D1051-Y1053 HydrophobicContact CB-CE2 3.77Å; Y1053-F1057 AromaticContact CD1-CD1 3.25Å; Y1053-F1057 HydrophobicContact CD1-CD1 3.25Å; Y1053-F1057 AromaticContact CD1-CE1 3.59Å; Y1053-F1057 HydrophobicContact CD1-CE1 3.59Å; Y1053-F1057 HydrophobicContact CD1-CG 4.19Å; Y1053-F1057 AromaticContact CE1-CD1 3.69Å; Y1053-F1057 HydrophobicContact CE1-CD1 3.69Å; Y1053-F1057 AromaticContact CE1-CE1 3.54Å; Y1053-F1057 HydrophobicContact CE1-CE1 3.54Å; Y1053-F1057 HydrophobicContact CG-CD1 4.07Å; Y1053-M1058 HydrophobicContact CD2-SD 4.19Å; Y1053-M1058 HydrophobicContact CG-SD 4.49Å; Y1053-I1061 HydrophobicContact CD1-CD1 4.02Å; Y1053-I1061 HydrophobicContact CD2-CD1 3.88Å; Y1053-I1061 HydrophobicContact CE1-CD1 4.01Å; Y1053-I1061 HydrophobicContact CE2-CD1 3.88Å; Y1053-I1061 HydrophobicContact CG-CD1 3.95Å; Y1053-C1082 HydrophobicContact CD1-CB 4.05Å
1054	T	93.2	Very high	90.3	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.018	19%	0.188	C	C	.	.			trans	-80.7	162.8	168.7	64.8	0	0	0	0	111.6	L1048 L1056 F1057 M1058 I1080	L1048-T1054 HydrophobicContact CD2-CG2 3.54Å; T1054-L1056 PolarHBondContact O-N 2.71Å; T1054-L1056 PolarHBondContact OG1-N 3.24Å; T1054-F1057 WeakPolarHBondContact O-CB 3.38Å; T1054-F1057 PolarHBondContact O-N 3.33Å; T1054-F1057 PolarHBondContact OG1-N 3.16Å; T1054-M1058 WeakPolarHBondContact O-CG 3.46Å; T1054-M1058 PolarHBondContact O-N 3.17Å; T1054-I1080 HydrophobicContact CG2-CD1 4.24Å; T1054-I1080 HydrophobicContact CG2-CG2 4.1Å
1055	P	93.3	Very high	90.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-50.3	-36.7	167.8	-33.3	38.3	0	0	0	114.7	F1021 A1025 I1045 I1047 M1058 S1059 L1071	F1021-P1055 HydrophobicContact CB-CB 3.99Å; F1021-P1055 HydrophobicContact CB-CG 3.62Å; A1025-P1055 HydrophobicContact CB-CB 4.41Å; A1025-P1055 WeakPolarHBondContact CB-O 3.34Å; I1045-P1055 WeakPolarHBondContact O-CD 3.46Å; I1045-P1055 VanDerWaalsContact O-CG 3.27Å; I1045-P1055 WeakPolarHBondContact O-CG 3.45Å; I1047-P1055 VanDerWaalsContact O-CD 3.27Å; I1047-P1055 WeakPolarHBondContact O-CD 3.26Å; P1055-M1058 PolarHBondContact O-N 3.02Å; P1055-S1059 PolarHBondContact O-N 2.8Å; P1055-L1071 HydrophobicContact CB-CD1 4.5Å; P1055-L1071 HydrophobicContact CB-CD2 4.36Å; P1055-L1071 WeakPolarHBondContact O-CD1 3.19Å
1056	L	93.8	Very high	90.2	Very high	4 Å²	4	39.3 Å²	39.3	2%	0.021	21%	0.205	C	C	.	.	H	α-helix	trans	-66.8	-44	175.2	-178	62.9	0	0	0	111.7	T1054 M1058 S1059 I1060 T1068 L1071 I1072 A1076 V1077 W1078	T1054-L1056 PolarHBondContact O-N 2.71Å; T1054-L1056 PolarHBondContact OG1-N 3.24Å; L1056-M1058 VanDerWaalsContact C-N 3.28Å; L1056-M1058 PolarHBondContact O-N 3.29Å; L1056-S1059 PolarHBondContact O-N 3.45Å; L1056-S1059 PolarHBondContact O-OG 3.24Å; L1056-I1060 WeakPolarHBondContact O-CG1 3.3Å; L1056-I1060 PolarHBondContact O-N 3.43Å; L1056-T1068 HydrophobicContact CD1-CG2 3.75Å; L1056-L1071 HydrophobicContact CD1-CB 4.07Å; L1056-L1071 HydrophobicContact CD1-CD1 4.49Å; L1056-I1072 HydrophobicContact CD1-CD1 4.23Å; L1056-I1072 HydrophobicContact CD1-CG1 3.85Å; L1056-I1072 HydrophobicContact CD2-CG1 4.28Å; L1056-A1076 HydrophobicContact CB-CB 4.16Å; L1056-A1076 HydrophobicContact CD2-CB 4.43Å; L1056-V1077 WeakPolarHBondContact CD2-O 3.21Å; L1056-W1078 HydrophobicContact CD2-CB 3.93Å
1057	F	92.5	Very high	90.3	Very high	6 Å²	6	37 Å²	37	3%	0.026	19%	0.193	C	C	.	.	H	α-helix	trans	-64.7	-36.1	175.6	-142.2	-98.1	0	0	0	111.1	Y1053 T1054 I1060 I1061 C1082 R1085 Q1090	Y1053-F1057 AromaticContact CD1-CD1 3.25Å; Y1053-F1057 HydrophobicContact CD1-CD1 3.25Å; Y1053-F1057 AromaticContact CD1-CE1 3.59Å; Y1053-F1057 HydrophobicContact CD1-CE1 3.59Å; Y1053-F1057 HydrophobicContact CD1-CG 4.19Å; Y1053-F1057 AromaticContact CE1-CD1 3.69Å; Y1053-F1057 HydrophobicContact CE1-CD1 3.69Å; Y1053-F1057 AromaticContact CE1-CE1 3.54Å; Y1053-F1057 HydrophobicContact CE1-CE1 3.54Å; Y1053-F1057 HydrophobicContact CG-CD1 4.07Å; T1054-F1057 WeakPolarHBondContact O-CB 3.38Å; T1054-F1057 PolarHBondContact O-N 3.33Å; T1054-F1057 PolarHBondContact OG1-N 3.16Å; F1057-I1060 PolarHBondContact O-N 3.44Å; F1057-I1061 HydrophobicContact CD1-CD1 3.73Å; F1057-I1061 HydrophobicContact CD1-CG1 4.35Å; F1057-I1061 HydrophobicContact CE1-CD1 4.26Å; F1057-I1061 WeakPolarHBondContact O-CG1 3.38Å; F1057-I1061 PolarHBondContact O-N 3.28Å; F1057-C1082 HydrophobicContact CD1-CB 3.88Å; F1057-C1082 HydrophobicContact CD2-CB 3.67Å; F1057-C1082 HydrophobicContact CE1-CB 3.79Å; F1057-C1082 HydrophobicContact CE2-CB 3.61Å; F1057-C1082 HydrophobicContact CG-CB 3.79Å; F1057-C1082 HydrophobicContact CZ-CB 3.65Å; F1057-R1085 HydrophobicContact CZ-CB 4.4Å; F1057-Q1090 HydrophobicContact CD1-CG 3.89Å; F1057-Q1090 HydrophobicContact CD2-CB 4.48Å; F1057-Q1090 HydrophobicContact CE1-CB 3.82Å; F1057-Q1090 VanDerWaalsContact CE1-CD 3.49Å; F1057-Q1090 HydrophobicContact CE1-CG 3.37Å; F1057-Q1090 HydrophobicContact CE2-CB 3.76Å; F1057-Q1090 HydrophobicContact CE2-CG 4.19Å; F1057-Q1090 HydrophobicContact CZ-CB 3.4Å; F1057-Q1090 VanDerWaalsContact CZ-CB 3.4Å; F1057-Q1090 HydrophobicContact CZ-CG 3.55Å
1058	M	90.5	Very high	90.4	Very high	23 Å²	23	33.9 Å²	33.9	11%	0.113	18%	0.177	C	C	.	.	H	α-helix	trans	-66.6	-33.1	173.3	-70.4	-65.7	-75.2	0	0	113.5	A1025 Y1053 T1054 P1055 L1056 I1060 I1061 S1062	A1025-M1058 HydrophobicContact CB-CB 4.24Å; Y1053-M1058 HydrophobicContact CD2-SD 4.19Å; Y1053-M1058 HydrophobicContact CG-SD 4.49Å; T1054-M1058 WeakPolarHBondContact O-CG 3.46Å; T1054-M1058 PolarHBondContact O-N 3.17Å; P1055-M1058 PolarHBondContact O-N 3.02Å; L1056-M1058 VanDerWaalsContact C-N 3.28Å; L1056-M1058 PolarHBondContact O-N 3.29Å; M1058-I1060 VanDerWaalsContact C-N 3.31Å; M1058-I1061 HydrophobicContact SD-CD1 4.41Å; M1058-S1062 WeakPolarHBondContact O-CB 3.37Å; M1058-S1062 PolarHBondContact O-N 3.43Å; M1058-S1062 PolarHBondContact O-OG 3.27Å
1059	S	92.7	Very high	90.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-70.2	-31.4	174.2	76.5	0	0	0	0	111.9	P1055 L1056 C1063 K1064 T1068	P1055-S1059 PolarHBondContact O-N 2.8Å; L1056-S1059 PolarHBondContact O-N 3.45Å; L1056-S1059 PolarHBondContact O-OG 3.24Å; S1059-C1063 PolarHBondContact O-N 2.95Å; S1059-K1064 PolarHBondContact O-N 3.33Å; S1059-T1068 WeakPolarHBondContact OG-CA 3.22Å; S1059-T1068 PolarHBondContact OG-OG1 2.98Å
1060	I	91.7	Very high	90.7	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-71.2	-49.9	172.9	-62	169.2	0	0	0	110.1	L1056 F1057 M1058 S1062 C1063 T1068 A1087 Q1090 A1091 Q1094 I1111 L1115	L1056-I1060 WeakPolarHBondContact O-CG1 3.3Å; L1056-I1060 PolarHBondContact O-N 3.43Å; F1057-I1060 PolarHBondContact O-N 3.44Å; M1058-I1060 VanDerWaalsContact C-N 3.31Å; I1060-S1062 VanDerWaalsContact C-N 3.28Å; I1060-S1062 PolarHBondContact O-N 3.23Å; I1060-C1063 WeakPolarHBondContact O-CA 3.33Å; I1060-C1063 PolarHBondContact O-N 3.23Å; I1060-T1068 HydrophobicContact CG1-CG2 4.15Å; I1060-A1087 HydrophobicContact CD1-CB 3.74Å; I1060-Q1090 HydrophobicContact CG2-CB 4.18Å; I1060-Q1090 HydrophobicContact CG2-CG 4.03Å; I1060-A1091 HydrophobicContact CG2-CB 4.09Å; I1060-Q1094 VanDerWaalsContact O-CD 3.23Å; I1060-Q1094 PolarHBondContact O-NE2 3.47Å; I1060-Q1094 PolarHBondContact O-OE1 2.82Å; I1060-Q1094 VanDerWaalsContact O-OE1 3.06Å; I1060-I1111 HydrophobicContact CG1-CG2 4.38Å; I1060-L1115 HydrophobicContact CD1-CD1 4.43Å
1061	I	88.2	Confident	91	Very high	58 Å²	58	24 Å²	24	30%	0.297	14%	0.135	S	C	.	.	H	α-helix	trans	-57.8	-37.5	174.2	-70.9	168.2	0	0	0	112.4	Y1053 F1057 M1058 C1063 Q1090 Q1094	Y1053-I1061 HydrophobicContact CD1-CD1 4.02Å; Y1053-I1061 HydrophobicContact CD2-CD1 3.88Å; Y1053-I1061 HydrophobicContact CE1-CD1 4.01Å; Y1053-I1061 HydrophobicContact CE2-CD1 3.88Å; Y1053-I1061 HydrophobicContact CG-CD1 3.95Å; F1057-I1061 HydrophobicContact CD1-CD1 3.73Å; F1057-I1061 HydrophobicContact CD1-CG1 4.35Å; F1057-I1061 HydrophobicContact CE1-CD1 4.26Å; F1057-I1061 WeakPolarHBondContact O-CG1 3.38Å; F1057-I1061 PolarHBondContact O-N 3.28Å; M1058-I1061 HydrophobicContact SD-CD1 4.41Å; I1061-C1063 PolarHBondContact O-N 3.07Å; I1061-Q1090 HydrophobicContact CG1-CG 4.08Å; I1061-Q1094 PolarHBondContact O-OE1 2.9Å
1062	S	85.8	Confident	91.4	Very high	45 Å²	45	21.3 Å²	21.3	32%	0.315	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-3.4	176.2	-57.9	0	0	0	0	113.3	M1058 I1060 K1064	M1058-S1062 WeakPolarHBondContact O-CB 3.37Å; M1058-S1062 PolarHBondContact O-N 3.43Å; M1058-S1062 PolarHBondContact O-OG 3.27Å; I1060-S1062 VanDerWaalsContact C-N 3.28Å; I1060-S1062 PolarHBondContact O-N 3.23Å; S1062-K1064 PolarHBondContact O-N 3.17Å
1063	C	87.4	Confident	91.6	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.027	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.3	55.6	-174.3	-155.4	0	0	0	0	112.1	S1059 I1060 I1061 P1065 K1107	S1059-C1063 PolarHBondContact O-N 2.95Å; I1060-C1063 WeakPolarHBondContact O-CA 3.33Å; I1060-C1063 PolarHBondContact O-N 3.23Å; I1061-C1063 PolarHBondContact O-N 3.07Å; C1063-P1065 WeakPolarHBondContact O-CD 3.46Å; C1063-K1107 HydrophobicContact CB-CD 4.34Å; C1063-K1107 WeakPolarHBondContact O-CD 3.41Å; C1063-K1107 WeakPolarHBondContact O-CE 3.22Å; C1063-K1107 PolarHBondContact O-NZ 3.19Å; C1063-K1107 VanDerWaalsContact SG-CB 3.51Å
1064	K	88.8	Confident	91.7	Very high	61 Å²	61	29.1 Å²	29.1	27%	0.265	15%	0.15	S	C	.	.			trans	-114.9	75.5	-179.2	-70.1	-57.8	-171.6	76.8	0	111	G1026 A1027 S1059 S1062 T1066 C1067 T1068	G1026-K1064 PolarHBondContact O-NZ 2.73Å; A1027-K1064 PolarHBondContact O-NZ 2.99Å; S1059-K1064 PolarHBondContact O-N 3.33Å; S1062-K1064 PolarHBondContact O-N 3.17Å; K1064-T1066 VanDerWaalsContact C-N 3.32Å; K1064-T1066 PolarHBondContact O-N 3.25Å; K1064-C1067 HydrophobicContact CB-CB 3.86Å; K1064-C1067 WeakPolarHBondContact O-CB 3.42Å; K1064-C1067 PolarHBondContact O-N 3.42Å; K1064-T1068 PolarHBondContact O-N 2.92Å; K1064-T1068 PolarHBondContact O-OG1 2.85Å
1065	P	90	Very high	91.5	Very high	14 Å²	14	31.2 Å²	31.2	9%	0.091	17%	0.172	C	C	.	.	H	α-helix	trans	-49.5	-46.2	-176.1	13.8	-29.6	0	0	0	114.3	C1063 C1067 T1068 T1069 K1107 L1110 I1111	C1063-P1065 WeakPolarHBondContact O-CD 3.46Å; P1065-C1067 VanDerWaalsContact C-N 3.31Å; P1065-C1067 PolarHBondContact O-N 3.39Å; P1065-T1068 WeakPolarHBondContact O-CA 3.25Å; P1065-T1068 VanDerWaalsContact O-CB 3.3Å; P1065-T1068 WeakPolarHBondContact O-CB 3.36Å; P1065-T1068 PolarHBondContact O-N 3.25Å; P1065-T1068 VanDerWaalsContact O-N 3.09Å; P1065-T1069 PolarHBondContact O-N 3.24Å; P1065-T1069 PolarHBondContact O-OG1 3.33Å; P1065-K1107 HydrophobicContact CG-CB 4.19Å; P1065-K1107 HydrophobicContact CG-CG 4.15Å; P1065-L1110 HydrophobicContact CB-CB 3.9Å; P1065-L1110 HydrophobicContact CB-CD2 3.73Å; P1065-L1110 HydrophobicContact CB-CG 3.71Å; P1065-L1110 HydrophobicContact CG-CB 4.45Å; P1065-L1110 HydrophobicContact CG-CD2 4.07Å; P1065-L1110 HydrophobicContact CG-CG 4.47Å; P1065-I1111 HydrophobicContact CB-CG1 3.87Å
1066	T	92.7	Very high	91.5	Very high	74 Å²	74	31.2 Å²	31.2	45%	0.454	17%	0.172	S	C	.	.	H	α-helix	trans	-66.7	-31.6	-178.3	51.7	0	0	0	0	112.9	K1064 A1070	K1064-T1066 VanDerWaalsContact C-N 3.32Å; K1064-T1066 PolarHBondContact O-N 3.25Å; T1066-A1070 WeakPolarHBondContact O-CB 3.45Å; T1066-A1070 PolarHBondContact O-N 3.1Å
1067	C	93.1	Very high	91.3	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.007	19%	0.188	C	C	.	.	H	α-helix	trans	-68.4	-41	170.2	-61.5	0	0	0	0	111.1	A1025 S1028 K1064 P1065 T1069 A1070 L1071	A1025-C1067 WeakPolarHBondContact O-CB 3.16Å; A1025-C1067 PolarHBondContact O-SG 2.88Å; S1028-C1067 VanDerWaalsContact C-SG 3.56Å; K1064-C1067 HydrophobicContact CB-CB 3.86Å; K1064-C1067 WeakPolarHBondContact O-CB 3.42Å; K1064-C1067 PolarHBondContact O-N 3.42Å; P1065-C1067 VanDerWaalsContact C-N 3.31Å; P1065-C1067 PolarHBondContact O-N 3.39Å; C1067-T1069 PolarHBondContact O-N 3.02Å; C1067-A1070 PolarHBondContact O-N 3.16Å; C1067-L1071 WeakPolarHBondContact O-CB 3.16Å; C1067-L1071 VanDerWaalsContact O-CG 3.31Å; C1067-L1071 WeakPolarHBondContact O-CG 3Å; C1067-L1071 PolarHBondContact O-N 3.18Å
1068	T	93.3	Very high	91	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.8	-48.1	173.4	-49.6	0	0	0	0	111	L1056 S1059 I1060 K1064 P1065 A1070 L1071 I1072	L1056-T1068 HydrophobicContact CD1-CG2 3.75Å; S1059-T1068 WeakPolarHBondContact OG-CA 3.22Å; S1059-T1068 PolarHBondContact OG-OG1 2.98Å; I1060-T1068 HydrophobicContact CG1-CG2 4.15Å; K1064-T1068 PolarHBondContact O-N 2.92Å; K1064-T1068 PolarHBondContact O-OG1 2.85Å; P1065-T1068 WeakPolarHBondContact O-CA 3.25Å; P1065-T1068 VanDerWaalsContact O-CB 3.3Å; P1065-T1068 WeakPolarHBondContact O-CB 3.36Å; P1065-T1068 PolarHBondContact O-N 3.25Å; P1065-T1068 VanDerWaalsContact O-N 3.09Å; T1068-A1070 VanDerWaalsContact C-N 3.35Å; T1068-A1070 PolarHBondContact O-N 3.17Å; T1068-L1071 PolarHBondContact O-N 3Å; T1068-I1072 HydrophobicContact CG2-CD1 4.09Å; T1068-I1072 WeakPolarHBondContact O-CG1 3.34Å; T1068-I1072 PolarHBondContact O-N 3.18Å; T1068-I1072 VanDerWaalsContact O-N 3.09Å
1069	T	93.2	Very high	90.7	Very high	37 Å²	37	42.5 Å²	42.5	23%	0.227	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-39.4	175.2	-41.4	0	0	0	0	112.4	P1065 C1067 K1073 T1114	P1065-T1069 PolarHBondContact O-N 3.24Å; P1065-T1069 PolarHBondContact O-OG1 3.33Å; C1067-T1069 PolarHBondContact O-N 3.02Å; T1069-K1073 HydrophobicContact CG2-CD 4.28Å; T1069-K1073 WeakPolarHBondContact O-CB 3.49Å; T1069-K1073 VanDerWaalsContact O-CG 3.28Å; T1069-K1073 WeakPolarHBondContact O-CG 3.32Å; T1069-K1073 PolarHBondContact O-N 3.13Å; T1069-K1073 VanDerWaalsContact O-N 3.14Å; T1069-T1114 HydrophobicContact CG2-CG2 4.1Å; T1069-T1114 PolarHBondContact OG1-OG1 2.96Å
1070	A	92.9	Very high	90.5	Very high	12 Å²	12	45.3 Å²	45.3	10%	0.099	24%	0.243	C	C	.	.	H	α-helix	trans	-69.9	-39.9	179	0	0	0	0	0	112.8	P1029 V1032 T1066 C1067 T1068 K1073 K1074	P1029-A1070 HydrophobicContact CB-CB 3.71Å; V1032-A1070 HydrophobicContact CB-CB 4.36Å; V1032-A1070 HydrophobicContact CG1-CB 4.08Å; T1066-A1070 WeakPolarHBondContact O-CB 3.45Å; T1066-A1070 PolarHBondContact O-N 3.1Å; C1067-A1070 PolarHBondContact O-N 3.16Å; T1068-A1070 VanDerWaalsContact C-N 3.35Å; T1068-A1070 PolarHBondContact O-N 3.17Å; A1070-K1073 PolarHBondContact O-N 2.92Å; A1070-K1074 WeakPolarHBondContact O-CB 3.39Å; A1070-K1074 WeakPolarHBondContact O-CG 3.45Å; A1070-K1074 PolarHBondContact O-N 3.4Å; A1070-K1074 VanDerWaalsContact O-N 3.1Å
1071	L	94.3	Very high	90.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-48.7	177.6	-76.3	167	0	0	0	111.3	A1025 V1032 I1045 P1055 L1056 C1067 T1068 K1073 K1074 G1075 A1076	A1025-L1071 HydrophobicContact CB-CD1 3.96Å; V1032-L1071 HydrophobicContact CG1-CD2 3.59Å; V1032-L1071 HydrophobicContact CG1-CG 3.83Å; V1032-L1071 HydrophobicContact CG2-CD2 4.41Å; V1032-L1071 HydrophobicContact CG2-CG 4.41Å; I1045-L1071 HydrophobicContact CD1-CD2 4.13Å; I1045-L1071 HydrophobicContact CG1-CD2 4.11Å; P1055-L1071 HydrophobicContact CB-CD1 4.5Å; P1055-L1071 HydrophobicContact CB-CD2 4.36Å; P1055-L1071 WeakPolarHBondContact O-CD1 3.19Å; L1056-L1071 HydrophobicContact CD1-CB 4.07Å; L1056-L1071 HydrophobicContact CD1-CD1 4.49Å; C1067-L1071 WeakPolarHBondContact O-CB 3.16Å; C1067-L1071 VanDerWaalsContact O-CG 3.31Å; C1067-L1071 WeakPolarHBondContact O-CG 3Å; C1067-L1071 PolarHBondContact O-N 3.18Å; T1068-L1071 PolarHBondContact O-N 3Å; L1071-K1073 VanDerWaalsContact C-N 3.32Å; L1071-K1073 PolarHBondContact O-N 2.94Å; L1071-K1074 CarbonylContact O-C 3.45Å; L1071-K1074 PolarHBondContact O-N 3.47Å; L1071-G1075 PolarHBondContact O-N 3.39Å; L1071-A1076 HydrophobicContact CB-CB 3.75Å; L1071-A1076 HydrophobicContact CD2-CB 4.46Å; L1071-A1076 VanDerWaalsContact O-CB 3.28Å; L1071-A1076 WeakPolarHBondContact O-CB 3.44Å; L1071-A1076 PolarHBondContact O-N 3.42Å
1072	I	92.9	Very high	90.1	Very high	27 Å²	27	48.4 Å²	48.4	14%	0.138	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-44.9	176.2	-67.3	166.8	0	0	0	110.3	L1056 T1068 K1074 G1075 W1078 T1114 L1115 A1118	L1056-I1072 HydrophobicContact CD1-CD1 4.23Å; L1056-I1072 HydrophobicContact CD1-CG1 3.85Å; L1056-I1072 HydrophobicContact CD2-CG1 4.28Å; T1068-I1072 HydrophobicContact CG2-CD1 4.09Å; T1068-I1072 WeakPolarHBondContact O-CG1 3.34Å; T1068-I1072 PolarHBondContact O-N 3.18Å; T1068-I1072 VanDerWaalsContact O-N 3.09Å; I1072-K1074 PolarHBondContact O-N 3.26Å; I1072-K1074 VanDerWaalsContact O-N 3.17Å; I1072-G1075 PolarHBondContact O-N 3.23Å; I1072-W1078 HydrophobicContact CG2-CE3 4.23Å; I1072-W1078 HydrophobicContact CG2-CZ3 4.27Å; I1072-T1114 HydrophobicContact CD1-CG2 4.02Å; I1072-L1115 HydrophobicContact CD1-CD2 4.19Å; I1072-A1118 HydrophobicContact CG2-CB 4.22Å
1073	K	92.2	Very high	90	Very high	173 Å²	173	51.2 Å²	51.2	75%	0.752	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-12.5	175.8	-74.9	-178.8	177.5	-174.5	0	115	T1069 A1070 L1071	T1069-K1073 HydrophobicContact CG2-CD 4.28Å; T1069-K1073 WeakPolarHBondContact O-CB 3.49Å; T1069-K1073 VanDerWaalsContact O-CG 3.28Å; T1069-K1073 WeakPolarHBondContact O-CG 3.32Å; T1069-K1073 PolarHBondContact O-N 3.13Å; T1069-K1073 VanDerWaalsContact O-N 3.14Å; A1070-K1073 PolarHBondContact O-N 2.92Å; L1071-K1073 VanDerWaalsContact C-N 3.32Å; L1071-K1073 PolarHBondContact O-N 2.94Å
1074	K	92.9	Very high	89.7	Confident	70 Å²	70	53 Å²	53	30%	0.304	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	14	177.4	-73	-73.1	-169.2	154.6	0	113.1	T1033 A1036 E1037 I1045 A1070 L1071 I1072	T1033-K1074 PolarHBondContact O-NZ 3.38Å; A1036-K1074 HydrophobicContact CB-CB 4.05Å; A1036-K1074 HydrophobicContact CB-CD 3.75Å; A1036-K1074 HydrophobicContact CB-CG 3.95Å; E1037-K1074 IonicContact OE1-NZ 2.64Å; E1037-K1074 PolarHBondContact OE1-NZ 2.92Å; I1045-K1074 HydrophobicContact CD1-CB 4.21Å; A1070-K1074 WeakPolarHBondContact O-CB 3.39Å; A1070-K1074 WeakPolarHBondContact O-CG 3.45Å; A1070-K1074 PolarHBondContact O-N 3.4Å; A1070-K1074 VanDerWaalsContact O-N 3.1Å; L1071-K1074 CarbonylContact O-C 3.45Å; L1071-K1074 PolarHBondContact O-N 3.47Å; I1072-K1074 PolarHBondContact O-N 3.26Å; I1072-K1074 VanDerWaalsContact O-N 3.17Å
1075	G	90.2	Very high	89.6	Confident	47 Å²	47	54.3 Å²	54.3	49%	0.485	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	19.2	172.8	0	0	0	0	0	115.7	N1046 L1071 I1072	N1046-G1075 PolarHBondContact ND2-O 3.39Å; L1071-G1075 PolarHBondContact O-N 3.39Å; I1072-G1075 PolarHBondContact O-N 3.23Å
1076	A	92	Very high	89.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.29	C	S	.	.			trans	-70.6	130	167	0	0	0	0	0	110.4	I1045 N1046 L1056 L1071	I1045-A1076 HydrophobicContact CD1-CB 4.25Å; I1045-A1076 HydrophobicContact CG1-CB 4.15Å; N1046-A1076 WeakPolarHBondContact OD1-CA 3.37Å; L1056-A1076 HydrophobicContact CB-CB 4.16Å; L1056-A1076 HydrophobicContact CD2-CB 4.43Å; L1071-A1076 HydrophobicContact CB-CB 3.75Å; L1071-A1076 HydrophobicContact CD2-CB 4.46Å; L1071-A1076 VanDerWaalsContact O-CB 3.28Å; L1071-A1076 WeakPolarHBondContact O-CB 3.44Å; L1071-A1076 PolarHBondContact O-N 3.42Å
1077	V	90.3	Very high	89.6	Confident	58 Å²	58	50.7 Å²	50.7	35%	0.352	27%	0.27	S	S	.	.			trans	-89.2	131.6	-170.7	177.9	0	0	0	0	110.5	N1046 L1056 D1079 I1080	N1046-V1077 PolarHBondContact OD1-N 2.68Å; L1056-V1077 WeakPolarHBondContact CD2-O 3.21Å; V1077-D1079 WeakPolarHBondContact CG1-OD1 3.39Å; V1077-I1080 HydrophobicContact CB-CD1 3.82Å; V1077-I1080 HydrophobicContact CB-CG1 4.29Å; V1077-I1080 HydrophobicContact CG1-CD1 4.02Å; V1077-I1080 HydrophobicContact CG1-CG1 3.94Å
1078	W	86	Confident	89.4	Confident	98 Å²	98	50.7 Å²	50.7	37%	0.371	27%	0.27	S	S	.	.	S	Bend	trans	-100.8	-15.8	-166.9	58.6	78.6	0	0	0	116	L1056 I1072	L1056-W1078 HydrophobicContact CD2-CB 3.93Å; I1072-W1078 HydrophobicContact CG2-CE3 4.23Å; I1072-W1078 HydrophobicContact CG2-CZ3 4.27Å
1079	D	84.8	Confident	89.3	Confident	113 Å²	113	50.9 Å²	50.9	60%	0.604	27%	0.271	S	S	*	.			trans	-88.5	-2.3	178.8	64.8	-12.7	0	0	0	113.6	V1077 M1081	V1077-D1079 WeakPolarHBondContact CG1-OD1 3.39Å; D1079-M1081 PolarHBondContact O-N 3.17Å
1080	I	87.3	Confident	89.2	Confident	60 Å²	60	50.2 Å²	50.2	31%	0.308	27%	0.265	S	S	.	.			trans	-64.4	100.5	173.9	-62.2	168.4	0	0	0	109.8	N1046 T1054 V1077 C1082	N1046-I1080 HydrophobicContact CB-CD1 4.46Å; T1054-I1080 HydrophobicContact CG2-CD1 4.24Å; T1054-I1080 HydrophobicContact CG2-CG2 4.1Å; V1077-I1080 HydrophobicContact CB-CD1 3.82Å; V1077-I1080 HydrophobicContact CB-CG1 4.29Å; V1077-I1080 HydrophobicContact CG1-CD1 4.02Å; V1077-I1080 HydrophobicContact CG1-CG1 3.94Å; I1080-C1082 PolarHBondContact O-N 3.31Å
1081	M	86	Confident	89	Confident	118 Å²	118	49.6 Å²	49.6	58%	0.581	26%	0.26	S	S	*	.			trans	-65.8	98.5	175.1	-72.2	-174.1	-71.3	0	0	111.5	D1079 R1085 P1128	D1079-M1081 PolarHBondContact O-N 3.17Å; M1081-R1085 CarbonylContact C-O 3.59Å; M1081-R1085 WeakPolarHBondContact CA-O 3.42Å; M1081-P1128 HydrophobicContact SD-CG 4.13Å
1082	C	85.9	Confident	88.9	Confident	4 Å²	4	49.6 Å²	49.6	3%	0.027	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-82.9	123.1	174.4	-57.3	0	0	0	0	109	G1052 Y1053 F1057 I1080 G1084 R1085	G1052-C1082 WeakPolarHBondContact O-CB 3.47Å; Y1053-C1082 HydrophobicContact CD1-CB 4.05Å; F1057-C1082 HydrophobicContact CD1-CB 3.88Å; F1057-C1082 HydrophobicContact CD2-CB 3.67Å; F1057-C1082 HydrophobicContact CE1-CB 3.79Å; F1057-C1082 HydrophobicContact CE2-CB 3.61Å; F1057-C1082 HydrophobicContact CG-CB 3.79Å; F1057-C1082 HydrophobicContact CZ-CB 3.65Å; I1080-C1082 PolarHBondContact O-N 3.31Å; C1082-G1084 PolarHBondContact O-N 2.86Å; C1082-G1084 VanDerWaalsContact O-N 3.15Å; C1082-R1085 PolarHBondContact N-O 2.88Å; C1082-R1085 VanDerWaalsContact N-O 3.12Å; C1082-R1085 PolarHBondContact O-N 2.85Å; C1082-R1085 VanDerWaalsContact O-N 3.11Å
1083	N	83	Confident	88.7	Confident	105 Å²	105	50.9 Å²	50.9	56%	0.561	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	39.8	-177.3	-64.5	-37.6	0	0	0	113.8	D1051	D1051-N1083 PolarHBondContact O-ND2 2.68Å
1084	G	82.2	Confident	88.2	Confident	41 Å²	41	43.4 Å²	43.4	42%	0.423	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	7.3	176.5	0	0	0	0	0	116	C1082	C1082-G1084 PolarHBondContact O-N 2.86Å; C1082-G1084 VanDerWaalsContact O-N 3.15Å
1085	R	87.2	Confident	87.1	Confident	88 Å²	88	44 Å²	44	33%	0.332	24%	0.241	S	C	.	.	B	Isolated β-bridge	trans	-124.5	140.2	-175.3	-65.2	-179.4	-178.3	134.8	4	112.4	F1057 M1081 C1082 H1089 E1127	F1057-R1085 HydrophobicContact CZ-CB 4.4Å; M1081-R1085 CarbonylContact C-O 3.59Å; M1081-R1085 WeakPolarHBondContact CA-O 3.42Å; C1082-R1085 PolarHBondContact N-O 2.88Å; C1082-R1085 VanDerWaalsContact N-O 3.12Å; C1082-R1085 PolarHBondContact O-N 2.85Å; C1082-R1085 VanDerWaalsContact O-N 3.11Å; R1085-H1089 HydrophobicContact CB-CB 4.06Å; R1085-H1089 HydrophobicContact CG-CB 4.43Å; R1085-E1127 HydrophobicContact CG-CG 4.49Å; R1085-E1127 IonicContact CZ-OE1 3.36Å; R1085-E1127 IonicContact NE-OE1 2.64Å; R1085-E1127 PolarHBondContact NE-OE1 2.83Å; R1085-E1127 IonicContact NH2-OE1 3.2Å
1086	S	90	Very high	85.7	Confident	10 Å²	10	43 Å²	43	7%	0.07	23%	0.23	C	C	.	.			trans	-81.4	170.5	170.5	64.9	0	0	0	0	112.4	V1088 H1089 Q1090 D1125	S1086-V1088 VanDerWaalsContact C-N 3.33Å; S1086-V1088 PolarHBondContact O-N 2.82Å; S1086-H1089 PolarHBondContact O-N 3.15Å; S1086-H1089 VanDerWaalsContact O-N 3.16Å; S1086-H1089 PolarHBondContact OG-ND1 3.48Å; S1086-Q1090 PolarHBondContact O-N 3.28Å; S1086-Q1090 VanDerWaalsContact O-N 3.15Å; S1086-D1125 WeakPolarHBondContact CB-OD2 3.38Å; S1086-D1125 PolarHBondContact OG-OD2 2.9Å
1087	A	90.8	Very high	84.3	Confident	3 Å²	3	47.4 Å²	47.4	3%	0.025	26%	0.261	C	S	.	.	H	α-helix	trans	-57.4	-39.9	-175.6	0	0	0	0	0	113.8	I1060 Q1090 A1091 L1115 M1122	I1060-A1087 HydrophobicContact CD1-CB 3.74Å; A1087-Q1090 PolarHBondContact O-N 3.02Å; A1087-A1091 PolarHBondContact O-N 3.21Å; A1087-L1115 HydrophobicContact CB-CD1 4.12Å; A1087-L1115 HydrophobicContact CB-CD2 3.76Å; A1087-M1122 HydrophobicContact CB-SD 4.16Å
1088	V	89.7	Confident	82.8	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	28%	0.282	C	S	.	.	H	α-helix	trans	-64.8	-45.4	176.4	169.3	0	0	0	0	110.9	S1086 Q1090 A1091 M1092 L1115 M1122 I1123 A1134	S1086-V1088 VanDerWaalsContact C-N 3.33Å; S1086-V1088 PolarHBondContact O-N 2.82Å; V1088-Q1090 VanDerWaalsContact C-N 3.28Å; V1088-Q1090 PolarHBondContact O-N 2.84Å; V1088-A1091 WeakPolarHBondContact O-CB 3.49Å; V1088-A1091 PolarHBondContact O-N 2.86Å; V1088-M1092 WeakPolarHBondContact O-CG 3.28Å; V1088-M1092 PolarHBondContact O-N 3.29Å; V1088-L1115 HydrophobicContact CG2-CB 4.18Å; V1088-L1115 HydrophobicContact CG2-CD1 3.99Å; V1088-M1122 HydrophobicContact CB-CG 4.33Å; V1088-M1122 HydrophobicContact CG2-CB 4.45Å; V1088-M1122 HydrophobicContact CG2-CE 4.07Å; V1088-M1122 HydrophobicContact CG2-CG 3.7Å; V1088-M1122 HydrophobicContact CG2-SD 3.9Å; V1088-I1123 HydrophobicContact CG1-CD1 4.34Å; V1088-A1134 HydrophobicContact CG1-CB 3.91Å
1089	H	91.3	Very high	81.8	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.019	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-38	177.4	-68.5	120.6	0	0	0	112.6	R1085 S1086 M1092 L1093 D1125 N1132	R1085-H1089 HydrophobicContact CB-CB 4.06Å; R1085-H1089 HydrophobicContact CG-CB 4.43Å; S1086-H1089 PolarHBondContact O-N 3.15Å; S1086-H1089 VanDerWaalsContact O-N 3.16Å; S1086-H1089 PolarHBondContact OG-ND1 3.48Å; H1089-M1092 PolarHBondContact O-N 3.4Å; H1089-L1093 WeakPolarHBondContact O-CG 3.35Å; H1089-L1093 PolarHBondContact O-N 3.42Å; H1089-D1125 VanDerWaalsContact CE1-CB 3.5Å; H1089-D1125 WeakPolarHBondContact CE1-CB 3.44Å; H1089-N1132 PolarHBondContact NE2-O 3.26Å
1090	Q	90.3	Very high	80.7	Confident	22 Å²	22	50.7 Å²	50.7	10%	0.103	27%	0.272	C	S	.	.	H	α-helix	trans	-73.1	-29.4	174.8	-169.5	60.8	34.1	0	0	113.7	F1057 I1060 I1061 S1086 A1087 V1088 M1092 L1093 Q1094	F1057-Q1090 HydrophobicContact CD1-CG 3.89Å; F1057-Q1090 HydrophobicContact CD2-CB 4.48Å; F1057-Q1090 HydrophobicContact CE1-CB 3.82Å; F1057-Q1090 VanDerWaalsContact CE1-CD 3.49Å; F1057-Q1090 HydrophobicContact CE1-CG 3.37Å; F1057-Q1090 HydrophobicContact CE2-CB 3.76Å; F1057-Q1090 HydrophobicContact CE2-CG 4.19Å; F1057-Q1090 HydrophobicContact CZ-CB 3.4Å; F1057-Q1090 VanDerWaalsContact CZ-CB 3.4Å; F1057-Q1090 HydrophobicContact CZ-CG 3.55Å; I1060-Q1090 HydrophobicContact CG2-CB 4.18Å; I1060-Q1090 HydrophobicContact CG2-CG 4.03Å; I1061-Q1090 HydrophobicContact CG1-CG 4.08Å; S1086-Q1090 PolarHBondContact O-N 3.28Å; S1086-Q1090 VanDerWaalsContact O-N 3.15Å; A1087-Q1090 PolarHBondContact O-N 3.02Å; V1088-Q1090 VanDerWaalsContact C-N 3.28Å; V1088-Q1090 PolarHBondContact O-N 2.84Å; Q1090-M1092 VanDerWaalsContact C-N 3.31Å; Q1090-L1093 PolarHBondContact O-N 3.48Å; Q1090-Q1094 PolarHBondContact O-NE2 2.71Å
1091	A	90.5	Very high	79.6	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.7	-35	170.8	0	0	0	0	0	111.4	I1060 A1087 V1088 L1093 Q1094 L1108 I1111 I1112 L1115	I1060-A1091 HydrophobicContact CG2-CB 4.09Å; A1087-A1091 PolarHBondContact O-N 3.21Å; V1088-A1091 WeakPolarHBondContact O-CB 3.49Å; V1088-A1091 PolarHBondContact O-N 2.86Å; A1091-L1093 VanDerWaalsContact C-N 3.28Å; A1091-L1093 PolarHBondContact O-N 3.25Å; A1091-Q1094 WeakPolarHBondContact O-CG 3.23Å; A1091-L1108 HydrophobicContact CB-CD2 4.43Å; A1091-L1108 WeakPolarHBondContact O-CD2 3.35Å; A1091-I1111 HydrophobicContact CB-CG2 3.87Å; A1091-I1112 HydrophobicContact CB-CG1 4.48Å; A1091-L1115 HydrophobicContact CB-CD1 4.4Å
1092	M	91.2	Very high	78.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-72.9	-17.3	175.9	-60.2	-50.9	-67	0	0	113.9	V1088 H1089 Q1090 I1112 A1134 A1138 G1139 A1143 L1144 L1147	V1088-M1092 WeakPolarHBondContact O-CG 3.28Å; V1088-M1092 PolarHBondContact O-N 3.29Å; H1089-M1092 PolarHBondContact O-N 3.4Å; Q1090-M1092 VanDerWaalsContact C-N 3.31Å; M1092-I1112 HydrophobicContact SD-CD1 4.03Å; M1092-A1134 HydrophobicContact CG-CB 3.9Å; M1092-A1138 HydrophobicContact CE-CB 3.5Å; M1092-A1138 WeakPolarHBondContact O-CA 3.27Å; M1092-G1139 PolarHBondContact O-N 2.88Å; M1092-A1143 HydrophobicContact CE-CB 3.9Å; M1092-A1143 WeakPolarHBondContact CE-O 3.49Å; M1092-A1143 HydrophobicContact SD-CB 4.45Å; M1092-L1144 HydrophobicContact CE-CD2 4.27Å; M1092-L1147 HydrophobicContact CE-CB 3.96Å; M1092-L1147 HydrophobicContact CE-CD2 3.53Å; M1092-L1147 HydrophobicContact CE-CG 4.36Å; M1092-L1147 HydrophobicContact SD-CB 4.19Å; M1092-L1147 HydrophobicContact SD-CD2 4.01Å
1093	L	88.6	Confident	77.9	Confident	53 Å²	53	49.9 Å²	49.9	28%	0.277	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	7.2	-178.9	-76.2	173.9	0	0	0	115.4	H1089 Q1090 A1091 D1095 I1137	H1089-L1093 WeakPolarHBondContact O-CG 3.35Å; H1089-L1093 PolarHBondContact O-N 3.42Å; Q1090-L1093 PolarHBondContact O-N 3.48Å; A1091-L1093 VanDerWaalsContact C-N 3.28Å; A1091-L1093 PolarHBondContact O-N 3.25Å; L1093-D1095 PolarHBondContact O-N 2.82Å; L1093-I1137 HydrophobicContact CD1-CG2 4.02Å; L1093-I1137 HydrophobicContact CD2-CG2 3.52Å; L1093-I1137 HydrophobicContact CG-CG2 3.53Å
1094	Q	82.6	Confident	77.7	Confident	16 Å²	16	45 Å²	45	8%	0.075	25%	0.245	C	C	.	.			trans	-62	130.8	-176.9	-66.4	-57.8	-63.5	0	0	112.5	I1060 I1061 Q1090 A1091 G1096 L1104 L1108 N1140	I1060-Q1094 VanDerWaalsContact O-CD 3.23Å; I1060-Q1094 PolarHBondContact O-NE2 3.47Å; I1060-Q1094 PolarHBondContact O-OE1 2.82Å; I1060-Q1094 VanDerWaalsContact O-OE1 3.06Å; I1061-Q1094 PolarHBondContact O-OE1 2.9Å; Q1090-Q1094 PolarHBondContact O-NE2 2.71Å; A1091-Q1094 WeakPolarHBondContact O-CG 3.23Å; Q1094-G1096 PolarHBondContact O-N 3.39Å; Q1094-L1104 HydrophobicContact CB-CD1 3.98Å; Q1094-L1108 HydrophobicContact CB-CD2 4.26Å; Q1094-L1108 HydrophobicContact CG-CD2 3.68Å; Q1094-N1140 PolarHBondContact O-ND2 2.81Å
1095	D	68.8	Low	77.3	Confident	84 Å²	84	44.5 Å²	44.5	45%	0.449	23%	0.232	S	C	.	.			trans	-76.6	117.6	178.1	173.2	22.1	0	0	0	111.5	L1093 S1097	L1093-D1095 PolarHBondContact O-N 2.82Å; D1095-S1097 VanDerWaalsContact C-N 3.28Å; D1095-S1097 PolarHBondContact O-N 3.09Å; D1095-S1097 WeakPolarHBondContact OD1-CB 3.13Å; D1095-S1097 PolarHBondContact OD1-N 2.94Å; D1095-S1097 PolarHBondContact OD1-OG 3.24Å; D1095-S1097 VanDerWaalsContact OD1-OG 3.1Å; D1095-S1097 PolarHBondContact OD2-OG 2.89Å
1096	G	61.5	Low	76.9	Confident	24 Å²	24	45.8 Å²	45.8	25%	0.247	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-71.5	-15.1	176.8	0	0	0	0	0	114.9	Q1094 K1098 V1099	Q1094-G1096 PolarHBondContact O-N 3.39Å; G1096-K1098 PolarHBondContact O-N 2.83Å; G1096-K1098 VanDerWaalsContact O-N 3.09Å; G1096-V1099 PolarHBondContact O-N 2.83Å
1097	S	62.4	Low	76.7	Confident	94 Å²	94	47.8 Å²	47.8	66%	0.657	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-62.4	-24.1	-173.2	79.2	0	0	0	0	114.3	D1095	D1095-S1097 VanDerWaalsContact C-N 3.28Å; D1095-S1097 PolarHBondContact O-N 3.09Å; D1095-S1097 WeakPolarHBondContact OD1-CB 3.13Å; D1095-S1097 PolarHBondContact OD1-N 2.94Å; D1095-S1097 PolarHBondContact OD1-OG 3.24Å; D1095-S1097 VanDerWaalsContact OD1-OG 3.1Å; D1095-S1097 PolarHBondContact OD2-OG 2.89Å
1098	K	59.3	Low	76.6	Confident	179 Å²	179	47.6 Å²	47.6	78%	0.778	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-104.3	-14.7	-173.4	-64.8	170.3	-170.4	167.6	0	114.4	G1096	G1096-K1098 PolarHBondContact O-N 2.83Å; G1096-K1098 VanDerWaalsContact O-N 3.09Å
1099	V	65.2	Low	76.3	Confident	42 Å²	42	48.7 Å²	48.7	26%	0.255	26%	0.256	S	S	.	.	S	Bend	trans	-135.2	126.9	-173.9	-177.3	0	0	0	0	108.9	G1096 E1101 V1103 L1104	G1096-V1099 PolarHBondContact O-N 2.83Å; V1099-E1101 PolarHBondContact O-N 3.1Å; V1099-V1103 HydrophobicContact CG1-CB 4.17Å; V1099-V1103 HydrophobicContact CG1-CG1 4.12Å; V1099-L1104 HydrophobicContact CB-CB 4.44Å; V1099-L1104 HydrophobicContact CG1-CB 4.13Å
1100	K	61.4	Low	76.2	Confident	117 Å²	117	52.1 Å²	52.1	51%	0.509	27%	0.274	S	S	.	.			trans	-39.1	124.2	170.5	-84.6	-163.2	162.7	-116.5	0	112.4	C1102 V1103 L1104 D1363	K1100-C1102 VanDerWaalsContact C-N 3.29Å; K1100-C1102 PolarHBondContact O-N 3Å; K1100-V1103 HydrophobicContact CB-CB 4.1Å; K1100-V1103 HydrophobicContact CB-CG2 3.91Å; K1100-V1103 CarbonylContact O-C 3.58Å; K1100-V1103 WeakPolarHBondContact O-CA 3.39Å; K1100-V1103 WeakPolarHBondContact O-CB 3.08Å; K1100-V1103 PolarHBondContact O-N 2.9Å; K1100-L1104 PolarHBondContact O-N 2.99Å; K1100-D1363 WeakPolarHBondContact CA-OD2 3.48Å; K1100-D1363 WeakPolarHBondContact CB-OD2 3.34Å; K1100-D1363 WeakPolarHBondContact CG-OD2 3.49Å; K1100-D1363 IonicContact NZ-OD1 3.92Å; K1100-D1363 PolarHBondContact NZ-OD1 3.46Å
1101	E	64.9	Low	76.2	Confident	76 Å²	76	51.1 Å²	51.1	36%	0.355	27%	0.269	S	S	.	.	H	α-helix	trans	-49.3	-45.5	-173.7	-69.7	-177.8	161.4	0	0	112.5	V1099 L1104 M1105 Q1142 E1362 D1363	V1099-E1101 PolarHBondContact O-N 3.1Å; E1101-L1104 PolarHBondContact O-N 2.82Å; E1101-M1105 WeakPolarHBondContact O-CB 3.44Å; E1101-M1105 PolarHBondContact O-N 3.24Å; E1101-Q1142 HydrophobicContact CB-CG 3.8Å; E1101-Q1142 HydrophobicContact CG-CG 4.33Å; E1101-Q1142 PolarHBondContact OE1-NE2 3.13Å; E1101-Q1142 PolarHBondContact OE2-NE2 3.26Å; E1101-E1362 WeakPolarHBondContact OE2-CG 3.37Å; E1101-D1363 PolarHBondContact N-OD2 3.39Å
1102	C	60.6	Low	76.1	Confident	26 Å²	26	51.1 Å²	51.1	18%	0.176	27%	0.269	C	S	.	.	H	α-helix	trans	-67.7	-37.3	177.5	-175.9	0	0	0	0	112.7	K1100 M1105 Q1106 D1363	K1100-C1102 VanDerWaalsContact C-N 3.29Å; K1100-C1102 PolarHBondContact O-N 3Å; C1102-M1105 PolarHBondContact O-N 3.23Å; C1102-Q1106 WeakPolarHBondContact O-CG 3.49Å; C1102-Q1106 PolarHBondContact O-N 3.24Å; C1102-Q1106 VanDerWaalsContact O-N 3.07Å; C1102-D1363 HydrophobicContact CB-CB 3.73Å
1103	V	73.6	Confident	76.1	Confident	63 Å²	63	55.9 Å²	55.9	38%	0.382	29%	0.29	S	S	.	.	H	α-helix	trans	-71.4	-36.7	176.9	179.9	0	0	0	0	110.7	V1099 K1100 K1107	V1099-V1103 HydrophobicContact CG1-CB 4.17Å; V1099-V1103 HydrophobicContact CG1-CG1 4.12Å; K1100-V1103 HydrophobicContact CB-CB 4.1Å; K1100-V1103 HydrophobicContact CB-CG2 3.91Å; K1100-V1103 CarbonylContact O-C 3.58Å; K1100-V1103 WeakPolarHBondContact O-CA 3.39Å; K1100-V1103 WeakPolarHBondContact O-CB 3.08Å; K1100-V1103 PolarHBondContact O-N 2.9Å; V1103-K1107 HydrophobicContact CG1-CD 4.22Å; V1103-K1107 WeakPolarHBondContact O-CB 3.31Å; V1103-K1107 WeakPolarHBondContact O-CD 3.5Å; V1103-K1107 VanDerWaalsContact O-CG 3.25Å; V1103-K1107 WeakPolarHBondContact O-CG 3.39Å; V1103-K1107 PolarHBondContact O-N 3.01Å; V1103-K1107 VanDerWaalsContact O-N 3.11Å
1104	L	78.7	Confident	76.2	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-62.6	-48.4	171.1	178.2	62.2	0	0	0	110.3	Q1094 V1099 K1100 E1101 Q1106 K1107 L1108	Q1094-L1104 HydrophobicContact CB-CD1 3.98Å; V1099-L1104 HydrophobicContact CB-CB 4.44Å; V1099-L1104 HydrophobicContact CG1-CB 4.13Å; K1100-L1104 PolarHBondContact O-N 2.99Å; E1101-L1104 PolarHBondContact O-N 2.82Å; L1104-Q1106 PolarHBondContact O-N 2.96Å; L1104-K1107 PolarHBondContact O-N 2.71Å; L1104-L1108 HydrophobicContact CD1-CD1 3.83Å; L1104-L1108 HydrophobicContact CD1-CD2 4.49Å; L1104-L1108 HydrophobicContact CD1-CG 3.81Å; L1104-L1108 HydrophobicContact CD2-CD1 4.34Å; L1104-L1108 HydrophobicContact CG-CD1 3.76Å; L1104-L1108 HydrophobicContact CG-CG 4.14Å; L1104-L1108 WeakPolarHBondContact O-CB 3.48Å; L1104-L1108 WeakPolarHBondContact O-CG 3.48Å; L1104-L1108 PolarHBondContact O-N 2.97Å
1105	M	75.3	Confident	76.6	Confident	30 Å²	30	53 Å²	53	15%	0.148	28%	0.276	C	S	.	.	H	α-helix	trans	-56.6	-45.9	179.5	-169.4	-153.6	-155.1	0	0	112.2	E1101 C1102 L1108 S1109 Q1142 S1145 S1146 L1359	E1101-M1105 WeakPolarHBondContact O-CB 3.44Å; E1101-M1105 PolarHBondContact O-N 3.24Å; C1102-M1105 PolarHBondContact O-N 3.23Å; M1105-L1108 PolarHBondContact O-N 3.18Å; M1105-S1109 PolarHBondContact O-N 2.79Å; M1105-S1109 PolarHBondContact O-OG 3.16Å; M1105-Q1142 HydrophobicContact CB-CB 4.29Å; M1105-S1145 VanDerWaalsContact CE-CB 3.49Å; M1105-S1146 VanDerWaalsContact CA-OG 3.26Å; M1105-S1146 WeakPolarHBondContact CA-OG 3.46Å; M1105-S1146 VanDerWaalsContact CG-OG 3.28Å; M1105-S1146 WeakPolarHBondContact CG-OG 3.34Å; M1105-S1146 PolarHBondContact O-OG 3.36Å; M1105-L1359 HydrophobicContact CE-CD2 4.36Å
1106	Q	79.3	Confident	77.5	Confident	115 Å²	115	50.4 Å²	50.4	54%	0.537	26%	0.263	S	S	.	.	H	α-helix	trans	-65.3	-39.8	177.1	-71.4	175.1	6.8	0	0	112.9	C1102 L1104 S1109 L1110	C1102-Q1106 WeakPolarHBondContact O-CG 3.49Å; C1102-Q1106 PolarHBondContact O-N 3.24Å; C1102-Q1106 VanDerWaalsContact O-N 3.07Å; L1104-Q1106 PolarHBondContact O-N 2.96Å; Q1106-S1109 PolarHBondContact O-OG 3.32Å; Q1106-S1109 VanDerWaalsContact O-OG 3.14Å; Q1106-L1110 PolarHBondContact O-N 2.85Å
1107	K	85.6	Confident	78.8	Confident	52 Å²	52	55.5 Å²	55.5	23%	0.226	28%	0.28	C	S	.	.	H	α-helix	trans	-69.3	-41.9	176.4	-73.9	170.1	160	-148.9	0	111.8	C1063 P1065 V1103 L1104 L1110 I1111	C1063-K1107 HydrophobicContact CB-CD 4.34Å; C1063-K1107 WeakPolarHBondContact O-CD 3.41Å; C1063-K1107 WeakPolarHBondContact O-CE 3.22Å; C1063-K1107 PolarHBondContact O-NZ 3.19Å; C1063-K1107 VanDerWaalsContact SG-CB 3.51Å; P1065-K1107 HydrophobicContact CG-CB 4.19Å; P1065-K1107 HydrophobicContact CG-CG 4.15Å; V1103-K1107 HydrophobicContact CG1-CD 4.22Å; V1103-K1107 WeakPolarHBondContact O-CB 3.31Å; V1103-K1107 WeakPolarHBondContact O-CD 3.5Å; V1103-K1107 VanDerWaalsContact O-CG 3.25Å; V1103-K1107 WeakPolarHBondContact O-CG 3.39Å; V1103-K1107 PolarHBondContact O-N 3.01Å; V1103-K1107 VanDerWaalsContact O-N 3.11Å; L1104-K1107 PolarHBondContact O-N 2.71Å; K1107-L1110 PolarHBondContact O-N 2.88Å; K1107-I1111 WeakPolarHBondContact O-CG1 3.35Å; K1107-I1111 PolarHBondContact O-N 2.92Å
1108	L	86.9	Confident	80	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-65.7	-43.4	178.3	-79	-178.8	0	0	0	111.9	A1091 Q1094 L1104 M1105 L1110 I1111 I1112 A1143 S1146	A1091-L1108 HydrophobicContact CB-CD2 4.43Å; A1091-L1108 WeakPolarHBondContact O-CD2 3.35Å; Q1094-L1108 HydrophobicContact CB-CD2 4.26Å; Q1094-L1108 HydrophobicContact CG-CD2 3.68Å; L1104-L1108 HydrophobicContact CD1-CD1 3.83Å; L1104-L1108 HydrophobicContact CD1-CD2 4.49Å; L1104-L1108 HydrophobicContact CD1-CG 3.81Å; L1104-L1108 HydrophobicContact CD2-CD1 4.34Å; L1104-L1108 HydrophobicContact CG-CD1 3.76Å; L1104-L1108 HydrophobicContact CG-CG 4.14Å; L1104-L1108 WeakPolarHBondContact O-CB 3.48Å; L1104-L1108 WeakPolarHBondContact O-CG 3.48Å; L1104-L1108 PolarHBondContact O-N 2.97Å; M1105-L1108 PolarHBondContact O-N 3.18Å; L1108-L1110 VanDerWaalsContact C-N 3.26Å; L1108-L1110 PolarHBondContact O-N 3.06Å; L1108-I1111 PolarHBondContact O-N 3.31Å; L1108-I1112 WeakPolarHBondContact O-CB 3.36Å; L1108-I1112 VanDerWaalsContact O-CG1 3.24Å; L1108-I1112 WeakPolarHBondContact O-CG1 3.48Å; L1108-I1112 PolarHBondContact O-N 2.83Å; L1108-A1143 HydrophobicContact CD1-CB 3.89Å; L1108-S1146 WeakPolarHBondContact CB-OG 3.43Å
1109	S	85.3	Confident	81.3	Confident	24 Å²	24	45.7 Å²	45.7	17%	0.168	24%	0.236	C	C	.	.	H	α-helix	trans	-63.9	-34.6	176.7	60.9	0	0	0	0	111.5	M1105 Q1106 K1113 V1150	M1105-S1109 PolarHBondContact O-N 2.79Å; M1105-S1109 PolarHBondContact O-OG 3.16Å; Q1106-S1109 PolarHBondContact O-OG 3.32Å; Q1106-S1109 VanDerWaalsContact O-OG 3.14Å; S1109-K1113 WeakPolarHBondContact O-CB 3.07Å; S1109-K1113 PolarHBondContact O-N 3.44Å; S1109-V1150 WeakPolarHBondContact O-CG2 3.44Å
1110	L	87.7	Confident	82.2	Confident	76 Å²	76	47.7 Å²	47.7	40%	0.398	25%	0.25	S	C	.	.	H	α-helix	trans	-72.9	-34.9	173.4	-171.9	56.9	0	0	0	113.4	P1065 Q1106 K1107 L1108 T1114	P1065-L1110 HydrophobicContact CB-CB 3.9Å; P1065-L1110 HydrophobicContact CB-CD2 3.73Å; P1065-L1110 HydrophobicContact CB-CG 3.71Å; P1065-L1110 HydrophobicContact CG-CB 4.45Å; P1065-L1110 HydrophobicContact CG-CD2 4.07Å; P1065-L1110 HydrophobicContact CG-CG 4.47Å; Q1106-L1110 PolarHBondContact O-N 2.85Å; K1107-L1110 PolarHBondContact O-N 2.88Å; L1108-L1110 VanDerWaalsContact C-N 3.26Å; L1108-L1110 PolarHBondContact O-N 3.06Å; L1110-T1114 WeakPolarHBondContact O-CB 3.33Å; L1110-T1114 PolarHBondContact O-N 3.49Å; L1110-T1114 PolarHBondContact O-OG1 3.44Å
1111	I	90.8	Very high	83.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-54.4	171.2	-71.5	168.5	0	0	0	110.2	I1060 P1065 A1091 K1107 L1108 K1113 T1114 L1115	I1060-I1111 HydrophobicContact CG1-CG2 4.38Å; P1065-I1111 HydrophobicContact CB-CG1 3.87Å; A1091-I1111 HydrophobicContact CB-CG2 3.87Å; K1107-I1111 WeakPolarHBondContact O-CG1 3.35Å; K1107-I1111 PolarHBondContact O-N 2.92Å; L1108-I1111 PolarHBondContact O-N 3.31Å; I1111-K1113 VanDerWaalsContact C-N 3.31Å; I1111-K1113 PolarHBondContact O-N 3.07Å; I1111-T1114 PolarHBondContact O-N 3.39Å; I1111-T1114 VanDerWaalsContact O-N 3.13Å; I1111-L1115 HydrophobicContact CG2-CD1 3.74Å; I1111-L1115 HydrophobicContact CG2-CG 4.29Å; I1111-L1115 WeakPolarHBondContact O-CB 3.34Å; I1111-L1115 WeakPolarHBondContact O-CG 3.41Å; I1111-L1115 PolarHBondContact O-N 2.88Å
1112	I	89.4	Confident	84.2	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.8	-44.4	-179.4	-66.2	165.4	0	0	0	110	A1091 M1092 L1108 L1115 V1116 L1147 V1150	A1091-I1112 HydrophobicContact CB-CG1 4.48Å; M1092-I1112 HydrophobicContact SD-CD1 4.03Å; L1108-I1112 WeakPolarHBondContact O-CB 3.36Å; L1108-I1112 VanDerWaalsContact O-CG1 3.24Å; L1108-I1112 WeakPolarHBondContact O-CG1 3.48Å; L1108-I1112 PolarHBondContact O-N 2.83Å; I1112-L1115 PolarHBondContact O-N 3.23Å; I1112-V1116 HydrophobicContact CG2-CG2 4.35Å; I1112-V1116 WeakPolarHBondContact O-CB 3.34Å; I1112-V1116 WeakPolarHBondContact O-CG2 3.48Å; I1112-V1116 PolarHBondContact O-N 2.88Å; I1112-L1147 HydrophobicContact CD1-CB 4.17Å; I1112-L1147 HydrophobicContact CG2-CD1 4.23Å; I1112-V1150 HydrophobicContact CB-CG2 4.5Å; I1112-V1150 HydrophobicContact CG2-CB 4.17Å; I1112-V1150 HydrophobicContact CG2-CG1 4.21Å; I1112-V1150 HydrophobicContact CG2-CG2 4.35Å
1113	K	90.3	Very high	85.4	Confident	100 Å²	100	43.6 Å²	43.6	44%	0.435	23%	0.234	S	C	.	.	H	α-helix	trans	-59	-49.2	173.5	179	170.7	174.5	171.5	0	112.3	S1109 I1111 L1115 V1116 E1117 V1150	S1109-K1113 WeakPolarHBondContact O-CB 3.07Å; S1109-K1113 PolarHBondContact O-N 3.44Å; I1111-K1113 VanDerWaalsContact C-N 3.31Å; I1111-K1113 PolarHBondContact O-N 3.07Å; K1113-L1115 VanDerWaalsContact C-N 3.26Å; K1113-L1115 PolarHBondContact O-N 2.88Å; K1113-V1116 PolarHBondContact O-N 2.72Å; K1113-E1117 WeakPolarHBondContact CE-OE1 3.17Å; K1113-E1117 HydrophobicContact CG-CG 4.24Å; K1113-E1117 IonicContact NZ-OE1 3.62Å; K1113-E1117 WeakPolarHBondContact O-CB 3.5Å; K1113-E1117 VanDerWaalsContact O-CG 3.28Å; K1113-E1117 WeakPolarHBondContact O-CG 3.48Å; K1113-E1117 PolarHBondContact O-N 2.55Å; K1113-V1150 HydrophobicContact CB-CG1 4.05Å; K1113-V1150 HydrophobicContact CB-CG2 4.21Å
1114	T	90.9	Very high	85.8	Confident	9 Å²	9	49.6 Å²	49.6	6%	0.055	25%	0.249	C	C	.	.	H	α-helix	trans	-58.9	-38.5	177.5	-57.2	0	0	0	0	111.8	T1069 I1072 L1110 I1111 A1118	T1069-T1114 HydrophobicContact CG2-CG2 4.1Å; T1069-T1114 PolarHBondContact OG1-OG1 2.96Å; I1072-T1114 HydrophobicContact CD1-CG2 4.02Å; L1110-T1114 WeakPolarHBondContact O-CB 3.33Å; L1110-T1114 PolarHBondContact O-N 3.49Å; L1110-T1114 PolarHBondContact O-OG1 3.44Å; I1111-T1114 PolarHBondContact O-N 3.39Å; I1111-T1114 VanDerWaalsContact O-N 3.13Å; T1114-A1118 WeakPolarHBondContact O-CB 3.45Å; T1114-A1118 PolarHBondContact O-N 2.84Å; T1114-A1118 VanDerWaalsContact O-N 3.16Å
1115	L	90.8	Very high	86.2	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70.5	-44.1	179.4	-71.8	175.2	0	0	0	111.9	I1060 I1072 A1087 V1088 A1091 I1111 I1112 K1113 A1118 S1119 M1122	I1060-L1115 HydrophobicContact CD1-CD1 4.43Å; I1072-L1115 HydrophobicContact CD1-CD2 4.19Å; A1087-L1115 HydrophobicContact CB-CD1 4.12Å; A1087-L1115 HydrophobicContact CB-CD2 3.76Å; V1088-L1115 HydrophobicContact CG2-CB 4.18Å; V1088-L1115 HydrophobicContact CG2-CD1 3.99Å; A1091-L1115 HydrophobicContact CB-CD1 4.4Å; I1111-L1115 HydrophobicContact CG2-CD1 3.74Å; I1111-L1115 HydrophobicContact CG2-CG 4.29Å; I1111-L1115 WeakPolarHBondContact O-CB 3.34Å; I1111-L1115 WeakPolarHBondContact O-CG 3.41Å; I1111-L1115 PolarHBondContact O-N 2.88Å; I1112-L1115 PolarHBondContact O-N 3.23Å; K1113-L1115 VanDerWaalsContact C-N 3.26Å; K1113-L1115 PolarHBondContact O-N 2.88Å; L1115-A1118 PolarHBondContact O-N 2.85Å; L1115-S1119 PolarHBondContact O-N 3.06Å; L1115-M1122 HydrophobicContact CB-CE 3.66Å; L1115-M1122 HydrophobicContact CD2-CE 3.99Å; L1115-M1122 HydrophobicContact CG-CE 4.36Å; L1115-M1122 WeakPolarHBondContact O-CE 3.41Å
1116	V	87.5	Confident	86.8	Confident	30 Å²	30	53 Å²	53	18%	0.182	28%	0.275	C	S	.	.	H	α-helix	trans	-69.2	-33.4	176.5	171.1	0	0	0	0	112	I1112 K1113 A1118 S1119 P1120 I1123	I1112-V1116 HydrophobicContact CG2-CG2 4.35Å; I1112-V1116 WeakPolarHBondContact O-CB 3.34Å; I1112-V1116 WeakPolarHBondContact O-CG2 3.48Å; I1112-V1116 PolarHBondContact O-N 2.88Å; K1113-V1116 PolarHBondContact O-N 2.72Å; V1116-A1118 VanDerWaalsContact C-N 3.29Å; V1116-A1118 PolarHBondContact O-N 3.16Å; V1116-S1119 CarbonylContact O-C 3.4Å; V1116-P1120 WeakPolarHBondContact O-CD 3.48Å; V1116-P1120 WeakPolarHBondContact O-CG 3.35Å; V1116-I1123 HydrophobicContact CG2-CD1 3.93Å; V1116-I1123 HydrophobicContact CG2-CG1 4.49Å
1117	E	88.6	Confident	87.2	Confident	131 Å²	131	48.8 Å²	48.8	61%	0.612	26%	0.255	S	S	*	.	H	α-helix	trans	-67.6	-27.3	171.5	-75.5	176.3	158.9	0	0	112.7	K1113	K1113-E1117 WeakPolarHBondContact CE-OE1 3.17Å; K1113-E1117 HydrophobicContact CG-CG 4.24Å; K1113-E1117 IonicContact NZ-OE1 3.62Å; K1113-E1117 WeakPolarHBondContact O-CB 3.5Å; K1113-E1117 VanDerWaalsContact O-CG 3.28Å; K1113-E1117 WeakPolarHBondContact O-CG 3.48Å; K1113-E1117 PolarHBondContact O-N 2.55Å
1118	A	87.6	Confident	87.3	Confident	34 Å²	34	50.2 Å²	50.2	28%	0.281	27%	0.27	S	S	.	.	H	α-helix	trans	-84.6	-37.7	175.9	0	0	0	0	0	113.1	I1072 T1114 L1115 V1116	I1072-A1118 HydrophobicContact CG2-CB 4.22Å; T1114-A1118 WeakPolarHBondContact O-CB 3.45Å; T1114-A1118 PolarHBondContact O-N 2.84Å; T1114-A1118 VanDerWaalsContact O-N 3.16Å; L1115-A1118 PolarHBondContact O-N 2.85Å; V1116-A1118 VanDerWaalsContact C-N 3.29Å; V1116-A1118 PolarHBondContact O-N 3.16Å
1119	S	86.8	Confident	87.3	Confident	32 Å²	32	58.5 Å²	58.5	22%	0.224	31%	0.309	C	S	.	.			trans	-152.3	106	172.5	-178.3	0	0	0	0	110.9	L1115 V1116 D1121 M1122	L1115-S1119 PolarHBondContact O-N 3.06Å; V1116-S1119 CarbonylContact O-C 3.4Å; S1119-D1121 VanDerWaalsContact C-N 3.29Å; S1119-D1121 PolarHBondContact O-N 2.96Å; S1119-M1122 WeakPolarHBondContact O-CB 3.36Å; S1119-M1122 PolarHBondContact O-N 2.88Å
1120	P	84.6	Confident	87.5	Confident	85 Å²	85	59.8 Å²	59.8	55%	0.552	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-62.2	-32.3	179.6	-26.4	35.4	0	0	0	114	V1116 M1122 I1123	V1116-P1120 WeakPolarHBondContact O-CD 3.48Å; V1116-P1120 WeakPolarHBondContact O-CG 3.35Å; P1120-M1122 VanDerWaalsContact C-N 3.3Å; P1120-M1122 PolarHBondContact O-N 2.8Å; P1120-I1123 VanDerWaalsContact O-CG2 3.3Å; P1120-I1123 WeakPolarHBondContact O-CG2 3.4Å; P1120-I1123 PolarHBondContact O-N 3.27Å
1121	D	84.3	Confident	87.7	Confident	92 Å²	92	56.8 Å²	56.8	49%	0.492	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-71.7	-21.5	-177.8	-74.8	-63.9	0	0	0	113.6	S1119 I1123 R1124	S1119-D1121 VanDerWaalsContact C-N 3.29Å; S1119-D1121 PolarHBondContact O-N 2.96Å; D1121-I1123 PolarHBondContact O-N 2.87Å; D1121-R1124 WeakPolarHBondContact O-CA 3.45Å; D1121-R1124 VanDerWaalsContact O-CB 3.29Å; D1121-R1124 WeakPolarHBondContact O-CB 3.25Å; D1121-R1124 PolarHBondContact O-N 3.05Å; D1121-R1124 IonicContact OD1-CZ 3.75Å; D1121-R1124 IonicContact OD1-NH1 2.7Å; D1121-R1124 PolarHBondContact OD1-NH1 3.42Å
1122	M	84.7	Confident	87.7	Confident	11 Å²	11	57.6 Å²	57.6	5%	0.054	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-60.6	-16.4	177.8	-171.4	175.9	30.8	0	0	113.1	A1087 V1088 L1115 S1119 P1120 R1124 D1125	A1087-M1122 HydrophobicContact CB-SD 4.16Å; V1088-M1122 HydrophobicContact CB-CG 4.33Å; V1088-M1122 HydrophobicContact CG2-CB 4.45Å; V1088-M1122 HydrophobicContact CG2-CE 4.07Å; V1088-M1122 HydrophobicContact CG2-CG 3.7Å; V1088-M1122 HydrophobicContact CG2-SD 3.9Å; L1115-M1122 HydrophobicContact CB-CE 3.66Å; L1115-M1122 HydrophobicContact CD2-CE 3.99Å; L1115-M1122 HydrophobicContact CG-CE 4.36Å; L1115-M1122 WeakPolarHBondContact O-CE 3.41Å; S1119-M1122 WeakPolarHBondContact O-CB 3.36Å; S1119-M1122 PolarHBondContact O-N 2.88Å; P1120-M1122 VanDerWaalsContact C-N 3.3Å; P1120-M1122 PolarHBondContact O-N 2.8Å; M1122-R1124 PolarHBondContact O-N 3.42Å; M1122-D1125 WeakPolarHBondContact CA-OD1 3.32Å; M1122-D1125 WeakPolarHBondContact CG-OD2 3.19Å; M1122-D1125 WeakPolarHBondContact O-CB 3.48Å; M1122-D1125 VanDerWaalsContact O-CG 3.26Å; M1122-D1125 PolarHBondContact O-N 3.34Å
1123	I	83.8	Confident	87.9	Confident	29 Å²	29	58.1 Å²	58.1	15%	0.149	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-70.8	-16.8	172.4	-148.2	62.3	0	0	0	113.1	V1088 V1116 P1120 D1121 L1147 L1154	V1088-I1123 HydrophobicContact CG1-CD1 4.34Å; V1116-I1123 HydrophobicContact CG2-CD1 3.93Å; V1116-I1123 HydrophobicContact CG2-CG1 4.49Å; P1120-I1123 VanDerWaalsContact O-CG2 3.3Å; P1120-I1123 WeakPolarHBondContact O-CG2 3.4Å; P1120-I1123 PolarHBondContact O-N 3.27Å; D1121-I1123 PolarHBondContact O-N 2.87Å; I1123-L1147 HydrophobicContact CD1-CD1 3.62Å; I1123-L1147 HydrophobicContact CG1-CD1 4.43Å; I1123-L1154 HydrophobicContact CG1-CD2 3.87Å
1124	R	83.4	Confident	88	Confident	189 Å²	189	53.6 Å²	53.6	71%	0.713	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-97	-1.3	178	-59.6	169.5	167.2	157.6	-7.8	112.9	D1121 M1122	D1121-R1124 WeakPolarHBondContact O-CA 3.45Å; D1121-R1124 VanDerWaalsContact O-CB 3.29Å; D1121-R1124 WeakPolarHBondContact O-CB 3.25Å; D1121-R1124 PolarHBondContact O-N 3.05Å; D1121-R1124 IonicContact OD1-CZ 3.75Å; D1121-R1124 IonicContact OD1-NH1 2.7Å; D1121-R1124 PolarHBondContact OD1-NH1 3.42Å; M1122-R1124 PolarHBondContact O-N 3.42Å
1125	D	86.1	Confident	88.1	Confident	54 Å²	54	53.4 Å²	53.4	29%	0.289	29%	0.291	S	S	.	.			trans	-53.7	146.5	174.9	-72.6	-1.1	0	0	0	111	S1086 H1089 M1122	S1086-D1125 WeakPolarHBondContact CB-OD2 3.38Å; S1086-D1125 PolarHBondContact OG-OD2 2.9Å; H1089-D1125 VanDerWaalsContact CE1-CB 3.5Å; H1089-D1125 WeakPolarHBondContact CE1-CB 3.44Å; M1122-D1125 WeakPolarHBondContact CA-OD1 3.32Å; M1122-D1125 WeakPolarHBondContact CG-OD2 3.19Å; M1122-D1125 WeakPolarHBondContact O-CB 3.48Å; M1122-D1125 VanDerWaalsContact O-CG 3.26Å; M1122-D1125 PolarHBondContact O-N 3.34Å
1126	A	87.5	Confident	88.2	Confident	50 Å²	50	53.7 Å²	53.7	41%	0.413	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-135.4	138.9	170.8	0	0	0	0	0	110.1	P1128 N1132	A1126-P1128 WeakPolarHBondContact O-CD 3.02Å; A1126-N1132 CarbonylContact C-O 3.4Å; A1126-N1132 WeakPolarHBondContact CA-O 3.49Å
1127	E	89.5	Confident	88.4	Confident	26 Å²	26	53.2 Å²	53.2	12%	0.121	29%	0.289	C	S	.	.			trans	-52.9	122.3	176.7	-99.8	-176.2	162.6	0	0	110.5	R1085 Q1129 T1130 G1131 N1132 I1137	R1085-E1127 HydrophobicContact CG-CG 4.49Å; R1085-E1127 IonicContact CZ-OE1 3.36Å; R1085-E1127 IonicContact NE-OE1 2.64Å; R1085-E1127 PolarHBondContact NE-OE1 2.83Å; R1085-E1127 IonicContact NH2-OE1 3.2Å; E1127-Q1129 PolarHBondContact O-N 3Å; E1127-T1130 WeakPolarHBondContact CB-OG1 3.24Å; E1127-T1130 PolarHBondContact O-N 3Å; E1127-T1130 PolarHBondContact OE2-OG1 3.04Å; E1127-G1131 WeakPolarHBondContact O-CA 3.41Å; E1127-G1131 PolarHBondContact O-N 2.66Å; E1127-N1132 HydrophobicContact CB-CB 4.43Å; E1127-N1132 PolarHBondContact N-O 2.96Å; E1127-N1132 PolarHBondContact OE2-ND2 3.06Å; E1127-I1137 HydrophobicContact CB-CD1 4.42Å; E1127-I1137 HydrophobicContact CG-CD1 3.58Å; E1127-I1137 WeakPolarHBondContact OE2-CD1 3.46Å
1128	P	86.6	Confident	88.5	Confident	82 Å²	82	47 Å²	47	53%	0.532	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-25.6	-171.6	-30.2	36	0	0	0	115.3	M1081 A1126 K1161	M1081-P1128 HydrophobicContact SD-CG 4.13Å; A1126-P1128 WeakPolarHBondContact O-CD 3.02Å; P1128-K1161 PolarHBondContact O-NZ 3.16Å
1129	Q	86.6	Confident	88.4	Confident	174 Å²	174	47.7 Å²	47.7	81%	0.813	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-56.4	177.2	-63.3	-177.2	3.3	0	0	111.9	E1127 K1161	E1127-Q1129 PolarHBondContact O-N 3Å; Q1129-K1161 WeakPolarHBondContact O-CD 3.43Å; Q1129-K1161 WeakPolarHBondContact O-CE 3.34Å; Q1129-K1161 PolarHBondContact O-NZ 2.7Å
1130	T	89.7	Confident	88.5	Confident	51 Å²	51	47 Å²	47	31%	0.313	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-26.1	-168.5	55.4	0	0	0	0	114.2	E1127 N1132 K1161	E1127-T1130 WeakPolarHBondContact CB-OG1 3.24Å; E1127-T1130 PolarHBondContact O-N 3Å; E1127-T1130 PolarHBondContact OE2-OG1 3.04Å; T1130-N1132 WeakPolarHBondContact CB-ND2 3.45Å; T1130-N1132 WeakPolarHBondContact OG1-CB 3.31Å; T1130-N1132 VanDerWaalsContact OG1-CG 3.28Å; T1130-N1132 PolarHBondContact OG1-N 2.89Å; T1130-N1132 VanDerWaalsContact OG1-N 3.1Å; T1130-N1132 PolarHBondContact OG1-ND2 2.69Å; T1130-K1161 WeakPolarHBondContact O-CB 3.43Å; T1130-K1161 WeakPolarHBondContact O-CG 3.44Å; T1130-K1161 PolarHBondContact O-N 3Å; T1130-K1161 VanDerWaalsContact O-N 3.07Å
1131	G	91.5	Very high	88.6	Confident	14 Å²	14	43.6 Å²	43.6	14%	0.144	24%	0.241	C	C	.	.			trans	69.3	15.3	-164	0	0	0	0	0	113.8	E1127 S1133 N1160	E1127-G1131 WeakPolarHBondContact O-CA 3.41Å; E1127-G1131 PolarHBondContact O-N 2.66Å; G1131-S1133 PolarHBondContact O-N 2.96Å; G1131-N1160 WeakPolarHBondContact O-CA 3.39Å
1132	N	92.3	Very high	88.7	Confident	16 Å²	16	39.7 Å²	39.7	9%	0.086	22%	0.219	C	C	.	.			trans	-69	124.9	175	-70.9	-26	0	0	0	109.9	H1089 A1126 E1127 T1130 H1136 I1137 N1160	H1089-N1132 PolarHBondContact NE2-O 3.26Å; A1126-N1132 CarbonylContact C-O 3.4Å; A1126-N1132 WeakPolarHBondContact CA-O 3.49Å; E1127-N1132 HydrophobicContact CB-CB 4.43Å; E1127-N1132 PolarHBondContact N-O 2.96Å; E1127-N1132 PolarHBondContact OE2-ND2 3.06Å; T1130-N1132 WeakPolarHBondContact CB-ND2 3.45Å; T1130-N1132 WeakPolarHBondContact OG1-CB 3.31Å; T1130-N1132 VanDerWaalsContact OG1-CG 3.28Å; T1130-N1132 PolarHBondContact OG1-N 2.89Å; T1130-N1132 VanDerWaalsContact OG1-N 3.1Å; T1130-N1132 PolarHBondContact OG1-ND2 2.69Å; N1132-H1136 HydrophobicContact CB-CB 3.76Å; N1132-I1137 HydrophobicContact CB-CD1 3.89Å; N1132-I1137 HydrophobicContact CB-CG1 3.66Å; N1132-N1160 WeakPolarHBondContact OD1-CB 3.44Å; N1132-N1160 PolarHBondContact OD1-ND2 3.03Å; N1132-N1160 VanDerWaalsContact OD1-ND2 3.11Å
1133	S	92.9	Very high	88.9	Confident	11 Å²	11	39.1 Å²	39.1	8%	0.077	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-86.9	175	169	68.7	0	0	0	0	112.1	G1131 L1135 H1136 I1137	G1131-S1133 PolarHBondContact O-N 2.96Å; S1133-L1135 PolarHBondContact O-N 3.18Å; S1133-H1136 PolarHBondContact N-ND1 2.64Å; S1133-H1136 WeakPolarHBondContact O-CB 3.33Å; S1133-H1136 PolarHBondContact O-N 2.78Å; S1133-H1136 PolarHBondContact OG-ND1 2.87Å; S1133-I1137 PolarHBondContact O-N 3.35Å
1134	A	91.8	Very high	89.2	Confident	6 Å²	6	37.8 Å²	37.8	5%	0.05	21%	0.21	C	C	.	.	H	α-helix	trans	-44.5	-39.9	176.4	0	0	0	0	0	114.9	V1088 M1092 A1138 L1147	V1088-A1134 HydrophobicContact CG1-CB 3.91Å; M1092-A1134 HydrophobicContact CG-CB 3.9Å; A1134-A1138 PolarHBondContact O-N 3Å; A1134-L1147 HydrophobicContact CB-CD2 4.01Å
1135	L	93.2	Very high	89.4	Confident	4 Å²	4	29.3 Å²	29.3	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-65.9	-36.7	177.7	-67.2	171.9	0	0	0	113.2	S1133 L1144 L1147 F1148 D1155 A1166 H1170 L1182	S1133-L1135 PolarHBondContact O-N 3.18Å; L1135-L1144 HydrophobicContact CD2-CD2 3.82Å; L1135-L1147 HydrophobicContact CD2-CD2 3.75Å; L1135-L1147 HydrophobicContact CG-CD2 4.28Å; L1135-F1148 HydrophobicContact CD2-CE1 4.4Å; L1135-F1148 HydrophobicContact CD2-CE2 4.07Å; L1135-F1148 HydrophobicContact CD2-CZ 3.74Å; L1135-D1155 VanDerWaalsContact CD1-O 3.26Å; L1135-D1155 WeakPolarHBondContact CD1-O 3.36Å; L1135-A1166 HydrophobicContact CB-CB 3.73Å; L1135-H1170 PolarHBondContact O-NE2 3.29Å; L1135-L1182 HydrophobicContact CD2-CD2 4.34Å
1136	H	93.7	Very high	89.5	Confident	7 Å²	7	26.8 Å²	26.8	3%	0.032	17%	0.166	C	C	.	.	H	α-helix	trans	-73.3	-32.8	-178.9	-64.3	81.6	0	0	0	112	N1132 S1133 L1158 Q1164 A1166	N1132-H1136 HydrophobicContact CB-CB 3.76Å; S1133-H1136 PolarHBondContact N-ND1 2.64Å; S1133-H1136 WeakPolarHBondContact O-CB 3.33Å; S1133-H1136 PolarHBondContact O-N 2.78Å; S1133-H1136 PolarHBondContact OG-ND1 2.87Å; H1136-L1158 PolarHBondContact CE1-O 3.36Å; H1136-L1158 PolarHBondContact NE2-O 2.74Å; H1136-Q1164 PolarHBondContact NE2-O 2.82Å; H1136-Q1164 VanDerWaalsContact NE2-O 3.15Å; H1136-A1166 PolarHBondContact NE2-N 3.48Å
1137	I	91	Very high	89.6	Confident	19 Å²	19	24.4 Å²	24.4	10%	0.097	15%	0.147	C	C	.	.	H	α-helix	trans	-87.5	-20.1	-172.6	-60.4	-159.8	0	0	0	113.2	L1093 E1127 N1132 S1133 G1139	L1093-I1137 HydrophobicContact CD1-CG2 4.02Å; L1093-I1137 HydrophobicContact CD2-CG2 3.52Å; L1093-I1137 HydrophobicContact CG-CG2 3.53Å; E1127-I1137 HydrophobicContact CB-CD1 4.42Å; E1127-I1137 HydrophobicContact CG-CD1 3.58Å; E1127-I1137 WeakPolarHBondContact OE2-CD1 3.46Å; N1132-I1137 HydrophobicContact CB-CD1 3.89Å; N1132-I1137 HydrophobicContact CB-CG1 3.66Å; S1133-I1137 PolarHBondContact O-N 3.35Å; I1137-G1139 PolarHBondContact O-N 3.27Å
1138	A	91.1	Very high	89.6	Confident	1 Å²	1	24 Å²	24	1%	0.008	14%	0.144	C	C	.	.			trans	-49.6	104.3	-171.2	0	0	0	0	0	115	M1092 A1134 N1140 A1143 L1144 H1170	M1092-A1138 HydrophobicContact CE-CB 3.5Å; M1092-A1138 WeakPolarHBondContact O-CA 3.27Å; A1134-A1138 PolarHBondContact O-N 3Å; A1138-N1140 PolarHBondContact O-N 3.4Å; A1138-N1140 VanDerWaalsContact O-N 3.16Å; A1138-A1143 HydrophobicContact CB-CB 4.47Å; A1138-L1144 HydrophobicContact CB-CD1 4.41Å; A1138-L1144 HydrophobicContact CB-CD2 3.38Å; A1138-L1144 HydrophobicContact CB-CG 3.49Å; A1138-L1144 VanDerWaalsContact CB-CG 3.49Å; A1138-H1170 PolarHBondContact O-CE1 3.05Å
1139	G	86	Confident	89.4	Confident	48 Å²	48	25.3 Å²	25.3	50%	0.495	15%	0.146	S	C	.	.			trans	-68.7	-16.5	-171.1	0	0	0	0	0	114.9	M1092 I1137	M1092-G1139 PolarHBondContact O-N 2.88Å; I1137-G1139 PolarHBondContact O-N 3.27Å
1140	N	87.6	Confident	89.3	Confident	19 Å²	19	19.2 Å²	19.2	10%	0.102	12%	0.121	C	C	.	.	S	Bend	trans	-152.4	166.3	177.4	62.4	64	0	0	0	111.8	Q1094 A1138 Q1142 A1143 L1144 C1178	Q1094-N1140 PolarHBondContact O-ND2 2.81Å; A1138-N1140 PolarHBondContact O-N 3.4Å; A1138-N1140 VanDerWaalsContact O-N 3.16Å; N1140-Q1142 VanDerWaalsContact C-N 3.27Å; N1140-Q1142 PolarHBondContact O-N 3.34Å; N1140-Q1142 WeakPolarHBondContact OD1-CA 3.44Å; N1140-Q1142 WeakPolarHBondContact OD1-CB 3.15Å; N1140-Q1142 PolarHBondContact OD1-N 3.02Å; N1140-Q1142 VanDerWaalsContact OD1-N 3.12Å; N1140-Q1142 PolarHBondContact OD1-OE1 2.82Å; N1140-A1143 PolarHBondContact O-N 2.9Å; N1140-A1143 PolarHBondContact OD1-N 3.17Å; N1140-L1144 PolarHBondContact O-N 3.2Å; N1140-C1178 PolarHBondContact O-SG 2.79Å
1141	K	87.5	Confident	89.2	Confident	13 Å²	13	18 Å²	18	6%	0.057	11%	0.114	C	C	.	.	H	α-helix	trans	-70	-23.8	-174.7	77.3	166.9	-176.6	167.8	0	113.3	S1145 C1178 V1181 D1358 E1362 D1593	K1141-S1145 WeakPolarHBondContact O-CB 3.41Å; K1141-S1145 PolarHBondContact O-N 2.85Å; K1141-S1145 PolarHBondContact O-OG 3Å; K1141-C1178 PolarHBondContact N-SG 3.37Å; K1141-V1181 HydrophobicContact CB-CG2 3.72Å; K1141-V1181 HydrophobicContact CD-CG2 4.5Å; K1141-D1358 IonicContact NZ-OD1 3.65Å; K1141-D1358 PolarHBondContact NZ-OD1 2.98Å; K1141-E1362 VanDerWaalsContact CE-CD 3.49Å; K1141-E1362 VanDerWaalsContact CE-OE1 3.28Å; K1141-E1362 WeakPolarHBondContact CE-OE1 3.48Å; K1141-E1362 WeakPolarHBondContact CE-OE2 3.43Å; K1141-E1362 VanDerWaalsContact NZ-CD 3.33Å; K1141-E1362 IonicContact NZ-OE1 3.78Å; K1141-E1362 PolarHBondContact NZ-OE1 2.93Å; K1141-E1362 IonicContact NZ-OE2 2.75Å; K1141-E1362 PolarHBondContact NZ-OE2 3.46Å; K1141-D1593 WeakPolarHBondContact CD-OD2 3.27Å; K1141-D1593 WeakPolarHBondContact CE-OD2 3.38Å; K1141-D1593 IonicContact NZ-OD1 3.54Å; K1141-D1593 PolarHBondContact NZ-OD1 3.24Å; K1141-D1593 IonicContact NZ-OD2 2.66Å; K1141-D1593 PolarHBondContact NZ-OD2 3.19Å
1142	Q	86.5	Confident	88.5	Confident	9 Å²	9	21.8 Å²	21.8	4%	0.042	14%	0.138	C	C	.	.	H	α-helix	trans	-71.5	-37.9	176.6	-64	75.8	16	0	0	110.8	E1101 M1105 N1140 S1145 S1146 E1362	E1101-Q1142 HydrophobicContact CB-CG 3.8Å; E1101-Q1142 HydrophobicContact CG-CG 4.33Å; E1101-Q1142 PolarHBondContact OE1-NE2 3.13Å; E1101-Q1142 PolarHBondContact OE2-NE2 3.26Å; M1105-Q1142 HydrophobicContact CB-CB 4.29Å; N1140-Q1142 VanDerWaalsContact C-N 3.27Å; N1140-Q1142 PolarHBondContact O-N 3.34Å; N1140-Q1142 WeakPolarHBondContact OD1-CA 3.44Å; N1140-Q1142 WeakPolarHBondContact OD1-CB 3.15Å; N1140-Q1142 PolarHBondContact OD1-N 3.02Å; N1140-Q1142 VanDerWaalsContact OD1-N 3.12Å; N1140-Q1142 PolarHBondContact OD1-OE1 2.82Å; Q1142-S1145 PolarHBondContact O-N 3.14Å; Q1142-S1146 WeakPolarHBondContact O-CB 3.29Å; Q1142-S1146 PolarHBondContact O-N 3.37Å; Q1142-S1146 PolarHBondContact O-OG 2.95Å; Q1142-S1146 VanDerWaalsContact O-OG 3.05Å; Q1142-E1362 PolarHBondContact NE2-OE2 2.88Å; Q1142-E1362 VanDerWaalsContact NE2-OE2 3.11Å
1143	A	88.7	Confident	88	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.7	-47.5	173.9	0	0	0	0	0	111.8	M1092 L1108 A1138 N1140 S1145 S1146 L1147	M1092-A1143 HydrophobicContact CE-CB 3.9Å; M1092-A1143 WeakPolarHBondContact CE-O 3.49Å; M1092-A1143 HydrophobicContact SD-CB 4.45Å; L1108-A1143 HydrophobicContact CD1-CB 3.89Å; A1138-A1143 HydrophobicContact CB-CB 4.47Å; N1140-A1143 PolarHBondContact O-N 2.9Å; N1140-A1143 PolarHBondContact OD1-N 3.17Å; A1143-S1145 PolarHBondContact O-N 2.74Å; A1143-S1146 PolarHBondContact O-N 3.31Å; A1143-L1147 WeakPolarHBondContact O-CB 3.34Å; A1143-L1147 PolarHBondContact O-N 2.73Å
1144	L	90.5	Very high	87.7	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.5	-44.3	171.8	-73.1	-178.6	0	0	0	112.2	M1092 L1135 A1138 N1140 S1146 L1147 F1148 C1178 V1181 L1182	M1092-L1144 HydrophobicContact CE-CD2 4.27Å; L1135-L1144 HydrophobicContact CD2-CD2 3.82Å; A1138-L1144 HydrophobicContact CB-CD1 4.41Å; A1138-L1144 HydrophobicContact CB-CD2 3.38Å; A1138-L1144 HydrophobicContact CB-CG 3.49Å; A1138-L1144 VanDerWaalsContact CB-CG 3.49Å; N1140-L1144 PolarHBondContact O-N 3.2Å; L1144-S1146 PolarHBondContact O-N 2.9Å; L1144-L1147 WeakPolarHBondContact O-CB 3.44Å; L1144-L1147 PolarHBondContact O-N 3.48Å; L1144-F1148 HydrophobicContact CB-CD2 4.48Å; L1144-F1148 WeakPolarHBondContact O-CD2 3.43Å; L1144-F1148 PolarHBondContact O-N 3.32Å; L1144-C1178 HydrophobicContact CD1-CB 3.6Å; L1144-V1181 HydrophobicContact CB-CB 4.32Å; L1144-V1181 HydrophobicContact CB-CG1 3.67Å; L1144-V1181 HydrophobicContact CD1-CB 4.25Å; L1144-V1181 HydrophobicContact CD1-CG1 4.32Å; L1144-L1182 HydrophobicContact CD1-CD1 4.34Å; L1144-L1182 HydrophobicContact CD1-CD2 4.15Å; L1144-L1182 HydrophobicContact CD1-CG 3.86Å; L1144-L1182 HydrophobicContact CD2-CD2 4.44Å
1145	S	87.6	Confident	87.6	Confident	12 Å²	12	33.5 Å²	33.5	8%	0.084	20%	0.199	C	C	.	.	H	α-helix	trans	-68.6	-35	-178	-59.7	0	0	0	0	112.7	M1105 K1141 Q1142 A1143 L1149 Y1184	M1105-S1145 VanDerWaalsContact CE-CB 3.49Å; K1141-S1145 WeakPolarHBondContact O-CB 3.41Å; K1141-S1145 PolarHBondContact O-N 2.85Å; K1141-S1145 PolarHBondContact O-OG 3Å; Q1142-S1145 PolarHBondContact O-N 3.14Å; A1143-S1145 PolarHBondContact O-N 2.74Å; S1145-L1149 WeakPolarHBondContact O-CB 3.4Å; S1145-L1149 PolarHBondContact O-N 3.49Å; S1145-Y1184 PolarHBondContact OG-OH 3.46Å
1146	S	87.6	Confident	87.5	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-38.8	170.1	-66.2	0	0	0	0	112.2	M1105 L1108 Q1142 A1143 L1144 L1149 V1150	M1105-S1146 VanDerWaalsContact CA-OG 3.26Å; M1105-S1146 WeakPolarHBondContact CA-OG 3.46Å; M1105-S1146 VanDerWaalsContact CG-OG 3.28Å; M1105-S1146 WeakPolarHBondContact CG-OG 3.34Å; M1105-S1146 PolarHBondContact O-OG 3.36Å; L1108-S1146 WeakPolarHBondContact CB-OG 3.43Å; Q1142-S1146 WeakPolarHBondContact O-CB 3.29Å; Q1142-S1146 PolarHBondContact O-N 3.37Å; Q1142-S1146 PolarHBondContact O-OG 2.95Å; Q1142-S1146 VanDerWaalsContact O-OG 3.05Å; A1143-S1146 PolarHBondContact O-N 3.31Å; L1144-S1146 PolarHBondContact O-N 2.9Å; S1146-L1149 PolarHBondContact O-N 3.16Å; S1146-V1150 WeakPolarHBondContact O-CG2 3.45Å; S1146-V1150 PolarHBondContact O-N 3.17Å
1147	L	90.4	Very high	87.5	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-49.9	176.9	175.3	59.8	0	0	0	111.3	M1092 I1112 I1123 A1134 L1135 A1143 L1144 L1149 V1150 C1151 L1154	M1092-L1147 HydrophobicContact CE-CB 3.96Å; M1092-L1147 HydrophobicContact CE-CD2 3.53Å; M1092-L1147 HydrophobicContact CE-CG 4.36Å; M1092-L1147 HydrophobicContact SD-CB 4.19Å; M1092-L1147 HydrophobicContact SD-CD2 4.01Å; I1112-L1147 HydrophobicContact CD1-CB 4.17Å; I1112-L1147 HydrophobicContact CG2-CD1 4.23Å; I1123-L1147 HydrophobicContact CD1-CD1 3.62Å; I1123-L1147 HydrophobicContact CG1-CD1 4.43Å; A1134-L1147 HydrophobicContact CB-CD2 4.01Å; L1135-L1147 HydrophobicContact CD2-CD2 3.75Å; L1135-L1147 HydrophobicContact CG-CD2 4.28Å; A1143-L1147 WeakPolarHBondContact O-CB 3.34Å; A1143-L1147 PolarHBondContact O-N 2.73Å; L1144-L1147 WeakPolarHBondContact O-CB 3.44Å; L1144-L1147 PolarHBondContact O-N 3.48Å; L1147-L1149 VanDerWaalsContact C-N 3.31Å; L1147-L1149 PolarHBondContact O-N 2.95Å; L1147-V1150 PolarHBondContact O-N 2.98Å; L1147-C1151 PolarHBondContact O-N 3.46Å; L1147-L1154 HydrophobicContact CD1-CD1 3.66Å; L1147-L1154 HydrophobicContact CD2-CD1 4.06Å; L1147-L1154 HydrophobicContact CG-CD1 3.51Å
1148	F	88.3	Confident	87.6	Confident	16 Å²	16	38.8 Å²	38.8	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-65.5	-29.7	175.1	-75.3	-62.9	0	0	0	113.8	L1135 L1144 C1151 S1152 L1154 V1156 V1181 L1182 N1185	L1135-F1148 HydrophobicContact CD2-CE1 4.4Å; L1135-F1148 HydrophobicContact CD2-CE2 4.07Å; L1135-F1148 HydrophobicContact CD2-CZ 3.74Å; L1144-F1148 HydrophobicContact CB-CD2 4.48Å; L1144-F1148 WeakPolarHBondContact O-CD2 3.43Å; L1144-F1148 PolarHBondContact O-N 3.32Å; F1148-C1151 CarbonylContact O-C 3.51Å; F1148-S1152 WeakPolarHBondContact O-CA 3.45Å; F1148-S1152 PolarHBondContact O-N 2.87Å; F1148-L1154 HydrophobicContact CD1-CD1 4.45Å; F1148-L1154 HydrophobicContact CE1-CB 4.35Å; F1148-V1156 HydrophobicContact CE1-CG2 3.79Å; F1148-V1156 HydrophobicContact CZ-CG1 4.27Å; F1148-V1156 HydrophobicContact CZ-CG2 3.94Å; F1148-V1181 HydrophobicContact CD2-CG1 3.98Å; F1148-V1181 HydrophobicContact CE2-CG1 4.17Å; F1148-L1182 HydrophobicContact CE2-CD2 4.09Å; F1148-L1182 HydrophobicContact CZ-CD2 4.11Å; F1148-N1185 HydrophobicContact CD1-CB 4Å; F1148-N1185 HydrophobicContact CD2-CB 4.02Å; F1148-N1185 VanDerWaalsContact CD2-ND2 3.25Å; F1148-N1185 WeakPolarHBondContact CD2-ND2 3.42Å; F1148-N1185 HydrophobicContact CE1-CB 3.78Å; F1148-N1185 HydrophobicContact CE2-CB 3.8Å; F1148-N1185 HydrophobicContact CG-CB 4.13Å; F1148-N1185 HydrophobicContact CZ-CB 3.67Å
1149	L	83.1	Confident	87.7	Confident	110 Å²	110	44.5 Å²	44.5	58%	0.576	25%	0.248	S	C	*	.	H	α-helix	trans	-69.3	-31	175.8	179.9	64.2	0	0	0	112.9	S1145 S1146 L1147	S1145-L1149 WeakPolarHBondContact O-CB 3.4Å; S1145-L1149 PolarHBondContact O-N 3.49Å; S1146-L1149 PolarHBondContact O-N 3.16Å; L1147-L1149 VanDerWaalsContact C-N 3.31Å; L1147-L1149 PolarHBondContact O-N 2.95Å
1150	V	85.4	Confident	88	Confident	46 Å²	46	42.9 Å²	42.9	28%	0.279	23%	0.228	S	C	.	.	H	α-helix	trans	-89.1	-36.6	176.1	179.2	0	0	0	0	111.3	S1109 I1112 K1113 S1146 L1147	S1109-V1150 WeakPolarHBondContact O-CG2 3.44Å; I1112-V1150 HydrophobicContact CB-CG2 4.5Å; I1112-V1150 HydrophobicContact CG2-CB 4.17Å; I1112-V1150 HydrophobicContact CG2-CG1 4.21Å; I1112-V1150 HydrophobicContact CG2-CG2 4.35Å; K1113-V1150 HydrophobicContact CB-CG1 4.05Å; K1113-V1150 HydrophobicContact CB-CG2 4.21Å; S1146-V1150 WeakPolarHBondContact O-CG2 3.45Å; S1146-V1150 PolarHBondContact O-N 3.17Å; L1147-V1150 PolarHBondContact O-N 2.98Å
1151	C	85.9	Confident	88.2	Confident	25 Å²	25	48.8 Å²	48.8	17%	0.169	25%	0.253	C	S	.	.			trans	-128	81.9	-175.6	-59.5	0	0	0	0	110.2	L1147 F1148 N1153 L1154	L1147-C1151 PolarHBondContact O-N 3.46Å; F1148-C1151 CarbonylContact O-C 3.51Å; C1151-N1153 PolarHBondContact O-N 3.05Å; C1151-L1154 HydrophobicContact CB-CD1 3.78Å; C1151-L1154 HydrophobicContact CB-CD2 4.09Å; C1151-L1154 HydrophobicContact CB-CG 3.67Å; C1151-L1154 WeakPolarHBondContact O-CD1 3.39Å; C1151-L1154 WeakPolarHBondContact O-CG 3.43Å
1152	S	78	Confident	88.2	Confident	94 Å²	94	50.6 Å²	50.6	66%	0.657	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.6	-179.1	57.3	0	0	0	0	114.5	F1148	F1148-S1152 WeakPolarHBondContact O-CA 3.45Å; F1148-S1152 PolarHBondContact O-N 2.87Å
1153	N	80.5	Confident	88.5	Confident	155 Å²	155	50.8 Å²	50.8	83%	0.829	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	29.6	-170.3	-57.5	4.2	0	0	0	112	C1151	C1151-N1153 PolarHBondContact O-N 3.05Å
1154	L	86.7	Confident	88.7	Confident	34 Å²	34	52.7 Å²	52.7	18%	0.178	28%	0.283	C	S	.	.			trans	-70.6	140.5	174.4	-72.6	167.4	0	0	0	111	I1123 L1147 F1148 C1151 V1156	I1123-L1154 HydrophobicContact CG1-CD2 3.87Å; L1147-L1154 HydrophobicContact CD1-CD1 3.66Å; L1147-L1154 HydrophobicContact CD2-CD1 4.06Å; L1147-L1154 HydrophobicContact CG-CD1 3.51Å; F1148-L1154 HydrophobicContact CD1-CD1 4.45Å; F1148-L1154 HydrophobicContact CE1-CB 4.35Å; C1151-L1154 HydrophobicContact CB-CD1 3.78Å; C1151-L1154 HydrophobicContact CB-CD2 4.09Å; C1151-L1154 HydrophobicContact CB-CG 3.67Å; C1151-L1154 WeakPolarHBondContact O-CD1 3.39Å; C1151-L1154 WeakPolarHBondContact O-CG 3.43Å; L1154-V1156 PolarHBondContact O-N 3.06Å
1155	D	89.9	Confident	89	Confident	90 Å²	90	52.7 Å²	52.7	48%	0.481	28%	0.283	S	S	.	.			trans	-70.6	114.2	166.1	-179.9	8.2	0	0	0	109.3	L1135 E1157 L1158	L1135-D1155 VanDerWaalsContact CD1-O 3.26Å; L1135-D1155 WeakPolarHBondContact CD1-O 3.36Å; D1155-E1157 PolarHBondContact OD1-N 2.87Å; D1155-L1158 HydrophobicContact CB-CD1 4.5Å; D1155-L1158 HydrophobicContact CB-CD2 4.33Å; D1155-L1158 HydrophobicContact CB-CG 3.95Å; D1155-L1158 WeakPolarHBondContact O-CD1 3.47Å; D1155-L1158 WeakPolarHBondContact O-CG 3.12Å
1156	V	91.8	Very high	89.3	Confident	16 Å²	16	52.1 Å²	52.1	10%	0.097	28%	0.279	C	S	.	.	S	Bend	trans	-85.5	-18.2	-178.5	-164.4	0	0	0	0	111.7	F1148 L1154 L1158 L1182 A1187	F1148-V1156 HydrophobicContact CE1-CG2 3.79Å; F1148-V1156 HydrophobicContact CZ-CG1 4.27Å; F1148-V1156 HydrophobicContact CZ-CG2 3.94Å; L1154-V1156 PolarHBondContact O-N 3.06Å; V1156-L1158 VanDerWaalsContact C-N 3.35Å; V1156-L1182 HydrophobicContact CG1-CD2 3.81Å; V1156-A1187 HydrophobicContact CG1-CB 3.62Å
1157	E	93.2	Very high	89.8	Confident	56 Å²	56	52.2 Å²	52.2	26%	0.262	28%	0.28	S	S	.	.			trans	-93.5	8.2	-177.6	-62.7	-60	126	0	0	113	D1155 R1159 A1187 N1188 A1191	D1155-E1157 PolarHBondContact OD1-N 2.87Å; E1157-R1159 PolarHBondContact O-N 2.87Å; E1157-A1187 WeakPolarHBondContact OE1-CA 3.44Å; E1157-N1188 PolarHBondContact OE1-N 3.35Å; E1157-A1191 WeakPolarHBondContact OE2-CB 3.48Å
1158	L	92.8	Very high	90	Very high	69 Å²	69	52.1 Å²	52.1	36%	0.361	28%	0.279	S	S	.	.			trans	-49	136.4	168.8	-73.7	175.4	0	0	0	111.1	H1136 D1155 V1156 T1165	H1136-L1158 PolarHBondContact CE1-O 3.36Å; H1136-L1158 PolarHBondContact NE2-O 2.74Å; D1155-L1158 HydrophobicContact CB-CD1 4.5Å; D1155-L1158 HydrophobicContact CB-CD2 4.33Å; D1155-L1158 HydrophobicContact CB-CG 3.95Å; D1155-L1158 WeakPolarHBondContact O-CD1 3.47Å; D1155-L1158 WeakPolarHBondContact O-CG 3.12Å; V1156-L1158 VanDerWaalsContact C-N 3.35Å; L1158-T1165 WeakPolarHBondContact O-CA 3.38Å
1159	R	93.8	Very high	90.3	Very high	121 Å²	121	52.8 Å²	52.8	46%	0.457	28%	0.283	S	S	.	.	B	Isolated β-bridge	trans	-115.1	137.8	-177.7	-68.6	171.8	-179.9	-107.8	1.8	112.1	E1157 G1163 Q1164 T1165 Q1192	E1157-R1159 PolarHBondContact O-N 2.87Å; R1159-G1163 PolarHBondContact NH1-O 2.72Å; R1159-Q1164 VanDerWaalsContact CA-O 3.28Å; R1159-Q1164 WeakPolarHBondContact CA-O 3.23Å; R1159-T1165 HydrophobicContact CG-CG2 3.85Å; R1159-Q1192 VanDerWaalsContact CZ-O 3.3Å; R1159-Q1192 PolarHBondContact NH1-O 2.62Å; R1159-Q1192 PolarHBondContact NH2-O 2.87Å
1160	N	93.3	Very high	90.9	Very high	14 Å²	14	48 Å²	48	8%	0.075	26%	0.257	C	S	.	.			trans	-76.5	-178.6	169.5	73.3	9.1	0	0	0	111.9	G1131 N1132 A1162 G1163 Q1164	G1131-N1160 WeakPolarHBondContact O-CA 3.39Å; N1132-N1160 WeakPolarHBondContact OD1-CB 3.44Å; N1132-N1160 PolarHBondContact OD1-ND2 3.03Å; N1132-N1160 VanDerWaalsContact OD1-ND2 3.11Å; N1160-A1162 PolarHBondContact O-N 3.03Å; N1160-A1162 VanDerWaalsContact O-N 3.16Å; N1160-A1162 WeakPolarHBondContact OD1-CA 3.33Å; N1160-A1162 WeakPolarHBondContact OD1-CB 3.14Å; N1160-A1162 PolarHBondContact OD1-N 2.91Å; N1160-G1163 WeakPolarHBondContact O-CA 3.28Å; N1160-G1163 PolarHBondContact O-N 3.01Å; N1160-G1163 PolarHBondContact OD1-N 3Å; N1160-Q1164 PolarHBondContact N-O 2.73Å; N1160-Q1164 PolarHBondContact OD1-N 3.41Å; N1160-Q1164 VanDerWaalsContact OD1-N 3.13Å; N1160-Q1164 PolarHBondContact OD1-O 3.39Å
1161	K	91.5	Very high	91.3	Very high	144 Å²	144	45.8 Å²	45.8	63%	0.626	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-15.9	-179.5	-65.6	-178.6	-166.6	174	0	114.6	P1128 Q1129 T1130	P1128-K1161 PolarHBondContact O-NZ 3.16Å; Q1129-K1161 WeakPolarHBondContact O-CD 3.43Å; Q1129-K1161 WeakPolarHBondContact O-CE 3.34Å; Q1129-K1161 PolarHBondContact O-NZ 2.7Å; T1130-K1161 WeakPolarHBondContact O-CB 3.43Å; T1130-K1161 WeakPolarHBondContact O-CG 3.44Å; T1130-K1161 PolarHBondContact O-N 3Å; T1130-K1161 VanDerWaalsContact O-N 3.07Å
1162	A	87.6	Confident	91.6	Very high	51 Å²	51	50.1 Å²	50.1	42%	0.421	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	2.3	171.7	0	0	0	0	0	112.4	N1160 Q1164 S1194	N1160-A1162 PolarHBondContact O-N 3.03Å; N1160-A1162 VanDerWaalsContact O-N 3.16Å; N1160-A1162 WeakPolarHBondContact OD1-CA 3.33Å; N1160-A1162 WeakPolarHBondContact OD1-CB 3.14Å; N1160-A1162 PolarHBondContact OD1-N 2.91Å; A1162-Q1164 HydrophobicContact CB-CG 4.13Å; A1162-Q1164 PolarHBondContact O-N 3.26Å; A1162-S1194 PolarHBondContact O-OG 3.06Å
1163	G	91.5	Very high	92.2	Very high	13 Å²	13	51.7 Å²	51.7	13%	0.134	26%	0.258	C	S	.	.	S	Bend	trans	72.9	8.4	-175.7	0	0	0	0	0	113.8	R1159 N1160	R1159-G1163 PolarHBondContact NH1-O 2.72Å; N1160-G1163 WeakPolarHBondContact O-CA 3.28Å; N1160-G1163 PolarHBondContact O-N 3.01Å; N1160-G1163 PolarHBondContact OD1-N 3Å
1164	Q	93.8	Very high	92.8	Very high	40 Å²	40	46 Å²	46	19%	0.187	24%	0.236	C	C	.	.			trans	-84.5	140.5	-179.5	-63.9	172	-39.9	0	0	110.2	H1136 R1159 N1160 A1162 H1168 D1193	H1136-Q1164 PolarHBondContact NE2-O 2.82Å; H1136-Q1164 VanDerWaalsContact NE2-O 3.15Å; R1159-Q1164 VanDerWaalsContact CA-O 3.28Å; R1159-Q1164 WeakPolarHBondContact CA-O 3.23Å; N1160-Q1164 PolarHBondContact N-O 2.73Å; N1160-Q1164 PolarHBondContact OD1-N 3.41Å; N1160-Q1164 VanDerWaalsContact OD1-N 3.13Å; N1160-Q1164 PolarHBondContact OD1-O 3.39Å; A1162-Q1164 HydrophobicContact CB-CG 4.13Å; A1162-Q1164 PolarHBondContact O-N 3.26Å; Q1164-H1168 HydrophobicContact CB-CB 4.09Å; Q1164-H1168 HydrophobicContact CG-CB 4.46Å; Q1164-D1193 HydrophobicContact CG-CB 4.24Å
1165	T	96.1	Very high	93	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-83.4	166.5	167	67	0	0	0	0	111	L1158 R1159 L1167 H1168 M1169	L1158-T1165 WeakPolarHBondContact O-CA 3.38Å; R1159-T1165 HydrophobicContact CG-CG2 3.85Å; T1165-L1167 PolarHBondContact O-N 3.35Å; T1165-L1167 VanDerWaalsContact O-N 3.14Å; T1165-H1168 WeakPolarHBondContact O-CB 3.42Å; T1165-H1168 PolarHBondContact O-N 3.46Å; T1165-H1168 VanDerWaalsContact O-N 3.09Å; T1165-H1168 PolarHBondContact OG1-ND1 2.96Å; T1165-M1169 PolarHBondContact O-N 3.03Å
1166	A	95.1	Very high	93.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-54.7	-33.7	176.6	0	0	0	0	0	113.1	L1135 H1136 H1168 M1169 H1170 L1182	L1135-A1166 HydrophobicContact CB-CB 3.73Å; H1136-A1166 PolarHBondContact NE2-N 3.48Å; A1166-H1168 PolarHBondContact O-N 3.13Å; A1166-M1169 PolarHBondContact O-N 3.24Å; A1166-H1170 PolarHBondContact O-CD2 3.43Å; A1166-H1170 PolarHBondContact O-N 3.01Å; A1166-L1182 HydrophobicContact CB-CD1 3.85Å; A1166-L1182 HydrophobicContact CB-CD2 4.34Å
1167	L	96.5	Very high	93.1	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-43.4	178.4	-173.2	67.6	0	0	0	111.8	T1165 M1169 H1170 V1171 T1179 L1182 L1183 A1187 S1199	T1165-L1167 PolarHBondContact O-N 3.35Å; T1165-L1167 VanDerWaalsContact O-N 3.14Å; L1167-M1169 VanDerWaalsContact C-N 3.31Å; L1167-M1169 PolarHBondContact O-N 2.92Å; L1167-H1170 PolarHBondContact O-N 3.18Å; L1167-V1171 HydrophobicContact CD1-CG2 4.39Å; L1167-V1171 HydrophobicContact CG-CG2 4.44Å; L1167-V1171 WeakPolarHBondContact O-CB 3.48Å; L1167-V1171 VanDerWaalsContact O-CG2 3.25Å; L1167-V1171 WeakPolarHBondContact O-CG2 3.5Å; L1167-V1171 PolarHBondContact O-N 3.29Å; L1167-T1179 HydrophobicContact CD1-CG2 3.95Å; L1167-L1182 HydrophobicContact CB-CD1 4.3Å; L1167-L1182 HydrophobicContact CD1-CB 3.98Å; L1167-L1182 HydrophobicContact CD1-CD1 4.38Å; L1167-L1183 HydrophobicContact CD1-CD1 4.43Å; L1167-L1183 HydrophobicContact CD1-CD2 4.14Å; L1167-L1183 HydrophobicContact CD1-CG 3.9Å; L1167-L1183 HydrophobicContact CD2-CD2 3.79Å; L1167-L1183 HydrophobicContact CD2-CG 4.46Å; L1167-A1187 HydrophobicContact CB-CB 4.39Å; L1167-A1187 HydrophobicContact CD2-CB 4.25Å; L1167-S1199 WeakPolarHBondContact CG-OG 3.12Å
1168	H	95.9	Very high	93.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60	-42.4	176.2	-67.3	86.3	0	0	0	111.6	Q1164 T1165 A1166 H1172 A1191 N1197 S1199 L1202	Q1164-H1168 HydrophobicContact CB-CB 4.09Å; Q1164-H1168 HydrophobicContact CG-CB 4.46Å; T1165-H1168 WeakPolarHBondContact O-CB 3.42Å; T1165-H1168 PolarHBondContact O-N 3.46Å; T1165-H1168 VanDerWaalsContact O-N 3.09Å; T1165-H1168 PolarHBondContact OG1-ND1 2.96Å; A1166-H1168 PolarHBondContact O-N 3.13Å; H1168-H1172 VanDerWaalsContact O-CB 3.29Å; H1168-H1172 WeakPolarHBondContact O-CB 3.31Å; H1168-H1172 PolarHBondContact O-N 2.93Å; H1168-A1191 PolarHBondContact CE1-O 3.08Å; H1168-A1191 PolarHBondContact NE2-O 3.27Å; H1168-A1191 VanDerWaalsContact NE2-O 3.07Å; H1168-N1197 PolarHBondContact NE2-O 2.9Å; H1168-S1199 PolarHBondContact NE2-N 2.76Å; H1168-L1202 HydrophobicContact CB-CD1 3.77Å
1169	M	94.3	Very high	93.2	Very high	29 Å²	29	36.9 Å²	36.9	14%	0.143	19%	0.192	C	C	.	.	H	α-helix	trans	-62.1	-51.4	177	-74.3	-70.9	-79.9	0	0	111.7	T1165 A1166 L1167 V1171 H1172 H1173	T1165-M1169 PolarHBondContact O-N 3.03Å; A1166-M1169 PolarHBondContact O-N 3.24Å; L1167-M1169 VanDerWaalsContact C-N 3.31Å; L1167-M1169 PolarHBondContact O-N 2.92Å; M1169-V1171 VanDerWaalsContact C-N 3.35Å; M1169-V1171 PolarHBondContact O-N 2.9Å; M1169-H1172 PolarHBondContact O-N 2.89Å; M1169-H1173 PolarHBondContact O-N 2.97Å; M1169-H1173 PolarHBondContact O-ND1 3.08Å
1170	H	94.9	Very high	93.2	Very high	9 Å²	9	31.2 Å²	31.2	4%	0.042	17%	0.17	C	C	.	.	H	α-helix	trans	-68.5	-33.4	-177.3	-71.6	-61	0	0	0	113.2	L1135 A1138 A1166 L1167 G1174 N1175 C1178	L1135-H1170 PolarHBondContact O-NE2 3.29Å; A1138-H1170 PolarHBondContact O-CE1 3.05Å; A1166-H1170 PolarHBondContact O-CD2 3.43Å; A1166-H1170 PolarHBondContact O-N 3.01Å; L1167-H1170 PolarHBondContact O-N 3.18Å; H1170-G1174 PolarHBondContact O-N 3.34Å; H1170-N1175 HydrophobicContact CB-CB 4.27Å; H1170-N1175 PolarHBondContact O-N 3.14Å; H1170-C1178 HydrophobicContact CB-CB 3.81Å; H1170-C1178 WeakPolarHBondContact ND1-CB 3.38Å
1171	V	95.3	Very high	93.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.7	-45.6	172.4	168.5	0	0	0	0	111.5	L1167 M1169 H1173 G1174 T1179 S1199 L1202 A1203 I1211 L1215	L1167-V1171 HydrophobicContact CD1-CG2 4.39Å; L1167-V1171 HydrophobicContact CG-CG2 4.44Å; L1167-V1171 WeakPolarHBondContact O-CB 3.48Å; L1167-V1171 VanDerWaalsContact O-CG2 3.25Å; L1167-V1171 WeakPolarHBondContact O-CG2 3.5Å; L1167-V1171 PolarHBondContact O-N 3.29Å; M1169-V1171 VanDerWaalsContact C-N 3.35Å; M1169-V1171 PolarHBondContact O-N 2.9Å; V1171-H1173 VanDerWaalsContact C-N 3.31Å; V1171-H1173 PolarHBondContact O-N 3.26Å; V1171-G1174 PolarHBondContact O-N 3.15Å; V1171-T1179 HydrophobicContact CG2-CG2 3.66Å; V1171-S1199 WeakPolarHBondContact CG1-O 3.46Å; V1171-L1202 HydrophobicContact CG1-CB 3.98Å; V1171-A1203 HydrophobicContact CG1-CB 3.94Å; V1171-I1211 HydrophobicContact CB-CG2 4.37Å; V1171-I1211 HydrophobicContact CG1-CG2 3.91Å; V1171-I1211 HydrophobicContact CG2-CG2 3.91Å; V1171-L1215 HydrophobicContact CG2-CD1 4.4Å
1172	H	92	Very high	93.3	Very high	116 Å²	116	23.7 Å²	23.7	54%	0.537	14%	0.137	S	C	.	.	H	α-helix	trans	-60.3	-39	176.9	179.9	-89.6	0	0	0	112.6	H1168 M1169 G1174	H1168-H1172 VanDerWaalsContact O-CB 3.29Å; H1168-H1172 WeakPolarHBondContact O-CB 3.31Å; H1168-H1172 PolarHBondContact O-N 2.93Å; M1169-H1172 PolarHBondContact O-N 2.89Å; H1172-G1174 PolarHBondContact O-N 3.15Å
1173	H	90.3	Very high	93.5	Very high	127 Å²	127	22 Å²	22	59%	0.588	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	2.9	176.4	-66.3	92.8	0	0	0	114	M1169 V1171 N1175	M1169-H1173 PolarHBondContact O-N 2.97Å; M1169-H1173 PolarHBondContact O-ND1 3.08Å; V1171-H1173 VanDerWaalsContact C-N 3.31Å; V1171-H1173 PolarHBondContact O-N 3.26Å; H1173-N1175 PolarHBondContact O-N 3.21Å
1174	G	92.1	Very high	93.4	Very high	35 Å²	35	22 Å²	22	36%	0.361	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	70	15.6	-179.6	0	0	0	0	0	114.8	H1170 V1171 H1172 L1176	H1170-G1174 PolarHBondContact O-N 3.34Å; V1171-G1174 PolarHBondContact O-N 3.15Å; H1172-G1174 PolarHBondContact O-N 3.15Å; G1174-L1176 PolarHBondContact O-N 2.87Å
1175	N	91.9	Very high	93.2	Very high	41 Å²	41	21.7 Å²	21.7	22%	0.219	12%	0.116	C	C	.	.			trans	-82.3	79.7	-175.6	-169.7	-16.4	0	0	0	111.1	H1170 H1173 G1177 C1178 T1179	H1170-N1175 HydrophobicContact CB-CB 4.27Å; H1170-N1175 PolarHBondContact O-N 3.14Å; H1173-N1175 PolarHBondContact O-N 3.21Å; N1175-G1177 PolarHBondContact O-N 3.48Å; N1175-G1177 PolarHBondContact OD1-N 2.79Å; N1175-C1178 HydrophobicContact CB-CB 4.33Å; N1175-C1178 PolarHBondContact ND2-SG 3.44Å; N1175-C1178 PolarHBondContact O-N 3.5Å; N1175-C1178 PolarHBondContact OD1-N 3.32Å; N1175-T1179 WeakPolarHBondContact O-CB 3.13Å; N1175-T1179 PolarHBondContact O-N 3.08Å; N1175-T1179 PolarHBondContact O-OG1 2.72Å
1176	L	93.4	Very high	92.8	Very high	24 Å²	24	24.4 Å²	24.4	13%	0.126	15%	0.145	C	C	.	.	H	α-helix	trans	-54.7	-38.7	178.7	176.7	63	0	0	0	112.3	G1174 T1179 L1180 I1211 A1214 D1593 R1594 V1597	G1174-L1176 PolarHBondContact O-N 2.87Å; L1176-T1179 WeakPolarHBondContact O-CB 3.45Å; L1176-T1179 PolarHBondContact O-N 3.04Å; L1176-L1180 HydrophobicContact CD1-CG 4.26Å; L1176-L1180 WeakPolarHBondContact O-CG 3.3Å; L1176-L1180 PolarHBondContact O-N 2.92Å; L1176-I1211 HydrophobicContact CB-CD1 4.37Å; L1176-I1211 HydrophobicContact CB-CG1 4.05Å; L1176-I1211 HydrophobicContact CD1-CG1 3.95Å; L1176-A1214 HydrophobicContact CD1-CB 3.62Å; L1176-D1593 HydrophobicContact CD2-CB 4.21Å; L1176-D1593 HydrophobicContact CG-CB 4.31Å; L1176-R1594 HydrophobicContact CD2-CB 4.25Å; L1176-V1597 HydrophobicContact CD1-CG2 4.38Å
1177	G	90.5	Very high	92.8	Very high	10 Å²	10	24.7 Å²	24.7	10%	0.103	15%	0.147	C	C	.	.	H	α-helix	trans	-60.3	-57.4	178.6	0	0	0	0	0	111.9	N1175 T1179 L1180 V1181	N1175-G1177 PolarHBondContact O-N 3.48Å; N1175-G1177 PolarHBondContact OD1-N 2.79Å; G1177-T1179 VanDerWaalsContact C-N 3.25Å; G1177-T1179 PolarHBondContact O-N 3.41Å; G1177-L1180 PolarHBondContact O-N 3.29Å; G1177-V1181 WeakPolarHBondContact O-CG2 3.49Å; G1177-V1181 PolarHBondContact O-N 3.03Å; G1177-V1181 VanDerWaalsContact O-N 3.1Å
1178	C	93.1	Very high	92.6	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.8	-34.7	176.8	-72.7	0	0	0	0	112.6	N1140 K1141 L1144 H1170 N1175 V1181 L1182	N1140-C1178 PolarHBondContact O-SG 2.79Å; K1141-C1178 PolarHBondContact N-SG 3.37Å; L1144-C1178 HydrophobicContact CD1-CB 3.6Å; H1170-C1178 HydrophobicContact CB-CB 3.81Å; H1170-C1178 WeakPolarHBondContact ND1-CB 3.38Å; N1175-C1178 HydrophobicContact CB-CB 4.33Å; N1175-C1178 PolarHBondContact ND2-SG 3.44Å; N1175-C1178 PolarHBondContact O-N 3.5Å; N1175-C1178 PolarHBondContact OD1-N 3.32Å; C1178-V1181 PolarHBondContact O-N 2.83Å; C1178-L1182 WeakPolarHBondContact O-CG 3.32Å; C1178-L1182 PolarHBondContact O-N 3.45Å
1179	T	95	Very high	92.5	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.6	-47.9	174.9	-58	0	0	0	0	111.2	L1167 V1171 N1175 L1176 G1177 L1182 L1183 I1211	L1167-T1179 HydrophobicContact CD1-CG2 3.95Å; V1171-T1179 HydrophobicContact CG2-CG2 3.66Å; N1175-T1179 WeakPolarHBondContact O-CB 3.13Å; N1175-T1179 PolarHBondContact O-N 3.08Å; N1175-T1179 PolarHBondContact O-OG1 2.72Å; L1176-T1179 WeakPolarHBondContact O-CB 3.45Å; L1176-T1179 PolarHBondContact O-N 3.04Å; G1177-T1179 VanDerWaalsContact C-N 3.25Å; G1177-T1179 PolarHBondContact O-N 3.41Å; T1179-L1182 PolarHBondContact O-N 3Å; T1179-L1183 HydrophobicContact CG2-CD1 3.87Å; T1179-L1183 WeakPolarHBondContact O-CD1 3.48Å; T1179-L1183 VanDerWaalsContact O-CG 3.26Å; T1179-L1183 WeakPolarHBondContact O-CG 3.26Å; T1179-L1183 PolarHBondContact O-N 3.28Å; T1179-L1183 VanDerWaalsContact O-N 3.11Å; T1179-I1211 HydrophobicContact CG2-CG2 4.25Å
1180	L	93.5	Very high	92.6	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-42.9	176.3	-69.2	-173.2	0	0	0	112.4	L1176 G1177 L1182 L1183 Y1184 A1214 L1218 D1593 V1597	L1176-L1180 HydrophobicContact CD1-CG 4.26Å; L1176-L1180 WeakPolarHBondContact O-CG 3.3Å; L1176-L1180 PolarHBondContact O-N 2.92Å; G1177-L1180 PolarHBondContact O-N 3.29Å; L1180-L1182 VanDerWaalsContact C-N 3.33Å; L1180-L1182 PolarHBondContact O-N 2.92Å; L1180-L1183 PolarHBondContact O-N 2.88Å; L1180-Y1184 WeakPolarHBondContact O-CD1 3.44Å; L1180-Y1184 PolarHBondContact O-N 2.99Å; L1180-A1214 HydrophobicContact CD2-CB 4.19Å; L1180-L1218 HydrophobicContact CD2-CD1 3.59Å; L1180-D1593 HydrophobicContact CD1-CB 3.61Å; L1180-V1597 HydrophobicContact CD1-CG2 4.22Å; L1180-V1597 HydrophobicContact CD2-CG2 4.09Å
1181	V	92.1	Very high	92.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.8	-41.1	179.7	179	0	0	0	0	111.7	K1141 L1144 F1148 G1177 C1178 Y1184 N1185	K1141-V1181 HydrophobicContact CB-CG2 3.72Å; K1141-V1181 HydrophobicContact CD-CG2 4.5Å; L1144-V1181 HydrophobicContact CB-CB 4.32Å; L1144-V1181 HydrophobicContact CB-CG1 3.67Å; L1144-V1181 HydrophobicContact CD1-CB 4.25Å; L1144-V1181 HydrophobicContact CD1-CG1 4.32Å; F1148-V1181 HydrophobicContact CD2-CG1 3.98Å; F1148-V1181 HydrophobicContact CE2-CG1 4.17Å; G1177-V1181 WeakPolarHBondContact O-CG2 3.49Å; G1177-V1181 PolarHBondContact O-N 3.03Å; G1177-V1181 VanDerWaalsContact O-N 3.1Å; C1178-V1181 PolarHBondContact O-N 2.83Å; V1181-Y1184 HydrophobicContact CB-CE1 4.36Å; V1181-Y1184 HydrophobicContact CG1-CE2 4.17Å; V1181-Y1184 HydrophobicContact CG2-CE1 3.99Å; V1181-N1185 WeakPolarHBondContact O-CB 3.36Å; V1181-N1185 PolarHBondContact O-N 3.37Å; V1181-N1185 VanDerWaalsContact O-N 3.1Å; V1181-N1185 PolarHBondContact O-ND2 2.93Å
1182	L	94.1	Very high	92.6	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65.8	-49	176.8	-72.4	173.7	0	0	0	111.2	L1135 L1144 F1148 V1156 A1166 L1167 C1178 T1179 L1180 Y1184 N1185 G1186 A1187	L1135-L1182 HydrophobicContact CD2-CD2 4.34Å; L1144-L1182 HydrophobicContact CD1-CD1 4.34Å; L1144-L1182 HydrophobicContact CD1-CD2 4.15Å; L1144-L1182 HydrophobicContact CD1-CG 3.86Å; L1144-L1182 HydrophobicContact CD2-CD2 4.44Å; F1148-L1182 HydrophobicContact CE2-CD2 4.09Å; F1148-L1182 HydrophobicContact CZ-CD2 4.11Å; V1156-L1182 HydrophobicContact CG1-CD2 3.81Å; A1166-L1182 HydrophobicContact CB-CD1 3.85Å; A1166-L1182 HydrophobicContact CB-CD2 4.34Å; L1167-L1182 HydrophobicContact CB-CD1 4.3Å; L1167-L1182 HydrophobicContact CD1-CB 3.98Å; L1167-L1182 HydrophobicContact CD1-CD1 4.38Å; C1178-L1182 WeakPolarHBondContact O-CG 3.32Å; C1178-L1182 PolarHBondContact O-N 3.45Å; T1179-L1182 PolarHBondContact O-N 3Å; L1180-L1182 VanDerWaalsContact C-N 3.33Å; L1180-L1182 PolarHBondContact O-N 2.92Å; L1182-Y1184 PolarHBondContact O-N 3.02Å; L1182-N1185 CarbonylContact O-C 3.59Å; L1182-N1185 PolarHBondContact O-N 3.46Å; L1182-N1185 VanDerWaalsContact O-N 3.07Å; L1182-G1186 PolarHBondContact O-N 3.01Å; L1182-G1186 VanDerWaalsContact O-N 3.14Å; L1182-A1187 VanDerWaalsContact C-CB 3.47Å; L1182-A1187 HydrophobicContact CB-CB 3.79Å; L1182-A1187 VanDerWaalsContact O-CB 3.24Å; L1182-A1187 WeakPolarHBondContact O-CB 3.46Å; L1182-A1187 PolarHBondContact O-N 2.77Å
1183	L	92.3	Very high	92.7	Very high	16 Å²	16	28 Å²	28	8%	0.084	17%	0.169	C	C	.	.	H	α-helix	trans	-60.2	-44.2	178.9	-68	166.2	0	0	0	112.1	L1167 T1179 L1180 N1185 G1186 P1189 L1215 L1218	L1167-L1183 HydrophobicContact CD1-CD1 4.43Å; L1167-L1183 HydrophobicContact CD1-CD2 4.14Å; L1167-L1183 HydrophobicContact CD1-CG 3.9Å; L1167-L1183 HydrophobicContact CD2-CD2 3.79Å; L1167-L1183 HydrophobicContact CD2-CG 4.46Å; T1179-L1183 HydrophobicContact CG2-CD1 3.87Å; T1179-L1183 WeakPolarHBondContact O-CD1 3.48Å; T1179-L1183 VanDerWaalsContact O-CG 3.26Å; T1179-L1183 WeakPolarHBondContact O-CG 3.26Å; T1179-L1183 PolarHBondContact O-N 3.28Å; T1179-L1183 VanDerWaalsContact O-N 3.11Å; L1180-L1183 PolarHBondContact O-N 2.88Å; L1183-N1185 PolarHBondContact O-N 3.48Å; L1183-G1186 PolarHBondContact O-N 2.66Å; L1183-G1186 VanDerWaalsContact O-N 3.12Å; L1183-P1189 HydrophobicContact CD2-CB 3.86Å; L1183-P1189 HydrophobicContact CD2-CG 4.34Å; L1183-L1215 HydrophobicContact CD1-CD2 3.89Å; L1183-L1215 HydrophobicContact CD2-CD2 4.28Å; L1183-L1218 HydrophobicContact CB-CD1 3.93Å; L1183-L1218 HydrophobicContact CD1-CB 4.43Å; L1183-L1218 HydrophobicContact CD1-CD1 3.51Å; L1183-L1218 HydrophobicContact CG-CD1 4.33Å
1184	Y	89.7	Confident	92.8	Very high	13 Å²	13	25.6 Å²	25.6	5%	0.051	17%	0.166	C	C	.	.	H	α-helix	trans	-75	-10.3	177.5	77.2	-131	0	0	0	114	S1145 L1180 V1181 L1182 V1351 L1354 R1355 D1358	S1145-Y1184 PolarHBondContact OG-OH 3.46Å; L1180-Y1184 WeakPolarHBondContact O-CD1 3.44Å; L1180-Y1184 PolarHBondContact O-N 2.99Å; V1181-Y1184 HydrophobicContact CB-CE1 4.36Å; V1181-Y1184 HydrophobicContact CG1-CE2 4.17Å; V1181-Y1184 HydrophobicContact CG2-CE1 3.99Å; L1182-Y1184 PolarHBondContact O-N 3.02Å; Y1184-V1351 WeakPolarHBondContact O-CG1 3.25Å; Y1184-L1354 HydrophobicContact CD1-CB 3.93Å; Y1184-L1354 HydrophobicContact CG-CB 4.47Å; Y1184-R1355 HydrophobicContact CD2-CG 3.48Å; Y1184-R1355 VanDerWaalsContact CD2-CG 3.48Å; Y1184-R1355 HydrophobicContact CE2-CG 3.66Å; Y1184-R1355 HydrophobicContact CG-CG 4.11Å; Y1184-R1355 PolarHBondContact O-NE 3.14Å; Y1184-R1355 PolarHBondContact O-NH2 2.76Å; Y1184-D1358 WeakPolarHBondContact CE1-OD2 3.35Å
1185	N	88.8	Confident	92.8	Very high	32 Å²	32	28.3 Å²	28.3	17%	0.171	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	8.1	168.2	-73	-64.5	0	0	0	113.9	F1148 V1181 L1182 L1183 R1355	F1148-N1185 HydrophobicContact CD1-CB 4Å; F1148-N1185 HydrophobicContact CD2-CB 4.02Å; F1148-N1185 VanDerWaalsContact CD2-ND2 3.25Å; F1148-N1185 WeakPolarHBondContact CD2-ND2 3.42Å; F1148-N1185 HydrophobicContact CE1-CB 3.78Å; F1148-N1185 HydrophobicContact CE2-CB 3.8Å; F1148-N1185 HydrophobicContact CG-CB 4.13Å; F1148-N1185 HydrophobicContact CZ-CB 3.67Å; V1181-N1185 WeakPolarHBondContact O-CB 3.36Å; V1181-N1185 PolarHBondContact O-N 3.37Å; V1181-N1185 VanDerWaalsContact O-N 3.1Å; V1181-N1185 PolarHBondContact O-ND2 2.93Å; L1182-N1185 CarbonylContact O-C 3.59Å; L1182-N1185 PolarHBondContact O-N 3.46Å; L1182-N1185 VanDerWaalsContact O-N 3.07Å; L1183-N1185 PolarHBondContact O-N 3.48Å; N1185-R1355 PolarHBondContact OD1-NH2 3.5Å; N1185-R1355 VanDerWaalsContact OD1-NH2 3.09Å
1186	G	89.1	Confident	92.8	Very high	58 Å²	58	26.4 Å²	26.4	60%	0.598	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	98.8	11.2	170.1	0	0	0	0	0	115.4	L1182 L1183 N1188	L1182-G1186 PolarHBondContact O-N 3.01Å; L1182-G1186 VanDerWaalsContact O-N 3.14Å; L1183-G1186 PolarHBondContact O-N 2.66Å; L1183-G1186 VanDerWaalsContact O-N 3.12Å; G1186-N1188 PolarHBondContact O-N 2.9Å
1187	A	93.5	Very high	92.9	Very high	5 Å²	5	26.6 Å²	26.6	4%	0.041	16%	0.164	C	C	.	.			trans	-57.2	132.7	168.8	0	0	0	0	0	110.4	V1156 E1157 L1167 L1182 P1189	V1156-A1187 HydrophobicContact CG1-CB 3.62Å; E1157-A1187 WeakPolarHBondContact OE1-CA 3.44Å; L1167-A1187 HydrophobicContact CB-CB 4.39Å; L1167-A1187 HydrophobicContact CD2-CB 4.25Å; L1182-A1187 VanDerWaalsContact C-CB 3.47Å; L1182-A1187 HydrophobicContact CB-CB 3.79Å; L1182-A1187 VanDerWaalsContact O-CB 3.24Å; L1182-A1187 WeakPolarHBondContact O-CB 3.46Å; L1182-A1187 PolarHBondContact O-N 2.77Å; A1187-P1189 WeakPolarHBondContact O-CD 3.5Å
1188	N	93.7	Very high	93.2	Very high	72 Å²	72	26.1 Å²	26.1	39%	0.385	16%	0.159	S	C	.	.			trans	-78.3	114.2	-179.1	-179.5	8.8	0	0	0	110.4	E1157 G1186 D1190 A1191	E1157-N1188 PolarHBondContact OE1-N 3.35Å; G1186-N1188 PolarHBondContact O-N 2.9Å; N1188-D1190 PolarHBondContact O-N 3.3Å; N1188-D1190 WeakPolarHBondContact OD1-CB 3.36Å; N1188-D1190 PolarHBondContact OD1-N 2.88Å; N1188-A1191 HydrophobicContact CB-CB 4.13Å; N1188-A1191 PolarHBondContact ND2-N 2.69Å; N1188-A1191 WeakPolarHBondContact O-CB 3.43Å; N1188-A1191 PolarHBondContact O-N 3.01Å
1189	P	94	Very high	93.3	Very high	20 Å²	20	26.1 Å²	26.1	13%	0.13	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.5	177.6	27.1	-34.8	0	0	0	113.3	L1183 A1187 L1215 A1220	L1183-P1189 HydrophobicContact CD2-CB 3.86Å; L1183-P1189 HydrophobicContact CD2-CG 4.34Å; A1187-P1189 WeakPolarHBondContact O-CD 3.5Å; P1189-L1215 HydrophobicContact CB-CD2 4.11Å; P1189-A1220 HydrophobicContact CB-CB 3.7Å; P1189-A1220 HydrophobicContact CG-CB 4.29Å
1190	D	95.5	Very high	93.4	Very high	41 Å²	41	26.1 Å²	26.1	22%	0.219	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	2.1	-176.3	-70.7	-6.2	0	0	0	112.7	N1188 Q1192 A1220 N1221 I1224	N1188-D1190 PolarHBondContact O-N 3.3Å; N1188-D1190 WeakPolarHBondContact OD1-CB 3.36Å; N1188-D1190 PolarHBondContact OD1-N 2.88Å; D1190-Q1192 PolarHBondContact O-N 2.72Å; D1190-A1220 WeakPolarHBondContact OD1-CA 2.96Å; D1190-N1221 PolarHBondContact OD1-N 3.36Å; D1190-N1221 WeakPolarHBondContact OD2-CB 3.48Å; D1190-N1221 PolarHBondContact OD2-N 3.49Å; D1190-I1224 HydrophobicContact CB-CD1 3.43Å; D1190-I1224 VanDerWaalsContact CB-CD1 3.43Å
1191	A	95.2	Very high	93.5	Very high	6 Å²	6	26 Å²	26	5%	0.05	16%	0.158	C	C	.	.			trans	-58.2	135.4	168.3	0	0	0	0	0	109.9	E1157 H1168 N1188 T1198	E1157-A1191 WeakPolarHBondContact OE2-CB 3.48Å; H1168-A1191 PolarHBondContact CE1-O 3.08Å; H1168-A1191 PolarHBondContact NE2-O 3.27Å; H1168-A1191 VanDerWaalsContact NE2-O 3.07Å; N1188-A1191 HydrophobicContact CB-CB 4.13Å; N1188-A1191 PolarHBondContact ND2-N 2.69Å; N1188-A1191 WeakPolarHBondContact O-CB 3.43Å; N1188-A1191 PolarHBondContact O-N 3.01Å; A1191-T1198 WeakPolarHBondContact O-CA 3.41Å
1192	Q	94.5	Very high	93.6	Very high	75 Å²	75	27 Å²	27	35%	0.35	16%	0.163	S	C	.	.	B	Isolated β-bridge	trans	-102.2	140.7	180	-64.8	-179	-80.2	0	0	111.4	R1159 D1190 G1196 N1197 T1198 I1224 L1225	R1159-Q1192 VanDerWaalsContact CZ-O 3.3Å; R1159-Q1192 PolarHBondContact NH1-O 2.62Å; R1159-Q1192 PolarHBondContact NH2-O 2.87Å; D1190-Q1192 PolarHBondContact O-N 2.72Å; Q1192-G1196 WeakPolarHBondContact CG-O 3.43Å; Q1192-G1196 PolarHBondContact NE2-O 3.48Å; Q1192-N1197 WeakPolarHBondContact CA-O 3.39Å; Q1192-T1198 HydrophobicContact CG-CG2 3.8Å; Q1192-I1224 HydrophobicContact CG-CG2 4.36Å; Q1192-L1225 PolarHBondContact NE2-O 3.44Å
1193	D	93.7	Very high	93.7	Very high	11 Å²	11	27 Å²	27	6%	0.059	16%	0.163	C	C	.	.			trans	-74.9	-177.1	168.7	82.4	-13.6	0	0	0	112.6	Q1164 N1195 G1196 N1197	Q1164-D1193 HydrophobicContact CG-CB 4.24Å; D1193-N1195 PolarHBondContact O-N 3.04Å; D1193-N1195 VanDerWaalsContact O-N 3.09Å; D1193-N1195 VanDerWaalsContact OD1-CA 3.27Å; D1193-N1195 WeakPolarHBondContact OD1-CA 3.41Å; D1193-N1195 VanDerWaalsContact OD1-CB 3.28Å; D1193-N1195 WeakPolarHBondContact OD1-CB 3.39Å; D1193-N1195 PolarHBondContact OD1-N 3.47Å; D1193-N1195 PolarHBondContact OD2-ND2 2.77Å; D1193-G1196 PolarHBondContact O-N 3.08Å; D1193-G1196 PolarHBondContact OD1-N 3.39Å; D1193-G1196 VanDerWaalsContact OD1-N 3.14Å; D1193-N1197 PolarHBondContact N-O 3.46Å; D1193-N1197 WeakPolarHBondContact OD1-CB 3.19Å; D1193-N1197 PolarHBondContact OD1-N 3.29Å
1194	S	93	Very high	93.8	Very high	76 Å²	76	26.2 Å²	26.2	53%	0.531	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-13.7	176.8	-61.6	0	0	0	0	114.9	A1162 N1227	A1162-S1194 PolarHBondContact O-OG 3.06Å; S1194-N1227 PolarHBondContact O-ND2 2.74Å
1195	N	92	Very high	93.9	Very high	92 Å²	92	28.6 Å²	28.6	49%	0.492	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	3.5	175.9	-50.6	-75.4	0	0	0	112.2	D1193 N1197 N1227	D1193-N1195 PolarHBondContact O-N 3.04Å; D1193-N1195 VanDerWaalsContact O-N 3.09Å; D1193-N1195 VanDerWaalsContact OD1-CA 3.27Å; D1193-N1195 WeakPolarHBondContact OD1-CA 3.41Å; D1193-N1195 VanDerWaalsContact OD1-CB 3.28Å; D1193-N1195 WeakPolarHBondContact OD1-CB 3.39Å; D1193-N1195 PolarHBondContact OD1-N 3.47Å; D1193-N1195 PolarHBondContact OD2-ND2 2.77Å; N1195-N1197 WeakPolarHBondContact CB-ND2 3.3Å; N1195-N1197 PolarHBondContact O-N 3.26Å; N1195-N1227 VanDerWaalsContact O-CB 3.22Å; N1195-N1227 WeakPolarHBondContact O-CB 3.17Å; N1195-N1227 VanDerWaalsContact O-CG 3.25Å; N1195-N1227 PolarHBondContact O-N 3.43Å
1196	G	93.1	Very high	94	Very high	2 Å²	2	29.6 Å²	29.6	2%	0.021	19%	0.187	C	C	.	.	S	Bend	trans	76.2	0.9	-172.4	0	0	0	0	0	113.7	Q1192 D1193 T1198 N1226 N1227	Q1192-G1196 WeakPolarHBondContact CG-O 3.43Å; Q1192-G1196 PolarHBondContact NE2-O 3.48Å; D1193-G1196 PolarHBondContact O-N 3.08Å; D1193-G1196 PolarHBondContact OD1-N 3.39Å; D1193-G1196 VanDerWaalsContact OD1-N 3.14Å; G1196-T1198 PolarHBondContact O-N 2.91Å; G1196-N1226 VanDerWaalsContact O-CA 3.29Å; G1196-N1226 WeakPolarHBondContact O-CA 3.24Å; G1196-N1226 WeakPolarHBondContact O-CB 3.35Å; G1196-N1227 WeakPolarHBondContact CA-OD1 3.44Å; G1196-N1227 PolarHBondContact N-ND2 3.26Å
1197	N	95	Very high	94.1	Very high	27 Å²	27	30.1 Å²	30.1	14%	0.144	18%	0.176	C	C	.	.			trans	-73	126	-179.2	-66.3	-43.6	0	0	0	109.2	H1168 Q1192 D1193 N1195 H1201 L1202 N1226	H1168-N1197 PolarHBondContact NE2-O 2.9Å; Q1192-N1197 WeakPolarHBondContact CA-O 3.39Å; D1193-N1197 PolarHBondContact N-O 3.46Å; D1193-N1197 WeakPolarHBondContact OD1-CB 3.19Å; D1193-N1197 PolarHBondContact OD1-N 3.29Å; N1195-N1197 WeakPolarHBondContact CB-ND2 3.3Å; N1195-N1197 PolarHBondContact O-N 3.26Å; N1197-H1201 HydrophobicContact CB-CB 3.88Å; N1197-L1202 HydrophobicContact CB-CD2 4.38Å; N1197-N1226 WeakPolarHBondContact OD1-CB 3.26Å; N1197-N1226 PolarHBondContact OD1-ND2 3.47Å
1198	T	96.3	Very high	94.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	-78	168.3	164.7	69.2	0	0	0	0	111	A1191 Q1192 G1196 L1200 H1201 L1202 I1224	A1191-T1198 WeakPolarHBondContact O-CA 3.41Å; Q1192-T1198 HydrophobicContact CG-CG2 3.8Å; G1196-T1198 PolarHBondContact O-N 2.91Å; T1198-L1200 PolarHBondContact O-N 2.81Å; T1198-L1200 VanDerWaalsContact O-N 3.13Å; T1198-L1200 PolarHBondContact OG1-N 3.37Å; T1198-H1201 PolarHBondContact N-ND1 2.89Å; T1198-H1201 VanDerWaalsContact N-ND1 3.15Å; T1198-H1201 WeakPolarHBondContact O-CB 3.17Å; T1198-H1201 PolarHBondContact O-N 3.12Å; T1198-H1201 PolarHBondContact OG1-ND1 3.17Å; T1198-L1202 PolarHBondContact O-N 2.73Å; T1198-I1224 HydrophobicContact CG2-CB 4.12Å; T1198-I1224 HydrophobicContact CG2-CD1 4.07Å; T1198-I1224 HydrophobicContact CG2-CG2 3.68Å
1199	S	96.2	Very high	94.1	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.7	-31.4	174.2	-72.7	0	0	0	0	113	L1167 H1168 V1171 H1201 L1202 A1203	L1167-S1199 WeakPolarHBondContact CG-OG 3.12Å; H1168-S1199 PolarHBondContact NE2-N 2.76Å; V1171-S1199 WeakPolarHBondContact CG1-O 3.46Å; S1199-H1201 PolarHBondContact O-N 3.12Å; S1199-L1202 PolarHBondContact O-N 3.08Å; S1199-A1203 PolarHBondContact O-N 2.57Å
1200	L	96.4	Very high	94	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68.6	-30.6	174.9	-175.3	58.3	0	0	0	113.2	T1198 A1203 V1204 A1212 L1215 L1216 A1220 P1222 P1232 L1250	T1198-L1200 PolarHBondContact O-N 2.81Å; T1198-L1200 VanDerWaalsContact O-N 3.13Å; T1198-L1200 PolarHBondContact OG1-N 3.37Å; L1200-A1203 PolarHBondContact O-N 3.15Å; L1200-V1204 WeakPolarHBondContact O-CG2 3.31Å; L1200-V1204 PolarHBondContact O-N 3.31Å; L1200-V1204 VanDerWaalsContact O-N 3.09Å; L1200-A1212 HydrophobicContact CD1-CB 4.2Å; L1200-L1215 HydrophobicContact CB-CD1 4.32Å; L1200-L1215 HydrophobicContact CD1-CB 4.28Å; L1200-L1215 HydrophobicContact CD1-CD1 4.35Å; L1200-L1216 HydrophobicContact CD1-CG 4.35Å; L1200-L1216 HydrophobicContact CD2-CD2 3.77Å; L1200-L1216 HydrophobicContact CD2-CG 4.42Å; L1200-A1220 HydrophobicContact CB-CB 4.5Å; L1200-A1220 HydrophobicContact CD2-CB 4.3Å; L1200-P1222 HydrophobicContact CD2-CB 3.95Å; L1200-P1232 HydrophobicContact CB-CG 4.37Å; L1200-P1232 HydrophobicContact CD2-CB 4.36Å; L1200-P1232 HydrophobicContact CD2-CG 4.1Å; L1200-P1232 HydrophobicContact CG-CB 4.08Å; L1200-P1232 HydrophobicContact CG-CG 3.99Å; L1200-L1250 HydrophobicContact CD1-CD2 4.32Å; L1200-L1250 HydrophobicContact CD2-CD2 4.04Å; L1200-L1250 HydrophobicContact CG-CD2 4.31Å
1201	H	95.2	Very high	94	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.7	-39.3	172.3	-66.2	75.2	0	0	0	111.3	N1197 T1198 S1199 S1205 I1224 D1230 P1232 L1235	N1197-H1201 HydrophobicContact CB-CB 3.88Å; T1198-H1201 PolarHBondContact N-ND1 2.89Å; T1198-H1201 VanDerWaalsContact N-ND1 3.15Å; T1198-H1201 WeakPolarHBondContact O-CB 3.17Å; T1198-H1201 PolarHBondContact O-N 3.12Å; T1198-H1201 PolarHBondContact OG1-ND1 3.17Å; S1199-H1201 PolarHBondContact O-N 3.12Å; H1201-S1205 WeakPolarHBondContact O-CB 3.43Å; H1201-S1205 PolarHBondContact O-N 2.66Å; H1201-S1205 PolarHBondContact O-OG 3.1Å; H1201-I1224 PolarHBondContact CE1-O 3.12Å; H1201-D1230 PolarHBondContact NE2-O 3.44Å; H1201-D1230 VanDerWaalsContact NE2-O 3.08Å; H1201-P1232 WeakPolarHBondContact NE2-CD 3.36Å; H1201-L1235 HydrophobicContact CB-CD1 3.92Å
1202	L	95	Very high	94.1	Very high	20 Å²	20	27.9 Å²	27.9	11%	0.105	16%	0.163	C	C	.	.	H	α-helix	trans	-69.3	-40.7	177	-59.7	-174	0	0	0	111.8	H1168 V1171 N1197 T1198 S1199 V1204 S1205 S1206	H1168-L1202 HydrophobicContact CB-CD1 3.77Å; V1171-L1202 HydrophobicContact CG1-CB 3.98Å; N1197-L1202 HydrophobicContact CB-CD2 4.38Å; T1198-L1202 PolarHBondContact O-N 2.73Å; S1199-L1202 PolarHBondContact O-N 3.08Å; L1202-V1204 VanDerWaalsContact C-N 3.34Å; L1202-V1204 PolarHBondContact O-N 3.01Å; L1202-S1205 PolarHBondContact O-N 3.45Å; L1202-S1206 WeakPolarHBondContact O-CB 3.36Å; L1202-S1206 PolarHBondContact O-N 2.77Å; L1202-S1206 PolarHBondContact O-OG 3.42Å
1203	A	95.6	Very high	94.1	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.3	-40.3	175.3	0	0	0	0	0	112.6	V1171 S1199 L1200 S1206 L1207 N1208 I1211 A1212 L1215	V1171-A1203 HydrophobicContact CG1-CB 3.94Å; S1199-A1203 PolarHBondContact O-N 2.57Å; L1200-A1203 PolarHBondContact O-N 3.15Å; A1203-S1206 PolarHBondContact O-OG 3.15Å; A1203-L1207 PolarHBondContact O-N 2.84Å; A1203-N1208 PolarHBondContact O-N 3.39Å; A1203-I1211 HydrophobicContact CB-CB 4.46Å; A1203-I1211 HydrophobicContact CB-CG2 3.93Å; A1203-A1212 HydrophobicContact CB-CB 4.17Å; A1203-L1215 HydrophobicContact CB-CD1 3.85Å
1204	V	93.9	Very high	94.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-68.9	-44.4	174.1	171.3	0	0	0	0	111.7	L1200 L1202 S1206 L1207 P1232 L1235 A1236 L1239 L1250	L1200-V1204 WeakPolarHBondContact O-CG2 3.31Å; L1200-V1204 PolarHBondContact O-N 3.31Å; L1200-V1204 VanDerWaalsContact O-N 3.09Å; L1202-V1204 VanDerWaalsContact C-N 3.34Å; L1202-V1204 PolarHBondContact O-N 3.01Å; V1204-S1206 VanDerWaalsContact C-N 3.29Å; V1204-S1206 PolarHBondContact O-N 3.14Å; V1204-L1207 PolarHBondContact O-N 2.84Å; V1204-P1232 HydrophobicContact CG2-CB 4.14Å; V1204-L1235 HydrophobicContact CG1-CB 3.9Å; V1204-A1236 HydrophobicContact CG1-CB 3.86Å; V1204-L1239 HydrophobicContact CG1-CD1 4.14Å; V1204-L1239 WeakPolarHBondContact O-CD1 3.12Å; V1204-L1250 HydrophobicContact CG2-CD1 3.95Å; V1204-L1250 HydrophobicContact CG2-CD2 4.43Å
1205	S	92	Very high	94.3	Very high	63 Å²	63	20.5 Å²	20.5	44%	0.441	12%	0.12	S	C	.	.	H	α-helix	trans	-64.7	-32.3	-178.6	-57.8	0	0	0	0	113.1	H1201 L1202 L1207	H1201-S1205 WeakPolarHBondContact O-CB 3.43Å; H1201-S1205 PolarHBondContact O-N 2.66Å; H1201-S1205 PolarHBondContact O-OG 3.1Å; L1202-S1205 PolarHBondContact O-N 3.45Å; S1205-L1207 VanDerWaalsContact C-N 3.26Å; S1205-L1207 PolarHBondContact O-N 3.32Å
1206	S	91.3	Very high	94.4	Very high	53 Å²	53	16.9 Å²	16.9	37%	0.371	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	3.6	174.3	54.2	0	0	0	0	113.9	L1202 A1203 V1204 N1208	L1202-S1206 WeakPolarHBondContact O-CB 3.36Å; L1202-S1206 PolarHBondContact O-N 2.77Å; L1202-S1206 PolarHBondContact O-OG 3.42Å; A1203-S1206 PolarHBondContact O-OG 3.15Å; V1204-S1206 VanDerWaalsContact C-N 3.29Å; V1204-S1206 PolarHBondContact O-N 3.14Å; S1206-N1208 PolarHBondContact O-N 3.47Å; S1206-N1208 VanDerWaalsContact O-N 3.15Å
1207	L	92	Very high	94.4	Very high	70 Å²	70	17 Å²	17	37%	0.366	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	21.2	-172.5	-65.2	172.1	0	0	0	114.5	A1203 V1204 S1205 V1209 L1239 N1242 A1243 L1246	A1203-L1207 PolarHBondContact O-N 2.84Å; V1204-L1207 PolarHBondContact O-N 2.84Å; S1205-L1207 VanDerWaalsContact C-N 3.26Å; S1205-L1207 PolarHBondContact O-N 3.32Å; L1207-V1209 PolarHBondContact O-N 2.77Å; L1207-L1239 HydrophobicContact CD2-CB 4.34Å; L1207-L1239 HydrophobicContact CD2-CD1 3.89Å; L1207-N1242 HydrophobicContact CD1-CB 4.3Å; L1207-A1243 HydrophobicContact CD2-CB 4.02Å; L1207-L1246 HydrophobicContact CD2-CD1 3.93Å
1208	N	93.3	Very high	94.3	Very high	37 Å²	37	16.8 Å²	16.8	20%	0.198	10%	0.099	C	C	.	.			trans	-83.3	87.1	-174	-166.2	-34.4	0	0	0	111.8	A1203 S1206 D1210 I1211 A1212	A1203-N1208 PolarHBondContact O-N 3.39Å; S1206-N1208 PolarHBondContact O-N 3.47Å; S1206-N1208 VanDerWaalsContact O-N 3.15Å; N1208-D1210 VanDerWaalsContact C-N 3.33Å; N1208-D1210 PolarHBondContact O-N 2.83Å; N1208-D1210 PolarHBondContact OD1-N 3.13Å; N1208-I1211 HydrophobicContact CB-CB 4.36Å; N1208-I1211 WeakPolarHBondContact ND2-CD1 3.48Å; N1208-I1211 PolarHBondContact O-N 2.99Å; N1208-I1211 PolarHBondContact OD1-N 3.23Å; N1208-A1212 WeakPolarHBondContact O-CB 3.23Å; N1208-A1212 PolarHBondContact O-N 3.22Å
1209	V	92.9	Very high	94	Very high	29 Å²	29	18.3 Å²	18.3	18%	0.176	12%	0.115	C	C	.	.	H	α-helix	trans	-53.4	-45.9	178.4	-179.2	0	0	0	0	112.5	L1207 A1212 K1213 E1245 L1246	L1207-V1209 PolarHBondContact O-N 2.77Å; V1209-A1212 PolarHBondContact O-N 3.42Å; V1209-K1213 HydrophobicContact CG1-CD 3.98Å; V1209-K1213 VanDerWaalsContact CG1-CE 3.42Å; V1209-K1213 HydrophobicContact CG1-CG 4.39Å; V1209-K1213 WeakPolarHBondContact O-CB 3.4Å; V1209-K1213 VanDerWaalsContact O-CG 3.3Å; V1209-K1213 WeakPolarHBondContact O-CG 3.28Å; V1209-K1213 PolarHBondContact O-N 2.79Å; V1209-E1245 HydrophobicContact CG1-CG 4.13Å; V1209-E1245 WeakPolarHBondContact CG1-OE1 3.25Å; V1209-L1246 HydrophobicContact CG2-CD2 4.31Å; V1209-L1246 HydrophobicContact CG2-CG 4.12Å
1210	D	92.6	Very high	93.9	Very high	29 Å²	29	18.5 Å²	18.5	16%	0.155	12%	0.117	C	C	.	.	H	α-helix	trans	-70	-36.8	-173.2	-68.3	-32.7	0	0	0	111.9	N1208 A1214 R1594	N1208-D1210 VanDerWaalsContact C-N 3.33Å; N1208-D1210 PolarHBondContact O-N 2.83Å; N1208-D1210 PolarHBondContact OD1-N 3.13Å; D1210-A1214 WeakPolarHBondContact O-CB 3.45Å; D1210-A1214 PolarHBondContact O-N 3.02Å; D1210-R1594 IonicContact OD1-NE 3.12Å; D1210-R1594 IonicContact OD1-NH2 3.92Å; D1210-R1594 IonicContact OD2-CZ 2.7Å; D1210-R1594 IonicContact OD2-NE 2.92Å; D1210-R1594 PolarHBondContact OD2-NE 3.26Å; D1210-R1594 IonicContact OD2-NH2 2.73Å; D1210-R1594 PolarHBondContact OD2-NH2 3.25Å
1211	I	95.8	Very high	93.8	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-73.3	-37.8	172.8	-67.5	-175.3	0	0	0	111.8	V1171 L1176 T1179 A1203 N1208 K1213 A1214 L1215	V1171-I1211 HydrophobicContact CB-CG2 4.37Å; V1171-I1211 HydrophobicContact CG1-CG2 3.91Å; V1171-I1211 HydrophobicContact CG2-CG2 3.91Å; L1176-I1211 HydrophobicContact CB-CD1 4.37Å; L1176-I1211 HydrophobicContact CB-CG1 4.05Å; L1176-I1211 HydrophobicContact CD1-CG1 3.95Å; T1179-I1211 HydrophobicContact CG2-CG2 4.25Å; A1203-I1211 HydrophobicContact CB-CB 4.46Å; A1203-I1211 HydrophobicContact CB-CG2 3.93Å; N1208-I1211 HydrophobicContact CB-CB 4.36Å; N1208-I1211 WeakPolarHBondContact ND2-CD1 3.48Å; N1208-I1211 PolarHBondContact O-N 2.99Å; N1208-I1211 PolarHBondContact OD1-N 3.23Å; I1211-K1213 VanDerWaalsContact C-N 3.32Å; I1211-K1213 PolarHBondContact O-N 3.23Å; I1211-A1214 WeakPolarHBondContact O-CB 3.02Å; I1211-A1214 PolarHBondContact O-N 2.82Å; I1211-A1214 VanDerWaalsContact O-N 3.16Å; I1211-L1215 HydrophobicContact CG2-CD1 3.87Å; I1211-L1215 HydrophobicContact CG2-CG 4.29Å; I1211-L1215 WeakPolarHBondContact O-CG 3.24Å; I1211-L1215 PolarHBondContact O-N 3.31Å
1212	A	95.6	Very high	93.7	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.008	14%	0.135	C	C	.	.	H	α-helix	trans	-60.7	-42.9	174.3	0	0	0	0	0	111.4	L1200 A1203 N1208 V1209 L1216 L1246	L1200-A1212 HydrophobicContact CD1-CB 4.2Å; A1203-A1212 HydrophobicContact CB-CB 4.17Å; N1208-A1212 WeakPolarHBondContact O-CB 3.23Å; N1208-A1212 PolarHBondContact O-N 3.22Å; V1209-A1212 PolarHBondContact O-N 3.42Å; A1212-L1216 VanDerWaalsContact O-CG 3.26Å; A1212-L1216 WeakPolarHBondContact O-CG 3.43Å; A1212-L1216 PolarHBondContact O-N 3.11Å; A1212-L1216 VanDerWaalsContact O-N 3.1Å; A1212-L1246 HydrophobicContact CB-CD2 3.4Å
1213	K	95.3	Very high	93.5	Very high	7 Å²	7	23.5 Å²	23.5	3%	0.03	14%	0.144	C	C	.	.	H	α-helix	trans	-60.2	-46.9	171	-70.9	173.4	179.8	163.2	0	111.3	V1209 I1211 L1215 L1216 V1217 E1245 C1249 V1597 M1598 W1601	V1209-K1213 HydrophobicContact CG1-CD 3.98Å; V1209-K1213 VanDerWaalsContact CG1-CE 3.42Å; V1209-K1213 HydrophobicContact CG1-CG 4.39Å; V1209-K1213 WeakPolarHBondContact O-CB 3.4Å; V1209-K1213 VanDerWaalsContact O-CG 3.3Å; V1209-K1213 WeakPolarHBondContact O-CG 3.28Å; V1209-K1213 PolarHBondContact O-N 2.79Å; I1211-K1213 VanDerWaalsContact C-N 3.32Å; I1211-K1213 PolarHBondContact O-N 3.23Å; K1213-L1215 PolarHBondContact O-N 2.7Å; K1213-L1216 PolarHBondContact O-N 3.45Å; K1213-V1217 WeakPolarHBondContact O-CG1 3.21Å; K1213-V1217 WeakPolarHBondContact O-CG2 3.43Å; K1213-V1217 PolarHBondContact O-N 3.01Å; K1213-E1245 WeakPolarHBondContact CE-OE1 3.31Å; K1213-E1245 IonicContact NZ-OE1 2.7Å; K1213-E1245 PolarHBondContact NZ-OE1 3.3Å; K1213-C1249 WeakPolarHBondContact CE-SG 3.44Å; K1213-V1597 HydrophobicContact CB-CG1 3.97Å; K1213-M1598 HydrophobicContact CD-SD 3.81Å; K1213-W1601 HydrophobicContact CB-CB 4.48Å; K1213-W1601 HydrophobicContact CB-CD2 4.07Å; K1213-W1601 HydrophobicContact CB-CE3 3.87Å; K1213-W1601 HydrophobicContact CB-CG 4.28Å; K1213-W1601 HydrophobicContact CD-CB 4.35Å; K1213-W1601 HydrophobicContact CD-CD2 3.97Å; K1213-W1601 HydrophobicContact CD-CG 3.74Å; K1213-W1601 HydrophobicContact CG-CD2 3.59Å; K1213-W1601 HydrophobicContact CG-CE3 3.75Å; K1213-W1601 HydrophobicContact CG-CG 3.88Å; K1213-W1601 HydrophobicContact CG-CZ3 4.43Å
1214	A	94.7	Very high	93.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.7	-46.7	179.2	0	0	0	0	0	112.9	L1176 L1180 D1210 I1211 V1217 L1218 V1597	L1176-A1214 HydrophobicContact CD1-CB 3.62Å; L1180-A1214 HydrophobicContact CD2-CB 4.19Å; D1210-A1214 WeakPolarHBondContact O-CB 3.45Å; D1210-A1214 PolarHBondContact O-N 3.02Å; I1211-A1214 WeakPolarHBondContact O-CB 3.02Å; I1211-A1214 PolarHBondContact O-N 2.82Å; I1211-A1214 VanDerWaalsContact O-N 3.16Å; A1214-V1217 WeakPolarHBondContact O-CG2 3.43Å; A1214-L1218 WeakPolarHBondContact O-CB 3.41Å; A1214-L1218 WeakPolarHBondContact O-CD1 3.41Å; A1214-L1218 WeakPolarHBondContact O-CG 3.49Å; A1214-L1218 PolarHBondContact O-N 3.28Å; A1214-V1597 HydrophobicContact CB-CG1 3.93Å; A1214-V1597 HydrophobicContact CB-CG2 3.75Å
1215	L	95.7	Very high	93.4	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-46.4	177.3	-74.9	165.2	0	0	0	111.6	V1171 L1183 P1189 L1200 A1203 I1211 K1213 L1218 G1219 A1220	V1171-L1215 HydrophobicContact CG2-CD1 4.4Å; L1183-L1215 HydrophobicContact CD1-CD2 3.89Å; L1183-L1215 HydrophobicContact CD2-CD2 4.28Å; P1189-L1215 HydrophobicContact CB-CD2 4.11Å; L1200-L1215 HydrophobicContact CB-CD1 4.32Å; L1200-L1215 HydrophobicContact CD1-CB 4.28Å; L1200-L1215 HydrophobicContact CD1-CD1 4.35Å; A1203-L1215 HydrophobicContact CB-CD1 3.85Å; I1211-L1215 HydrophobicContact CG2-CD1 3.87Å; I1211-L1215 HydrophobicContact CG2-CG 4.29Å; I1211-L1215 WeakPolarHBondContact O-CG 3.24Å; I1211-L1215 PolarHBondContact O-N 3.31Å; K1213-L1215 PolarHBondContact O-N 2.7Å; L1215-L1218 CarbonylContact O-C 3.6Å; L1215-L1218 PolarHBondContact O-N 3.49Å; L1215-G1219 PolarHBondContact O-N 3.15Å; L1215-G1219 VanDerWaalsContact O-N 3.08Å; L1215-A1220 HydrophobicContact CB-CB 3.85Å; L1215-A1220 VanDerWaalsContact O-CB 3.28Å; L1215-A1220 WeakPolarHBondContact O-CB 3.28Å; L1215-A1220 PolarHBondContact O-N 3.03Å
1216	L	94.2	Very high	93.5	Very high	16 Å²	16	27.1 Å²	27.1	8%	0.084	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-46.2	179.1	-70	170.8	0	0	0	112.4	L1200 A1212 K1213 L1218 G1219 P1222 C1249 L1250 W1601	L1200-L1216 HydrophobicContact CD1-CG 4.35Å; L1200-L1216 HydrophobicContact CD2-CD2 3.77Å; L1200-L1216 HydrophobicContact CD2-CG 4.42Å; A1212-L1216 VanDerWaalsContact O-CG 3.26Å; A1212-L1216 WeakPolarHBondContact O-CG 3.43Å; A1212-L1216 PolarHBondContact O-N 3.11Å; A1212-L1216 VanDerWaalsContact O-N 3.1Å; K1213-L1216 PolarHBondContact O-N 3.45Å; L1216-L1218 PolarHBondContact O-N 3.38Å; L1216-G1219 PolarHBondContact O-N 3.31Å; L1216-P1222 HydrophobicContact CD2-CB 4.1Å; L1216-P1222 HydrophobicContact CD2-CG 4.35Å; L1216-C1249 HydrophobicContact CD1-CB 4.24Å; L1216-L1250 HydrophobicContact CD1-CD2 4.49Å; L1216-W1601 HydrophobicContact CB-CZ3 4.02Å; L1216-W1601 HydrophobicContact CD1-CH2 4.22Å; L1216-W1601 HydrophobicContact CD1-CZ3 3.93Å
1217	V	93.5	Very high	93.6	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.018	17%	0.17	C	C	.	.	H	α-helix	trans	-68.9	-18.2	178.9	-57.2	0	0	0	0	113.2	K1213 A1214 Q1307 R1347 Q1350 M1600 W1601 V1604	K1213-V1217 WeakPolarHBondContact O-CG1 3.21Å; K1213-V1217 WeakPolarHBondContact O-CG2 3.43Å; K1213-V1217 PolarHBondContact O-N 3.01Å; A1214-V1217 WeakPolarHBondContact O-CG2 3.43Å; V1217-Q1307 PolarHBondContact O-NE2 3.28Å; V1217-R1347 PolarHBondContact O-NH1 3.03Å; V1217-Q1350 PolarHBondContact O-NE2 3.03Å; V1217-M1600 HydrophobicContact CB-CB 4.1Å; V1217-M1600 HydrophobicContact CG1-CB 4.15Å; V1217-M1600 HydrophobicContact CG2-CB 4.1Å; V1217-M1600 HydrophobicContact CG2-CE 3.81Å; V1217-M1600 HydrophobicContact CG2-SD 4.31Å; V1217-W1601 HydrophobicContact CG1-CB 4.33Å; V1217-W1601 HydrophobicContact CG1-CE3 3.8Å; V1217-V1604 HydrophobicContact CG1-CG2 4.19Å
1218	L	92.4	Very high	93.5	Very high	23 Å²	23	31.8 Å²	31.8	12%	0.12	18%	0.182	C	C	.	.	H	α-helix	trans	-92.6	-3.9	172.6	-73.5	164	0	0	0	113.7	L1180 L1183 A1214 L1215 L1216 L1354	L1180-L1218 HydrophobicContact CD2-CD1 3.59Å; L1183-L1218 HydrophobicContact CB-CD1 3.93Å; L1183-L1218 HydrophobicContact CD1-CB 4.43Å; L1183-L1218 HydrophobicContact CD1-CD1 3.51Å; L1183-L1218 HydrophobicContact CG-CD1 4.33Å; A1214-L1218 WeakPolarHBondContact O-CB 3.41Å; A1214-L1218 WeakPolarHBondContact O-CD1 3.41Å; A1214-L1218 WeakPolarHBondContact O-CG 3.49Å; A1214-L1218 PolarHBondContact O-N 3.28Å; L1215-L1218 CarbonylContact O-C 3.6Å; L1215-L1218 PolarHBondContact O-N 3.49Å; L1216-L1218 PolarHBondContact O-N 3.38Å; L1218-L1354 HydrophobicContact CD2-CD1 3.81Å
1219	G	90.3	Very high	93.2	Very high	32 Å²	32	31.1 Å²	31.1	33%	0.33	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.1	16.8	169.1	0	0	0	0	0	116.4	L1215 L1216 N1221	L1215-G1219 PolarHBondContact O-N 3.15Å; L1215-G1219 VanDerWaalsContact O-N 3.08Å; L1216-G1219 PolarHBondContact O-N 3.31Å; G1219-N1221 PolarHBondContact O-N 3.27Å
1220	A	94	Very high	93	Very high	5 Å²	5	30 Å²	30	4%	0.041	18%	0.177	C	C	.	.			trans	-57.8	131	171	0	0	0	0	0	111.4	P1189 D1190 L1200 L1215 P1222	P1189-A1220 HydrophobicContact CB-CB 3.7Å; P1189-A1220 HydrophobicContact CG-CB 4.29Å; D1190-A1220 WeakPolarHBondContact OD1-CA 2.96Å; L1200-A1220 HydrophobicContact CB-CB 4.5Å; L1200-A1220 HydrophobicContact CD2-CB 4.3Å; L1215-A1220 HydrophobicContact CB-CB 3.85Å; L1215-A1220 VanDerWaalsContact O-CB 3.28Å; L1215-A1220 WeakPolarHBondContact O-CB 3.28Å; L1215-A1220 PolarHBondContact O-N 3.03Å; A1220-P1222 VanDerWaalsContact O-CD 3.31Å; A1220-P1222 WeakPolarHBondContact O-CD 3.41Å
1221	N	93.6	Very high	92.9	Very high	63 Å²	63	28.9 Å²	28.9	34%	0.337	17%	0.172	S	C	.	.			trans	-80.5	113	-178.1	-178.2	-5.5	0	0	0	111.2	D1190 G1219 N1223 I1224	D1190-N1221 PolarHBondContact OD1-N 3.36Å; D1190-N1221 WeakPolarHBondContact OD2-CB 3.48Å; D1190-N1221 PolarHBondContact OD2-N 3.49Å; G1219-N1221 PolarHBondContact O-N 3.27Å; N1221-N1223 PolarHBondContact O-N 3.19Å; N1221-N1223 VanDerWaalsContact O-N 3.14Å; N1221-N1223 WeakPolarHBondContact OD1-CB 3.48Å; N1221-N1223 PolarHBondContact OD1-N 2.86Å; N1221-N1223 PolarHBondContact OD1-ND2 3.26Å; N1221-I1224 HydrophobicContact CB-CD1 3.94Å; N1221-I1224 HydrophobicContact CB-CG1 4.07Å
1222	P	93.2	Very high	92.8	Very high	7 Å²	7	28.9 Å²	28.9	5%	0.045	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	6.7	-177.2	36.4	-39.2	0	0	0	114.1	L1200 L1216 A1220 P1232 L1250 G1253 A1255	L1200-P1222 HydrophobicContact CD2-CB 3.95Å; L1216-P1222 HydrophobicContact CD2-CB 4.1Å; L1216-P1222 HydrophobicContact CD2-CG 4.35Å; A1220-P1222 VanDerWaalsContact O-CD 3.31Å; A1220-P1222 WeakPolarHBondContact O-CD 3.41Å; P1222-P1232 WeakPolarHBondContact O-CD 3.38Å; P1222-L1250 HydrophobicContact CB-CD2 4.08Å; P1222-G1253 WeakPolarHBondContact CG-O 3.37Å; P1222-A1255 HydrophobicContact CB-CB 3.88Å; P1222-A1255 HydrophobicContact CG-CB 4.11Å
1223	N	92.1	Very high	92.4	Very high	54 Å²	54	29.4 Å²	29.4	29%	0.289	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-2.6	-175.5	-55.9	-61.5	0	0	0	113.8	N1221 G1254 A1255 V1256	N1221-N1223 PolarHBondContact O-N 3.19Å; N1221-N1223 VanDerWaalsContact O-N 3.14Å; N1221-N1223 WeakPolarHBondContact OD1-CB 3.48Å; N1221-N1223 PolarHBondContact OD1-N 2.86Å; N1221-N1223 PolarHBondContact OD1-ND2 3.26Å; N1223-G1254 PolarHBondContact ND2-O 2.87Å; N1223-G1254 PolarHBondContact OD1-O 2.78Å; N1223-A1255 WeakPolarHBondContact OD1-CA 3.2Å; N1223-V1256 WeakPolarHBondContact OD1-CG2 3.45Å; N1223-V1256 PolarHBondContact OD1-N 2.69Å
1224	I	93.9	Very high	92	Very high	35 Å²	35	29.6 Å²	29.6	18%	0.179	18%	0.175	C	C	.	.			trans	-64.2	139.1	171.9	-65.7	173.2	0	0	0	109.1	D1190 Q1192 T1198 H1201 N1221	D1190-I1224 HydrophobicContact CB-CD1 3.43Å; D1190-I1224 VanDerWaalsContact CB-CD1 3.43Å; Q1192-I1224 HydrophobicContact CG-CG2 4.36Å; T1198-I1224 HydrophobicContact CG2-CB 4.12Å; T1198-I1224 HydrophobicContact CG2-CD1 4.07Å; T1198-I1224 HydrophobicContact CG2-CG2 3.68Å; H1201-I1224 PolarHBondContact CE1-O 3.12Å; N1221-I1224 HydrophobicContact CB-CD1 3.94Å; N1221-I1224 HydrophobicContact CB-CG1 4.07Å
1225	L	93.4	Very high	91.7	Very high	89 Å²	89	30.8 Å²	30.8	47%	0.466	18%	0.181	S	C	.	.			trans	-102.3	139.1	177.2	-53	-176.9	0	0	0	110.6	Q1192 D1230	Q1192-L1225 PolarHBondContact NE2-O 3.44Å; L1225-D1230 CarbonylContact C-O 3.45Å; L1225-D1230 VanDerWaalsContact CA-O 3.3Å; L1225-D1230 WeakPolarHBondContact CA-O 3.45Å
1226	N	93.4	Very high	91.3	Very high	16 Å²	16	30.8 Å²	30.8	9%	0.086	18%	0.181	C	C	.	.			trans	-80.9	-176	170.7	75.9	-3.7	0	0	0	112.5	G1196 N1197 T1228 G1229 D1230	G1196-N1226 VanDerWaalsContact O-CA 3.29Å; G1196-N1226 WeakPolarHBondContact O-CA 3.24Å; G1196-N1226 WeakPolarHBondContact O-CB 3.35Å; N1197-N1226 WeakPolarHBondContact OD1-CB 3.26Å; N1197-N1226 PolarHBondContact OD1-ND2 3.47Å; N1226-T1228 PolarHBondContact ND2-OG1 3.48Å; N1226-T1228 PolarHBondContact O-N 3.02Å; N1226-T1228 VanDerWaalsContact O-N 3.15Å; N1226-T1228 PolarHBondContact OD1-N 3.23Å; N1226-T1228 PolarHBondContact OD1-OG1 3.44Å; N1226-G1229 PolarHBondContact O-N 2.66Å; N1226-G1229 PolarHBondContact OD1-N 2.98Å; N1226-D1230 PolarHBondContact N-O 2.84Å; N1226-D1230 WeakPolarHBondContact OD1-CB 3.41Å; N1226-D1230 PolarHBondContact OD1-N 3.44Å; N1226-D1230 PolarHBondContact OD1-O 3.46Å
1227	N	93.8	Very high	90.7	Very high	118 Å²	118	30.9 Å²	30.9	63%	0.631	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-11.2	-178.4	-64	-7.2	0	0	0	113.9	S1194 N1195 G1196	S1194-N1227 PolarHBondContact O-ND2 2.74Å; N1195-N1227 VanDerWaalsContact O-CB 3.22Å; N1195-N1227 WeakPolarHBondContact O-CB 3.17Å; N1195-N1227 VanDerWaalsContact O-CG 3.25Å; N1195-N1227 PolarHBondContact O-N 3.43Å; G1196-N1227 WeakPolarHBondContact CA-OD1 3.44Å; G1196-N1227 PolarHBondContact N-ND2 3.26Å
1228	T	89	Confident	90.2	Very high	102 Å²	102	36.3 Å²	36.3	63%	0.626	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	3.3	169.9	60.5	0	0	0	0	113.1	N1226 D1230	N1226-T1228 PolarHBondContact ND2-OG1 3.48Å; N1226-T1228 PolarHBondContact O-N 3.02Å; N1226-T1228 VanDerWaalsContact O-N 3.15Å; N1226-T1228 PolarHBondContact OD1-N 3.23Å; N1226-T1228 PolarHBondContact OD1-OG1 3.44Å; T1228-D1230 VanDerWaalsContact C-N 3.29Å; T1228-D1230 PolarHBondContact OG1-OD2 3.23Å
1229	G	87.8	Confident	89.8	Confident	24 Å²	24	38.4 Å²	38.4	25%	0.247	22%	0.215	C	C	.	.	S	Bend	trans	77.5	13.9	-176.4	0	0	0	0	0	113.5	N1226 H1262	N1226-G1229 PolarHBondContact O-N 2.66Å; N1226-G1229 PolarHBondContact OD1-N 2.98Å; G1229-H1262 PolarHBondContact O-CE1 3.01Å; G1229-H1262 VanDerWaalsContact O-CE1 3.25Å
1230	D	88.7	Confident	88.9	Confident	4 Å²	4	39 Å²	39	2%	0.021	22%	0.221	C	C	.	.			trans	-94.8	137.1	-175.6	-73	-58.3	0	0	0	112.6	H1201 L1225 N1226 T1228 H1234 L1235 R1238	H1201-D1230 PolarHBondContact NE2-O 3.44Å; H1201-D1230 VanDerWaalsContact NE2-O 3.08Å; L1225-D1230 CarbonylContact C-O 3.45Å; L1225-D1230 VanDerWaalsContact CA-O 3.3Å; L1225-D1230 WeakPolarHBondContact CA-O 3.45Å; N1226-D1230 PolarHBondContact N-O 2.84Å; N1226-D1230 WeakPolarHBondContact OD1-CB 3.41Å; N1226-D1230 PolarHBondContact OD1-N 3.44Å; N1226-D1230 PolarHBondContact OD1-O 3.46Å; T1228-D1230 VanDerWaalsContact C-N 3.29Å; T1228-D1230 PolarHBondContact OG1-OD2 3.23Å; D1230-H1234 HydrophobicContact CB-CB 4.11Å; D1230-H1234 WeakPolarHBondContact OD1-CB 3.19Å; D1230-H1234 IonicContact OD1-CG 2.85Å; D1230-H1234 IonicContact OD1-ND1 3.66Å; D1230-H1234 PolarHBondContact OD1-ND1 3.31Å; D1230-L1235 HydrophobicContact CB-CD2 4.27Å; D1230-R1238 VanDerWaalsContact CG-NH2 3.3Å; D1230-R1238 IonicContact OD1-CZ 3.86Å; D1230-R1238 VanDerWaalsContact OD1-CZ 3.27Å; D1230-R1238 IonicContact OD1-NH1 2.79Å; D1230-R1238 PolarHBondContact OD1-NH1 3.49Å; D1230-R1238 IonicContact OD1-NH2 2.84Å; D1230-R1238 PolarHBondContact OD1-NH2 3.11Å; D1230-R1238 IonicContact OD2-CZ 3.11Å; D1230-R1238 IonicContact OD2-NH1 3.83Å; D1230-R1238 PolarHBondContact OD2-NH1 3.36Å; D1230-R1238 IonicContact OD2-NH2 2.71Å; D1230-R1238 PolarHBondContact OD2-NH2 3.34Å
1231	S	90.9	Very high	87.9	Confident	7 Å²	7	44.6 Å²	44.6	5%	0.049	26%	0.255	C	S	.	.			trans	-86.7	163.7	164.6	64.3	0	0	0	0	110.7	R1233 H1234 L1235	S1231-R1233 PolarHBondContact O-N 3.35Å; S1231-R1233 VanDerWaalsContact O-N 3.07Å; S1231-R1233 PolarHBondContact OG-N 2.75Å; S1231-H1234 PolarHBondContact N-ND1 2.75Å; S1231-H1234 WeakPolarHBondContact O-CB 3.45Å; S1231-H1234 PolarHBondContact O-N 3Å; S1231-H1234 PolarHBondContact OG-CD2 3.44Å; S1231-H1234 PolarHBondContact OG-N 3.05Å; S1231-H1234 PolarHBondContact OG-NE2 3.36Å; S1231-L1235 PolarHBondContact O-N 3.43Å
1232	P	92.2	Very high	87	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-52.6	-30	168.3	-26.2	35.1	0	0	0	113	L1200 H1201 V1204 P1222 L1235 A1236 L1250	L1200-P1232 HydrophobicContact CB-CG 4.37Å; L1200-P1232 HydrophobicContact CD2-CB 4.36Å; L1200-P1232 HydrophobicContact CD2-CG 4.1Å; L1200-P1232 HydrophobicContact CG-CB 4.08Å; L1200-P1232 HydrophobicContact CG-CG 3.99Å; H1201-P1232 WeakPolarHBondContact NE2-CD 3.36Å; V1204-P1232 HydrophobicContact CG2-CB 4.14Å; P1222-P1232 WeakPolarHBondContact O-CD 3.38Å; P1232-L1235 PolarHBondContact O-N 3.34Å; P1232-A1236 WeakPolarHBondContact O-CB 3.44Å; P1232-A1236 PolarHBondContact O-N 3.22Å; P1232-L1250 HydrophobicContact CB-CD1 4.31Å; P1232-L1250 HydrophobicContact CB-CD2 3.88Å; P1232-L1250 WeakPolarHBondContact O-CD1 3.46Å
1233	R	88	Confident	86.5	Confident	13 Å²	13	47.4 Å²	47.4	5%	0.049	27%	0.27	C	S	.	.	H	α-helix	trans	-67.6	-36.6	174.5	-169.1	-175.1	178.6	135.4	9.6	112.9	S1231 A1237 L1247 A1255 V1256	S1231-R1233 PolarHBondContact O-N 3.35Å; S1231-R1233 VanDerWaalsContact O-N 3.07Å; S1231-R1233 PolarHBondContact OG-N 2.75Å; R1233-A1237 WeakPolarHBondContact O-CB 3.44Å; R1233-A1237 PolarHBondContact O-N 2.95Å; R1233-L1247 HydrophobicContact CG-CD1 3.86Å; R1233-A1255 HydrophobicContact CB-CB 4.15Å; R1233-A1255 HydrophobicContact CG-CB 4.45Å; R1233-A1255 PolarHBondContact NH1-O 2.86Å; R1233-V1256 WeakPolarHBondContact CD-O 3.3Å; R1233-V1256 PolarHBondContact NH1-O 3.03Å
1234	H	87.2	Confident	86	Confident	10 Å²	10	54.7 Å²	54.7	5%	0.046	29%	0.293	C	S	.	.	H	α-helix	trans	-68.6	-41.1	176.5	-57.9	175.3	0	0	0	110.5	D1230 S1231 A1237 R1238 H1262	D1230-H1234 HydrophobicContact CB-CB 4.11Å; D1230-H1234 WeakPolarHBondContact OD1-CB 3.19Å; D1230-H1234 IonicContact OD1-CG 2.85Å; D1230-H1234 IonicContact OD1-ND1 3.66Å; D1230-H1234 PolarHBondContact OD1-ND1 3.31Å; S1231-H1234 PolarHBondContact N-ND1 2.75Å; S1231-H1234 WeakPolarHBondContact O-CB 3.45Å; S1231-H1234 PolarHBondContact O-N 3Å; S1231-H1234 PolarHBondContact OG-CD2 3.44Å; S1231-H1234 PolarHBondContact OG-N 3.05Å; S1231-H1234 PolarHBondContact OG-NE2 3.36Å; H1234-A1237 PolarHBondContact O-N 3.31Å; H1234-R1238 WeakPolarHBondContact O-CG 3.43Å; H1234-R1238 PolarHBondContact O-N 3.49Å; H1234-R1238 VanDerWaalsContact O-N 3.1Å; H1234-H1262 AromaticContact CE1-CD2 3.52Å; H1234-H1262 AromaticContact CE1-CE1 3.64Å; H1234-H1262 AromaticContact CE1-NE2 3.16Å; H1234-H1262 PolarHBondContact CE1-NE2 3.33Å; H1234-H1262 AromaticContact ND1-CD2 3.76Å; H1234-H1262 AromaticContact ND1-CE1 3.94Å; H1234-H1262 AromaticContact ND1-NE2 3.17Å; H1234-H1262 PolarHBondContact ND1-NE2 2.95Å; H1234-H1262 VanDerWaalsContact ND1-NE2 3.17Å
1235	L	88.9	Confident	85.6	Confident	25 Å²	25	58 Å²	58	13%	0.131	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-49.9	173.6	-59.3	-173.9	0	0	0	111.5	H1201 V1204 D1230 S1231 P1232 A1237 R1238 L1239	H1201-L1235 HydrophobicContact CB-CD1 3.92Å; V1204-L1235 HydrophobicContact CG1-CB 3.9Å; D1230-L1235 HydrophobicContact CB-CD2 4.27Å; S1231-L1235 PolarHBondContact O-N 3.43Å; P1232-L1235 PolarHBondContact O-N 3.34Å; L1235-A1237 VanDerWaalsContact C-N 3.29Å; L1235-A1237 PolarHBondContact O-N 2.87Å; L1235-R1238 PolarHBondContact O-N 3.11Å; L1235-R1238 VanDerWaalsContact O-N 3.13Å; L1235-L1239 WeakPolarHBondContact O-CG 3.47Å; L1235-L1239 PolarHBondContact O-N 2.99Å; L1235-L1239 VanDerWaalsContact O-N 3.16Å
1236	A	87.4	Confident	85.3	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.008	29%	0.286	C	S	.	.	H	α-helix	trans	-59	-38.7	176.7	0	0	0	0	0	112.6	V1204 P1232 R1238 L1239 A1243 L1247 L1250	V1204-A1236 HydrophobicContact CG1-CB 3.86Å; P1232-A1236 WeakPolarHBondContact O-CB 3.44Å; P1232-A1236 PolarHBondContact O-N 3.22Å; A1236-R1238 PolarHBondContact O-N 3.1Å; A1236-L1239 PolarHBondContact O-N 3.45Å; A1236-A1243 HydrophobicContact CB-CB 4.32Å; A1236-A1243 VanDerWaalsContact O-CB 3.31Å; A1236-A1243 WeakPolarHBondContact O-CB 3.26Å; A1236-L1247 HydrophobicContact CB-CB 4.46Å; A1236-L1247 HydrophobicContact CB-CD1 4.35Å; A1236-L1250 HydrophobicContact CB-CD1 3.65Å
1237	A	81.5	Confident	85	Confident	17 Å²	17	55 Å²	55	14%	0.14	29%	0.292	C	S	.	.	H	α-helix	trans	-66.9	-33.1	177.2	0	0	0	0	0	113.3	R1233 H1234 L1235 V1266	R1233-A1237 WeakPolarHBondContact O-CB 3.44Å; R1233-A1237 PolarHBondContact O-N 2.95Å; H1234-A1237 PolarHBondContact O-N 3.31Å; L1235-A1237 VanDerWaalsContact C-N 3.29Å; L1235-A1237 PolarHBondContact O-N 2.87Å; A1237-V1266 HydrophobicContact CB-CG2 4.09Å; A1237-V1266 WeakPolarHBondContact O-CG2 3.39Å
1238	R	83.4	Confident	84.6	Confident	117 Å²	117	52.2 Å²	52.2	44%	0.442	28%	0.282	S	S	.	.	H	α-helix	trans	-73.1	-31.3	176.4	-71.3	177.2	-173.2	149.1	8.9	113.3	D1230 H1234 L1235 A1236 G1240 V1266	D1230-R1238 VanDerWaalsContact CG-NH2 3.3Å; D1230-R1238 IonicContact OD1-CZ 3.86Å; D1230-R1238 VanDerWaalsContact OD1-CZ 3.27Å; D1230-R1238 IonicContact OD1-NH1 2.79Å; D1230-R1238 PolarHBondContact OD1-NH1 3.49Å; D1230-R1238 IonicContact OD1-NH2 2.84Å; D1230-R1238 PolarHBondContact OD1-NH2 3.11Å; D1230-R1238 IonicContact OD2-CZ 3.11Å; D1230-R1238 IonicContact OD2-NH1 3.83Å; D1230-R1238 PolarHBondContact OD2-NH1 3.36Å; D1230-R1238 IonicContact OD2-NH2 2.71Å; D1230-R1238 PolarHBondContact OD2-NH2 3.34Å; H1234-R1238 WeakPolarHBondContact O-CG 3.43Å; H1234-R1238 PolarHBondContact O-N 3.49Å; H1234-R1238 VanDerWaalsContact O-N 3.1Å; L1235-R1238 PolarHBondContact O-N 3.11Å; L1235-R1238 VanDerWaalsContact O-N 3.13Å; A1236-R1238 PolarHBondContact O-N 3.1Å; R1238-G1240 PolarHBondContact O-N 2.91Å; R1238-V1266 HydrophobicContact CG-CG2 4.05Å
1239	L	83	Confident	84.5	Confident	67 Å²	67	47.5 Å²	47.5	35%	0.351	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-0.9	178.2	-67	167.2	0	0	0	113.8	V1204 L1207 L1235 A1236 A1243	V1204-L1239 HydrophobicContact CG1-CD1 4.14Å; V1204-L1239 WeakPolarHBondContact O-CD1 3.12Å; L1207-L1239 HydrophobicContact CD2-CB 4.34Å; L1207-L1239 HydrophobicContact CD2-CD1 3.89Å; L1235-L1239 WeakPolarHBondContact O-CG 3.47Å; L1235-L1239 PolarHBondContact O-N 2.99Å; L1235-L1239 VanDerWaalsContact O-N 3.16Å; A1236-L1239 PolarHBondContact O-N 3.45Å; L1239-A1243 HydrophobicContact CB-CB 3.65Å; L1239-A1243 HydrophobicContact CD1-CB 4.48Å
1240	G	72.2	Confident	84.5	Confident	44 Å²	44	46.4 Å²	46.4	45%	0.454	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	66	-142	168	0	0	0	0	0	114.1	R1238 N1242 A1243	R1238-G1240 PolarHBondContact O-N 2.91Å; G1240-N1242 PolarHBondContact O-N 3.41Å; G1240-A1243 PolarHBondContact O-N 3.31Å
1241	T	72.7	Confident	84.3	Confident	123 Å²	123	49.2 Å²	49.2	76%	0.755	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-58.9	-32.3	-175.5	44.7	0	0	0	0	113.5	A1243 R1244	T1241-A1243 VanDerWaalsContact C-N 3.26Å; T1241-A1243 PolarHBondContact O-N 2.97Å; T1241-R1244 WeakPolarHBondContact O-CB 3.45Å; T1241-R1244 PolarHBondContact O-N 2.98Å
1242	N	74.9	Confident	84	Confident	129 Å²	129	50.2 Å²	50.2	69%	0.69	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-70.9	-24.1	-174.1	-61.6	0.6	0	0	0	112.1	L1207 G1240	L1207-N1242 HydrophobicContact CD1-CB 4.3Å; G1240-N1242 PolarHBondContact O-N 3.41Å
1243	A	82	Confident	83.4	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.008	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-97.3	16.1	176.8	0	0	0	0	0	113.5	L1207 A1236 L1239 G1240 T1241 E1245 L1246 L1247	L1207-A1243 HydrophobicContact CD2-CB 4.02Å; A1236-A1243 HydrophobicContact CB-CB 4.32Å; A1236-A1243 VanDerWaalsContact O-CB 3.31Å; A1236-A1243 WeakPolarHBondContact O-CB 3.26Å; L1239-A1243 HydrophobicContact CB-CB 3.65Å; L1239-A1243 HydrophobicContact CD1-CB 4.48Å; G1240-A1243 PolarHBondContact O-N 3.31Å; T1241-A1243 VanDerWaalsContact C-N 3.26Å; T1241-A1243 PolarHBondContact O-N 2.97Å; A1243-E1245 VanDerWaalsContact C-N 3.35Å; A1243-E1245 PolarHBondContact O-N 2.86Å; A1243-L1246 HydrophobicContact CB-CB 4.34Å; A1243-L1246 HydrophobicContact CB-CD1 4.36Å; A1243-L1246 WeakPolarHBondContact O-CB 3.38Å; A1243-L1246 PolarHBondContact O-N 2.99Å; A1243-L1247 WeakPolarHBondContact O-CB 3.45Å; A1243-L1247 PolarHBondContact O-N 3.46Å
1244	R	82.6	Confident	83.2	Confident	207 Å²	207	52.8 Å²	52.8	78%	0.781	29%	0.294	S	S	*	.	H	α-helix	trans	-60	-39.5	-177.6	-174.4	174.1	-177.4	155.9	1.4	113.5	T1241 S1248	T1241-R1244 WeakPolarHBondContact O-CB 3.45Å; T1241-R1244 PolarHBondContact O-N 2.98Å; R1244-S1248 PolarHBondContact O-N 3.31Å
1245	E	84.4	Confident	83.1	Confident	105 Å²	105	52.6 Å²	52.6	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-69	-45.9	174.9	-169.4	177.7	171	0	0	111	V1209 K1213 A1243 L1247 S1248 C1249	V1209-E1245 HydrophobicContact CG1-CG 4.13Å; V1209-E1245 WeakPolarHBondContact CG1-OE1 3.25Å; K1213-E1245 WeakPolarHBondContact CE-OE1 3.31Å; K1213-E1245 IonicContact NZ-OE1 2.7Å; K1213-E1245 PolarHBondContact NZ-OE1 3.3Å; A1243-E1245 VanDerWaalsContact C-N 3.35Å; A1243-E1245 PolarHBondContact O-N 2.86Å; E1245-L1247 VanDerWaalsContact C-N 3.32Å; E1245-L1247 PolarHBondContact O-N 3.32Å; E1245-S1248 CarbonylContact O-C 3.53Å; E1245-S1248 WeakPolarHBondContact O-CA 3.38Å; E1245-S1248 WeakPolarHBondContact O-CB 3.25Å; E1245-S1248 PolarHBondContact O-N 3.28Å; E1245-C1249 PolarHBondContact O-N 2.97Å; E1245-C1249 PolarHBondContact O-SG 3.12Å; E1245-C1249 VanDerWaalsContact O-SG 3.36Å
1246	L	88.1	Confident	82.8	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-56	-43.4	174.9	-76.8	169.3	0	0	0	112.7	L1207 V1209 A1212 A1243 S1248 C1249 L1250	L1207-L1246 HydrophobicContact CD2-CD1 3.93Å; V1209-L1246 HydrophobicContact CG2-CD2 4.31Å; V1209-L1246 HydrophobicContact CG2-CG 4.12Å; A1212-L1246 HydrophobicContact CB-CD2 3.4Å; A1243-L1246 HydrophobicContact CB-CB 4.34Å; A1243-L1246 HydrophobicContact CB-CD1 4.36Å; A1243-L1246 WeakPolarHBondContact O-CB 3.38Å; A1243-L1246 PolarHBondContact O-N 2.99Å; L1246-S1248 VanDerWaalsContact C-N 3.3Å; L1246-S1248 PolarHBondContact O-N 2.97Å; L1246-C1249 PolarHBondContact O-N 3.45Å; L1246-L1250 WeakPolarHBondContact O-CB 3.34Å; L1246-L1250 VanDerWaalsContact O-CG 3.27Å; L1246-L1250 WeakPolarHBondContact O-CG 3.29Å; L1246-L1250 PolarHBondContact O-N 3.02Å
1247	L	85.4	Confident	82.2	Confident	38 Å²	38	61.7 Å²	61.7	20%	0.199	34%	0.336	C	S	.	.	H	α-helix	trans	-62.3	-38.3	176.3	-173.5	65.4	0	0	0	111.5	R1233 A1236 A1243 E1245 V1251	R1233-L1247 HydrophobicContact CG-CD1 3.86Å; A1236-L1247 HydrophobicContact CB-CB 4.46Å; A1236-L1247 HydrophobicContact CB-CD1 4.35Å; A1243-L1247 WeakPolarHBondContact O-CB 3.45Å; A1243-L1247 PolarHBondContact O-N 3.46Å; E1245-L1247 VanDerWaalsContact C-N 3.32Å; E1245-L1247 PolarHBondContact O-N 3.32Å; L1247-V1251 WeakPolarHBondContact O-CB 3.41Å; L1247-V1251 VanDerWaalsContact O-CG2 3.24Å; L1247-V1251 WeakPolarHBondContact O-CG2 3.39Å; L1247-V1251 PolarHBondContact O-N 2.98Å
1248	S	85.6	Confident	81.7	Confident	61 Å²	61	62.6 Å²	62.6	43%	0.427	34%	0.341	S	S	.	.	H	α-helix	trans	-66.3	-42.5	172.7	-161.8	0	0	0	0	111.7	R1244 E1245 L1246 V1251 I1252	R1244-S1248 PolarHBondContact O-N 3.31Å; E1245-S1248 CarbonylContact O-C 3.53Å; E1245-S1248 WeakPolarHBondContact O-CA 3.38Å; E1245-S1248 WeakPolarHBondContact O-CB 3.25Å; E1245-S1248 PolarHBondContact O-N 3.28Å; L1246-S1248 VanDerWaalsContact C-N 3.3Å; L1246-S1248 PolarHBondContact O-N 2.97Å; S1248-V1251 PolarHBondContact O-N 2.64Å; S1248-I1252 WeakPolarHBondContact O-CG1 3.47Å; S1248-I1252 PolarHBondContact O-N 3.04Å
1249	C	87.9	Confident	81	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.02	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-46.3	177	-66.4	0	0	0	0	111.5	K1213 L1216 E1245 L1246 V1251 I1252 G1253 W1601	K1213-C1249 WeakPolarHBondContact CE-SG 3.44Å; L1216-C1249 HydrophobicContact CD1-CB 4.24Å; E1245-C1249 PolarHBondContact O-N 2.97Å; E1245-C1249 PolarHBondContact O-SG 3.12Å; E1245-C1249 VanDerWaalsContact O-SG 3.36Å; L1246-C1249 PolarHBondContact O-N 3.45Å; C1249-V1251 PolarHBondContact O-N 3.44Å; C1249-I1252 PolarHBondContact O-N 2.96Å; C1249-G1253 PolarHBondContact O-N 2.82Å; C1249-W1601 HydrophobicContact CB-CH2 3.79Å; C1249-W1601 HydrophobicContact CB-CZ2 3.81Å; C1249-W1601 HydrophobicContact CB-CZ3 4.49Å; C1249-W1601 VanDerWaalsContact O-CH2 3.31Å; C1249-W1601 WeakPolarHBondContact O-CH2 3.28Å
1250	L	88.3	Confident	79.9	Confident	1 Å²	1	68 Å²	68	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-61.2	-43	176.5	-70	167.2	0	0	0	111.7	L1200 V1204 L1216 P1222 P1232 A1236 L1246 I1252 G1253 G1254 A1255	L1200-L1250 HydrophobicContact CD1-CD2 4.32Å; L1200-L1250 HydrophobicContact CD2-CD2 4.04Å; L1200-L1250 HydrophobicContact CG-CD2 4.31Å; V1204-L1250 HydrophobicContact CG2-CD1 3.95Å; V1204-L1250 HydrophobicContact CG2-CD2 4.43Å; L1216-L1250 HydrophobicContact CD1-CD2 4.49Å; P1222-L1250 HydrophobicContact CB-CD2 4.08Å; P1232-L1250 HydrophobicContact CB-CD1 4.31Å; P1232-L1250 HydrophobicContact CB-CD2 3.88Å; P1232-L1250 WeakPolarHBondContact O-CD1 3.46Å; A1236-L1250 HydrophobicContact CB-CD1 3.65Å; L1246-L1250 WeakPolarHBondContact O-CB 3.34Å; L1246-L1250 VanDerWaalsContact O-CG 3.27Å; L1246-L1250 WeakPolarHBondContact O-CG 3.29Å; L1246-L1250 PolarHBondContact O-N 3.02Å; L1250-I1252 PolarHBondContact O-N 3.06Å; L1250-G1253 CarbonylContact O-C 3.6Å; L1250-G1253 PolarHBondContact O-N 3Å; L1250-G1254 PolarHBondContact O-N 3.44Å; L1250-A1255 HydrophobicContact CB-CB 3.88Å; L1250-A1255 WeakPolarHBondContact O-CB 3.49Å; L1250-A1255 PolarHBondContact O-N 3.46Å
1251	V	84.4	Confident	79.5	Confident	63 Å²	63	72.8 Å²	72.8	38%	0.382	39%	0.391	S	S	.	.	H	α-helix	trans	-60.6	-43.6	175	166.9	0	0	0	0	112	L1247 S1248 C1249 G1254	L1247-V1251 WeakPolarHBondContact O-CB 3.41Å; L1247-V1251 VanDerWaalsContact O-CG2 3.24Å; L1247-V1251 WeakPolarHBondContact O-CG2 3.39Å; L1247-V1251 PolarHBondContact O-N 2.98Å; S1248-V1251 PolarHBondContact O-N 2.64Å; C1249-V1251 PolarHBondContact O-N 3.44Å; V1251-G1254 PolarHBondContact O-N 3.28Å
1252	I	83.5	Confident	79.2	Confident	28 Å²	28	69.5 Å²	69.5	14%	0.144	37%	0.367	C	S	.	.	H	α-helix	trans	-69.3	-35.4	178.4	-70.4	166.5	0	0	0	111.2	S1248 C1249 L1250 G1254 W1601 V1604 E1605 Q1608	S1248-I1252 WeakPolarHBondContact O-CG1 3.47Å; S1248-I1252 PolarHBondContact O-N 3.04Å; C1249-I1252 PolarHBondContact O-N 2.96Å; L1250-I1252 PolarHBondContact O-N 3.06Å; I1252-G1254 PolarHBondContact O-N 3.12Å; I1252-W1601 HydrophobicContact CB-CH2 3.93Å; I1252-W1601 HydrophobicContact CB-CZ2 3.98Å; I1252-W1601 HydrophobicContact CD1-CZ2 4.24Å; I1252-W1601 HydrophobicContact CG2-CH2 3.76Å; I1252-W1601 HydrophobicContact CG2-CZ2 3.82Å; I1252-V1604 HydrophobicContact CG2-CG1 4.01Å; I1252-E1605 HydrophobicContact CD1-CG 4.05Å; I1252-E1605 HydrophobicContact CG2-CG 4.4Å; I1252-Q1608 HydrophobicContact CG2-CB 4.32Å; I1252-Q1608 HydrophobicContact CG2-CG 4.42Å
1253	G	80.8	Confident	78.5	Confident	26 Å²	26	74.6 Å²	74.6	27%	0.268	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	4.1	175.9	0	0	0	0	0	115.5	P1222 C1249 L1250	P1222-G1253 WeakPolarHBondContact CG-O 3.37Å; C1249-G1253 PolarHBondContact O-N 2.82Å; L1250-G1253 CarbonylContact O-C 3.6Å; L1250-G1253 PolarHBondContact O-N 3Å
1254	G	83.8	Confident	77.3	Confident	40 Å²	40	77.3 Å²	77.3	41%	0.412	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	20	174.8	0	0	0	0	0	116	N1223 L1250 V1251 I1252 V1256	N1223-G1254 PolarHBondContact ND2-O 2.87Å; N1223-G1254 PolarHBondContact OD1-O 2.78Å; L1250-G1254 PolarHBondContact O-N 3.44Å; V1251-G1254 PolarHBondContact O-N 3.28Å; I1252-G1254 PolarHBondContact O-N 3.12Å; G1254-V1256 PolarHBondContact O-N 2.79Å
1255	A	84.6	Confident	76.4	Confident	7 Å²	7	69.3 Å²	69.3	6%	0.058	38%	0.379	C	S	.	.			trans	-68.5	113.3	173.4	0	0	0	0	0	111.1	P1222 N1223 R1233 L1250	P1222-A1255 HydrophobicContact CB-CB 3.88Å; P1222-A1255 HydrophobicContact CG-CB 4.11Å; N1223-A1255 WeakPolarHBondContact OD1-CA 3.2Å; R1233-A1255 HydrophobicContact CB-CB 4.15Å; R1233-A1255 HydrophobicContact CG-CB 4.45Å; R1233-A1255 PolarHBondContact NH1-O 2.86Å; L1250-A1255 HydrophobicContact CB-CB 3.88Å; L1250-A1255 WeakPolarHBondContact O-CB 3.49Å; L1250-A1255 PolarHBondContact O-N 3.46Å
1256	V	82.4	Confident	75.2	Confident	94 Å²	94	67.7 Å²	67.7	57%	0.57	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-66.9	167.2	177.1	-54.2	0	0	0	0	111.4	N1223 R1233 G1254	N1223-V1256 WeakPolarHBondContact OD1-CG2 3.45Å; N1223-V1256 PolarHBondContact OD1-N 2.69Å; R1233-V1256 WeakPolarHBondContact CD-O 3.3Å; R1233-V1256 PolarHBondContact NH1-O 3.03Å; G1254-V1256 PolarHBondContact O-N 2.79Å
1257	R	73.9	Confident	73.8	Confident	122 Å²	122	70.7 Å²	70.7	46%	0.46	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-88	148.2	168.4	-65.8	169.9	-175.8	-104.3	12.4	108.6	C1269 M1270	R1257-C1269 VanDerWaalsContact NH1-C 3.26Å; R1257-C1269 PolarHBondContact NH1-O 3.37Å; R1257-M1270 PolarHBondContact NH1-O 2.83Å
1258	C	72.8	Confident	72.4	Confident	36 Å²	36	71 Å²	71	24%	0.243	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-66.1	162.5	173.5	66.9	0	0	0	0	111.3	H1262 C1265	C1258-H1262 HydrophobicContact CB-CB 3.82Å; C1258-C1265 PolarHBondContact SG-SG 3.45Å
1259	N	67.6	Low	71.1	Confident	111 Å²	111	68.8 Å²	68.8	59%	0.594	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-66.4	161.9	167	69.2	34.6	0	0	0	111	N1261 H1262	N1259-N1261 PolarHBondContact O-N 2.96Å; N1259-N1261 VanDerWaalsContact O-N 3.09Å; N1259-N1261 PolarHBondContact OD1-N 3.4Å; N1259-H1262 PolarHBondContact O-N 2.91Å; N1259-H1262 PolarHBondContact OD1-N 2.8Å; N1259-H1262 VanDerWaalsContact OD1-N 3.11Å
1260	M	60.4	Low	69.3	Low	188 Å²	188	75.6 Å²	75.6	93%	0.926	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.7	-175.1	-62.9	-119.9	-68.4	0	0	114.2
1261	N	63.4	Low	67.1	Low	143 Å²	143	82.9 Å²	82.9	77%	0.765	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	4.4	-173.3	-63.2	-10.5	0	0	0	113	N1259 R1263	N1259-N1261 PolarHBondContact O-N 2.96Å; N1259-N1261 VanDerWaalsContact O-N 3.09Å; N1259-N1261 PolarHBondContact OD1-N 3.4Å; N1261-R1263 PolarHBondContact O-N 3.11Å; N1261-R1263 VanDerWaalsContact O-N 3.17Å
1262	H	66.1	Low	64.8	Low	54 Å²	54	90.9 Å²	90.9	25%	0.25	48%	0.484	C	S	.	.			trans	-73.1	106.8	-178.1	-169	84	0	0	0	111.3	G1229 H1234 C1258 N1259 G1264	G1229-H1262 PolarHBondContact O-CE1 3.01Å; G1229-H1262 VanDerWaalsContact O-CE1 3.25Å; H1234-H1262 AromaticContact CE1-CD2 3.52Å; H1234-H1262 AromaticContact CE1-CE1 3.64Å; H1234-H1262 AromaticContact CE1-NE2 3.16Å; H1234-H1262 PolarHBondContact CE1-NE2 3.33Å; H1234-H1262 AromaticContact ND1-CD2 3.76Å; H1234-H1262 AromaticContact ND1-CE1 3.94Å; H1234-H1262 AromaticContact ND1-NE2 3.17Å; H1234-H1262 PolarHBondContact ND1-NE2 2.95Å; H1234-H1262 VanDerWaalsContact ND1-NE2 3.17Å; C1258-H1262 HydrophobicContact CB-CB 3.82Å; N1259-H1262 PolarHBondContact O-N 2.91Å; N1259-H1262 PolarHBondContact OD1-N 2.8Å; N1259-H1262 VanDerWaalsContact OD1-N 3.11Å; H1262-G1264 PolarHBondContact O-N 2.98Å
1263	R	59.7	Low	62.4	Low	237 Å²	237	95 Å²	95	89%	0.894	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	134.9	-176.6	-60.7	-175.8	-174.4	-177.4	2.9	111.1	N1261	N1261-R1263 PolarHBondContact O-N 3.11Å; N1261-R1263 VanDerWaalsContact O-N 3.17Å
1264	G	58.1	Low	59.9	Low	57 Å²	57	98.6 Å²	98.6	59%	0.588	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	12.4	174.6	0	0	0	0	0	115.9	H1262	H1262-G1264 PolarHBondContact O-N 2.98Å
1265	C	62.7	Low	57.3	Low	39 Å²	39	101.6 Å²	101.6	26%	0.264	54%	0.537	S	S	.	.			trans	-84.5	132.9	170.9	-156.8	0	0	0	0	111.5	C1258 C1269	C1258-C1265 PolarHBondContact SG-SG 3.45Å; C1265-C1269 VanDerWaalsContact SG-CB 3.52Å
1266	V	60.6	Low	54.5	Low	71 Å²	71	110.3 Å²	110.3	43%	0.43	58%	0.577	S	S	.	*			trans	-90	162.5	-175.5	-132.7	0	0	0	0	111.9	A1237 R1238 G1268 C1269	A1237-V1266 HydrophobicContact CB-CG2 4.09Å; A1237-V1266 WeakPolarHBondContact O-CG2 3.39Å; R1238-V1266 HydrophobicContact CG-CG2 4.05Å; V1266-G1268 PolarHBondContact O-N 3.15Å; V1266-C1269 PolarHBondContact O-N 3.03Å; V1266-C1269 VanDerWaalsContact O-N 3.08Å
1267	A	57.5	Low	51.9	Low	66 Å²	66	112.5 Å²	112.5	55%	0.545	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-50.6	-23.9	-171.6	0	0	0	0	0	116.2	C1269 M1270	A1267-C1269 PolarHBondContact O-N 2.68Å; A1267-M1270 HydrophobicContact CB-CE 4.09Å; A1267-M1270 PolarHBondContact O-N 2.91Å; A1267-M1270 VanDerWaalsContact O-N 3.08Å
1268	G	55.5	Low	49.7	Very low	45 Å²	45	115.8 Å²	115.8	46%	0.464	61%	0.606	S	S	.	*	G	3₁₀ helix	trans	-60.7	-6.1	174.3	0	0	0	0	0	115.8	V1266	V1266-G1268 PolarHBondContact O-N 3.15Å
1269	C	60.1	Low	47.6	Very low	14 Å²	14	119.7 Å²	119.7	10%	0.095	63%	0.629	C	S	.	*	G	3₁₀ helix	trans	-94.7	-8.7	173.4	-138.2	0	0	0	0	114.5	R1257 C1265 V1266 A1267	R1257-C1269 VanDerWaalsContact NH1-C 3.26Å; R1257-C1269 PolarHBondContact NH1-O 3.37Å; C1265-C1269 VanDerWaalsContact SG-CB 3.52Å; V1266-C1269 PolarHBondContact O-N 3.03Å; V1266-C1269 VanDerWaalsContact O-N 3.08Å; A1267-C1269 PolarHBondContact O-N 2.68Å
1270	M	48.7	Very low	45.6	Very low	145 Å²	145	120.9 Å²	120.9	71%	0.714	64%	0.64	S	S	*	*			trans	-75	154.2	-168	-64.6	-159.5	-59.4	0	0	116	R1257 A1267	R1257-M1270 PolarHBondContact NH1-O 2.83Å; A1267-M1270 HydrophobicContact CB-CE 4.09Å; A1267-M1270 PolarHBondContact O-N 2.91Å; A1267-M1270 VanDerWaalsContact O-N 3.08Å
1271	Y	43.2	Very low	44.2	Very low	155 Å²	155	116.7 Å²	116.7	61%	0.608	63%	0.629	S	S	*	*			trans	-101.5	158.7	-150.6	173.3	-104.2	0	0	0	115.9	N1273	Y1271-N1273 HydrophobicContact CE1-CB 4.44Å; Y1271-N1273 WeakPolarHBondContact CE1-OD1 3.34Å; Y1271-N1273 PolarHBondContact OH-OD1 3.08Å; Y1271-N1273 VanDerWaalsContact OH-OD1 3.09Å
1272	R	36.1	Very low	42.6	Very low	231 Å²	231	118.4 Å²	118.4	87%	0.872	63%	0.633	S	S	*	*			trans	-148	151.9	152.4	-116	179.1	-179.6	-179.2	-0.6	110
1273	N	32.6	Very low	41	Very low	114 Å²	114	121.2 Å²	121.2	61%	0.61	66%	0.657	S	S	*	*			trans	-70.8	164.6	-163.9	-65.7	-67.5	0	0	0	116.2	Y1271	Y1271-N1273 HydrophobicContact CE1-CB 4.44Å; Y1271-N1273 WeakPolarHBondContact CE1-OD1 3.34Å; Y1271-N1273 PolarHBondContact OH-OD1 3.08Å; Y1271-N1273 VanDerWaalsContact OH-OD1 3.09Å
1274	S	29.1	Very low	39.7	Very low	102 Å²	102	116.4 Å²	116.4	71%	0.713	65%	0.654	S	S	*	*			trans	50.4	131	142.3	59.3	0	0	0	0	118.5
1275	V	28.7	Very low	38.9	Very low	103 Å²	103	116.6 Å²	116.6	62%	0.624	65%	0.646	S	S	*	*				-149.5	142.8	57.6	167.3	0	0	0	0	110.7	D1277	V1275-D1277 HydrophobicContact CG1-CB 3.96Å; V1275-D1277 WeakPolarHBondContact CG1-OD2 3.47Å
1276	E	25.4	Very low	38.2	Very low	190 Å²	190	119.2 Å²	119.2	89%	0.888	68%	0.68	S	S	*	*			trans	-128.3	102.8	156.5	-71.3	-175.5	154.9	0	0	106.4
1277	D	28.1	Very low	37.9	Very low	139 Å²	139	119.6 Å²	119.6	74%	0.743	68%	0.676	S	S	*	*			trans	-111.2	134.6	178.2	-82.8	-38.7	0	0	0	109.7	V1275	V1275-D1277 HydrophobicContact CG1-CB 3.96Å; V1275-D1277 WeakPolarHBondContact CG1-OD2 3.47Å
1278	E	27.6	Very low	38.3	Very low	191 Å²	191	122.5 Å²	122.5	89%	0.893	68%	0.676	S	S	*	*			trans	-75.5	133	-177.3	-60.2	175.6	118.5	0	0	111.6
1279	V	27.8	Very low	39.4	Very low	119 Å²	119	122.2 Å²	122.2	72%	0.721	66%	0.664	S	S	*	*			trans	-135.3	91.9	167.7	-173.5	0	0	0	0	110.1
1280	T	26.6	Very low	40.7	Very low	135 Å²	135	123.6 Å²	123.6	83%	0.828	67%	0.668	S	S	*	*			trans	-119.6	113.1	166.7	44.2	0	0	0	0	108.9
1281	S	30	Very low	42.8	Very low	101 Å²	101	116.9 Å²	116.9	71%	0.706	64%	0.635	S	S	*	*			trans	-136.9	110.4	175.3	62.2	0	0	0	0	110.7
1282	E	31.1	Very low	45.3	Very low	179 Å²	179	109.5 Å²	109.5	84%	0.836	61%	0.606	S	S	*	*			trans	-2.3	131.7	163	-56.5	177.8	148.4	0	0	118.7
1283	C	31	Very low	48.1	Very low	113 Å²	113	98.6 Å²	98.6	76%	0.764	57%	0.565	S	S	*	*			trans	-132.6	97.6	158.2	-81.4	0	0	0	0	108.9	S1285	C1283-S1285 PolarHBondContact O-N 2.72Å
1284	T	33.7	Very low	51.2	Low	136 Å²	136	93.2 Å²	93.2	83%	0.834	54%	0.536	S	S	*	.			trans	-90.1	83.6	-172.9	36.3	0	0	0	0	112.1
1285	S	40.6	Very low	54.5	Low	60 Å²	60	88.3 Å²	88.3	42%	0.42	50%	0.502	S	S	.	.			trans	-138.7	125.5	169.5	-177.5	0	0	0	0	110.4	C1283 K1287	C1283-S1285 PolarHBondContact O-N 2.72Å; S1285-K1287 PolarHBondContact O-N 2.9Å; S1285-K1287 VanDerWaalsContact O-N 3.1Å
1286	G	47.6	Very low	57.7	Low	94 Å²	94	83.4 Å²	83.4	97%	0.969	47%	0.472	S	S	*	.			trans	-81	31.1	-179.5	0	0	0	0	0	114.5
1287	K	55.9	Low	61	Low	80 Å²	80	74.4 Å²	74.4	35%	0.348	43%	0.43	S	S	.	.	S	Bend	trans	-111.4	144.3	-177.9	-68.5	-167.6	178.4	-164.8	0	111.1	S1285 L1289 E1506 E1508	S1285-K1287 PolarHBondContact O-N 2.9Å; S1285-K1287 VanDerWaalsContact O-N 3.1Å; K1287-L1289 PolarHBondContact O-N 3.46Å; K1287-L1289 VanDerWaalsContact O-N 3.13Å; K1287-E1506 IonicContact NZ-OE2 2.88Å; K1287-E1506 PolarHBondContact NZ-OE2 3.26Å; K1287-E1508 VanDerWaalsContact CD-CD 3.45Å; K1287-E1508 VanDerWaalsContact CD-OE1 3.31Å; K1287-E1508 WeakPolarHBondContact CD-OE1 3.48Å; K1287-E1508 WeakPolarHBondContact CD-OE2 3.41Å; K1287-E1508 IonicContact NZ-OE1 3.26Å; K1287-E1508 PolarHBondContact NZ-OE1 3.41Å
1288	K	64.8	Low	63.8	Low	126 Å²	126	68.1 Å²	68.1	55%	0.548	40%	0.398	S	S	.	.			trans	-88.6	79.3	-173.4	-164	173.5	-161	80.2	0	112.4	Q1627	K1288-Q1627 PolarHBondContact NZ-O 3.44Å; K1288-Q1627 PolarHBondContact NZ-OXT 3.41Å
1289	L	79.3	Confident	66.7	Low	40 Å²	40	60.2 Å²	60.2	21%	0.209	37%	0.368	C	S	.	.			trans	-61.1	152.1	-178.3	-64	177.9	0	0	0	113.4	K1287 E1508 L1624	K1287-L1289 PolarHBondContact O-N 3.46Å; K1287-L1289 VanDerWaalsContact O-N 3.13Å; L1289-E1508 HydrophobicContact CD2-CB 3.67Å; L1289-L1624 HydrophobicContact CB-CD2 3.55Å; L1289-L1624 HydrophobicContact CD1-CD2 3.64Å; L1289-L1624 HydrophobicContact CG-CD2 4.25Å
1290	K	86.5	Confident	69.7	Low	43 Å²	43	54.7 Å²	54.7	19%	0.187	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	135.5	-173.7	-60.8	-65.8	169.8	-163.6	0	115	L1292 D1325 L1507 E1508 G1510 C1511	K1290-L1292 HydrophobicContact CB-CD2 4.28Å; K1290-D1325 WeakPolarHBondContact CA-OD2 3.49Å; K1290-D1325 HydrophobicContact CB-CB 4.37Å; K1290-D1325 HydrophobicContact CD-CB 3.77Å; K1290-D1325 VanDerWaalsContact CD-OD1 3.25Å; K1290-D1325 WeakPolarHBondContact CD-OD1 3.32Å; K1290-D1325 WeakPolarHBondContact CD-OD2 3.49Å; K1290-D1325 IonicContact NZ-OD1 2.6Å; K1290-D1325 PolarHBondContact NZ-OD1 3.16Å; K1290-D1325 IonicContact NZ-OD2 3.87Å; K1290-L1507 HydrophobicContact CG-CG 4.48Å; K1290-E1508 WeakPolarHBondContact CB-O 3.19Å; K1290-E1508 WeakPolarHBondContact CG-O 3.37Å; K1290-E1508 PolarHBondContact N-O 3.28Å; K1290-G1510 PolarHBondContact O-N 3.06Å; K1290-C1511 PolarHBondContact O-N 3.22Å
1291	F	92.8	Very high	72.9	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.018	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.3	172.9	178.4	-137.6	0	0	0	111.6	L1320 V1324 D1325 W1326 C1511 L1513 I1621	F1291-L1320 HydrophobicContact CE1-CD1 4.23Å; F1291-V1324 HydrophobicContact CD1-CB 4.47Å; F1291-V1324 HydrophobicContact CD1-CG2 3.94Å; F1291-V1324 HydrophobicContact CE1-CG2 3.76Å; F1291-D1325 PolarHBondContact N-OD2 2.85Å; F1291-D1325 VanDerWaalsContact N-OD2 3.11Å; F1291-D1325 PolarHBondContact O-N 3.12Å; F1291-W1326 PolarHBondContact O-N 3.35Å; F1291-C1511 HydrophobicContact CD2-CB 4.12Å; F1291-L1513 HydrophobicContact CE2-CB 3.71Å; F1291-L1513 HydrophobicContact CZ-CB 3.98Å; F1291-L1513 HydrophobicContact CZ-CD2 4.01Å; F1291-I1621 HydrophobicContact CD1-CG1 4.4Å; F1291-I1621 HydrophobicContact CD1-CG2 4.45Å; F1291-I1621 HydrophobicContact CD2-CG1 4.32Å; F1291-I1621 HydrophobicContact CE1-CD1 3.87Å; F1291-I1621 HydrophobicContact CE1-CG1 4.07Å; F1291-I1621 HydrophobicContact CE1-CG2 4.4Å; F1291-I1621 HydrophobicContact CE2-CD1 4.02Å; F1291-I1621 HydrophobicContact CE2-CG1 3.98Å; F1291-I1621 HydrophobicContact CZ-CD1 3.5Å; F1291-I1621 VanDerWaalsContact CZ-CD1 3.5Å; F1291-I1621 HydrophobicContact CZ-CG1 3.86Å
1292	L	95	Very high	75.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	133.5	-177.7	-41.9	-178	0	0	0	110.8	K1290 W1326 L1471 L1472 I1475 I1509 C1511 L1512 L1513	K1290-L1292 HydrophobicContact CB-CD2 4.28Å; L1292-W1326 HydrophobicContact CD2-CB 3.68Å; L1292-W1326 HydrophobicContact CD2-CG 3.91Å; L1292-L1471 HydrophobicContact CB-CD2 4.12Å; L1292-L1472 HydrophobicContact CD1-CD2 4.27Å; L1292-I1475 HydrophobicContact CD1-CD1 3.58Å; L1292-I1475 HydrophobicContact CD2-CD1 3.75Å; L1292-I1475 HydrophobicContact CG-CD1 4.31Å; L1292-I1509 HydrophobicContact CD1-CB 4.44Å; L1292-I1509 HydrophobicContact CD1-CD1 4.03Å; L1292-I1509 HydrophobicContact CD1-CG1 4.14Å; L1292-I1509 HydrophobicContact CD1-CG2 3.45Å; L1292-I1509 VanDerWaalsContact CD1-CG2 3.45Å; L1292-I1509 HydrophobicContact CG-CG2 3.83Å; L1292-C1511 PolarHBondContact N-O 3.47Å; L1292-L1512 HydrophobicContact CB-CB 4.36Å; L1292-L1512 HydrophobicContact CB-CG 4.09Å; L1292-L1512 HydrophobicContact CD1-CB 4.44Å; L1292-L1512 HydrophobicContact CD1-CD1 4.09Å; L1292-L1512 HydrophobicContact CD1-CG 4.37Å; L1292-L1513 PolarHBondContact O-N 3.25Å
1293	L	96.6	Very high	78.9	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.6	175.3	177.9	56.4	0	0	0	111.1	L1295 L1309 L1320 V1324 W1326 L1327 A1328 L1513 L1515	L1293-L1295 HydrophobicContact CD1-CD2 3.93Å; L1293-L1295 HydrophobicContact CD2-CD2 4.5Å; L1293-L1295 HydrophobicContact CG-CD2 4.16Å; L1293-L1295 HydrophobicContact CG-CG 4.35Å; L1293-L1309 HydrophobicContact CD2-CD2 4.25Å; L1293-L1320 HydrophobicContact CD2-CD2 4.08Å; L1293-V1324 HydrophobicContact CB-CG1 4.04Å; L1293-V1324 HydrophobicContact CB-CG2 4.18Å; L1293-V1324 HydrophobicContact CD2-CG2 4.1Å; L1293-W1326 PolarHBondContact N-O 3.4Å; L1293-L1327 HydrophobicContact CB-CD1 3.86Å; L1293-L1327 HydrophobicContact CD2-CD1 3.83Å; L1293-L1327 HydrophobicContact CG-CD1 3.69Å; L1293-L1327 CarbonylContact O-C 3.45Å; L1293-L1327 WeakPolarHBondContact O-CA 3.49Å; L1293-A1328 PolarHBondContact O-N 3.4Å; L1293-L1513 CarbonylContact C-O 3.56Å; L1293-L1513 WeakPolarHBondContact CA-O 3.26Å; L1293-L1513 HydrophobicContact CD1-CB 4.22Å; L1293-L1513 HydrophobicContact CD1-CD2 3.93Å; L1293-L1513 HydrophobicContact CD1-CG 3.93Å; L1293-L1515 HydrophobicContact CD1-CD1 4.39Å; L1293-L1515 HydrophobicContact CD1-CG 4.41Å
1294	S	96.9	Very high	82	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.2	-179.9	-170.5	0	0	0	0	110.7	S1468 L1513 N1514 L1515	S1294-S1468 WeakPolarHBondContact CB-OG 3.39Å; S1294-S1468 WeakPolarHBondContact OG-CA 3.35Å; S1294-S1468 PolarHBondContact OG-N 3.37Å; S1294-S1468 PolarHBondContact OG-OG 2.88Å; S1294-L1513 PolarHBondContact N-O 2.98Å; S1294-N1514 WeakPolarHBondContact O-CA 3.45Å; S1294-L1515 PolarHBondContact O-N 2.9Å
1295	L	97.9	Very high	85.1	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	116.7	-174.5	-59.6	-176.7	0	0	0	111.5	L1293 L1305 L1309 L1327 A1328 G1329 T1330 L1336 A1337 L1515	L1293-L1295 HydrophobicContact CD1-CD2 3.93Å; L1293-L1295 HydrophobicContact CD2-CD2 4.5Å; L1293-L1295 HydrophobicContact CG-CD2 4.16Å; L1293-L1295 HydrophobicContact CG-CG 4.35Å; L1295-L1305 HydrophobicContact CB-CD1 4.27Å; L1295-L1309 HydrophobicContact CD2-CD1 4.35Å; L1295-L1327 HydrophobicContact CD1-CD1 4.25Å; L1295-L1327 HydrophobicContact CG-CD1 4.39Å; L1295-A1328 PolarHBondContact N-O 3.36Å; L1295-G1329 WeakPolarHBondContact O-CA 3.14Å; L1295-T1330 PolarHBondContact O-N 3.08Å; L1295-L1336 HydrophobicContact CD1-CB 4.33Å; L1295-L1336 HydrophobicContact CD1-CD2 4.22Å; L1295-L1336 HydrophobicContact CD1-CG 4.08Å; L1295-A1337 HydrophobicContact CD1-CB 4.2Å; L1295-L1515 HydrophobicContact CD2-CB 3.97Å; L1295-L1515 HydrophobicContact CD2-CD1 4.01Å; L1295-L1515 HydrophobicContact CD2-CG 4.31Å
1296	D	97.1	Very high	87.8	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.131	C	C	.	.			trans	-65.6	158.5	-178.7	-76	2.9	0	0	0	114.5	G1333 N1465 N1466 L1515 G1516 T1517 T1556 R1577	D1296-G1333 WeakPolarHBondContact O-CA 3.48Å; D1296-G1333 PolarHBondContact O-N 3.13Å; D1296-N1465 VanDerWaalsContact CA-O 3.29Å; D1296-N1465 WeakPolarHBondContact CA-O 3.45Å; D1296-N1466 VanDerWaalsContact OD1-CA 3.29Å; D1296-N1466 WeakPolarHBondContact OD1-CA 3.31Å; D1296-N1466 VanDerWaalsContact OD1-CB 3.31Å; D1296-N1466 WeakPolarHBondContact OD1-CB 3.17Å; D1296-L1515 PolarHBondContact N-O 3.26Å; D1296-G1516 VanDerWaalsContact OD2-CA 3.25Å; D1296-G1516 WeakPolarHBondContact OD2-CA 3.32Å; D1296-T1517 HydrophobicContact CB-CG2 4.21Å; D1296-T1556 HydrophobicContact CB-CG2 3.89Å; D1296-T1556 WeakPolarHBondContact OD2-CB 3.33Å; D1296-T1556 VanDerWaalsContact OD2-CG2 3.23Å; D1296-T1556 WeakPolarHBondContact OD2-CG2 3.42Å; D1296-R1577 IonicContact OD1-NH1 3.23Å; D1296-R1577 PolarHBondContact OD1-NH1 3.28Å; D1296-R1577 IonicContact OD2-CZ 2.62Å; D1296-R1577 IonicContact OD2-NH1 2.77Å; D1296-R1577 PolarHBondContact OD2-NH1 3.33Å; D1296-R1577 IonicContact OD2-NH2 2.66Å; D1296-R1577 PolarHBondContact OD2-NH2 2.89Å
1297	G	93.1	Very high	90	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.087	C	C	.	.			trans	-77.1	165.5	164.3	0	0	0	0	0	113.9	T1330 N1465 T1517	G1297-T1330 WeakPolarHBondContact CA-O 3.26Å; G1297-T1330 PolarHBondContact N-O 3.35Å; G1297-N1465 WeakPolarHBondContact CA-OD1 3.26Å; G1297-N1465 PolarHBondContact N-O 3.39Å; G1297-N1465 PolarHBondContact N-OD1 2.94Å; G1297-T1517 WeakPolarHBondContact O-CB 3.34Å; G1297-T1517 VanDerWaalsContact O-CG2 3.26Å; G1297-T1517 WeakPolarHBondContact O-CG2 3.42Å; G1297-T1517 PolarHBondContact O-OG1 3.27Å
1298	G	87.8	Confident	92	Very high	7 Å²	7	13.8 Å²	13.8	7%	0.072	7%	0.07	C	C	.	.			trans	158.5	15.7	-177.8	0	0	0	0	0	118.6	I1300 R1301 L1588	G1298-I1300 PolarHBondContact O-N 3.02Å; G1298-R1301 WeakPolarHBondContact O-CB 3.38Å; G1298-R1301 VanDerWaalsContact O-CG 3.29Å; G1298-R1301 WeakPolarHBondContact O-CG 3.41Å; G1298-R1301 PolarHBondContact O-N 2.74Å; G1298-L1588 VanDerWaalsContact C-CD2 3.42Å; G1298-L1588 VanDerWaalsContact O-CD2 3.3Å; G1298-L1588 WeakPolarHBondContact O-CD2 3.5Å
1299	G	89	Confident	93.5	Very high	25 Å²	25	7.8 Å²	7.8	26%	0.258	4%	0.044	S	C	.	.	G	3₁₀ helix	trans	61.3	-134.4	179.3	0	0	0	0	0	113.1	R1301 G1302 T1332	G1299-R1301 PolarHBondContact O-N 2.78Å; G1299-R1301 VanDerWaalsContact O-N 3.07Å; G1299-G1302 PolarHBondContact O-N 2.8Å; G1299-T1332 WeakPolarHBondContact O-CB 3.44Å; G1299-T1332 PolarHBondContact O-OG1 3.26Å
1300	I	90.4	Very high	94.3	Very high	4 Å²	4	7.2 Å²	7.2	2%	0.021	4%	0.041	C	C	.	.	G	3₁₀ helix	trans	-63.1	-15.8	-179.4	-162.9	54.9	0	0	0	113.7	G1298 G1302 L1303 Y1353 K1357 F1361 L1588	G1298-I1300 PolarHBondContact O-N 3.02Å; I1300-G1302 PolarHBondContact O-N 2.99Å; I1300-L1303 HydrophobicContact CD1-CD1 4.05Å; I1300-L1303 HydrophobicContact CG1-CD1 4.26Å; I1300-L1303 PolarHBondContact O-N 3.1Å; I1300-Y1353 HydrophobicContact CD1-CD1 4.31Å; I1300-Y1353 WeakPolarHBondContact CD1-O 3.45Å; I1300-K1357 HydrophobicContact CD1-CB 4Å; I1300-K1357 HydrophobicContact CG1-CB 4.46Å; I1300-F1361 HydrophobicContact CB-CE2 4.24Å; I1300-L1588 WeakPolarHBondContact CG2-O 3.36Å; I1300-L1588 PolarHBondContact N-O 2.89Å
1301	R	92.8	Very high	94.6	Very high	30 Å²	30	6.4 Å²	6.4	11%	0.113	4%	0.037	C	C	.	.	G	3₁₀ helix	trans	-59.7	-10.4	170.1	-57.8	-175.1	-171	-174	-0.1	113.5	G1298 G1299 L1303 I1304 T1517 D1585 Y1586 M1599	G1298-R1301 WeakPolarHBondContact O-CB 3.38Å; G1298-R1301 VanDerWaalsContact O-CG 3.29Å; G1298-R1301 WeakPolarHBondContact O-CG 3.41Å; G1298-R1301 PolarHBondContact O-N 2.74Å; G1299-R1301 PolarHBondContact O-N 2.78Å; G1299-R1301 VanDerWaalsContact O-N 3.07Å; R1301-L1303 PolarHBondContact O-N 2.85Å; R1301-L1303 VanDerWaalsContact O-N 3.1Å; R1301-I1304 HydrophobicContact CB-CD1 4.11Å; R1301-I1304 HydrophobicContact CG-CD1 4.5Å; R1301-I1304 VanDerWaalsContact O-CB 3.24Å; R1301-I1304 WeakPolarHBondContact O-CB 3.38Å; R1301-I1304 PolarHBondContact O-N 3.33Å; R1301-T1517 HydrophobicContact CB-CG2 4.19Å; R1301-T1517 VanDerWaalsContact CD-O 3.25Å; R1301-T1517 WeakPolarHBondContact CD-O 3.22Å; R1301-D1585 IonicContact CZ-OD1 2.69Å; R1301-D1585 IonicContact NH1-OD1 3.98Å; R1301-D1585 IonicContact NH2-OD1 2.72Å; R1301-D1585 PolarHBondContact NH2-OD1 2.88Å; R1301-Y1586 PolarHBondContact NE-O 3.27Å; R1301-Y1586 PolarHBondContact NH2-O 3.48Å; R1301-M1599 HydrophobicContact CG-SD 4.21Å
1302	G	93.3	Very high	94.7	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-52.7	-26	168.8	0	0	0	0	0	113.8	G1299 I1300 I1304 L1305 V1306 T1332	G1299-G1302 PolarHBondContact O-N 2.8Å; I1300-G1302 PolarHBondContact O-N 2.99Å; G1302-I1304 PolarHBondContact O-N 2.92Å; G1302-L1305 WeakPolarHBondContact O-CB 3.46Å; G1302-L1305 PolarHBondContact O-N 3.39Å; G1302-L1305 VanDerWaalsContact O-N 3.12Å; G1302-V1306 WeakPolarHBondContact O-CG2 3.22Å; G1302-V1306 PolarHBondContact O-N 3Å; G1302-T1332 WeakPolarHBondContact CA-OG1 3.28Å
1303	L	95.1	Very high	94.7	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-60	-28.6	170.8	-75.4	169.3	0	0	0	113.7	I1300 R1301 V1306 Q1307 Q1350 Y1353 L1354 V1596 M1599 M1600	I1300-L1303 HydrophobicContact CD1-CD1 4.05Å; I1300-L1303 HydrophobicContact CG1-CD1 4.26Å; I1300-L1303 PolarHBondContact O-N 3.1Å; R1301-L1303 PolarHBondContact O-N 2.85Å; R1301-L1303 VanDerWaalsContact O-N 3.1Å; L1303-V1306 PolarHBondContact O-N 3.42Å; L1303-Q1307 WeakPolarHBondContact O-CG 3.38Å; L1303-Q1307 PolarHBondContact O-N 3.03Å; L1303-Q1350 HydrophobicContact CD2-CG 3.9Å; L1303-Y1353 HydrophobicContact CD2-CG 4.33Å; L1303-Y1353 HydrophobicContact CG-CG 4.31Å; L1303-L1354 HydrophobicContact CD1-CD2 3.94Å; L1303-L1354 HydrophobicContact CD1-CG 4.47Å; L1303-L1354 HydrophobicContact CD2-CG 4.46Å; L1303-V1596 HydrophobicContact CD1-CG1 3.42Å; L1303-V1596 VanDerWaalsContact CD1-CG1 3.42Å; L1303-M1599 HydrophobicContact CB-CE 3.97Å; L1303-M1599 HydrophobicContact CD1-CE 4.35Å; L1303-M1600 HydrophobicContact CB-CG 4.12Å; L1303-M1600 HydrophobicContact CB-SD 4.36Å; L1303-M1600 HydrophobicContact CD1-SD 4.39Å; L1303-M1600 HydrophobicContact CD2-SD 4.1Å
1304	I	96.7	Very high	94.5	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.005	7%	0.074	C	C	.	.	H	α-helix	trans	-65.4	-46.1	173.3	-64.7	166.8	0	0	0	109.9	R1301 G1302 V1306 Q1307 M1308 T1517 P1580 M1582 M1599 T1603	R1301-I1304 HydrophobicContact CB-CD1 4.11Å; R1301-I1304 HydrophobicContact CG-CD1 4.5Å; R1301-I1304 VanDerWaalsContact O-CB 3.24Å; R1301-I1304 WeakPolarHBondContact O-CB 3.38Å; R1301-I1304 PolarHBondContact O-N 3.33Å; G1302-I1304 PolarHBondContact O-N 2.92Å; I1304-V1306 VanDerWaalsContact C-N 3.33Å; I1304-V1306 PolarHBondContact O-N 3.42Å; I1304-Q1307 PolarHBondContact O-N 3.41Å; I1304-M1308 HydrophobicContact CG2-CE 4.16Å; I1304-M1308 WeakPolarHBondContact O-CG 3.46Å; I1304-M1308 PolarHBondContact O-N 2.88Å; I1304-T1517 VanDerWaalsContact CD1-O 3.27Å; I1304-T1517 WeakPolarHBondContact CD1-O 3.11Å; I1304-P1580 HydrophobicContact CG2-CG 3.52Å; I1304-M1582 HydrophobicContact CD1-CE 3.68Å; I1304-M1582 HydrophobicContact CD1-SD 4.11Å; I1304-M1582 HydrophobicContact CG1-CE 4.14Å; I1304-M1599 HydrophobicContact CD1-CG 3.63Å; I1304-M1599 HydrophobicContact CD1-SD 3.81Å; I1304-M1599 HydrophobicContact CG1-CE 4.44Å; I1304-M1599 HydrophobicContact CG1-CG 3.69Å; I1304-M1599 HydrophobicContact CG1-SD 4.05Å; I1304-T1603 HydrophobicContact CG2-CG2 3.93Å
1305	L	97.4	Very high	94.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-58.5	-48.3	175.7	-53.2	177.4	0	0	0	110.2	L1295 G1302 Q1307 M1308 L1309 T1332 L1336 L1515 T1517	L1295-L1305 HydrophobicContact CB-CD1 4.27Å; G1302-L1305 WeakPolarHBondContact O-CB 3.46Å; G1302-L1305 PolarHBondContact O-N 3.39Å; G1302-L1305 VanDerWaalsContact O-N 3.12Å; L1305-Q1307 VanDerWaalsContact C-N 3.34Å; L1305-Q1307 PolarHBondContact O-N 2.9Å; L1305-M1308 HydrophobicContact CD2-CE 4.18Å; L1305-M1308 PolarHBondContact O-N 3.14Å; L1305-L1309 HydrophobicContact CB-CD1 4.48Å; L1305-L1309 WeakPolarHBondContact O-CB 3.29Å; L1305-L1309 WeakPolarHBondContact O-CD1 3.44Å; L1305-L1309 WeakPolarHBondContact O-CG 3.41Å; L1305-L1309 PolarHBondContact O-N 2.84Å; L1305-T1332 HydrophobicContact CD1-CG2 4.39Å; L1305-L1336 HydrophobicContact CB-CD2 3.63Å; L1305-L1336 HydrophobicContact CD1-CD2 4.23Å; L1305-L1515 HydrophobicContact CD2-CB 3.83Å; L1305-L1515 WeakPolarHBondContact CD2-O 3.47Å; L1305-T1517 HydrophobicContact CD1-CG2 3.88Å; L1305-T1517 HydrophobicContact CD2-CG2 3.98Å; L1305-T1517 HydrophobicContact CG-CG2 3.85Å
1306	V	96.9	Very high	93.8	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.5	-44.1	178.1	176.1	0	0	0	0	111.7	G1302 L1303 I1304 L1309 I1310 L1336 L1346 C1349 Q1350 Y1353	G1302-V1306 WeakPolarHBondContact O-CG2 3.22Å; G1302-V1306 PolarHBondContact O-N 3Å; L1303-V1306 PolarHBondContact O-N 3.42Å; I1304-V1306 VanDerWaalsContact C-N 3.33Å; I1304-V1306 PolarHBondContact O-N 3.42Å; V1306-L1309 PolarHBondContact O-N 3.1Å; V1306-I1310 HydrophobicContact CG1-CD1 3.74Å; V1306-I1310 HydrophobicContact CG1-CG1 4.38Å; V1306-I1310 WeakPolarHBondContact O-CB 3.16Å; V1306-I1310 VanDerWaalsContact O-CG1 3.23Å; V1306-I1310 WeakPolarHBondContact O-CG1 3.47Å; V1306-I1310 PolarHBondContact O-N 2.93Å; V1306-L1336 HydrophobicContact CG2-CD1 3.76Å; V1306-L1336 HydrophobicContact CG2-CD2 3.72Å; V1306-L1336 HydrophobicContact CG2-CG 4.41Å; V1306-L1346 WeakPolarHBondContact CG1-O 3.3Å; V1306-C1349 HydrophobicContact CG2-CB 4.33Å; V1306-Q1350 HydrophobicContact CG1-CB 3.81Å; V1306-Q1350 HydrophobicContact CG1-CG 4.29Å; V1306-Y1353 HydrophobicContact CG2-CD2 4.12Å; V1306-Y1353 HydrophobicContact CG2-CE2 4.16Å
1307	Q	95.7	Very high	93.4	Very high	8 Å²	8	20.7 Å²	20.7	4%	0.037	12%	0.117	C	C	.	.	H	α-helix	trans	-66.9	-41.5	178.2	-70.3	-66.1	1.6	0	0	113.1	V1217 L1303 I1304 L1305 L1309 I1310 F1311 M1600 T1603	V1217-Q1307 PolarHBondContact O-NE2 3.28Å; L1303-Q1307 WeakPolarHBondContact O-CG 3.38Å; L1303-Q1307 PolarHBondContact O-N 3.03Å; I1304-Q1307 PolarHBondContact O-N 3.41Å; L1305-Q1307 VanDerWaalsContact C-N 3.34Å; L1305-Q1307 PolarHBondContact O-N 2.9Å; Q1307-L1309 VanDerWaalsContact C-N 3.34Å; Q1307-I1310 PolarHBondContact O-N 3.18Å; Q1307-F1311 PolarHBondContact O-N 3.35Å; Q1307-M1600 HydrophobicContact CG-CB 4.01Å; Q1307-M1600 HydrophobicContact CG-CG 3.9Å; Q1307-M1600 HydrophobicContact CG-SD 4.33Å; Q1307-M1600 PolarHBondContact NE2-SD 2.93Å; Q1307-M1600 VanDerWaalsContact NE2-SD 3.36Å; Q1307-T1603 HydrophobicContact CB-CG2 3.77Å
1308	M	96.6	Very high	93.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-40.7	175.1	-64.9	-167.1	-62.8	0	0	111.6	I1304 L1305 F1311 I1312 L1515 G1516 F1578 T1603 Y1606 M1607	I1304-M1308 HydrophobicContact CG2-CE 4.16Å; I1304-M1308 WeakPolarHBondContact O-CG 3.46Å; I1304-M1308 PolarHBondContact O-N 2.88Å; L1305-M1308 HydrophobicContact CD2-CE 4.18Å; L1305-M1308 PolarHBondContact O-N 3.14Å; M1308-F1311 PolarHBondContact O-N 2.9Å; M1308-I1312 WeakPolarHBondContact O-CD1 3.27Å; M1308-I1312 VanDerWaalsContact O-CG1 3.28Å; M1308-I1312 WeakPolarHBondContact O-CG1 3.41Å; M1308-I1312 PolarHBondContact O-N 3.09Å; M1308-L1515 HydrophobicContact CE-CB 3.81Å; M1308-L1515 HydrophobicContact CE-CD2 4.08Å; M1308-L1515 HydrophobicContact CE-CG 4.4Å; M1308-G1516 VanDerWaalsContact CE-O 3.24Å; M1308-G1516 WeakPolarHBondContact CE-O 3.44Å; M1308-F1578 HydrophobicContact SD-CB 3.75Å; M1308-T1603 HydrophobicContact CG-CG2 3.51Å; M1308-Y1606 HydrophobicContact SD-CE1 4.21Å; M1308-M1607 HydrophobicContact CB-CE 4.39Å; M1308-M1607 HydrophobicContact CB-CG 4.37Å; M1308-M1607 HydrophobicContact CB-SD 4.06Å; M1308-M1607 HydrophobicContact CG-CG 3.89Å; M1308-M1607 HydrophobicContact CG-SD 3.68Å; M1308-M1607 HydrophobicContact SD-SD 3.97Å
1309	L	96.7	Very high	93.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-41.7	175.8	-69.9	161.7	0	0	0	111.8	L1293 L1295 L1305 V1306 Q1307 F1311 I1312 E1313 L1320 L1336 L1340 L1346 L1515	L1293-L1309 HydrophobicContact CD2-CD2 4.25Å; L1295-L1309 HydrophobicContact CD2-CD1 4.35Å; L1305-L1309 HydrophobicContact CB-CD1 4.48Å; L1305-L1309 WeakPolarHBondContact O-CB 3.29Å; L1305-L1309 WeakPolarHBondContact O-CD1 3.44Å; L1305-L1309 WeakPolarHBondContact O-CG 3.41Å; L1305-L1309 PolarHBondContact O-N 2.84Å; V1306-L1309 PolarHBondContact O-N 3.1Å; Q1307-L1309 VanDerWaalsContact C-N 3.34Å; L1309-F1311 VanDerWaalsContact C-N 3.31Å; L1309-F1311 PolarHBondContact O-N 3.4Å; L1309-I1312 PolarHBondContact O-N 3.36Å; L1309-E1313 VanDerWaalsContact O-CB 3.26Å; L1309-E1313 WeakPolarHBondContact O-CB 3.45Å; L1309-E1313 PolarHBondContact O-N 3.43Å; L1309-L1320 HydrophobicContact CD2-CD2 3.25Å; L1309-L1336 HydrophobicContact CD1-CD2 3.68Å; L1309-L1336 HydrophobicContact CD1-CG 4.31Å; L1309-L1340 HydrophobicContact CD1-CD1 4.35Å; L1309-L1346 HydrophobicContact CB-CD1 3.66Å; L1309-L1346 HydrophobicContact CB-CD2 3.56Å; L1309-L1346 HydrophobicContact CB-CG 4.29Å; L1309-L1346 HydrophobicContact CD1-CD2 3.83Å; L1309-L1346 HydrophobicContact CG-CD2 4.3Å; L1309-L1515 HydrophobicContact CD1-CD1 4.27Å; L1309-L1515 HydrophobicContact CD2-CD1 3.36Å; L1309-L1515 HydrophobicContact CG-CD1 3.48Å; L1309-L1515 VanDerWaalsContact CG-CD1 3.48Å
1310	I	95.2	Very high	93.6	Very high	27 Å²	27	28.6 Å²	28.6	14%	0.138	15%	0.15	C	C	.	.	H	α-helix	trans	-61.6	-41.7	176.2	-73.1	166.9	0	0	0	110.4	V1306 Q1307 E1313 S1314 L1346	V1306-I1310 HydrophobicContact CG1-CD1 3.74Å; V1306-I1310 HydrophobicContact CG1-CG1 4.38Å; V1306-I1310 WeakPolarHBondContact O-CB 3.16Å; V1306-I1310 VanDerWaalsContact O-CG1 3.23Å; V1306-I1310 WeakPolarHBondContact O-CG1 3.47Å; V1306-I1310 PolarHBondContact O-N 2.93Å; Q1307-I1310 PolarHBondContact O-N 3.18Å; I1310-E1313 PolarHBondContact O-N 2.98Å; I1310-S1314 PolarHBondContact O-N 3.44Å; I1310-L1346 HydrophobicContact CD1-CB 4.18Å; I1310-L1346 HydrophobicContact CG1-CB 3.57Å; I1310-L1346 HydrophobicContact CG1-CD1 4.01Å; I1310-L1346 HydrophobicContact CG1-CG 4.36Å
1311	F	94.4	Very high	93.8	Very high	26 Å²	26	30 Å²	30	11%	0.114	16%	0.157	C	C	.	.	H	α-helix	trans	-64.8	-43.9	177.4	-167.5	-88.6	0	0	0	111.8	Q1307 M1308 L1309 S1314 F1315 M1607 Q1608 K1611 C1614	Q1307-F1311 PolarHBondContact O-N 3.35Å; M1308-F1311 PolarHBondContact O-N 2.9Å; L1309-F1311 VanDerWaalsContact C-N 3.31Å; L1309-F1311 PolarHBondContact O-N 3.4Å; F1311-S1314 PolarHBondContact O-N 3.09Å; F1311-S1314 PolarHBondContact O-OG 2.73Å; F1311-F1315 AromaticContact CD1-CE2 3.8Å; F1311-F1315 HydrophobicContact CD1-CE2 3.8Å; F1311-F1315 AromaticContact CE1-CE2 3.59Å; F1311-F1315 HydrophobicContact CE1-CE2 3.59Å; F1311-F1315 HydrophobicContact CE1-CZ 4.06Å; F1311-F1315 HydrophobicContact CZ-CE2 4.16Å; F1311-F1315 HydrophobicContact CZ-CZ 4.2Å; F1311-F1315 WeakPolarHBondContact O-CD2 3.44Å; F1311-F1315 VanDerWaalsContact O-CE2 3.3Å; F1311-F1315 WeakPolarHBondContact O-CE2 3.48Å; F1311-M1607 HydrophobicContact CB-CB 4.15Å; F1311-M1607 HydrophobicContact CB-CE 4.35Å; F1311-M1607 HydrophobicContact CB-CG 4.28Å; F1311-M1607 HydrophobicContact CD1-CB 3.66Å; F1311-M1607 HydrophobicContact CD1-CE 3.73Å; F1311-M1607 HydrophobicContact CD1-CG 4.37Å; F1311-M1607 HydrophobicContact CD2-CB 3.84Å; F1311-M1607 HydrophobicContact CE1-CB 3.89Å; F1311-M1607 HydrophobicContact CE1-CE 4.42Å; F1311-M1607 HydrophobicContact CE2-CB 4.07Å; F1311-M1607 HydrophobicContact CG-CB 3.61Å; F1311-M1607 HydrophobicContact CG-CE 4.34Å; F1311-M1607 HydrophobicContact CG-CG 4.26Å; F1311-M1607 HydrophobicContact CZ-CB 4.09Å; F1311-Q1608 HydrophobicContact CE2-CB 4.47Å; F1311-K1611 HydrophobicContact CZ-CG 4.36Å; F1311-C1614 HydrophobicContact CE1-CB 4.22Å
1312	I	94.9	Very high	93.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-43.7	176.6	-64.2	162.3	0	0	0	111.3	M1308 L1309 S1314 F1315 L1316 L1320 L1513 L1515 M1607 L1617 V1618	M1308-I1312 WeakPolarHBondContact O-CD1 3.27Å; M1308-I1312 VanDerWaalsContact O-CG1 3.28Å; M1308-I1312 WeakPolarHBondContact O-CG1 3.41Å; M1308-I1312 PolarHBondContact O-N 3.09Å; L1309-I1312 PolarHBondContact O-N 3.36Å; I1312-S1314 PolarHBondContact O-N 2.84Å; I1312-F1315 PolarHBondContact O-N 3.39Å; I1312-L1316 HydrophobicContact CG2-CD1 4.41Å; I1312-L1320 HydrophobicContact CG2-CD1 4.11Å; I1312-L1513 HydrophobicContact CD1-CD2 4.15Å; I1312-L1515 HydrophobicContact CD1-CD2 4.2Å; I1312-M1607 HydrophobicContact CD1-CE 4.32Å; I1312-M1607 HydrophobicContact CG1-CE 4.02Å; I1312-L1617 HydrophobicContact CD1-CD2 4.08Å; I1312-L1617 HydrophobicContact CG1-CD2 4.34Å; I1312-L1617 HydrophobicContact CG2-CD2 4.26Å; I1312-V1618 HydrophobicContact CG2-CG2 4.14Å
1313	E	94.8	Very high	93.7	Very high	49 Å²	49	31.3 Å²	31.3	23%	0.229	17%	0.169	C	C	.	.	H	α-helix	trans	-62.7	-29.7	178.2	-172.8	164.6	93.5	0	0	112	L1309 I1310 F1315 L1316 P1319 L1320 L1346	L1309-E1313 VanDerWaalsContact O-CB 3.26Å; L1309-E1313 WeakPolarHBondContact O-CB 3.45Å; L1309-E1313 PolarHBondContact O-N 3.43Å; I1310-E1313 PolarHBondContact O-N 2.98Å; E1313-F1315 PolarHBondContact O-N 3.25Å; E1313-L1316 PolarHBondContact O-N 2.81Å; E1313-P1319 VanDerWaalsContact OE2-CA 3.3Å; E1313-P1319 WeakPolarHBondContact OE2-CA 3.44Å; E1313-L1320 PolarHBondContact OE2-N 2.68Å; E1313-L1346 HydrophobicContact CB-CD1 4.08Å; E1313-L1346 HydrophobicContact CG-CD1 4.49Å
1314	S	91.2	Very high	93.6	Very high	82 Å²	82	31.3 Å²	31.3	57%	0.573	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-11.7	178.1	77.6	0	0	0	0	115.6	I1310 F1311 I1312	I1310-S1314 PolarHBondContact O-N 3.44Å; F1311-S1314 PolarHBondContact O-N 3.09Å; F1311-S1314 PolarHBondContact O-OG 2.73Å; I1312-S1314 PolarHBondContact O-N 2.84Å
1315	F	91.1	Very high	93.4	Very high	43 Å²	43	32.9 Å²	32.9	19%	0.189	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-2.4	174	-54.1	-73.4	0	0	0	113.7	F1311 I1312 E1313 K1611 Y1615 V1618 K1622	F1311-F1315 AromaticContact CD1-CE2 3.8Å; F1311-F1315 HydrophobicContact CD1-CE2 3.8Å; F1311-F1315 AromaticContact CE1-CE2 3.59Å; F1311-F1315 HydrophobicContact CE1-CE2 3.59Å; F1311-F1315 HydrophobicContact CE1-CZ 4.06Å; F1311-F1315 HydrophobicContact CZ-CE2 4.16Å; F1311-F1315 HydrophobicContact CZ-CZ 4.2Å; F1311-F1315 WeakPolarHBondContact O-CD2 3.44Å; F1311-F1315 VanDerWaalsContact O-CE2 3.3Å; F1311-F1315 WeakPolarHBondContact O-CE2 3.48Å; I1312-F1315 PolarHBondContact O-N 3.39Å; E1313-F1315 PolarHBondContact O-N 3.25Å; F1315-K1611 HydrophobicContact CZ-CG 4.16Å; F1315-Y1615 HydrophobicContact CD1-CD1 4.21Å; F1315-Y1615 AromaticContact CD1-CE1 3.48Å; F1315-Y1615 HydrophobicContact CD1-CE1 3.48Å; F1315-Y1615 VanDerWaalsContact CD1-CE1 3.48Å; F1315-Y1615 AromaticContact CE1-CE1 3.66Å; F1315-Y1615 HydrophobicContact CE1-CE1 3.66Å; F1315-Y1615 AromaticContact CE1-CZ 3.71Å; F1315-Y1615 HydrophobicContact CG-CE1 4.19Å; F1315-V1618 HydrophobicContact CB-CB 4.38Å; F1315-V1618 HydrophobicContact CB-CG1 3.84Å; F1315-V1618 HydrophobicContact CB-CG2 4Å; F1315-K1622 WeakPolarHBondContact O-CE 3.49Å; F1315-K1622 PolarHBondContact O-NZ 3.02Å
1316	L	90.5	Very high	93.3	Very high	19 Å²	19	33.1 Å²	33.1	10%	0.099	18%	0.179	C	C	.	.	S	Bend	trans	-96.7	149.5	179.5	-70.4	169.5	0	0	0	111.2	I1312 E1313 K1318 L1320 Y1323 V1618 I1621 K1622	I1312-L1316 HydrophobicContact CG2-CD1 4.41Å; E1313-L1316 PolarHBondContact O-N 2.81Å; L1316-K1318 VanDerWaalsContact C-N 3.27Å; L1316-K1318 WeakPolarHBondContact CB-O 3.25Å; L1316-K1318 PolarHBondContact O-N 2.88Å; L1316-L1320 HydrophobicContact CD1-CB 4.2Å; L1316-L1320 HydrophobicContact CD1-CD1 3.4Å; L1316-L1320 VanDerWaalsContact CD1-CD1 3.4Å; L1316-L1320 HydrophobicContact CD1-CG 4.41Å; L1316-Y1323 HydrophobicContact CB-CE2 4.13Å; L1316-Y1323 HydrophobicContact CD1-CD2 4.33Å; L1316-Y1323 HydrophobicContact CD1-CE2 4.23Å; L1316-Y1323 HydrophobicContact CD2-CE1 4.35Å; L1316-Y1323 HydrophobicContact CD2-CE2 4.06Å; L1316-Y1323 HydrophobicContact CG-CE2 4.39Å; L1316-V1618 HydrophobicContact CD2-CG1 3.91Å; L1316-V1618 HydrophobicContact CG-CG1 4.35Å; L1316-I1621 HydrophobicContact CD2-CB 4.47Å; L1316-I1621 HydrophobicContact CD2-CG2 3.95Å; L1316-K1622 HydrophobicContact CD2-CG 4.03Å
1317	D	87.7	Confident	93.2	Very high	114 Å²	114	33.1 Å²	33.1	61%	0.61	18%	0.179	S	C	*	.	S	Bend	trans	-85.8	-5.3	-174.1	-33	-76.5	0	0	0	112.2	Y1323 K1622	D1317-Y1323 PolarHBondContact N-OH 3.19Å; D1317-Y1323 PolarHBondContact OD2-OH 2.83Å; D1317-K1622 IonicContact OD1-NZ 3.36Å; D1317-K1622 PolarHBondContact OD1-NZ 2.8Å; D1317-K1622 WeakPolarHBondContact OD2-CD 3.45Å; D1317-K1622 WeakPolarHBondContact OD2-CE 3.01Å; D1317-K1622 IonicContact OD2-NZ 2.67Å; D1317-K1622 PolarHBondContact OD2-NZ 3.47Å
1318	K	90.2	Very high	93.3	Very high	119 Å²	119	32.7 Å²	32.7	52%	0.517	18%	0.177	S	C	.	.	S	Bend	trans	-147.9	161.4	-178.8	-60.2	175.4	-175.3	169.5	0	108.7	L1316 L1320 Y1323	L1316-K1318 VanDerWaalsContact C-N 3.27Å; L1316-K1318 WeakPolarHBondContact CB-O 3.25Å; L1316-K1318 PolarHBondContact O-N 2.88Å; K1318-L1320 PolarHBondContact O-N 3.1Å; K1318-Y1323 HydrophobicContact CB-CE2 3.82Å
1319	P	92.1	Very high	93.3	Very high	76 Å²	76	32.7 Å²	32.7	49%	0.494	18%	0.177	S	C	.	.			trans	-55.6	137.3	173.4	-25.5	35.3	0	0	0	112.2	E1313 I1321 S1322	E1313-P1319 VanDerWaalsContact OE2-CA 3.3Å; E1313-P1319 WeakPolarHBondContact OE2-CA 3.44Å; P1319-I1321 HydrophobicContact CB-CG2 4.35Å; P1319-I1321 PolarHBondContact O-N 2.97Å; P1319-I1321 VanDerWaalsContact O-N 3.11Å; P1319-S1322 WeakPolarHBondContact O-CB 3.43Å; P1319-S1322 PolarHBondContact O-N 2.6Å; P1319-S1322 PolarHBondContact O-OG 2.8Å
1320	L	92.7	Very high	93.2	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.016	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-51.9	-41.6	-172.2	177.7	77.4	0	0	0	112.2	F1291 L1293 L1309 I1312 E1313 L1316 K1318 S1322 Y1323 I1621	F1291-L1320 HydrophobicContact CE1-CD1 4.23Å; L1293-L1320 HydrophobicContact CD2-CD2 4.08Å; L1309-L1320 HydrophobicContact CD2-CD2 3.25Å; I1312-L1320 HydrophobicContact CG2-CD1 4.11Å; E1313-L1320 PolarHBondContact OE2-N 2.68Å; L1316-L1320 HydrophobicContact CD1-CB 4.2Å; L1316-L1320 HydrophobicContact CD1-CD1 3.4Å; L1316-L1320 VanDerWaalsContact CD1-CD1 3.4Å; L1316-L1320 HydrophobicContact CD1-CG 4.41Å; K1318-L1320 PolarHBondContact O-N 3.1Å; L1320-S1322 PolarHBondContact O-N 3.16Å; L1320-S1322 VanDerWaalsContact O-N 3.08Å; L1320-Y1323 WeakPolarHBondContact O-CB 3.35Å; L1320-Y1323 PolarHBondContact O-N 3.09Å; L1320-I1621 HydrophobicContact CD1-CD1 4.4Å
1321	I	93.8	Very high	93.2	Very high	33 Å²	33	31.8 Å²	31.8	17%	0.169	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-58	-24.2	-177.9	-168.2	62.7	0	0	0	113.4	P1319 Y1323 V1324 L1327 L1340 P1393	P1319-I1321 HydrophobicContact CB-CG2 4.35Å; P1319-I1321 PolarHBondContact O-N 2.97Å; P1319-I1321 VanDerWaalsContact O-N 3.11Å; I1321-Y1323 VanDerWaalsContact C-N 3.31Å; I1321-Y1323 PolarHBondContact O-N 3.49Å; I1321-V1324 HydrophobicContact CD1-CB 4.44Å; I1321-V1324 PolarHBondContact O-N 3.28Å; I1321-L1327 HydrophobicContact CD1-CD2 3.85Å; I1321-L1340 HydrophobicContact CB-CB 4.45Å; I1321-L1340 HydrophobicContact CD1-CB 4Å; I1321-L1340 HydrophobicContact CG1-CB 4.18Å; I1321-P1393 HydrophobicContact CD1-CG 3.78Å
1322	S	92	Very high	93.2	Very high	46 Å²	46	30.7 Å²	30.7	32%	0.322	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-67.8	-30.8	177.6	66.8	0	0	0	0	113.3	P1319 L1320 K1392	P1319-S1322 WeakPolarHBondContact O-CB 3.43Å; P1319-S1322 PolarHBondContact O-N 2.6Å; P1319-S1322 PolarHBondContact O-OG 2.8Å; L1320-S1322 PolarHBondContact O-N 3.16Å; L1320-S1322 VanDerWaalsContact O-N 3.08Å; S1322-K1392 PolarHBondContact O-NZ 2.77Å
1323	Y	92.3	Very high	93.2	Very high	11 Å²	11	30.7 Å²	30.7	4%	0.043	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-21.3	177.8	-60.4	-97.2	0	0	0	113	L1316 D1317 K1318 L1320 I1321 I1621 N1625	L1316-Y1323 HydrophobicContact CB-CE2 4.13Å; L1316-Y1323 HydrophobicContact CD1-CD2 4.33Å; L1316-Y1323 HydrophobicContact CD1-CE2 4.23Å; L1316-Y1323 HydrophobicContact CD2-CE1 4.35Å; L1316-Y1323 HydrophobicContact CD2-CE2 4.06Å; L1316-Y1323 HydrophobicContact CG-CE2 4.39Å; D1317-Y1323 PolarHBondContact N-OH 3.19Å; D1317-Y1323 PolarHBondContact OD2-OH 2.83Å; K1318-Y1323 HydrophobicContact CB-CE2 3.82Å; L1320-Y1323 WeakPolarHBondContact O-CB 3.35Å; L1320-Y1323 PolarHBondContact O-N 3.09Å; I1321-Y1323 VanDerWaalsContact C-N 3.31Å; I1321-Y1323 PolarHBondContact O-N 3.49Å; Y1323-I1621 HydrophobicContact CD1-CG2 3.57Å; Y1323-I1621 HydrophobicContact CD2-CG2 4.46Å; Y1323-I1621 HydrophobicContact CE1-CG2 4.25Å; Y1323-I1621 HydrophobicContact CG-CG2 3.72Å; Y1323-N1625 HydrophobicContact CD1-CB 3.56Å; Y1323-N1625 HydrophobicContact CE1-CB 3.99Å
1324	V	93.5	Very high	93.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.158	C	C	.	.			trans	-77	130.1	-173.9	-178.4	0	0	0	0	110.8	F1291 L1293 I1321 W1326 L1327 K1392 P1393	F1291-V1324 HydrophobicContact CD1-CB 4.47Å; F1291-V1324 HydrophobicContact CD1-CG2 3.94Å; F1291-V1324 HydrophobicContact CE1-CG2 3.76Å; L1293-V1324 HydrophobicContact CB-CG1 4.04Å; L1293-V1324 HydrophobicContact CB-CG2 4.18Å; L1293-V1324 HydrophobicContact CD2-CG2 4.1Å; I1321-V1324 HydrophobicContact CD1-CB 4.44Å; I1321-V1324 PolarHBondContact O-N 3.28Å; V1324-W1326 WeakPolarHBondContact CG1-O 3.39Å; V1324-L1327 HydrophobicContact CG1-CB 4.16Å; V1324-K1392 VanDerWaalsContact O-CE 3.22Å; V1324-K1392 WeakPolarHBondContact O-CE 3.32Å; V1324-P1393 HydrophobicContact CB-CB 4.42Å; V1324-P1393 HydrophobicContact CG1-CB 3.91Å; V1324-P1393 HydrophobicContact CG1-CG 4.27Å
1325	D	92.4	Very high	93.4	Very high	35 Å²	35	25 Å²	25	19%	0.187	13%	0.133	C	C	.	.	S	Bend	trans	-90.9	-43.1	169.9	-71.7	-84.8	0	0	0	111.9	K1290 F1291 P1393 K1394	K1290-D1325 WeakPolarHBondContact CA-OD2 3.49Å; K1290-D1325 HydrophobicContact CB-CB 4.37Å; K1290-D1325 HydrophobicContact CD-CB 3.77Å; K1290-D1325 VanDerWaalsContact CD-OD1 3.25Å; K1290-D1325 WeakPolarHBondContact CD-OD1 3.32Å; K1290-D1325 WeakPolarHBondContact CD-OD2 3.49Å; K1290-D1325 IonicContact NZ-OD1 2.6Å; K1290-D1325 PolarHBondContact NZ-OD1 3.16Å; K1290-D1325 IonicContact NZ-OD2 3.87Å; F1291-D1325 PolarHBondContact N-OD2 2.85Å; F1291-D1325 VanDerWaalsContact N-OD2 3.11Å; F1291-D1325 PolarHBondContact O-N 3.12Å; D1325-P1393 CarbonylContact O-C 3.55Å; D1325-P1393 WeakPolarHBondContact O-CA 3.38Å; D1325-P1393 VanDerWaalsContact O-CB 3.26Å; D1325-P1393 WeakPolarHBondContact O-CB 3.46Å; D1325-K1394 PolarHBondContact O-N 3.35Å
1326	W	94.4	Very high	93.6	Very high	4 Å²	4	23 Å²	23	2%	0.015	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	138	-177.1	-72.4	79	0	0	0	111.2	F1291 L1292 L1293 V1324 K1394 Y1415 L1471 I1475 Y1478 L1507	F1291-W1326 PolarHBondContact O-N 3.35Å; L1292-W1326 HydrophobicContact CD2-CB 3.68Å; L1292-W1326 HydrophobicContact CD2-CG 3.91Å; L1293-W1326 PolarHBondContact N-O 3.4Å; V1324-W1326 WeakPolarHBondContact CG1-O 3.39Å; W1326-K1394 WeakPolarHBondContact CA-O 3.3Å; W1326-K1394 HydrophobicContact CD2-CB 3.82Å; W1326-K1394 HydrophobicContact CD2-CD 4.05Å; W1326-K1394 HydrophobicContact CE3-CB 3.84Å; W1326-K1394 HydrophobicContact CE3-CD 4.36Å; W1326-K1394 HydrophobicContact CG-CB 4.26Å; W1326-K1394 HydrophobicContact CH2-CD 3.81Å; W1326-K1394 HydrophobicContact CZ2-CD 3.42Å; W1326-K1394 VanDerWaalsContact CZ2-CD 3.42Å; W1326-K1394 HydrophobicContact CZ3-CB 4.28Å; W1326-K1394 HydrophobicContact CZ3-CD 4.26Å; W1326-Y1415 HydrophobicContact CH2-CE1 4.39Å; W1326-Y1415 HydrophobicContact CH2-CE2 4.34Å; W1326-Y1415 AromaticContact CH2-CZ 3.98Å; W1326-Y1415 AromaticContact CZ3-CE1 3.87Å; W1326-Y1415 HydrophobicContact CZ3-CE1 3.87Å; W1326-Y1415 HydrophobicContact CZ3-CE2 4.45Å; W1326-Y1415 AromaticContact CZ3-CZ 3.66Å; W1326-Y1415 WeakPolarHBondContact CZ3-OH 3.29Å; W1326-L1471 HydrophobicContact CB-CD1 4.3Å; W1326-L1471 HydrophobicContact CE3-CD1 3.94Å; W1326-I1475 HydrophobicContact CD2-CD1 4.1Å; W1326-I1475 HydrophobicContact CD2-CG1 3.83Å; W1326-I1475 HydrophobicContact CE3-CD1 4.32Å; W1326-I1475 HydrophobicContact CE3-CG1 3.79Å; W1326-I1475 HydrophobicContact CG-CD1 4.25Å; W1326-I1475 HydrophobicContact CG-CG1 4.48Å; W1326-I1475 HydrophobicContact CH2-CG1 3.93Å; W1326-I1475 HydrophobicContact CZ2-CG1 3.98Å; W1326-I1475 HydrophobicContact CZ3-CG1 3.83Å; W1326-Y1478 HydrophobicContact CH2-CD1 4.22Å; W1326-Y1478 HydrophobicContact CH2-CD2 4.19Å; W1326-Y1478 AromaticContact CH2-CG 3.84Å; W1326-Y1478 HydrophobicContact CH2-CG 3.84Å; W1326-Y1478 AromaticContact CZ2-CD1 3.98Å; W1326-Y1478 HydrophobicContact CZ2-CD1 3.98Å; W1326-Y1478 HydrophobicContact CZ2-CE1 4.43Å; W1326-Y1478 HydrophobicContact CZ2-CG 4.09Å; W1326-L1507 HydrophobicContact CZ2-CD1 4.34Å
1327	L	96.1	Very high	93.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125	-174.6	-178.9	55.2	0	0	0	110.4	L1293 L1295 I1321 V1324 A1337 A1341 P1393 K1394 L1395 I1396	L1293-L1327 HydrophobicContact CB-CD1 3.86Å; L1293-L1327 HydrophobicContact CD2-CD1 3.83Å; L1293-L1327 HydrophobicContact CG-CD1 3.69Å; L1293-L1327 CarbonylContact O-C 3.45Å; L1293-L1327 WeakPolarHBondContact O-CA 3.49Å; L1295-L1327 HydrophobicContact CD1-CD1 4.25Å; L1295-L1327 HydrophobicContact CG-CD1 4.39Å; I1321-L1327 HydrophobicContact CD1-CD2 3.85Å; V1324-L1327 HydrophobicContact CG1-CB 4.16Å; L1327-A1337 HydrophobicContact CD1-CB 4.11Å; L1327-A1337 HydrophobicContact CD2-CB 3.78Å; L1327-A1337 WeakPolarHBondContact CD2-O 3.18Å; L1327-A1337 HydrophobicContact CG-CB 3.74Å; L1327-A1341 HydrophobicContact CD2-CB 4.47Å; L1327-P1393 HydrophobicContact CB-CB 4.06Å; L1327-P1393 HydrophobicContact CB-CG 3.64Å; L1327-P1393 HydrophobicContact CD2-CG 3.78Å; L1327-P1393 HydrophobicContact CG-CG 4.4Å; L1327-K1394 PolarHBondContact N-O 2.87Å; L1327-L1395 HydrophobicContact CB-CD1 4.16Å; L1327-L1395 HydrophobicContact CD2-CD1 4.1Å; L1327-L1395 HydrophobicContact CG-CD1 3.88Å; L1327-L1395 CarbonylContact O-C 3.44Å; L1327-L1395 WeakPolarHBondContact O-CA 3.44Å; L1327-I1396 PolarHBondContact O-N 3.07Å
1328	A	96.6	Very high	94.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.8	174.9	0	0	0	0	0	111.2	L1293 L1295 I1396 P1467 L1471	L1293-A1328 PolarHBondContact O-N 3.4Å; L1295-A1328 PolarHBondContact N-O 3.36Å; A1328-I1396 WeakPolarHBondContact CA-O 3.45Å; A1328-I1396 HydrophobicContact CB-CD1 3.87Å; A1328-I1396 HydrophobicContact CB-CG1 3.54Å; A1328-P1467 HydrophobicContact CB-CB 4.14Å; A1328-P1467 HydrophobicContact CB-CG 4.02Å; A1328-L1471 HydrophobicContact CB-CB 4.01Å; A1328-L1471 HydrophobicContact CB-CD1 4.25Å; A1328-L1471 HydrophobicContact CB-CD2 3.9Å; A1328-L1471 HydrophobicContact CB-CG 4.27Å
1329	G	96.6	Very high	94.4	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.066	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146.6	176.9	0	0	0	0	0	114.1	L1295 I1396 I1397 T1398	L1295-G1329 WeakPolarHBondContact O-CA 3.14Å; G1329-I1396 PolarHBondContact N-O 3.5Å; G1329-I1397 WeakPolarHBondContact O-CA 3.38Å; G1329-T1398 PolarHBondContact O-N 3.11Å
1330	T	95.9	Very high	94.5	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132.2	175.7	-56.1	0	0	0	0	110.3	L1295 G1297 T1332 G1333 A1334 T1398 A1464 P1467	L1295-T1330 PolarHBondContact O-N 3.08Å; G1297-T1330 WeakPolarHBondContact CA-O 3.26Å; G1297-T1330 PolarHBondContact N-O 3.35Å; T1330-T1332 PolarHBondContact O-N 2.85Å; T1330-G1333 WeakPolarHBondContact O-CA 3.17Å; T1330-G1333 PolarHBondContact O-N 3.1Å; T1330-A1334 PolarHBondContact O-N 3.43Å; T1330-T1398 WeakPolarHBondContact CB-OG1 3.44Å; T1330-T1398 WeakPolarHBondContact CG2-OG1 3.38Å; T1330-T1398 PolarHBondContact OG1-OG1 3.35Å; T1330-A1464 PolarHBondContact OG1-O 3.17Å; T1330-P1467 WeakPolarHBondContact OG1-CG 3.25Å
1331	S	94	Very high	94.5	Very high	7 Å²	7	8.6 Å²	8.6	5%	0.049	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	-111.5	175	-170.4	0	0	0	0	112.1	A1334 I1335 S1443 D1459	S1331-A1334 WeakPolarHBondContact O-CB 3.24Å; S1331-A1334 PolarHBondContact O-N 3.49Å; S1331-A1334 VanDerWaalsContact O-N 3.14Å; S1331-I1335 PolarHBondContact O-N 3.14Å; S1331-I1335 VanDerWaalsContact O-N 3.13Å; S1331-S1443 WeakPolarHBondContact CA-O 3.47Å; S1331-S1443 PolarHBondContact N-OG 2.9Å; S1331-D1459 WeakPolarHBondContact CB-OD1 3.35Å; S1331-D1459 VanDerWaalsContact CB-OD2 3.24Å; S1331-D1459 WeakPolarHBondContact CB-OD2 3.48Å; S1331-D1459 PolarHBondContact OG-OD2 2.92Å
1332	T	94.3	Very high	94.4	Very high	4 Å²	4	12.2 Å²	12.2	3%	0.025	6%	0.063	C	C	.	.	H	α-helix	trans	-61.8	-39.5	173.2	-155.3	0	0	0	0	113.1	G1299 G1302 L1305 T1330 A1334 I1335 L1336 Y1353 T1517	G1299-T1332 WeakPolarHBondContact O-CB 3.44Å; G1299-T1332 PolarHBondContact O-OG1 3.26Å; G1302-T1332 WeakPolarHBondContact CA-OG1 3.28Å; L1305-T1332 HydrophobicContact CD1-CG2 4.39Å; T1330-T1332 PolarHBondContact O-N 2.85Å; T1332-A1334 VanDerWaalsContact C-N 3.25Å; T1332-A1334 PolarHBondContact O-N 3.43Å; T1332-I1335 PolarHBondContact O-N 3.27Å; T1332-L1336 PolarHBondContact O-N 2.73Å; T1332-Y1353 PolarHBondContact O-OH 2.89Å; T1332-Y1353 VanDerWaalsContact OG1-CE1 3.29Å; T1332-Y1353 WeakPolarHBondContact OG1-CE1 3.06Å; T1332-Y1353 PolarHBondContact OG1-OH 2.98Å; T1332-T1517 HydrophobicContact CG2-CG2 4.01Å
1333	G	95.7	Very high	94.4	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.8	-32.6	172.4	0	0	0	0	0	112.5	D1296 T1330 A1337	D1296-G1333 WeakPolarHBondContact O-CA 3.48Å; D1296-G1333 PolarHBondContact O-N 3.13Å; T1330-G1333 WeakPolarHBondContact O-CA 3.17Å; T1330-G1333 PolarHBondContact O-N 3.1Å; G1333-A1337 WeakPolarHBondContact O-CB 3.36Å; G1333-A1337 PolarHBondContact O-N 3.45Å
1334	A	95.4	Very high	94.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-68.9	-45	174	0	0	0	0	0	112	T1330 S1331 T1332 L1336 A1337 A1338 I1397 L1440	T1330-A1334 PolarHBondContact O-N 3.43Å; S1331-A1334 WeakPolarHBondContact O-CB 3.24Å; S1331-A1334 PolarHBondContact O-N 3.49Å; S1331-A1334 VanDerWaalsContact O-N 3.14Å; T1332-A1334 VanDerWaalsContact C-N 3.25Å; T1332-A1334 PolarHBondContact O-N 3.43Å; A1334-L1336 VanDerWaalsContact C-N 3.32Å; A1334-L1336 PolarHBondContact O-N 3.42Å; A1334-A1337 PolarHBondContact O-N 2.83Å; A1334-A1338 WeakPolarHBondContact O-CB 3.27Å; A1334-A1338 PolarHBondContact O-N 3.36Å; A1334-I1397 HydrophobicContact CB-CB 4.39Å; A1334-I1397 HydrophobicContact CB-CD1 4.27Å; A1334-I1397 HydrophobicContact CB-CG1 3.96Å; A1334-I1397 HydrophobicContact CB-CG2 3.72Å; A1334-L1440 HydrophobicContact CB-CD2 3.88Å; A1334-L1440 VanDerWaalsContact O-CD2 3.31Å; A1334-L1440 WeakPolarHBondContact O-CD2 3.44Å
1335	I	94.6	Very high	94.4	Very high	11 Å²	11	18.2 Å²	18.2	6%	0.056	11%	0.109	C	C	.	.	H	α-helix	trans	-60.2	-44.9	177	-64.3	170.6	0	0	0	110.1	S1331 T1332 S1339 M1373 L1440	S1331-I1335 PolarHBondContact O-N 3.14Å; S1331-I1335 VanDerWaalsContact O-N 3.13Å; T1332-I1335 PolarHBondContact O-N 3.27Å; I1335-S1339 VanDerWaalsContact O-CB 3.3Å; I1335-S1339 WeakPolarHBondContact O-CB 3.41Å; I1335-S1339 PolarHBondContact O-N 2.94Å; I1335-S1339 PolarHBondContact O-OG 2.83Å; I1335-M1373 HydrophobicContact CD1-CE 4.37Å; I1335-L1440 HydrophobicContact CB-CD2 4.45Å; I1335-L1440 HydrophobicContact CG1-CB 4.3Å; I1335-L1440 HydrophobicContact CG1-CD1 4.46Å; I1335-L1440 HydrophobicContact CG1-CD2 4.03Å
1336	L	95.8	Very high	94.5	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-65.2	-45.3	176.9	-177	53	0	0	0	112.2	L1295 L1305 V1306 L1309 T1332 A1334 S1339 L1340 L1346 C1349 Y1353	L1295-L1336 HydrophobicContact CD1-CB 4.33Å; L1295-L1336 HydrophobicContact CD1-CD2 4.22Å; L1295-L1336 HydrophobicContact CD1-CG 4.08Å; L1305-L1336 HydrophobicContact CB-CD2 3.63Å; L1305-L1336 HydrophobicContact CD1-CD2 4.23Å; V1306-L1336 HydrophobicContact CG2-CD1 3.76Å; V1306-L1336 HydrophobicContact CG2-CD2 3.72Å; V1306-L1336 HydrophobicContact CG2-CG 4.41Å; L1309-L1336 HydrophobicContact CD1-CD2 3.68Å; L1309-L1336 HydrophobicContact CD1-CG 4.31Å; T1332-L1336 PolarHBondContact O-N 2.73Å; A1334-L1336 VanDerWaalsContact C-N 3.32Å; A1334-L1336 PolarHBondContact O-N 3.42Å; L1336-S1339 PolarHBondContact O-N 3.01Å; L1336-L1340 HydrophobicContact CD1-CD1 4.1Å; L1336-L1340 HydrophobicContact CD1-CG 4.19Å; L1336-L1340 HydrophobicContact CG-CD1 4.15Å; L1336-L1340 WeakPolarHBondContact O-CG 3.49Å; L1336-L1340 PolarHBondContact O-N 3.47Å; L1336-L1346 HydrophobicContact CD1-CD2 4.46Å; L1336-C1349 HydrophobicContact CD1-CB 3.76Å; L1336-Y1353 HydrophobicContact CB-CE2 4.5Å
1337	A	95.6	Very high	94.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.1	-50	178.4	0	0	0	0	0	112.6	L1295 L1327 G1333 A1334 S1339 L1340 A1341 L1395	L1295-A1337 HydrophobicContact CD1-CB 4.2Å; L1327-A1337 HydrophobicContact CD1-CB 4.11Å; L1327-A1337 HydrophobicContact CD2-CB 3.78Å; L1327-A1337 WeakPolarHBondContact CD2-O 3.18Å; L1327-A1337 HydrophobicContact CG-CB 3.74Å; G1333-A1337 WeakPolarHBondContact O-CB 3.36Å; G1333-A1337 PolarHBondContact O-N 3.45Å; A1334-A1337 PolarHBondContact O-N 2.83Å; A1337-S1339 VanDerWaalsContact C-N 3.33Å; A1337-S1339 PolarHBondContact O-N 3.33Å; A1337-L1340 PolarHBondContact O-N 3.41Å; A1337-A1341 WeakPolarHBondContact O-CB 3.48Å; A1337-A1341 PolarHBondContact O-N 3.34Å; A1337-L1395 HydrophobicContact CB-CD1 3.73Å
1338	A	94.3	Very high	94.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-38.8	177	0	0	0	0	0	112	A1334 A1341 R1342 L1395 I1397 L1436 L1440	A1334-A1338 WeakPolarHBondContact O-CB 3.27Å; A1334-A1338 PolarHBondContact O-N 3.36Å; A1338-A1341 PolarHBondContact O-N 2.97Å; A1338-R1342 WeakPolarHBondContact O-CB 3.3Å; A1338-R1342 WeakPolarHBondContact O-CG 3.23Å; A1338-R1342 PolarHBondContact O-N 3.12Å; A1338-L1395 HydrophobicContact CB-CD2 4.3Å; A1338-I1397 HydrophobicContact CB-CD1 4.49Å; A1338-L1436 HydrophobicContact CB-CD1 4.07Å; A1338-L1436 HydrophobicContact CB-CD2 4.36Å; A1338-L1436 HydrophobicContact CB-CG 4.45Å; A1338-L1440 HydrophobicContact CB-CD1 3.97Å; A1338-L1440 HydrophobicContact CB-CD2 3.93Å; A1338-L1440 HydrophobicContact CB-CG 4.34Å
1339	S	93.7	Very high	94.1	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.014	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-44.3	179.2	-57.6	0	0	0	0	111.9	I1335 L1336 A1337 R1342 G1343 K1344 H1380	I1335-S1339 VanDerWaalsContact O-CB 3.3Å; I1335-S1339 WeakPolarHBondContact O-CB 3.41Å; I1335-S1339 PolarHBondContact O-N 2.94Å; I1335-S1339 PolarHBondContact O-OG 2.83Å; L1336-S1339 PolarHBondContact O-N 3.01Å; A1337-S1339 VanDerWaalsContact C-N 3.33Å; A1337-S1339 PolarHBondContact O-N 3.33Å; S1339-R1342 CarbonylContact O-C 3.58Å; S1339-R1342 PolarHBondContact O-N 2.93Å; S1339-G1343 PolarHBondContact O-N 3.3Å; S1339-K1344 VanDerWaalsContact O-CB 3.27Å; S1339-K1344 WeakPolarHBondContact O-CB 3.44Å; S1339-K1344 VanDerWaalsContact O-CG 3.27Å; S1339-K1344 WeakPolarHBondContact O-CG 3.35Å; S1339-K1344 PolarHBondContact O-N 3.05Å; S1339-H1380 PolarHBondContact OG-CD2 3Å; S1339-H1380 VanDerWaalsContact OG-CD2 3.24Å; S1339-H1380 PolarHBondContact OG-NE2 2.95Å
1340	L	94.2	Very high	94	Very high	9 Å²	9	25.8 Å²	25.8	5%	0.047	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-46.8	174.4	-70.5	170	0	0	0	111.6	L1309 I1321 L1336 A1337 R1342 G1343 L1346	L1309-L1340 HydrophobicContact CD1-CD1 4.35Å; I1321-L1340 HydrophobicContact CB-CB 4.45Å; I1321-L1340 HydrophobicContact CD1-CB 4Å; I1321-L1340 HydrophobicContact CG1-CB 4.18Å; L1336-L1340 HydrophobicContact CD1-CD1 4.1Å; L1336-L1340 HydrophobicContact CD1-CG 4.19Å; L1336-L1340 HydrophobicContact CG-CD1 4.15Å; L1336-L1340 WeakPolarHBondContact O-CG 3.49Å; L1336-L1340 PolarHBondContact O-N 3.47Å; A1337-L1340 PolarHBondContact O-N 3.41Å; L1340-R1342 PolarHBondContact O-N 3.4Å; L1340-G1343 WeakPolarHBondContact O-CA 3.5Å; L1340-G1343 PolarHBondContact O-N 2.85Å; L1340-L1346 HydrophobicContact CD1-CD2 4.25Å; L1340-L1346 HydrophobicContact CD2-CD2 3.76Å; L1340-L1346 HydrophobicContact CD2-CG 4.02Å
1341	A	93	Very high	93.8	Very high	19 Å²	19	27.5 Å²	27.5	16%	0.157	15%	0.15	C	C	.	.	H	α-helix	trans	-66.3	-21.2	178.3	0	0	0	0	0	113.5	L1327 A1337 A1338 G1343 I1390 P1393	L1327-A1341 HydrophobicContact CD2-CB 4.47Å; A1337-A1341 WeakPolarHBondContact O-CB 3.48Å; A1337-A1341 PolarHBondContact O-N 3.34Å; A1338-A1341 PolarHBondContact O-N 2.97Å; A1341-G1343 VanDerWaalsContact C-N 3.31Å; A1341-I1390 HydrophobicContact CB-CD1 4.31Å; A1341-I1390 HydrophobicContact CB-CG2 3.59Å; A1341-P1393 HydrophobicContact CB-CG 4.34Å
1342	R	92.3	Very high	93.5	Very high	109 Å²	109	27.4 Å²	27.4	41%	0.411	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	10.8	168.6	-67.5	-71.1	-65.9	153.3	0.4	113.6	A1338 S1339 L1340 I1390 L1436	A1338-R1342 WeakPolarHBondContact O-CB 3.3Å; A1338-R1342 WeakPolarHBondContact O-CG 3.23Å; A1338-R1342 PolarHBondContact O-N 3.12Å; S1339-R1342 CarbonylContact O-C 3.58Å; S1339-R1342 PolarHBondContact O-N 2.93Å; L1340-R1342 PolarHBondContact O-N 3.4Å; R1342-I1390 HydrophobicContact CG-CD1 4.13Å; R1342-I1390 HydrophobicContact CG-CG1 4.46Å; R1342-L1436 HydrophobicContact CG-CD2 3.92Å
1343	G	90.7	Very high	93.4	Very high	63 Å²	63	27.8 Å²	27.8	65%	0.649	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	14.9	173.4	0	0	0	0	0	115.8	S1339 L1340 A1341	S1339-G1343 PolarHBondContact O-N 3.3Å; L1340-G1343 WeakPolarHBondContact O-CA 3.5Å; L1340-G1343 PolarHBondContact O-N 2.85Å; A1341-G1343 VanDerWaalsContact C-N 3.31Å
1344	K	92.6	Very high	93.2	Very high	64 Å²	64	27.8 Å²	27.8	28%	0.278	15%	0.151	S	C	.	.			trans	-71.9	141.2	172.9	-56.7	-66.6	-175.5	169.3	0	110.3	S1339 Q1348 H1380	S1339-K1344 VanDerWaalsContact O-CB 3.27Å; S1339-K1344 WeakPolarHBondContact O-CB 3.44Å; S1339-K1344 VanDerWaalsContact O-CG 3.27Å; S1339-K1344 WeakPolarHBondContact O-CG 3.35Å; S1339-K1344 PolarHBondContact O-N 3.05Å; K1344-Q1348 HydrophobicContact CB-CB 4.49Å; K1344-H1380 WeakPolarHBondContact CE-O 3.22Å; K1344-H1380 PolarHBondContact NZ-O 3.15Å
1345	S	93.9	Very high	92.8	Very high	56 Å²	56	31.7 Å²	31.7	39%	0.392	17%	0.165	S	C	.	.			trans	-75.1	157.5	171.7	76.9	0	0	0	0	111.6	R1347 Q1348 C1349	S1345-R1347 PolarHBondContact O-N 3.12Å; S1345-Q1348 WeakPolarHBondContact O-CB 3.11Å; S1345-Q1348 PolarHBondContact O-N 3.35Å; S1345-Q1348 WeakPolarHBondContact OG-CG 3.4Å; S1345-Q1348 PolarHBondContact OG-N 3.24Å; S1345-C1349 PolarHBondContact O-N 3.07Å; S1345-C1349 PolarHBondContact O-SG 2.82Å
1346	L	94.9	Very high	92.4	Very high	3 Å²	3	31.8 Å²	31.8	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-33.5	177.7	-72.9	166	0	0	0	112.9	V1306 L1309 I1310 E1313 L1336 L1340 C1349 Q1350	V1306-L1346 WeakPolarHBondContact CG1-O 3.3Å; L1309-L1346 HydrophobicContact CB-CD1 3.66Å; L1309-L1346 HydrophobicContact CB-CD2 3.56Å; L1309-L1346 HydrophobicContact CB-CG 4.29Å; L1309-L1346 HydrophobicContact CD1-CD2 3.83Å; L1309-L1346 HydrophobicContact CG-CD2 4.3Å; I1310-L1346 HydrophobicContact CD1-CB 4.18Å; I1310-L1346 HydrophobicContact CG1-CB 3.57Å; I1310-L1346 HydrophobicContact CG1-CD1 4.01Å; I1310-L1346 HydrophobicContact CG1-CG 4.36Å; E1313-L1346 HydrophobicContact CB-CD1 4.08Å; E1313-L1346 HydrophobicContact CG-CD1 4.49Å; L1336-L1346 HydrophobicContact CD1-CD2 4.46Å; L1340-L1346 HydrophobicContact CD1-CD2 4.25Å; L1340-L1346 HydrophobicContact CD2-CD2 3.76Å; L1340-L1346 HydrophobicContact CD2-CG 4.02Å; L1346-C1349 WeakPolarHBondContact O-CB 3.16Å; L1346-C1349 PolarHBondContact O-N 2.94Å; L1346-Q1350 WeakPolarHBondContact O-CB 3.36Å; L1346-Q1350 PolarHBondContact O-N 3.31Å
1347	R	92.5	Very high	92.1	Very high	91 Å²	91	31.8 Å²	31.8	34%	0.343	17%	0.166	S	C	.	.	H	α-helix	trans	-67.7	-37.9	172.9	-67.4	-63.8	-171.6	-173.3	2.2	112.4	V1217 S1345 C1349 Q1350 V1351	V1217-R1347 PolarHBondContact O-NH1 3.03Å; S1345-R1347 PolarHBondContact O-N 3.12Å; R1347-C1349 VanDerWaalsContact C-N 3.33Å; R1347-Q1350 VanDerWaalsContact CD-OE1 3.27Å; R1347-Q1350 WeakPolarHBondContact O-CB 3.36Å; R1347-Q1350 PolarHBondContact O-N 2.91Å; R1347-V1351 WeakPolarHBondContact O-CG2 3.25Å; R1347-V1351 PolarHBondContact O-N 3.03Å
1348	Q	92	Very high	91.5	Very high	100 Å²	100	32.5 Å²	32.5	47%	0.467	17%	0.17	S	C	.	.	H	α-helix	trans	-63.8	-39	171.8	-71.9	170.4	-13.4	0	0	111.7	K1344 S1345 A1352	K1344-Q1348 HydrophobicContact CB-CB 4.49Å; S1345-Q1348 WeakPolarHBondContact O-CB 3.11Å; S1345-Q1348 PolarHBondContact O-N 3.35Å; S1345-Q1348 WeakPolarHBondContact OG-CG 3.4Å; S1345-Q1348 PolarHBondContact OG-N 3.24Å; Q1348-A1352 WeakPolarHBondContact O-CB 3.45Å; Q1348-A1352 PolarHBondContact O-N 2.99Å
1349	C	93.7	Very high	90.7	Very high	1 Å²	1	35 Å²	35	1%	0.007	18%	0.183	C	C	.	.	H	α-helix	trans	-64.4	-43.6	173.6	-60.3	0	0	0	0	111.6	V1306 L1336 S1345 L1346 R1347 V1351 A1352 Y1353	V1306-C1349 HydrophobicContact CG2-CB 4.33Å; L1336-C1349 HydrophobicContact CD1-CB 3.76Å; S1345-C1349 PolarHBondContact O-N 3.07Å; S1345-C1349 PolarHBondContact O-SG 2.82Å; L1346-C1349 WeakPolarHBondContact O-CB 3.16Å; L1346-C1349 PolarHBondContact O-N 2.94Å; R1347-C1349 VanDerWaalsContact C-N 3.33Å; C1349-V1351 PolarHBondContact O-N 3.36Å; C1349-A1352 PolarHBondContact O-N 3.32Å; C1349-Y1353 VanDerWaalsContact O-CD2 3.25Å; C1349-Y1353 WeakPolarHBondContact O-CD2 3.27Å; C1349-Y1353 PolarHBondContact O-N 2.79Å
1350	Q	94.2	Very high	90	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.009	18%	0.184	C	C	.	.	H	α-helix	trans	-56.7	-48.6	175.8	-165.4	-175.9	5.4	0	0	111.7	V1217 L1303 V1306 L1346 R1347 A1352 Y1353 L1354	V1217-Q1350 PolarHBondContact O-NE2 3.03Å; L1303-Q1350 HydrophobicContact CD2-CG 3.9Å; V1306-Q1350 HydrophobicContact CG1-CB 3.81Å; V1306-Q1350 HydrophobicContact CG1-CG 4.29Å; L1346-Q1350 WeakPolarHBondContact O-CB 3.36Å; L1346-Q1350 PolarHBondContact O-N 3.31Å; R1347-Q1350 VanDerWaalsContact CD-OE1 3.27Å; R1347-Q1350 WeakPolarHBondContact O-CB 3.36Å; R1347-Q1350 PolarHBondContact O-N 2.91Å; Q1350-A1352 PolarHBondContact O-N 3.14Å; Q1350-Y1353 PolarHBondContact O-N 3.1Å; Q1350-L1354 WeakPolarHBondContact O-CG 3.27Å; Q1350-L1354 PolarHBondContact O-N 3.06Å; Q1350-L1354 VanDerWaalsContact O-N 3.11Å
1351	V	91.2	Very high	89.4	Confident	37 Å²	37	35.5 Å²	35.5	22%	0.224	18%	0.184	C	C	.	.	H	α-helix	trans	-60.7	-42.6	176.8	163.8	0	0	0	0	111.6	Y1184 R1347 C1349 L1354 R1355	Y1184-V1351 WeakPolarHBondContact O-CG1 3.25Å; R1347-V1351 WeakPolarHBondContact O-CG2 3.25Å; R1347-V1351 PolarHBondContact O-N 3.03Å; C1349-V1351 PolarHBondContact O-N 3.36Å; V1351-L1354 PolarHBondContact O-N 3.41Å; V1351-R1355 HydrophobicContact CG1-CG 4.47Å; V1351-R1355 WeakPolarHBondContact O-CG 3.43Å; V1351-R1355 PolarHBondContact O-N 3.01Å
1352	A	89.5	Confident	88.2	Confident	5 Å²	5	35.8 Å²	35.8	4%	0.041	18%	0.182	C	C	.	.	H	α-helix	trans	-64.1	-41.2	177.5	0	0	0	0	0	112.6	Q1348 C1349 Q1350 L1354 R1355 M1356 H1380	Q1348-A1352 WeakPolarHBondContact O-CB 3.45Å; Q1348-A1352 PolarHBondContact O-N 2.99Å; C1349-A1352 PolarHBondContact O-N 3.32Å; Q1350-A1352 PolarHBondContact O-N 3.14Å; A1352-L1354 PolarHBondContact O-N 2.96Å; A1352-R1355 PolarHBondContact O-N 3.23Å; A1352-M1356 HydrophobicContact CB-CE 4.4Å; A1352-M1356 WeakPolarHBondContact O-CB 3.4Å; A1352-M1356 WeakPolarHBondContact O-CG 3.37Å; A1352-M1356 PolarHBondContact O-N 3.26Å; A1352-H1380 WeakPolarHBondContact CB-CE1 3.47Å; A1352-H1380 WeakPolarHBondContact CB-ND1 3.42Å
1353	Y	91.7	Very high	86.8	Confident	11 Å²	11	32.9 Å²	32.9	4%	0.043	18%	0.175	C	C	.	.	H	α-helix	trans	-63	-40.9	174.7	-83.6	-64.9	0	0	0	113.2	I1300 L1303 V1306 T1332 L1336 C1349 Q1350 M1356 K1357	I1300-Y1353 HydrophobicContact CD1-CD1 4.31Å; I1300-Y1353 WeakPolarHBondContact CD1-O 3.45Å; L1303-Y1353 HydrophobicContact CD2-CG 4.33Å; L1303-Y1353 HydrophobicContact CG-CG 4.31Å; V1306-Y1353 HydrophobicContact CG2-CD2 4.12Å; V1306-Y1353 HydrophobicContact CG2-CE2 4.16Å; T1332-Y1353 PolarHBondContact O-OH 2.89Å; T1332-Y1353 VanDerWaalsContact OG1-CE1 3.29Å; T1332-Y1353 WeakPolarHBondContact OG1-CE1 3.06Å; T1332-Y1353 PolarHBondContact OG1-OH 2.98Å; L1336-Y1353 HydrophobicContact CB-CE2 4.5Å; C1349-Y1353 VanDerWaalsContact O-CD2 3.25Å; C1349-Y1353 WeakPolarHBondContact O-CD2 3.27Å; C1349-Y1353 PolarHBondContact O-N 2.79Å; Q1350-Y1353 PolarHBondContact O-N 3.1Å; Y1353-M1356 HydrophobicContact CD1-CE 3.84Å; Y1353-M1356 HydrophobicContact CE1-CE 3.98Å; Y1353-M1356 HydrophobicContact CG-CE 4.3Å; Y1353-M1356 PolarHBondContact O-N 3.34Å; Y1353-K1357 PolarHBondContact O-N 3.48Å
1354	L	91.4	Very high	85.6	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-65.7	-45.7	176.4	-67.5	169.4	0	0	0	111.2	Y1184 L1218 L1303 Q1350 V1351 A1352 M1356 K1357 D1358 V1596 M1600	Y1184-L1354 HydrophobicContact CD1-CB 3.93Å; Y1184-L1354 HydrophobicContact CG-CB 4.47Å; L1218-L1354 HydrophobicContact CD2-CD1 3.81Å; L1303-L1354 HydrophobicContact CD1-CD2 3.94Å; L1303-L1354 HydrophobicContact CD1-CG 4.47Å; L1303-L1354 HydrophobicContact CD2-CG 4.46Å; Q1350-L1354 WeakPolarHBondContact O-CG 3.27Å; Q1350-L1354 PolarHBondContact O-N 3.06Å; Q1350-L1354 VanDerWaalsContact O-N 3.11Å; V1351-L1354 PolarHBondContact O-N 3.41Å; A1352-L1354 PolarHBondContact O-N 2.96Å; L1354-M1356 PolarHBondContact O-N 3.49Å; L1354-K1357 WeakPolarHBondContact O-CB 3.2Å; L1354-K1357 PolarHBondContact O-N 3.09Å; L1354-D1358 PolarHBondContact O-N 2.95Å; L1354-V1596 HydrophobicContact CD2-CG1 3.88Å; L1354-M1600 HydrophobicContact CD2-CE 4.32Å
1355	R	87.1	Confident	84.4	Confident	81 Å²	81	37.5 Å²	37.5	31%	0.306	18%	0.176	S	C	.	.	H	α-helix	trans	-59.8	-42.6	173.2	-70.1	175.3	-176.8	-141.1	5.4	112.4	Y1184 N1185 V1351 A1352 K1357 D1358 L1359 H1376	Y1184-R1355 HydrophobicContact CD2-CG 3.48Å; Y1184-R1355 VanDerWaalsContact CD2-CG 3.48Å; Y1184-R1355 HydrophobicContact CE2-CG 3.66Å; Y1184-R1355 HydrophobicContact CG-CG 4.11Å; Y1184-R1355 PolarHBondContact O-NE 3.14Å; Y1184-R1355 PolarHBondContact O-NH2 2.76Å; N1185-R1355 PolarHBondContact OD1-NH2 3.5Å; N1185-R1355 VanDerWaalsContact OD1-NH2 3.09Å; V1351-R1355 HydrophobicContact CG1-CG 4.47Å; V1351-R1355 WeakPolarHBondContact O-CG 3.43Å; V1351-R1355 PolarHBondContact O-N 3.01Å; A1352-R1355 PolarHBondContact O-N 3.23Å; R1355-K1357 VanDerWaalsContact C-N 3.34Å; R1355-K1357 PolarHBondContact O-N 3.14Å; R1355-D1358 PolarHBondContact O-N 3.14Å; R1355-L1359 WeakPolarHBondContact O-CB 3.34Å; R1355-L1359 VanDerWaalsContact O-CG 3.25Å; R1355-L1359 WeakPolarHBondContact O-CG 3.37Å; R1355-L1359 PolarHBondContact O-N 3.43Å; R1355-H1376 WeakPolarHBondContact CB-NE2 3.46Å; R1355-H1376 WeakPolarHBondContact CD-NE2 3.27Å
1356	M	85.5	Confident	83.3	Confident	13 Å²	13	37.3 Å²	37.3	6%	0.064	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-39.1	176.5	-80.5	-170.8	-79.4	0	0	112.4	A1352 Y1353 L1354 D1358 L1359 L1360 H1376	A1352-M1356 HydrophobicContact CB-CE 4.4Å; A1352-M1356 WeakPolarHBondContact O-CB 3.4Å; A1352-M1356 WeakPolarHBondContact O-CG 3.37Å; A1352-M1356 PolarHBondContact O-N 3.26Å; Y1353-M1356 HydrophobicContact CD1-CE 3.84Å; Y1353-M1356 HydrophobicContact CE1-CE 3.98Å; Y1353-M1356 HydrophobicContact CG-CE 4.3Å; Y1353-M1356 PolarHBondContact O-N 3.34Å; L1354-M1356 PolarHBondContact O-N 3.49Å; M1356-D1358 PolarHBondContact O-N 3.07Å; M1356-L1359 PolarHBondContact O-N 3.12Å; M1356-L1360 HydrophobicContact CB-CD1 4.12Å; M1356-L1360 HydrophobicContact CB-CG 4.46Å; M1356-L1360 HydrophobicContact CG-CD1 4.32Å; M1356-L1360 WeakPolarHBondContact O-CB 3.32Å; M1356-L1360 WeakPolarHBondContact O-CG 3.26Å; M1356-L1360 PolarHBondContact O-N 3.33Å; M1356-H1376 HydrophobicContact CG-CB 4.23Å; M1356-H1376 WeakPolarHBondContact CG-CD2 3.43Å
1357	K	88.8	Confident	82.1	Confident	1 Å²	1	39.2 Å²	39.2	0%	0.004	18%	0.179	C	C	.	.	I	π-helix	trans	-54.8	-53.1	178	-178.4	-173	69.9	67.2	0	111.8	I1300 Y1353 L1354 R1355 F1361 E1362 K1591 D1593 V1596	I1300-K1357 HydrophobicContact CD1-CB 4Å; I1300-K1357 HydrophobicContact CG1-CB 4.46Å; Y1353-K1357 PolarHBondContact O-N 3.48Å; L1354-K1357 WeakPolarHBondContact O-CB 3.2Å; L1354-K1357 PolarHBondContact O-N 3.09Å; R1355-K1357 VanDerWaalsContact C-N 3.34Å; R1355-K1357 PolarHBondContact O-N 3.14Å; K1357-F1361 HydrophobicContact CG-CD2 4.49Å; K1357-F1361 WeakPolarHBondContact O-CB 3.2Å; K1357-F1361 PolarHBondContact O-N 2.78Å; K1357-E1362 PolarHBondContact O-N 3.44Å; K1357-K1591 WeakPolarHBondContact CD-O 3.31Å; K1357-K1591 PolarHBondContact NZ-O 3.3Å; K1357-D1593 WeakPolarHBondContact CE-OD1 3.38Å; K1357-D1593 IonicContact NZ-OD1 3.64Å; K1357-D1593 PolarHBondContact NZ-OD1 3.22Å; K1357-V1596 HydrophobicContact CD-CB 4.37Å; K1357-V1596 HydrophobicContact CD-CG1 4.47Å; K1357-V1596 HydrophobicContact CD-CG2 3.71Å
1358	D	83.4	Confident	81.3	Confident	15 Å²	15	35.3 Å²	35.3	8%	0.08	16%	0.164	C	C	.	.	I	π-helix	trans	-72	-34.8	-176.7	-63.1	-51.3	0	0	0	111.8	K1141 Y1184 L1354 R1355 M1356 E1362	K1141-D1358 IonicContact NZ-OD1 3.65Å; K1141-D1358 PolarHBondContact NZ-OD1 2.98Å; Y1184-D1358 WeakPolarHBondContact CE1-OD2 3.35Å; L1354-D1358 PolarHBondContact O-N 2.95Å; R1355-D1358 PolarHBondContact O-N 3.14Å; M1356-D1358 PolarHBondContact O-N 3.07Å; D1358-E1362 WeakPolarHBondContact O-CB 3.15Å
1359	L	78	Confident	80.3	Confident	53 Å²	53	33.5 Å²	33.5	28%	0.277	16%	0.158	S	C	.	.	I	π-helix	trans	-74	-36.7	177.8	-69.4	171.4	0	0	0	114	M1105 R1355 M1356 R1364 H1376	M1105-L1359 HydrophobicContact CE-CD2 4.36Å; R1355-L1359 WeakPolarHBondContact O-CB 3.34Å; R1355-L1359 VanDerWaalsContact O-CG 3.25Å; R1355-L1359 WeakPolarHBondContact O-CG 3.37Å; R1355-L1359 PolarHBondContact O-N 3.43Å; M1356-L1359 PolarHBondContact O-N 3.12Å; L1359-R1364 PolarHBondContact O-NE 2.96Å; L1359-R1364 VanDerWaalsContact O-NE 3.1Å; L1359-R1364 PolarHBondContact O-NH2 2.9Å; L1359-H1376 WeakPolarHBondContact CD1-CE1 3.46Å
1360	L	79.9	Confident	79.7	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.031	17%	0.166	C	C	.	.	I	π-helix	trans	-97.5	-43.3	-171	-56.7	-175.5	0	0	0	113.4	M1356 R1364 Y1368 A1372 M1373	M1356-L1360 HydrophobicContact CB-CD1 4.12Å; M1356-L1360 HydrophobicContact CB-CG 4.46Å; M1356-L1360 HydrophobicContact CG-CD1 4.32Å; M1356-L1360 WeakPolarHBondContact O-CB 3.32Å; M1356-L1360 WeakPolarHBondContact O-CG 3.26Å; M1356-L1360 PolarHBondContact O-N 3.33Å; L1360-R1364 VanDerWaalsContact O-CD 3.27Å; L1360-R1364 WeakPolarHBondContact O-CD 3.44Å; L1360-Y1368 WeakPolarHBondContact O-CD1 3.17Å; L1360-A1372 HydrophobicContact CD2-CB 3.58Å; L1360-M1373 HydrophobicContact CD1-CB 4.08Å; L1360-M1373 HydrophobicContact CD1-CG 4.01Å; L1360-M1373 VanDerWaalsContact CD2-CA 3.5Å; L1360-M1373 HydrophobicContact CD2-CB 4Å; L1360-M1373 VanDerWaalsContact CD2-N 3.28Å
1361	F	80.9	Confident	79.1	Confident	14 Å²	14	39.3 Å²	39.3	6%	0.061	19%	0.19	C	C	.	.	I	π-helix	trans	-102.2	-34.1	-168.2	-54.4	-44.3	0	0	0	113	I1300 K1357 D1363 R1364 Y1368 F1450 D1589 K1591	I1300-F1361 HydrophobicContact CB-CE2 4.24Å; K1357-F1361 HydrophobicContact CG-CD2 4.49Å; K1357-F1361 WeakPolarHBondContact O-CB 3.2Å; K1357-F1361 PolarHBondContact O-N 2.78Å; F1361-D1363 PolarHBondContact O-N 3.33Å; F1361-R1364 PolarHBondContact O-N 2.94Å; F1361-Y1368 HydrophobicContact CD1-CD1 4.43Å; F1361-Y1368 AromaticContact CD1-CD2 3.83Å; F1361-Y1368 HydrophobicContact CD1-CD2 3.83Å; F1361-Y1368 HydrophobicContact CD1-CE1 4.22Å; F1361-Y1368 AromaticContact CD1-CE2 3.56Å; F1361-Y1368 HydrophobicContact CD1-CE2 3.56Å; F1361-Y1368 HydrophobicContact CD1-CG 4.27Å; F1361-Y1368 AromaticContact CD1-CZ 3.8Å; F1361-Y1368 AromaticContact CE1-CD2 3.96Å; F1361-Y1368 HydrophobicContact CE1-CD2 3.96Å; F1361-Y1368 AromaticContact CE1-CE2 3.93Å; F1361-Y1368 HydrophobicContact CE1-CE2 3.93Å; F1361-F1450 HydrophobicContact CE1-CE2 4.38Å; F1361-F1450 AromaticContact CE1-CZ 3.91Å; F1361-F1450 HydrophobicContact CE1-CZ 3.91Å; F1361-F1450 HydrophobicContact CZ-CZ 4.49Å; F1361-D1589 HydrophobicContact CB-CB 4.48Å; F1361-D1589 HydrophobicContact CD1-CB 3.74Å; F1361-D1589 HydrophobicContact CD2-CB 4.11Å; F1361-D1589 HydrophobicContact CE1-CB 3.88Å; F1361-D1589 HydrophobicContact CE2-CB 4.26Å; F1361-D1589 HydrophobicContact CG-CB 3.86Å; F1361-D1589 HydrophobicContact CZ-CB 4.15Å; F1361-K1591 HydrophobicContact CB-CD 4.15Å; F1361-K1591 HydrophobicContact CB-CG 3.97Å; F1361-K1591 VanDerWaalsContact O-CD 3.32Å; F1361-K1591 WeakPolarHBondContact O-CD 3.43Å; F1361-K1591 VanDerWaalsContact O-CE 3.25Å; F1361-K1591 WeakPolarHBondContact O-CE 3.26Å; F1361-K1591 PolarHBondContact O-NZ 2.85Å
1362	E	67.7	Low	78.5	Confident	25 Å²	25	37.9 Å²	37.9	12%	0.117	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	127	-173	-166.8	147.2	-82.5	0	0	112.8	E1101 K1141 Q1142 K1357 D1358 R1364	E1101-E1362 WeakPolarHBondContact OE2-CG 3.37Å; K1141-E1362 VanDerWaalsContact CE-CD 3.49Å; K1141-E1362 VanDerWaalsContact CE-OE1 3.28Å; K1141-E1362 WeakPolarHBondContact CE-OE1 3.48Å; K1141-E1362 WeakPolarHBondContact CE-OE2 3.43Å; K1141-E1362 VanDerWaalsContact NZ-CD 3.33Å; K1141-E1362 IonicContact NZ-OE1 3.78Å; K1141-E1362 PolarHBondContact NZ-OE1 2.93Å; K1141-E1362 IonicContact NZ-OE2 2.75Å; K1141-E1362 PolarHBondContact NZ-OE2 3.46Å; Q1142-E1362 PolarHBondContact NE2-OE2 2.88Å; Q1142-E1362 VanDerWaalsContact NE2-OE2 3.11Å; K1357-E1362 PolarHBondContact O-N 3.44Å; D1358-E1362 WeakPolarHBondContact O-CB 3.15Å; E1362-R1364 WeakPolarHBondContact O-CG 3.4Å; E1362-R1364 PolarHBondContact O-N 3.24Å
1363	D	62.1	Low	78.2	Confident	49 Å²	49	38.1 Å²	38.1	26%	0.262	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	-5.3	-176.7	-134.8	-15.1	0	0	0	118	K1100 E1101 C1102 F1361	K1100-D1363 WeakPolarHBondContact CA-OD2 3.48Å; K1100-D1363 WeakPolarHBondContact CB-OD2 3.34Å; K1100-D1363 WeakPolarHBondContact CG-OD2 3.49Å; K1100-D1363 IonicContact NZ-OD1 3.92Å; K1100-D1363 PolarHBondContact NZ-OD1 3.46Å; E1101-D1363 PolarHBondContact N-OD2 3.39Å; C1102-D1363 HydrophobicContact CB-CB 3.73Å; F1361-D1363 PolarHBondContact O-N 3.33Å
1364	R	66.5	Low	78	Confident	67 Å²	67	39.4 Å²	39.4	25%	0.253	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-76.4	151.2	175	-54.6	-158.6	-163.6	-136.2	12.9	111.5	L1359 L1360 F1361 E1362 Y1368 D1369 K1591	L1359-R1364 PolarHBondContact O-NE 2.96Å; L1359-R1364 VanDerWaalsContact O-NE 3.1Å; L1359-R1364 PolarHBondContact O-NH2 2.9Å; L1360-R1364 VanDerWaalsContact O-CD 3.27Å; L1360-R1364 WeakPolarHBondContact O-CD 3.44Å; F1361-R1364 PolarHBondContact O-N 2.94Å; E1362-R1364 WeakPolarHBondContact O-CG 3.4Å; E1362-R1364 PolarHBondContact O-N 3.24Å; R1364-Y1368 HydrophobicContact CB-CD1 3.67Å; R1364-Y1368 HydrophobicContact CB-CE1 3.78Å; R1364-D1369 IonicContact CZ-OD2 3.45Å; R1364-D1369 IonicContact NH1-OD2 3.51Å; R1364-D1369 PolarHBondContact NH1-OD2 3.12Å; R1364-D1369 IonicContact NH2-OD2 2.72Å; R1364-K1591 PolarHBondContact O-NZ 3.45Å
1365	K	68	Low	77.7	Confident	157 Å²	157	45.4 Å²	45.4	68%	0.683	21%	0.211	S	C	*	.	P	Polyproline II helix	trans	-95.6	162.5	170	-71.7	-168.8	171.9	-168.7	0	110.6	P1367 Y1368	K1365-P1367 CarbonylContact O-C 3.59Å; K1365-P1367 VanDerWaalsContact O-O 3.07Å; K1365-Y1368 VanDerWaalsContact O-CD1 3.28Å; K1365-Y1368 WeakPolarHBondContact O-CD1 3.42Å
1366	R	70	Confident	77.5	Confident	52 Å²	52	42.6 Å²	42.6	20%	0.196	20%	0.201	C	C	.	.	S	Bend	trans	-87	146.2	171.7	-67.6	-171	-159.4	165.1	5.1	111.1	Y1368 T1448 Y1449 D1589	R1366-Y1368 HydrophobicContact CG-CD2 4.07Å; R1366-Y1368 HydrophobicContact CG-CE1 4.37Å; R1366-Y1368 HydrophobicContact CG-CE2 3.52Å; R1366-T1448 WeakPolarHBondContact CB-O 3.24Å; R1366-T1448 WeakPolarHBondContact CD-O 3.19Å; R1366-Y1449 VanDerWaalsContact NH1-CZ 3.26Å; R1366-Y1449 PolarHBondContact NH1-OH 3.13Å; R1366-Y1449 VanDerWaalsContact NH2-CE1 3.28Å; R1366-Y1449 PolarHBondContact NH2-OH 3.39Å; R1366-D1589 IonicContact CZ-OD1 2.78Å; R1366-D1589 IonicContact CZ-OD2 2.62Å; R1366-D1589 VanDerWaalsContact CZ-OD2 3.27Å; R1366-D1589 IonicContact NE-OD2 3.44Å; R1366-D1589 PolarHBondContact NE-OD2 3.41Å; R1366-D1589 IonicContact NH2-OD1 2.74Å; R1366-D1589 PolarHBondContact NH2-OD1 3.2Å; R1366-D1589 IonicContact NH2-OD2 2.72Å; R1366-D1589 PolarHBondContact NH2-OD2 3.07Å
1367	P	70.1	Confident	77.6	Confident	43 Å²	43	42.2 Å²	42.2	28%	0.279	20%	0.2	S	C	.	.	S	Bend	cis	-63.7	147	-10.9	30.6	-36.4	0	0	0	111.2	F768 K1365	F768-P1367 WeakPolarHBondContact O-CG 3.14Å; K1365-P1367 CarbonylContact O-C 3.59Å; K1365-P1367 VanDerWaalsContact O-O 3.07Å
1368	Y	76.1	Confident	77.6	Confident	8 Å²	8	44.6 Å²	44.6	3%	0.031	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-80.4	144.6	-177.7	-68.4	-63.6	0	0	0	111.5	L1360 F1361 R1364 K1365 R1366 T1370 Y1449 F1450 D1589 K1591	L1360-Y1368 WeakPolarHBondContact O-CD1 3.17Å; F1361-Y1368 HydrophobicContact CD1-CD1 4.43Å; F1361-Y1368 AromaticContact CD1-CD2 3.83Å; F1361-Y1368 HydrophobicContact CD1-CD2 3.83Å; F1361-Y1368 HydrophobicContact CD1-CE1 4.22Å; F1361-Y1368 AromaticContact CD1-CE2 3.56Å; F1361-Y1368 HydrophobicContact CD1-CE2 3.56Å; F1361-Y1368 HydrophobicContact CD1-CG 4.27Å; F1361-Y1368 AromaticContact CD1-CZ 3.8Å; F1361-Y1368 AromaticContact CE1-CD2 3.96Å; F1361-Y1368 HydrophobicContact CE1-CD2 3.96Å; F1361-Y1368 AromaticContact CE1-CE2 3.93Å; F1361-Y1368 HydrophobicContact CE1-CE2 3.93Å; R1364-Y1368 HydrophobicContact CB-CD1 3.67Å; R1364-Y1368 HydrophobicContact CB-CE1 3.78Å; K1365-Y1368 VanDerWaalsContact O-CD1 3.28Å; K1365-Y1368 WeakPolarHBondContact O-CD1 3.42Å; R1366-Y1368 HydrophobicContact CG-CD2 4.07Å; R1366-Y1368 HydrophobicContact CG-CE1 4.37Å; R1366-Y1368 HydrophobicContact CG-CE2 3.52Å; Y1368-T1370 PolarHBondContact O-N 3.4Å; Y1368-T1370 VanDerWaalsContact O-N 3.16Å; Y1368-Y1449 WeakPolarHBondContact CB-O 3.27Å; Y1368-Y1449 WeakPolarHBondContact CD2-O 3.33Å; Y1368-Y1449 HydrophobicContact CE2-CD1 4.13Å; Y1368-Y1449 PolarHBondContact N-O 3.09Å; Y1368-F1450 HydrophobicContact CD2-CE1 4.47Å; Y1368-F1450 HydrophobicContact CD2-CZ 4.44Å; Y1368-F1450 HydrophobicContact CG-CE1 4.44Å; Y1368-D1589 HydrophobicContact CE2-CB 4.05Å; Y1368-D1589 WeakPolarHBondContact CE2-OD2 3.22Å; Y1368-D1589 PolarHBondContact OH-OD2 2.87Å; Y1368-K1591 WeakPolarHBondContact OH-CE 3.26Å; Y1368-K1591 PolarHBondContact OH-NZ 2.95Å
1369	D	70.7	Confident	77.7	Confident	63 Å²	63	49.9 Å²	49.9	34%	0.337	23%	0.234	S	C	.	.			trans	-49.5	115	171.1	166.8	15	0	0	0	111.2	R1364 D1371 A1372	R1364-D1369 IonicContact CZ-OD2 3.45Å; R1364-D1369 IonicContact NH1-OD2 3.51Å; R1364-D1369 PolarHBondContact NH1-OD2 3.12Å; R1364-D1369 IonicContact NH2-OD2 2.72Å; D1369-D1371 WeakPolarHBondContact OD1-CB 3.14Å; D1369-D1371 PolarHBondContact OD1-N 3.22Å; D1369-A1372 HydrophobicContact CB-CB 4.48Å; D1369-A1372 PolarHBondContact OD1-N 3.2Å; D1369-A1372 WeakPolarHBondContact OD2-CB 3.47Å
1370	T	80.3	Confident	78.1	Confident	28 Å²	28	48.7 Å²	48.7	17%	0.172	23%	0.227	C	C	.	.	H	α-helix	trans	-77.4	-27.3	-177	50.4	0	0	0	0	113	Y1368 A1372 M1373 E1374 F1450 T1451	Y1368-T1370 PolarHBondContact O-N 3.4Å; Y1368-T1370 VanDerWaalsContact O-N 3.16Å; T1370-A1372 VanDerWaalsContact C-N 3.27Å; T1370-A1372 PolarHBondContact O-N 2.8Å; T1370-M1373 PolarHBondContact O-N 3.37Å; T1370-M1373 VanDerWaalsContact O-N 3.14Å; T1370-E1374 WeakPolarHBondContact O-CG 3.12Å; T1370-E1374 PolarHBondContact O-N 3.27Å; T1370-F1450 HydrophobicContact CG2-CD1 4.38Å; T1370-T1451 HydrophobicContact CG2-CG2 4.21Å
1371	D	81.9	Confident	78.4	Confident	97 Å²	97	48.6 Å²	48.6	52%	0.519	23%	0.227	S	C	.	.	H	α-helix	trans	-69.2	-32.7	-178.6	-63.8	0.4	0	0	0	110.2	D1369 R1375	D1369-D1371 WeakPolarHBondContact OD1-CB 3.14Å; D1369-D1371 PolarHBondContact OD1-N 3.22Å; D1371-R1375 WeakPolarHBondContact O-CB 3.4Å; D1371-R1375 PolarHBondContact O-N 3.25Å; D1371-R1375 PolarHBondContact O-NH1 3.14Å
1372	A	78.9	Confident	78.6	Confident	6 Å²	6	49.1 Å²	49.1	5%	0.05	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-44.2	170.1	0	0	0	0	0	112.5	L1360 D1369 T1370 H1376	L1360-A1372 HydrophobicContact CD2-CB 3.58Å; D1369-A1372 HydrophobicContact CB-CB 4.48Å; D1369-A1372 PolarHBondContact OD1-N 3.2Å; D1369-A1372 WeakPolarHBondContact OD2-CB 3.47Å; T1370-A1372 VanDerWaalsContact C-N 3.27Å; T1370-A1372 PolarHBondContact O-N 2.8Å; A1372-H1376 PolarHBondContact O-N 3Å
1373	M	83.2	Confident	79.4	Confident	10 Å²	10	52.4 Å²	52.4	5%	0.049	25%	0.254	C	S	.	.	H	α-helix	trans	-67.8	-50	179.1	-173.3	-175.8	-168.1	0	0	111.1	I1335 L1360 T1370 R1375 H1376 V1377 S1444 F1450	I1335-M1373 HydrophobicContact CD1-CE 4.37Å; L1360-M1373 HydrophobicContact CD1-CB 4.08Å; L1360-M1373 HydrophobicContact CD1-CG 4.01Å; L1360-M1373 VanDerWaalsContact CD2-CA 3.5Å; L1360-M1373 HydrophobicContact CD2-CB 4Å; L1360-M1373 VanDerWaalsContact CD2-N 3.28Å; T1370-M1373 PolarHBondContact O-N 3.37Å; T1370-M1373 VanDerWaalsContact O-N 3.14Å; M1373-R1375 VanDerWaalsContact C-N 3.33Å; M1373-R1375 PolarHBondContact O-N 2.88Å; M1373-H1376 PolarHBondContact O-N 3.28Å; M1373-V1377 WeakPolarHBondContact O-CG2 3.3Å; M1373-V1377 PolarHBondContact O-N 3.09Å; M1373-S1444 WeakPolarHBondContact CE-OG 3.38Å; M1373-F1450 HydrophobicContact CB-CE1 4.15Å; M1373-F1450 HydrophobicContact CE-CE2 4.16Å; M1373-F1450 HydrophobicContact CE-CZ 4.32Å; M1373-F1450 HydrophobicContact CG-CE1 4.4Å; M1373-F1450 HydrophobicContact CG-CZ 4.46Å; M1373-F1450 HydrophobicContact SD-CD1 3.93Å; M1373-F1450 HydrophobicContact SD-CD2 4.06Å; M1373-F1450 HydrophobicContact SD-CE1 3.67Å; M1373-F1450 HydrophobicContact SD-CE2 3.82Å; M1373-F1450 HydrophobicContact SD-CG 4.11Å; M1373-F1450 HydrophobicContact SD-CZ 3.62Å
1374	E	87.8	Confident	80.4	Confident	39 Å²	39	57.2 Å²	57.2	18%	0.182	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-43.8	179.2	-74.9	-167.9	-169.3	0	0	112	T1370 H1376 V1377 K1378 W1437 R1441	T1370-E1374 WeakPolarHBondContact O-CG 3.12Å; T1370-E1374 PolarHBondContact O-N 3.27Å; E1374-H1376 PolarHBondContact O-N 2.96Å; E1374-V1377 PolarHBondContact O-N 3.2Å; E1374-K1378 HydrophobicContact CB-CD 4.38Å; E1374-K1378 VanDerWaalsContact O-CB 3.29Å; E1374-K1378 WeakPolarHBondContact O-CB 3.45Å; E1374-K1378 VanDerWaalsContact O-CD 3.29Å; E1374-K1378 WeakPolarHBondContact O-CD 3.15Å; E1374-K1378 WeakPolarHBondContact O-CG 3.32Å; E1374-K1378 PolarHBondContact O-N 2.73Å; E1374-K1378 IonicContact OE2-NZ 2.68Å; E1374-K1378 PolarHBondContact OE2-NZ 3.45Å; E1374-W1437 HydrophobicContact CB-CZ3 4.46Å; E1374-W1437 VanDerWaalsContact CD-CZ3 3.43Å; E1374-W1437 HydrophobicContact CG-CE3 4.25Å; E1374-W1437 HydrophobicContact CG-CZ3 3.95Å; E1374-W1437 WeakPolarHBondContact OE2-CZ3 3.25Å; E1374-R1441 HydrophobicContact CG-CG 4.01Å
1375	R	85.2	Confident	81.5	Confident	127 Å²	127	54.3 Å²	54.3	48%	0.479	27%	0.265	S	S	.	.	H	α-helix	trans	-58.5	-48.7	178.5	-172.9	-176.1	-51.3	96.9	10.6	111.5	D1371 M1373 V1377 K1378 E1379	D1371-R1375 WeakPolarHBondContact O-CB 3.4Å; D1371-R1375 PolarHBondContact O-N 3.25Å; D1371-R1375 PolarHBondContact O-NH1 3.14Å; M1373-R1375 VanDerWaalsContact C-N 3.33Å; M1373-R1375 PolarHBondContact O-N 2.88Å; R1375-V1377 PolarHBondContact O-N 2.94Å; R1375-K1378 PolarHBondContact O-N 3.43Å; R1375-E1379 VanDerWaalsContact CG-OE1 3.31Å; R1375-E1379 WeakPolarHBondContact CG-OE1 3.27Å; R1375-E1379 WeakPolarHBondContact O-CB 3.42Å; R1375-E1379 VanDerWaalsContact O-CG 3.3Å; R1375-E1379 WeakPolarHBondContact O-CG 3.41Å; R1375-E1379 PolarHBondContact O-N 3.24Å
1376	H	82.9	Confident	82.4	Confident	22 Å²	22	51.6 Å²	51.6	10%	0.102	25%	0.25	C	S	.	.	H	α-helix	trans	-67.1	-36.9	179.7	-163.5	90.7	0	0	0	112.6	R1355 M1356 L1359 A1372 M1373 E1374 E1379 H1380	R1355-H1376 WeakPolarHBondContact CB-NE2 3.46Å; R1355-H1376 WeakPolarHBondContact CD-NE2 3.27Å; M1356-H1376 HydrophobicContact CG-CB 4.23Å; M1356-H1376 WeakPolarHBondContact CG-CD2 3.43Å; L1359-H1376 WeakPolarHBondContact CD1-CE1 3.46Å; A1372-H1376 PolarHBondContact O-N 3Å; M1373-H1376 PolarHBondContact O-N 3.28Å; E1374-H1376 PolarHBondContact O-N 2.96Å; H1376-E1379 IonicContact CE1-OE2 3.57Å; H1376-E1379 PolarHBondContact CE1-OE2 3.19Å; H1376-E1379 PolarHBondContact O-N 3.46Å; H1376-H1380 VanDerWaalsContact O-CB 3.32Å; H1376-H1380 WeakPolarHBondContact O-CB 3.44Å; H1376-H1380 PolarHBondContact O-N 2.81Å
1377	V	86.8	Confident	83.2	Confident	4 Å²	4	49.4 Å²	49.4	2%	0.024	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-43.2	175.2	178.4	0	0	0	0	110.7	M1373 E1374 R1375 E1379 H1380 V1381 W1437 L1440	M1373-V1377 WeakPolarHBondContact O-CG2 3.3Å; M1373-V1377 PolarHBondContact O-N 3.09Å; E1374-V1377 PolarHBondContact O-N 3.2Å; R1375-V1377 PolarHBondContact O-N 2.94Å; V1377-E1379 PolarHBondContact O-N 3.23Å; V1377-H1380 PolarHBondContact O-N 3.21Å; V1377-H1380 VanDerWaalsContact O-N 3.15Å; V1377-V1381 HydrophobicContact CG1-CG2 4.31Å; V1377-V1381 WeakPolarHBondContact O-CG2 3.19Å; V1377-V1381 PolarHBondContact O-N 3.34Å; V1377-W1437 HydrophobicContact CB-CB 4.49Å; V1377-W1437 HydrophobicContact CG1-CB 3.77Å; V1377-L1440 HydrophobicContact CG1-CB 4.15Å; V1377-L1440 HydrophobicContact CG1-CD1 3.83Å
1378	K	89.9	Confident	83.9	Confident	51 Å²	51	50.7 Å²	50.7	22%	0.222	25%	0.25	C	C	.	.	H	α-helix	trans	-57.5	-45.3	174	-72.3	160.4	-176.6	165	0	111.6	E1374 R1375 G1382 L1383 W1437	E1374-K1378 HydrophobicContact CB-CD 4.38Å; E1374-K1378 VanDerWaalsContact O-CB 3.29Å; E1374-K1378 WeakPolarHBondContact O-CB 3.45Å; E1374-K1378 VanDerWaalsContact O-CD 3.29Å; E1374-K1378 WeakPolarHBondContact O-CD 3.15Å; E1374-K1378 WeakPolarHBondContact O-CG 3.32Å; E1374-K1378 PolarHBondContact O-N 2.73Å; E1374-K1378 IonicContact OE2-NZ 2.68Å; E1374-K1378 PolarHBondContact OE2-NZ 3.45Å; R1375-K1378 PolarHBondContact O-N 3.43Å; K1378-G1382 CarbonylContact O-C 3.59Å; K1378-G1382 WeakPolarHBondContact O-CA 3.43Å; K1378-G1382 PolarHBondContact O-N 3.41Å; K1378-L1383 HydrophobicContact CB-CD1 4.07Å; K1378-L1383 HydrophobicContact CD-CD1 3.81Å; K1378-L1383 HydrophobicContact CG-CD1 3.79Å; K1378-L1383 PolarHBondContact O-N 3.49Å; K1378-W1437 HydrophobicContact CD-CD2 4.13Å; K1378-W1437 HydrophobicContact CD-CE3 4.41Å; K1378-W1437 HydrophobicContact CD-CG 4.45Å; K1378-W1437 VanDerWaalsContact CE-CH2 3.42Å; K1378-W1437 VanDerWaalsContact CE-CZ3 3.42Å; K1378-W1437 HydrophobicContact CG-CB 3.92Å; K1378-W1437 HydrophobicContact CG-CD2 3.67Å; K1378-W1437 HydrophobicContact CG-CE3 4.24Å; K1378-W1437 HydrophobicContact CG-CG 3.49Å; K1378-W1437 VanDerWaalsContact CG-CG 3.49Å
1379	E	84.7	Confident	84.4	Confident	126 Å²	126	53.8 Å²	53.8	59%	0.589	27%	0.267	S	S	*	.	H	α-helix	trans	-63.5	-38.6	174.2	-73.7	165.8	-170.9	0	0	112.5	R1375 H1376 V1377	R1375-E1379 VanDerWaalsContact CG-OE1 3.31Å; R1375-E1379 WeakPolarHBondContact CG-OE1 3.27Å; R1375-E1379 WeakPolarHBondContact O-CB 3.42Å; R1375-E1379 VanDerWaalsContact O-CG 3.3Å; R1375-E1379 WeakPolarHBondContact O-CG 3.41Å; R1375-E1379 PolarHBondContact O-N 3.24Å; H1376-E1379 IonicContact CE1-OE2 3.57Å; H1376-E1379 PolarHBondContact CE1-OE2 3.19Å; H1376-E1379 PolarHBondContact O-N 3.46Å; V1377-E1379 PolarHBondContact O-N 3.23Å
1380	H	86	Confident	85.2	Confident	28 Å²	28	51 Å²	51	13%	0.13	25%	0.252	C	S	.	.	H	α-helix	trans	-76.8	-52.9	-175.7	-163.7	76.2	0	0	0	113.2	S1339 K1344 A1352 H1376 V1377	S1339-H1380 PolarHBondContact OG-CD2 3Å; S1339-H1380 VanDerWaalsContact OG-CD2 3.24Å; S1339-H1380 PolarHBondContact OG-NE2 2.95Å; K1344-H1380 WeakPolarHBondContact CE-O 3.22Å; K1344-H1380 PolarHBondContact NZ-O 3.15Å; A1352-H1380 WeakPolarHBondContact CB-CE1 3.47Å; A1352-H1380 WeakPolarHBondContact CB-ND1 3.42Å; H1376-H1380 VanDerWaalsContact O-CB 3.32Å; H1376-H1380 WeakPolarHBondContact O-CB 3.44Å; H1376-H1380 PolarHBondContact O-N 2.81Å; V1377-H1380 PolarHBondContact O-N 3.21Å; V1377-H1380 VanDerWaalsContact O-N 3.15Å
1381	V	87.8	Confident	85.4	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.03	28%	0.281	C	S	.	.	H	α-helix	trans	-92.8	-19.1	-174.7	-51.5	0	0	0	0	114.3	V1377 L1436 W1437 L1440	V1377-V1381 HydrophobicContact CG1-CG2 4.31Å; V1377-V1381 WeakPolarHBondContact O-CG2 3.19Å; V1377-V1381 PolarHBondContact O-N 3.34Å; V1381-L1436 HydrophobicContact CB-CD2 4.12Å; V1381-L1436 HydrophobicContact CG2-CB 4.42Å; V1381-L1436 HydrophobicContact CG2-CD2 4.08Å; V1381-L1436 HydrophobicContact CG2-CG 4.13Å; V1381-W1437 HydrophobicContact CG2-CB 4.24Å; V1381-L1440 HydrophobicContact CG1-CD1 3.85Å; V1381-L1440 HydrophobicContact CG2-CD1 4.23Å
1382	G	84.7	Confident	85.6	Confident	24 Å²	24	56.4 Å²	56.4	25%	0.247	28%	0.279	C	S	.	.			trans	110.6	140	-175	0	0	0	0	0	112.4	K1378	K1378-G1382 CarbonylContact O-C 3.59Å; K1378-G1382 WeakPolarHBondContact O-CA 3.43Å; K1378-G1382 PolarHBondContact O-N 3.41Å
1383	L	84.5	Confident	86.2	Confident	94 Å²	94	56.2 Å²	56.2	49%	0.492	28%	0.278	S	S	.	.	S	Bend	trans	-66.1	-47.1	-179.4	-175.6	66.6	0	0	0	112.4	K1378 W1437	K1378-L1383 HydrophobicContact CB-CD1 4.07Å; K1378-L1383 HydrophobicContact CD-CD1 3.81Å; K1378-L1383 HydrophobicContact CG-CD1 3.79Å; K1378-L1383 PolarHBondContact O-N 3.49Å; L1383-W1437 PolarHBondContact O-NE1 2.9Å
1384	E	83.7	Confident	86.7	Confident	150 Å²	150	57.8 Å²	57.8	70%	0.701	28%	0.284	S	S	*	.	S	Bend	trans	-92.6	-3.5	-175.7	-55.4	-51.6	133.8	0	0	113.9	R1386	E1384-R1386 PolarHBondContact O-N 2.95Å
1385	A	87.8	Confident	86.9	Confident	6 Å²	6	56 Å²	56	5%	0.05	28%	0.275	C	S	.	.			trans	-65	130.7	-178	0	0	0	0	0	110.3	D1389 L1436	A1385-D1389 WeakPolarHBondContact CA-OD2 3.26Å; A1385-L1436 HydrophobicContact CB-CB 4.37Å; A1385-L1436 HydrophobicContact CB-CD2 4.33Å; A1385-L1436 WeakPolarHBondContact O-CB 3.4Å; A1385-L1436 PolarHBondContact O-N 3.44Å
1386	R	87.8	Confident	87.3	Confident	100 Å²	100	49.9 Å²	49.9	38%	0.377	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-102.5	161	178.5	-58.8	179.4	173	-145.2	-5.6	111	E1384 T1388 D1389 E1433	E1384-R1386 PolarHBondContact O-N 2.95Å; R1386-T1388 WeakPolarHBondContact CB-OG1 3.37Å; R1386-T1388 PolarHBondContact O-N 3.1Å; R1386-D1389 PolarHBondContact N-OD2 2.91Å; R1386-D1389 WeakPolarHBondContact O-CB 3.43Å; R1386-D1389 PolarHBondContact O-N 3.44Å; R1386-E1433 IonicContact CZ-OE1 3.97Å; R1386-E1433 IonicContact NH1-OE1 3.05Å; R1386-E1433 PolarHBondContact NH1-OE1 3.04Å; R1386-E1433 IonicContact NH2-OE1 3.39Å
1387	M	86.4	Confident	87.8	Confident	7 Å²	7	48.9 Å²	48.9	3%	0.034	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-61.9	-35	174	-170.3	68.4	177.9	0	0	111.9	D1389 I1390 L1395 I1397 F1412 R1413 S1414 L1436 V1439	M1387-D1389 VanDerWaalsContact C-N 3.25Å; M1387-D1389 PolarHBondContact O-N 2.87Å; M1387-I1390 PolarHBondContact O-N 3.34Å; M1387-L1395 HydrophobicContact CE-CB 4.22Å; M1387-L1395 HydrophobicContact CE-CD2 3.9Å; M1387-L1395 HydrophobicContact CE-CG 3.75Å; M1387-L1395 WeakPolarHBondContact CE-O 3.4Å; M1387-L1395 HydrophobicContact SD-CD2 4.16Å; M1387-I1397 HydrophobicContact CE-CB 4.31Å; M1387-I1397 HydrophobicContact CE-CD1 3.88Å; M1387-I1397 HydrophobicContact CE-CG1 4.02Å; M1387-I1397 HydrophobicContact SD-CD1 3.94Å; M1387-F1412 HydrophobicContact CE-CB 4.33Å; M1387-R1413 WeakPolarHBondContact CG-O 3.43Å; M1387-S1414 WeakPolarHBondContact O-CA 3.49Å; M1387-S1414 WeakPolarHBondContact O-CB 3.38Å; M1387-L1436 HydrophobicContact SD-CD1 3.8Å; M1387-V1439 HydrophobicContact SD-CG1 4.21Å
1388	T	85.1	Confident	88.2	Confident	70 Å²	70	48.7 Å²	48.7	43%	0.429	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-67.3	-16.9	177.7	51	0	0	0	0	114.7	R1386 I1390	R1386-T1388 WeakPolarHBondContact CB-OG1 3.37Å; R1386-T1388 PolarHBondContact O-N 3.1Å; T1388-I1390 PolarHBondContact O-N 3.01Å
1389	D	87.1	Confident	88.2	Confident	72 Å²	72	46.2 Å²	46.2	39%	0.385	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-73.4	-8.7	-179.6	-56.7	-11.5	0	0	0	112.2	A1385 R1386 M1387	A1385-D1389 WeakPolarHBondContact CA-OD2 3.26Å; R1386-D1389 PolarHBondContact N-OD2 2.91Å; R1386-D1389 WeakPolarHBondContact O-CB 3.43Å; R1386-D1389 PolarHBondContact O-N 3.44Å; M1387-D1389 VanDerWaalsContact C-N 3.25Å; M1387-D1389 PolarHBondContact O-N 2.87Å
1390	I	87.3	Confident	88.4	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.021	21%	0.208	C	C	.	.			trans	-100.1	84.4	-174.7	-60.6	175.1	0	0	0	109.5	A1341 R1342 M1387 T1388 L1395 S1414 L1436	A1341-I1390 HydrophobicContact CB-CD1 4.31Å; A1341-I1390 HydrophobicContact CB-CG2 3.59Å; R1342-I1390 HydrophobicContact CG-CD1 4.13Å; R1342-I1390 HydrophobicContact CG-CG1 4.46Å; M1387-I1390 PolarHBondContact O-N 3.34Å; T1388-I1390 PolarHBondContact O-N 3.01Å; I1390-L1395 HydrophobicContact CD1-CD2 3.6Å; I1390-L1395 HydrophobicContact CG2-CB 4.06Å; I1390-L1395 HydrophobicContact CG2-CD2 4.25Å; I1390-S1414 WeakPolarHBondContact O-CB 3.31Å; I1390-S1414 PolarHBondContact O-OG 3.07Å; I1390-L1436 HydrophobicContact CD1-CD1 4.18Å; I1390-L1436 HydrophobicContact CD1-CD2 3.89Å
1391	T	84.1	Confident	88.3	Confident	128 Å²	128	40 Å²	40	79%	0.785	21%	0.208	S	C	*	.			trans	-81.9	-28.6	-176.3	56	0	0	0	0	114.1
1392	K	85.7	Confident	87.7	Confident	112 Å²	112	40.2 Å²	40.2	49%	0.487	21%	0.21	S	C	.	.	S	Bend	trans	-141.8	136.9	168.3	-166.7	-169.2	-177.9	-158.1	0	110.1	S1322 V1324	S1322-K1392 PolarHBondContact O-NZ 2.77Å; V1324-K1392 VanDerWaalsContact O-CE 3.22Å; V1324-K1392 WeakPolarHBondContact O-CE 3.32Å
1393	P	92.5	Very high	87.2	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.013	21%	0.209	C	C	.	.	S	Bend	cis	-65.1	166.4	-12	30	-37.1	0	0	0	112.1	I1321 V1324 D1325 L1327 A1341 L1395	I1321-P1393 HydrophobicContact CD1-CG 3.78Å; V1324-P1393 HydrophobicContact CB-CB 4.42Å; V1324-P1393 HydrophobicContact CG1-CB 3.91Å; V1324-P1393 HydrophobicContact CG1-CG 4.27Å; D1325-P1393 CarbonylContact O-C 3.55Å; D1325-P1393 WeakPolarHBondContact O-CA 3.38Å; D1325-P1393 VanDerWaalsContact O-CB 3.26Å; D1325-P1393 WeakPolarHBondContact O-CB 3.46Å; L1327-P1393 HydrophobicContact CB-CB 4.06Å; L1327-P1393 HydrophobicContact CB-CG 3.64Å; L1327-P1393 HydrophobicContact CD2-CG 3.78Å; L1327-P1393 HydrophobicContact CG-CG 4.4Å; A1341-P1393 HydrophobicContact CB-CG 4.34Å; P1393-L1395 PolarHBondContact O-N 3.2Å; P1393-L1395 VanDerWaalsContact O-N 3.12Å
1394	K	92.1	Very high	86.5	Confident	43 Å²	43	41.1 Å²	41.1	19%	0.187	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	111.6	163.7	-79.8	178.1	174.1	-76.2	0	108.1	D1325 W1326 L1327 Y1415 Y1478	D1325-K1394 PolarHBondContact O-N 3.35Å; W1326-K1394 WeakPolarHBondContact CA-O 3.3Å; W1326-K1394 HydrophobicContact CD2-CB 3.82Å; W1326-K1394 HydrophobicContact CD2-CD 4.05Å; W1326-K1394 HydrophobicContact CE3-CB 3.84Å; W1326-K1394 HydrophobicContact CE3-CD 4.36Å; W1326-K1394 HydrophobicContact CG-CB 4.26Å; W1326-K1394 HydrophobicContact CH2-CD 3.81Å; W1326-K1394 HydrophobicContact CZ2-CD 3.42Å; W1326-K1394 VanDerWaalsContact CZ2-CD 3.42Å; W1326-K1394 HydrophobicContact CZ3-CB 4.28Å; W1326-K1394 HydrophobicContact CZ3-CD 4.26Å; L1327-K1394 PolarHBondContact N-O 2.87Å; K1394-Y1415 HydrophobicContact CB-CD1 3.78Å; K1394-Y1415 HydrophobicContact CB-CE1 3.95Å; K1394-Y1415 HydrophobicContact CD-CD1 4.19Å; K1394-Y1415 HydrophobicContact CD-CG 4.4Å; K1394-Y1415 HydrophobicContact CG-CD1 3.78Å; K1394-Y1415 HydrophobicContact CG-CE1 4.34Å; K1394-Y1415 HydrophobicContact CG-CG 4.27Å; K1394-Y1478 WeakPolarHBondContact CE-OH 3.35Å; K1394-Y1478 PolarHBondContact NZ-OH 2.76Å
1395	L	93.2	Very high	85.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	132.5	-173.3	177.2	64.3	0	0	0	110.6	L1327 A1337 A1338 M1387 I1390 P1393 I1397 R1413 S1414	L1327-L1395 HydrophobicContact CB-CD1 4.16Å; L1327-L1395 HydrophobicContact CD2-CD1 4.1Å; L1327-L1395 HydrophobicContact CG-CD1 3.88Å; L1327-L1395 CarbonylContact O-C 3.44Å; L1327-L1395 WeakPolarHBondContact O-CA 3.44Å; A1337-L1395 HydrophobicContact CB-CD1 3.73Å; A1338-L1395 HydrophobicContact CB-CD2 4.3Å; M1387-L1395 HydrophobicContact CE-CB 4.22Å; M1387-L1395 HydrophobicContact CE-CD2 3.9Å; M1387-L1395 HydrophobicContact CE-CG 3.75Å; M1387-L1395 WeakPolarHBondContact CE-O 3.4Å; M1387-L1395 HydrophobicContact SD-CD2 4.16Å; I1390-L1395 HydrophobicContact CD1-CD2 3.6Å; I1390-L1395 HydrophobicContact CG2-CB 4.06Å; I1390-L1395 HydrophobicContact CG2-CD2 4.25Å; P1393-L1395 PolarHBondContact O-N 3.2Å; P1393-L1395 VanDerWaalsContact O-N 3.12Å; L1395-I1397 HydrophobicContact CD1-CG1 4.34Å; L1395-I1397 HydrophobicContact CD2-CD1 4.09Å; L1395-I1397 HydrophobicContact CG-CD1 4.39Å; L1395-I1397 HydrophobicContact CG-CG1 4.28Å; L1395-R1413 WeakPolarHBondContact O-CA 3.33Å; L1395-S1414 PolarHBondContact N-OG 2.99Å; L1395-S1414 PolarHBondContact O-N 3.11Å
1396	I	93.3	Very high	84.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.3	169.2	72.1	170.8	0	0	0	111.3	L1327 A1328 G1329 I1411 F1412 Y1415 L1471 E1474	L1327-I1396 PolarHBondContact O-N 3.07Å; A1328-I1396 WeakPolarHBondContact CA-O 3.45Å; A1328-I1396 HydrophobicContact CB-CD1 3.87Å; A1328-I1396 HydrophobicContact CB-CG1 3.54Å; G1329-I1396 PolarHBondContact N-O 3.5Å; I1396-I1411 HydrophobicContact CB-CG2 3.91Å; I1396-I1411 HydrophobicContact CG2-CG2 4.32Å; I1396-F1412 WeakPolarHBondContact CA-O 3.18Å; I1396-Y1415 HydrophobicContact CG2-CE1 3.83Å; I1396-Y1415 WeakPolarHBondContact CG2-OH 3.4Å; I1396-L1471 HydrophobicContact CD1-CB 4.04Å; I1396-L1471 HydrophobicContact CD1-CD1 3.71Å; I1396-L1471 HydrophobicContact CD1-CG 4.48Å; I1396-L1471 HydrophobicContact CG1-CD1 4.25Å; I1396-E1474 HydrophobicContact CD1-CB 4.29Å; I1396-E1474 HydrophobicContact CD1-CG 4.29Å; I1396-E1474 HydrophobicContact CG2-CG 4.15Å
1397	I	94	Very high	84.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	125.1	-179.6	-70	172.8	0	0	0	109.3	G1329 A1334 A1338 M1387 L1395 F1412 V1439 L1440 S1443	G1329-I1397 WeakPolarHBondContact O-CA 3.38Å; A1334-I1397 HydrophobicContact CB-CB 4.39Å; A1334-I1397 HydrophobicContact CB-CD1 4.27Å; A1334-I1397 HydrophobicContact CB-CG1 3.96Å; A1334-I1397 HydrophobicContact CB-CG2 3.72Å; A1338-I1397 HydrophobicContact CB-CD1 4.49Å; M1387-I1397 HydrophobicContact CE-CB 4.31Å; M1387-I1397 HydrophobicContact CE-CD1 3.88Å; M1387-I1397 HydrophobicContact CE-CG1 4.02Å; M1387-I1397 HydrophobicContact SD-CD1 3.94Å; L1395-I1397 HydrophobicContact CD1-CG1 4.34Å; L1395-I1397 HydrophobicContact CD2-CD1 4.09Å; L1395-I1397 HydrophobicContact CG-CD1 4.39Å; L1395-I1397 HydrophobicContact CG-CG1 4.28Å; I1397-F1412 HydrophobicContact CB-CB 4.29Å; I1397-F1412 HydrophobicContact CG2-CD2 4.27Å; I1397-F1412 PolarHBondContact N-O 2.88Å; I1397-F1412 PolarHBondContact O-N 3.06Å; I1397-V1439 HydrophobicContact CB-CG1 4.29Å; I1397-V1439 HydrophobicContact CD1-CG1 4.04Å; I1397-V1439 HydrophobicContact CG2-CG1 4.04Å; I1397-L1440 HydrophobicContact CD1-CD2 3.9Å; I1397-S1443 VanDerWaalsContact CG2-CB 3.48Å; I1397-S1443 WeakPolarHBondContact CG2-OG 3.47Å
1398	T	93.6	Very high	83.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	142.7	-177.7	71	0	0	0	0	112.4	G1329 T1330 S1443 A1464 P1467	G1329-T1398 PolarHBondContact O-N 3.11Å; T1330-T1398 WeakPolarHBondContact CB-OG1 3.44Å; T1330-T1398 WeakPolarHBondContact CG2-OG1 3.38Å; T1330-T1398 PolarHBondContact OG1-OG1 3.35Å; T1398-S1443 WeakPolarHBondContact O-CB 3.45Å; T1398-S1443 PolarHBondContact O-OG 3.47Å; T1398-A1464 HydrophobicContact CG2-CB 3.88Å; T1398-P1467 HydrophobicContact CG2-CB 3.95Å
1399	S	91.5	Very high	83.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	173.3	170	-176.2	0	0	0	0	109.6	H1410 C1442 V1458	S1399-H1410 PolarHBondContact N-O 3.41Å; S1399-H1410 PolarHBondContact O-N 2.79Å; S1399-H1410 VanDerWaalsContact O-O 3.11Å; S1399-C1442 PolarHBondContact OG-O 3.19Å; S1399-V1458 PolarHBondContact OG-O 3.16Å
1400	V	87.5	Confident	83.9	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	125.5	178.3	177.1	0	0	0	0	110.6	A1402 V1407 R1408 F1457 V1458 L1462 I1463	V1400-A1402 PolarHBondContact O-N 2.81Å; V1400-V1407 HydrophobicContact CG1-CB 3.95Å; V1400-V1407 HydrophobicContact CG1-CG2 3.63Å; V1400-R1408 WeakPolarHBondContact CA-O 3.46Å; V1400-F1457 WeakPolarHBondContact O-CA 3.19Å; V1400-V1458 HydrophobicContact CB-CG2 3.81Å; V1400-V1458 HydrophobicContact CG1-CG2 4.07Å; V1400-V1458 PolarHBondContact N-O 2.76Å; V1400-V1458 PolarHBondContact O-N 2.92Å; V1400-L1462 HydrophobicContact CG2-CB 4.18Å; V1400-I1463 HydrophobicContact CB-CD1 4.43Å; V1400-I1463 HydrophobicContact CG1-CD1 3.89Å; V1400-I1463 HydrophobicContact CG2-CB 4.15Å; V1400-I1463 HydrophobicContact CG2-CD1 3.71Å; V1400-I1463 HydrophobicContact CG2-CG1 3.73Å
1401	L	83.9	Confident	83.9	Confident	23 Å²	23	35.2 Å²	35.2	12%	0.12	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	104.7	176.7	-172.4	66.1	0	0	0	109.6	Q1403 V1407 R1408 K1456 F1457	L1401-Q1403 HydrophobicContact CD1-CG 4.27Å; L1401-V1407 WeakPolarHBondContact O-CB 3.12Å; L1401-R1408 PolarHBondContact N-O 3.41Å; L1401-R1408 PolarHBondContact O-N 2.68Å; L1401-K1456 HydrophobicContact CD1-CB 4.08Å; L1401-F1457 HydrophobicContact CD1-CD1 4.23Å; L1401-F1457 HydrophobicContact CD1-CE1 3.86Å; L1401-F1457 HydrophobicContact CD1-CZ 4.08Å
1402	A	77	Confident	84.2	Confident	10 Å²	10	29.5 Å²	29.5	8%	0.083	14%	0.137	C	C	.	.			trans	-97.3	5.6	-167.2	0	0	0	0	0	115.2	L763 V1400 K1404 V1407 K1456 V1458	L763-A1402 WeakPolarHBondContact CB-O 3.39Å; L763-A1402 WeakPolarHBondContact CD1-O 3.35Å; V1400-A1402 PolarHBondContact O-N 2.81Å; A1402-K1404 VanDerWaalsContact C-N 3.33Å; A1402-K1404 PolarHBondContact O-N 3.28Å; A1402-V1407 HydrophobicContact CB-CG1 4.3Å; A1402-K1456 PolarHBondContact N-O 3.19Å; A1402-V1458 HydrophobicContact CB-CG1 4.25Å; A1402-V1458 HydrophobicContact CB-CG2 4.13Å
1403	Q	73.1	Confident	84.4	Confident	49 Å²	49	27.5 Å²	27.5	23%	0.229	13%	0.126	C	C	.	.	S	Bend	trans	-67.7	-27.9	-178.7	-61.3	165.2	-49.1	0	0	114.2	P762 L763 L1401 D1429 K1456	P762-Q1403 WeakPolarHBondContact CA-O 3.47Å; L763-Q1403 PolarHBondContact N-O 3.38Å; L1401-Q1403 HydrophobicContact CD1-CG 4.27Å; Q1403-D1429 PolarHBondContact NE2-OD2 2.84Å; Q1403-K1456 HydrophobicContact CG-CB 4.07Å; Q1403-K1456 HydrophobicContact CG-CG 3.99Å
1404	K	70.4	Confident	84.3	Confident	88 Å²	88	28 Å²	28	38%	0.383	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	145.8	-171.3	-64.2	170.3	-173.8	164.7	0	109.5	R761 A1402 P1406 V1407	R761-K1404 CarbonylContact O-C 3.54Å; R761-K1404 WeakPolarHBondContact O-CA 3.47Å; A1402-K1404 VanDerWaalsContact C-N 3.33Å; A1402-K1404 PolarHBondContact O-N 3.28Å; K1404-P1406 CarbonylContact O-C 3.56Å; K1404-V1407 VanDerWaalsContact O-CA 3.26Å; K1404-V1407 WeakPolarHBondContact O-CA 3.4Å; K1404-V1407 VanDerWaalsContact O-CG1 3.3Å; K1404-V1407 WeakPolarHBondContact O-CG1 3.19Å; K1404-V1407 PolarHBondContact O-N 2.98Å
1405	H	66.7	Low	83.9	Confident	4 Å²	4	27.2 Å²	27.2	2%	0.019	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.5	171.6	168.9	-91.9	0	0	0	109.3	E760 R761 L763 N789	E760-H1405 VanDerWaalsContact CA-O 3.29Å; E760-H1405 WeakPolarHBondContact CA-O 3.28Å; R761-H1405 HydrophobicContact CG-CB 3.76Å; R761-H1405 PolarHBondContact N-O 3.2Å; R761-H1405 PolarHBondContact NE-ND1 3.03Å; R761-H1405 PolarHBondContact NH2-CD2 3.32Å; R761-H1405 PolarHBondContact NH2-CE1 3.45Å; R761-H1405 VanDerWaalsContact NH2-CE1 3.29Å; R761-H1405 PolarHBondContact NH2-ND1 2.69Å; R761-H1405 PolarHBondContact NH2-NE2 2.96Å; R761-H1405 PolarHBondContact O-N 3.06Å; L763-H1405 HydrophobicContact CD1-CB 3.96Å; L763-H1405 HydrophobicContact CD2-CB 3.91Å; L763-H1405 HydrophobicContact CG-CB 3.73Å; N789-H1405 PolarHBondContact ND2-CD2 2.91Å; N789-H1405 PolarHBondContact ND2-NE2 3.48Å; N789-H1405 PolarHBondContact OD1-NE2 3.31Å
1406	P	68.3	Low	83.1	Confident	37 Å²	37	30.6 Å²	30.6	24%	0.24	15%	0.147	C	C	.	.	S	Bend	cis	-65.8	148.5	-7.6	30	-35.9	0	0	0	112.5	K1404	K1404-P1406 CarbonylContact O-C 3.56Å
1407	V	76.2	Confident	82.2	Confident	10 Å²	10	31.5 Å²	31.5	6%	0.061	15%	0.152	C	C	.	.			trans	-74	153.7	178.6	-54.7	0	0	0	0	110.8	L763 V786 Q790 V1400 L1401 A1402 K1404 I1463	L763-V1407 HydrophobicContact CD1-CG1 3.55Å; V786-V1407 HydrophobicContact CG1-CG1 4.08Å; V786-V1407 HydrophobicContact CG1-CG2 3.76Å; V786-V1407 HydrophobicContact CG2-CG1 3.68Å; Q790-V1407 HydrophobicContact CG-CG2 4.28Å; Q790-V1407 PolarHBondContact NE2-O 3.17Å; Q790-V1407 VanDerWaalsContact NE2-O 3.12Å; V1400-V1407 HydrophobicContact CG1-CB 3.95Å; V1400-V1407 HydrophobicContact CG1-CG2 3.63Å; L1401-V1407 WeakPolarHBondContact O-CB 3.12Å; A1402-V1407 HydrophobicContact CB-CG1 4.3Å; K1404-V1407 VanDerWaalsContact O-CA 3.26Å; K1404-V1407 WeakPolarHBondContact O-CA 3.4Å; K1404-V1407 VanDerWaalsContact O-CG1 3.3Å; K1404-V1407 WeakPolarHBondContact O-CG1 3.19Å; K1404-V1407 PolarHBondContact O-N 2.98Å; V1407-I1463 HydrophobicContact CG2-CD1 4.41Å
1408	R	79.3	Confident	80.8	Confident	118 Å²	118	33.2 Å²	33.2	45%	0.445	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.6	-175.2	-59.7	-173.7	-174.6	-176.9	3.2	111.9	E760 V1400 L1401	E760-R1408 IonicContact OE1-CZ 3.24Å; E760-R1408 IonicContact OE1-NE 2.9Å; E760-R1408 IonicContact OE1-NH2 2.72Å; E760-R1408 PolarHBondContact OE1-NH2 2.95Å; E760-R1408 IonicContact OE2-NH2 3.6Å; E760-R1408 PolarHBondContact OE2-NH2 3.14Å; V1400-R1408 WeakPolarHBondContact CA-O 3.46Å; L1401-R1408 PolarHBondContact N-O 3.41Å; L1401-R1408 PolarHBondContact O-N 2.68Å
1409	L	85.1	Confident	79.2	Confident	43 Å²	43	34.4 Å²	34.4	23%	0.225	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	141	164.4	-176.9	66.2	0	0	0	109	I1411 I1463 A1464 D1470	L1409-I1411 HydrophobicContact CD2-CD1 4.24Å; L1409-I1411 HydrophobicContact CD2-CG1 4.24Å; L1409-I1411 HydrophobicContact CG-CG1 4.25Å; L1409-I1463 HydrophobicContact CB-CD1 4.31Å; L1409-I1463 HydrophobicContact CB-CG2 4.11Å; L1409-I1463 HydrophobicContact CD1-CB 4.16Å; L1409-I1463 HydrophobicContact CD1-CG2 4.16Å; L1409-A1464 HydrophobicContact CD1-CB 3.75Å; L1409-A1464 HydrophobicContact CD2-CB 4.49Å; L1409-D1470 WeakPolarHBondContact CD2-OD1 3.42Å
1410	H	87.3	Confident	77.8	Confident	42 Å²	42	37.3 Å²	37.3	19%	0.194	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132	170.6	-170.8	87	0	0	0	108.5	S1399 F1412 F1457	S1399-H1410 PolarHBondContact N-O 3.41Å; S1399-H1410 PolarHBondContact O-N 2.79Å; S1399-H1410 VanDerWaalsContact O-O 3.11Å; H1410-F1412 AromaticContact CD2-CD1 3.89Å; H1410-F1412 AromaticContact CD2-CD2 3.92Å; H1410-F1412 AromaticContact CD2-CE1 3.72Å; H1410-F1412 AromaticContact CD2-CE2 3.77Å; H1410-F1412 AromaticContact CD2-CG 3.99Å; H1410-F1412 AromaticContact CD2-CZ 3.66Å; H1410-F1412 AromaticContact NE2-CD1 3.69Å; H1410-F1412 AromaticContact NE2-CE1 3.56Å; H1410-F1412 AromaticContact NE2-CZ 3.97Å; H1410-F1457 HydrophobicContact CB-CE1 4.35Å; H1410-F1457 AromaticContact CD2-CE1 3.93Å; H1410-F1457 AromaticContact CG-CE1 4Å
1411	I	88.4	Confident	76.1	Confident	30 Å²	30	43.1 Å²	43.1	15%	0.154	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	110.2	179.6	-59	178.7	0	0	0	107.4	I1396 L1409 R1413	I1396-I1411 HydrophobicContact CB-CG2 3.91Å; I1396-I1411 HydrophobicContact CG2-CG2 4.32Å; L1409-I1411 HydrophobicContact CD2-CD1 4.24Å; L1409-I1411 HydrophobicContact CD2-CG1 4.24Å; L1409-I1411 HydrophobicContact CG-CG1 4.25Å; I1411-R1413 HydrophobicContact CG2-CG 4.24Å
1412	F	90.2	Very high	74.2	Confident	9 Å²	9	51.2 Å²	51.2	4%	0.039	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	135.2	167.7	-59.3	-84.7	0	0	0	108.5	M1387 I1396 I1397 H1410 C1431 M1434 V1439 C1442 F1457	M1387-F1412 HydrophobicContact CE-CB 4.33Å; I1396-F1412 WeakPolarHBondContact CA-O 3.18Å; I1397-F1412 HydrophobicContact CB-CB 4.29Å; I1397-F1412 HydrophobicContact CG2-CD2 4.27Å; I1397-F1412 PolarHBondContact N-O 2.88Å; I1397-F1412 PolarHBondContact O-N 3.06Å; H1410-F1412 AromaticContact CD2-CD1 3.89Å; H1410-F1412 AromaticContact CD2-CD2 3.92Å; H1410-F1412 AromaticContact CD2-CE1 3.72Å; H1410-F1412 AromaticContact CD2-CE2 3.77Å; H1410-F1412 AromaticContact CD2-CG 3.99Å; H1410-F1412 AromaticContact CD2-CZ 3.66Å; H1410-F1412 AromaticContact NE2-CD1 3.69Å; H1410-F1412 AromaticContact NE2-CE1 3.56Å; H1410-F1412 AromaticContact NE2-CZ 3.97Å; F1412-C1431 HydrophobicContact CD1-CB 4.01Å; F1412-C1431 HydrophobicContact CE1-CB 3.61Å; F1412-M1434 HydrophobicContact CE1-SD 4.21Å; F1412-V1439 HydrophobicContact CB-CG1 3.73Å; F1412-V1439 HydrophobicContact CD1-CG1 4.06Å; F1412-V1439 HydrophobicContact CD1-CG2 3.94Å; F1412-V1439 HydrophobicContact CD2-CG1 3.72Å; F1412-V1439 HydrophobicContact CE1-CG2 4.17Å; F1412-V1439 HydrophobicContact CE2-CG1 4.26Å; F1412-V1439 HydrophobicContact CG-CG1 3.59Å; F1412-V1439 HydrophobicContact CG-CG2 4.34Å; F1412-C1442 HydrophobicContact CE2-CB 4.01Å; F1412-C1442 HydrophobicContact CZ-CB 4.01Å; F1412-F1457 HydrophobicContact CZ-CD1 4.25Å; F1412-F1457 AromaticContact CZ-CE1 3.91Å; F1412-F1457 HydrophobicContact CZ-CE1 3.91Å; F1412-F1457 HydrophobicContact CZ-CZ 4.15Å
1413	R	89.1	Confident	72.5	Confident	69 Å²	69	54.3 Å²	54.3	26%	0.26	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.3	-176.6	-57.8	174	178.4	99.7	7.6	110.5	M1387 L1395 I1411 Y1415 E1474	M1387-R1413 WeakPolarHBondContact CG-O 3.43Å; L1395-R1413 WeakPolarHBondContact O-CA 3.33Å; I1411-R1413 HydrophobicContact CG2-CG 4.24Å; R1413-Y1415 VanDerWaalsContact C-N 3.29Å; R1413-Y1415 HydrophobicContact CB-CD1 4.32Å; R1413-Y1415 HydrophobicContact CB-CE1 4.07Å; R1413-Y1415 HydrophobicContact CB-CE2 4.45Å; R1413-Y1415 WeakPolarHBondContact CB-O 3.16Å; R1413-Y1415 HydrophobicContact CG-CE1 4.39Å; R1413-Y1415 HydrophobicContact CG-CE2 4.39Å; R1413-E1474 IonicContact CZ-OE1 3.84Å; R1413-E1474 IonicContact CZ-OE2 3.82Å; R1413-E1474 VanDerWaalsContact NE-CD 3.31Å; R1413-E1474 IonicContact NE-OE1 2.68Å; R1413-E1474 PolarHBondContact NE-OE1 3.16Å; R1413-E1474 IonicContact NE-OE2 3.86Å; R1413-E1474 PolarHBondContact NE-OE2 2.73Å; R1413-E1474 IonicContact NH2-OE1 2.68Å; R1413-E1474 PolarHBondContact NH2-OE1 3.17Å; R1413-E1474 IonicContact NH2-OE2 2.89Å; R1413-E1474 PolarHBondContact NH2-OE2 3.37Å
1414	S	89.5	Confident	70.5	Confident	13 Å²	13	58 Å²	58	9%	0.091	29%	0.291	C	S	.	.	S	Bend	trans	-88.3	5.7	167.5	74.6	0	0	0	0	114.1	M1387 I1390 L1395	M1387-S1414 WeakPolarHBondContact O-CA 3.49Å; M1387-S1414 WeakPolarHBondContact O-CB 3.38Å; I1390-S1414 WeakPolarHBondContact O-CB 3.31Å; I1390-S1414 PolarHBondContact O-OG 3.07Å; L1395-S1414 PolarHBondContact N-OG 2.99Å; L1395-S1414 PolarHBondContact O-N 3.11Å
1415	Y	84.5	Confident	68.8	Low	27 Å²	27	59 Å²	59	11%	0.106	31%	0.307	C	S	.	.	S	Bend	trans	-140.9	150.8	-179.2	60	-85.6	0	0	0	109.5	W1326 K1394 I1396 R1413 L1417 E1474 Y1478	W1326-Y1415 HydrophobicContact CH2-CE1 4.39Å; W1326-Y1415 HydrophobicContact CH2-CE2 4.34Å; W1326-Y1415 AromaticContact CH2-CZ 3.98Å; W1326-Y1415 AromaticContact CZ3-CE1 3.87Å; W1326-Y1415 HydrophobicContact CZ3-CE1 3.87Å; W1326-Y1415 HydrophobicContact CZ3-CE2 4.45Å; W1326-Y1415 AromaticContact CZ3-CZ 3.66Å; W1326-Y1415 WeakPolarHBondContact CZ3-OH 3.29Å; K1394-Y1415 HydrophobicContact CB-CD1 3.78Å; K1394-Y1415 HydrophobicContact CB-CE1 3.95Å; K1394-Y1415 HydrophobicContact CD-CD1 4.19Å; K1394-Y1415 HydrophobicContact CD-CG 4.4Å; K1394-Y1415 HydrophobicContact CG-CD1 3.78Å; K1394-Y1415 HydrophobicContact CG-CE1 4.34Å; K1394-Y1415 HydrophobicContact CG-CG 4.27Å; I1396-Y1415 HydrophobicContact CG2-CE1 3.83Å; I1396-Y1415 WeakPolarHBondContact CG2-OH 3.4Å; R1413-Y1415 VanDerWaalsContact C-N 3.29Å; R1413-Y1415 HydrophobicContact CB-CD1 4.32Å; R1413-Y1415 HydrophobicContact CB-CE1 4.07Å; R1413-Y1415 HydrophobicContact CB-CE2 4.45Å; R1413-Y1415 WeakPolarHBondContact CB-O 3.16Å; R1413-Y1415 HydrophobicContact CG-CE1 4.39Å; R1413-Y1415 HydrophobicContact CG-CE2 4.39Å; Y1415-L1417 HydrophobicContact CE2-CD2 4.36Å; Y1415-E1474 VanDerWaalsContact OH-CD 3.31Å; Y1415-E1474 WeakPolarHBondContact OH-CG 3.1Å; Y1415-E1474 PolarHBondContact OH-OE1 2.81Å; Y1415-Y1478 AromaticContact CD2-CD2 3.9Å; Y1415-Y1478 HydrophobicContact CD2-CD2 3.9Å; Y1415-Y1478 AromaticContact CD2-CE2 3.9Å; Y1415-Y1478 HydrophobicContact CD2-CE2 3.9Å; Y1415-Y1478 AromaticContact CE2-CD2 3.77Å; Y1415-Y1478 HydrophobicContact CE2-CD2 3.77Å; Y1415-Y1478 HydrophobicContact CE2-CE2 4.25Å
1416	T	76.8	Confident	67.4	Low	71 Å²	71	66.1 Å²	66.1	44%	0.436	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-83.1	155.4	167.3	48.6	0	0	0	0	110.9
1417	L	74.7	Confident	66.2	Low	19 Å²	19	68.6 Å²	68.6	10%	0.099	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-74	136.4	170.2	-66.4	169.6	0	0	0	109.3	Y1415 G1419 E1420 L1477 Y1478 A1481	Y1415-L1417 HydrophobicContact CE2-CD2 4.36Å; L1417-G1419 PolarHBondContact O-N 3.31Å; L1417-G1419 VanDerWaalsContact O-N 3.12Å; L1417-E1420 HydrophobicContact CB-CB 4.2Å; L1417-E1420 WeakPolarHBondContact CB-OE2 3.3Å; L1417-E1420 PolarHBondContact N-OE2 2.75Å; L1417-E1420 WeakPolarHBondContact O-CB 3.29Å; L1417-E1420 PolarHBondContact O-N 2.91Å; L1417-L1477 HydrophobicContact CD1-CD2 3.87Å; L1417-L1477 HydrophobicContact CD1-CG 4.07Å; L1417-L1477 HydrophobicContact CD2-CG 4.25Å; L1417-Y1478 HydrophobicContact CD2-CD2 4.2Å; L1417-A1481 HydrophobicContact CB-CB 4.24Å
1418	P	65	Low	64.4	Low	36 Å²	36	74 Å²	74	23%	0.234	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	119.8	179	-30.1	34	0	0	0	113.3	Y1478 A1481 L1482	P1418-Y1478 HydrophobicContact CG-CD2 4.5Å; P1418-Y1478 HydrophobicContact CG-CE2 4Å; P1418-A1481 HydrophobicContact CB-CB 4.24Å; P1418-A1481 HydrophobicContact CG-CB 4.28Å; P1418-L1482 HydrophobicContact CB-CD2 4.11Å; P1418-L1482 HydrophobicContact CG-CD2 3.61Å; P1418-L1482 HydrophobicContact CG-CG 4.04Å
1419	G	59	Low	63	Low	24 Å²	24	70.4 Å²	70.4	25%	0.247	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	0.2	179.3	0	0	0	0	0	116.4	L1417 D1421 R1422 V1486	L1417-G1419 PolarHBondContact O-N 3.31Å; L1417-G1419 VanDerWaalsContact O-N 3.12Å; G1419-D1421 PolarHBondContact O-N 3.36Å; G1419-D1421 VanDerWaalsContact O-N 3.12Å; G1419-R1422 WeakPolarHBondContact O-CB 3.11Å; G1419-R1422 PolarHBondContact O-N 3.32Å; G1419-V1486 WeakPolarHBondContact O-CG2 3.41Å
1420	E	62.2	Low	61.4	Low	62 Å²	62	70.8 Å²	70.8	29%	0.29	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-54.8	-28.9	178.7	-170.4	163.5	-146	0	0	112.6	L1417 R1422 I1423	L1417-E1420 HydrophobicContact CB-CB 4.2Å; L1417-E1420 WeakPolarHBondContact CB-OE2 3.3Å; L1417-E1420 PolarHBondContact N-OE2 2.75Å; L1417-E1420 WeakPolarHBondContact O-CB 3.29Å; L1417-E1420 PolarHBondContact O-N 2.91Å; E1420-R1422 PolarHBondContact O-N 3.41Å; E1420-I1423 PolarHBondContact O-N 2.9Å; E1420-I1423 VanDerWaalsContact O-N 3.14Å
1421	D	51.4	Low	59.8	Low	121 Å²	121	70.1 Å²	70.1	65%	0.647	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-53.6	-15.4	171.1	-52.9	-57.7	0	0	0	115	G1419	G1419-D1421 PolarHBondContact O-N 3.36Å; G1419-D1421 VanDerWaalsContact O-N 3.12Å
1422	R	43.5	Very low	58.3	Low	193 Å²	193	72 Å²	72	73%	0.728	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-99.6	2.6	-176.3	-55.6	-176.5	-175.3	-177.6	3.3	113.8	G1419 E1420 P1424	G1419-R1422 WeakPolarHBondContact O-CB 3.11Å; G1419-R1422 PolarHBondContact O-N 3.32Å; E1420-R1422 PolarHBondContact O-N 3.41Å; R1422-P1424 WeakPolarHBondContact O-CD 3.46Å
1423	I	42.7	Very low	57	Low	75 Å²	75	78.1 Å²	78.1	39%	0.385	41%	0.413	S	S	.	.			trans	-91.2	115.9	177.9	-49.2	178	0	0	0	110.6	E1420 C1425 V1486	E1420-I1423 PolarHBondContact O-N 2.9Å; E1420-I1423 VanDerWaalsContact O-N 3.14Å; I1423-C1425 HydrophobicContact CG2-CB 3.91Å; I1423-C1425 PolarHBondContact O-N 3.05Å; I1423-V1486 HydrophobicContact CD1-CG1 3.76Å; I1423-V1486 HydrophobicContact CG1-CG1 3.24Å
1424	P	31	Very low	56.4	Low	128 Å²	128	75.9 Å²	75.9	83%	0.831	41%	0.406	S	S	*	.	S	Bend	trans	-78.7	42.5	172.4	35.1	-36.6	0	0	0	112.5	R1422	R1422-P1424 WeakPolarHBondContact O-CD 3.46Å
1425	C	33.2	Very low	56.3	Low	107 Å²	107	77.4 Å²	77.4	72%	0.723	42%	0.415	S	S	*	.			trans	-152.7	62.7	-180	-88.3	0	0	0	0	110.5	I1423 D1427	I1423-C1425 HydrophobicContact CG2-CB 3.91Å; I1423-C1425 PolarHBondContact O-N 3.05Å; C1425-D1427 PolarHBondContact O-N 2.71Å
1426	R	37.7	Very low	56.7	Low	155 Å²	155	76.1 Å²	76.1	59%	0.585	41%	0.41	S	S	*	.			trans	-64.8	122.3	160.4	-70.6	-175	173.9	-148.3	-4.8	108.1	P1428 E1432	R1426-P1428 WeakPolarHBondContact O-CD 3.39Å; R1426-E1432 IonicContact CZ-OE2 2.73Å; R1426-E1432 VanDerWaalsContact CZ-OE2 3.24Å; R1426-E1432 IonicContact NH1-OE2 2.67Å; R1426-E1432 PolarHBondContact NH1-OE2 2.66Å; R1426-E1432 IonicContact NH2-OE2 2.71Å; R1426-E1432 PolarHBondContact NH2-OE2 3.35Å
1427	D	43.3	Very low	57.4	Low	89 Å²	89	74.4 Å²	74.4	48%	0.476	40%	0.396	S	S	.	.			trans	-59.9	122.8	165	-164.2	-10.3	0	0	0	106.5	C1425 D1429 S1430	C1425-D1427 PolarHBondContact O-N 2.71Å; D1427-D1429 PolarHBondContact O-N 3.29Å; D1427-S1430 VanDerWaalsContact O-CB 3.27Å; D1427-S1430 WeakPolarHBondContact O-CB 3.38Å; D1427-S1430 PolarHBondContact O-N 2.8Å; D1427-S1430 PolarHBondContact O-OG 2.91Å
1428	P	38.6	Very low	58.2	Low	124 Å²	124	75.6 Å²	75.6	81%	0.805	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-4.5	-171.3	22.7	-34.6	0	0	0	114.9	R1426	R1426-P1428 WeakPolarHBondContact O-CD 3.39Å
1429	D	49.9	Very low	59.4	Low	41 Å²	41	73.9 Å²	73.9	22%	0.219	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	17.1	168.2	-78.1	-38.3	0	0	0	113.4	Q1403 D1427 C1431 K1456	Q1403-D1429 PolarHBondContact NE2-OD2 2.84Å; D1427-D1429 PolarHBondContact O-N 3.29Å; D1429-C1431 PolarHBondContact O-N 3.19Å; D1429-C1431 PolarHBondContact O-SG 2.99Å; D1429-K1456 IonicContact OD1-NZ 2.7Å; D1429-K1456 PolarHBondContact OD1-NZ 3.26Å; D1429-K1456 IonicContact OD2-NZ 3.27Å
1430	S	51.2	Low	61	Low	51 Å²	51	72.7 Å²	72.7	36%	0.357	38%	0.377	S	S	.	.			trans	-67.8	100.7	178.2	63.5	0	0	0	0	112.2	D1427 E1432	D1427-S1430 VanDerWaalsContact O-CB 3.27Å; D1427-S1430 WeakPolarHBondContact O-CB 3.38Å; D1427-S1430 PolarHBondContact O-N 2.8Å; D1427-S1430 PolarHBondContact O-OG 2.91Å; S1430-E1432 PolarHBondContact O-N 3.25Å
1431	C	55	Low	62.4	Low	29 Å²	29	70 Å²	70	20%	0.196	36%	0.364	C	S	.	.			trans	-78.3	31.7	-165.5	-68	0	0	0	0	116.2	F1412 D1429 E1433 M1434	F1412-C1431 HydrophobicContact CD1-CB 4.01Å; F1412-C1431 HydrophobicContact CE1-CB 3.61Å; D1429-C1431 PolarHBondContact O-N 3.19Å; D1429-C1431 PolarHBondContact O-SG 2.99Å; C1431-E1433 VanDerWaalsContact C-N 3.3Å; C1431-E1433 PolarHBondContact O-N 3.48Å; C1431-M1434 HydrophobicContact CB-CB 4.1Å; C1431-M1434 HydrophobicContact CB-CE 4Å; C1431-M1434 VanDerWaalsContact O-CB 3.27Å; C1431-M1434 WeakPolarHBondContact O-CB 3.5Å; C1431-M1434 PolarHBondContact O-N 3.25Å; C1431-M1434 WeakPolarHBondContact SG-CE 3.35Å
1432	E	55.3	Low	64.3	Low	69 Å²	69	64.2 Å²	64.2	32%	0.322	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-34.7	-171.6	-61.4	179	141	0	0	113.8	R1426 S1430	R1426-E1432 IonicContact CZ-OE2 2.73Å; R1426-E1432 VanDerWaalsContact CZ-OE2 3.24Å; R1426-E1432 IonicContact NH1-OE2 2.67Å; R1426-E1432 PolarHBondContact NH1-OE2 2.66Å; R1426-E1432 IonicContact NH2-OE2 2.71Å; R1426-E1432 PolarHBondContact NH2-OE2 3.35Å; S1430-E1432 PolarHBondContact O-N 3.25Å
1433	E	63.1	Low	66.6	Low	137 Å²	137	55 Å²	55	64%	0.64	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	5.6	177.7	-64.4	-148.9	98.7	0	0	114.6	R1386 C1431	R1386-E1433 IonicContact CZ-OE1 3.97Å; R1386-E1433 IonicContact NH1-OE1 3.05Å; R1386-E1433 PolarHBondContact NH1-OE1 3.04Å; R1386-E1433 IonicContact NH2-OE1 3.39Å; C1431-E1433 VanDerWaalsContact C-N 3.3Å; C1431-E1433 PolarHBondContact O-N 3.48Å
1434	M	77.2	Confident	68.8	Low	23 Å²	23	51.7 Å²	51.7	11%	0.113	28%	0.282	C	S	.	.			trans	-69.1	131.5	-173	-170.8	174.9	-72.3	0	0	111.9	F1412 C1431 L1436 K1438 V1439	F1412-M1434 HydrophobicContact CE1-SD 4.21Å; C1431-M1434 HydrophobicContact CB-CB 4.1Å; C1431-M1434 HydrophobicContact CB-CE 4Å; C1431-M1434 VanDerWaalsContact O-CB 3.27Å; C1431-M1434 WeakPolarHBondContact O-CB 3.5Å; C1431-M1434 PolarHBondContact O-N 3.25Å; C1431-M1434 WeakPolarHBondContact SG-CE 3.35Å; M1434-L1436 PolarHBondContact O-N 3.48Å; M1434-K1438 HydrophobicContact CE-CD 4.31Å; M1434-K1438 HydrophobicContact CG-CB 3.9Å; M1434-K1438 HydrophobicContact CG-CD 4.11Å; M1434-K1438 HydrophobicContact CG-CG 4.16Å; M1434-K1438 HydrophobicContact SD-CB 4.07Å; M1434-K1438 HydrophobicContact SD-CD 4.03Å; M1434-K1438 HydrophobicContact SD-CG 3.83Å; M1434-V1439 HydrophobicContact CB-CG2 3.92Å; M1434-V1439 HydrophobicContact CG-CG2 3.84Å; M1434-V1439 HydrophobicContact SD-CG2 3.89Å
1435	P	88.2	Confident	71.3	Confident	44 Å²	44	45.6 Å²	45.6	29%	0.286	24%	0.243	S	C	.	.	B	Isolated β-bridge	trans	-56.2	138.2	172.8	-27.2	35.6	0	0	0	112.1	W1437 K1438 V1439	P1435-W1437 VanDerWaalsContact C-N 3.26Å; P1435-W1437 HydrophobicContact CB-CG 4.37Å; P1435-W1437 VanDerWaalsContact CB-NE1 3.34Å; P1435-W1437 PolarHBondContact O-N 3.49Å; P1435-K1438 WeakPolarHBondContact O-CA 3.21Å; P1435-K1438 WeakPolarHBondContact O-CB 3.47Å; P1435-K1438 PolarHBondContact O-N 3.2Å; P1435-V1439 PolarHBondContact O-N 2.97Å
1436	L	91.2	Very high	73.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.7	-39.2	-175.9	-179.2	61.5	0	0	0	112	A1338 R1342 V1381 A1385 M1387 I1390 M1434 K1438 V1439 L1440	A1338-L1436 HydrophobicContact CB-CD1 4.07Å; A1338-L1436 HydrophobicContact CB-CD2 4.36Å; A1338-L1436 HydrophobicContact CB-CG 4.45Å; R1342-L1436 HydrophobicContact CG-CD2 3.92Å; V1381-L1436 HydrophobicContact CB-CD2 4.12Å; V1381-L1436 HydrophobicContact CG2-CB 4.42Å; V1381-L1436 HydrophobicContact CG2-CD2 4.08Å; V1381-L1436 HydrophobicContact CG2-CG 4.13Å; A1385-L1436 HydrophobicContact CB-CB 4.37Å; A1385-L1436 HydrophobicContact CB-CD2 4.33Å; A1385-L1436 WeakPolarHBondContact O-CB 3.4Å; A1385-L1436 PolarHBondContact O-N 3.44Å; M1387-L1436 HydrophobicContact SD-CD1 3.8Å; I1390-L1436 HydrophobicContact CD1-CD1 4.18Å; I1390-L1436 HydrophobicContact CD1-CD2 3.89Å; M1434-L1436 PolarHBondContact O-N 3.48Å; L1436-K1438 PolarHBondContact O-N 2.99Å; L1436-V1439 PolarHBondContact O-N 3.49Å; L1436-L1440 HydrophobicContact CG-CD1 4.39Å; L1436-L1440 WeakPolarHBondContact O-CB 3.45Å; L1436-L1440 VanDerWaalsContact O-CG 3.26Å; L1436-L1440 WeakPolarHBondContact O-CG 3.4Å; L1436-L1440 PolarHBondContact O-N 3.49Å
1437	W	91.9	Very high	74.9	Confident	35 Å²	35	34.3 Å²	34.3	13%	0.133	19%	0.19	C	C	.	.	H	α-helix	trans	-61	-32.8	175.1	69.4	-101.4	0	0	0	112.5	E1374 V1377 K1378 V1381 L1383 P1435 R1441	E1374-W1437 HydrophobicContact CB-CZ3 4.46Å; E1374-W1437 VanDerWaalsContact CD-CZ3 3.43Å; E1374-W1437 HydrophobicContact CG-CE3 4.25Å; E1374-W1437 HydrophobicContact CG-CZ3 3.95Å; E1374-W1437 WeakPolarHBondContact OE2-CZ3 3.25Å; V1377-W1437 HydrophobicContact CB-CB 4.49Å; V1377-W1437 HydrophobicContact CG1-CB 3.77Å; K1378-W1437 HydrophobicContact CD-CD2 4.13Å; K1378-W1437 HydrophobicContact CD-CE3 4.41Å; K1378-W1437 HydrophobicContact CD-CG 4.45Å; K1378-W1437 VanDerWaalsContact CE-CH2 3.42Å; K1378-W1437 VanDerWaalsContact CE-CZ3 3.42Å; K1378-W1437 HydrophobicContact CG-CB 3.92Å; K1378-W1437 HydrophobicContact CG-CD2 3.67Å; K1378-W1437 HydrophobicContact CG-CE3 4.24Å; K1378-W1437 HydrophobicContact CG-CG 3.49Å; K1378-W1437 VanDerWaalsContact CG-CG 3.49Å; V1381-W1437 HydrophobicContact CG2-CB 4.24Å; L1383-W1437 PolarHBondContact O-NE1 2.9Å; P1435-W1437 VanDerWaalsContact C-N 3.26Å; P1435-W1437 HydrophobicContact CB-CG 4.37Å; P1435-W1437 VanDerWaalsContact CB-NE1 3.34Å; P1435-W1437 PolarHBondContact O-N 3.49Å; W1437-R1441 VanDerWaalsContact O-CB 3.3Å; W1437-R1441 WeakPolarHBondContact O-CB 3.46Å; W1437-R1441 PolarHBondContact O-N 2.9Å
1438	K	91.1	Very high	76.2	Confident	44 Å²	44	31.4 Å²	31.4	19%	0.191	18%	0.175	C	C	.	.	H	α-helix	trans	-79	-40.7	179.4	-167.8	177.1	-178	179.8	0	111	M1434 P1435 L1436 L1440 R1441 C1442 V1453 D1454	M1434-K1438 HydrophobicContact CE-CD 4.31Å; M1434-K1438 HydrophobicContact CG-CB 3.9Å; M1434-K1438 HydrophobicContact CG-CD 4.11Å; M1434-K1438 HydrophobicContact CG-CG 4.16Å; M1434-K1438 HydrophobicContact SD-CB 4.07Å; M1434-K1438 HydrophobicContact SD-CD 4.03Å; M1434-K1438 HydrophobicContact SD-CG 3.83Å; P1435-K1438 WeakPolarHBondContact O-CA 3.21Å; P1435-K1438 WeakPolarHBondContact O-CB 3.47Å; P1435-K1438 PolarHBondContact O-N 3.2Å; L1436-K1438 PolarHBondContact O-N 2.99Å; K1438-L1440 VanDerWaalsContact C-N 3.29Å; K1438-L1440 PolarHBondContact O-N 3.33Å; K1438-R1441 CarbonylContact O-C 3.45Å; K1438-R1441 PolarHBondContact O-N 3.25Å; K1438-R1441 VanDerWaalsContact O-N 3.12Å; K1438-C1442 PolarHBondContact O-N 3.24Å; K1438-C1442 PolarHBondContact O-SG 3.27Å; K1438-V1453 HydrophobicContact CG-CG1 4.2Å; K1438-D1454 WeakPolarHBondContact CE-OD1 3.49Å; K1438-D1454 VanDerWaalsContact CE-OD2 3.23Å; K1438-D1454 WeakPolarHBondContact CE-OD2 3.28Å; K1438-D1454 IonicContact NZ-OD1 3.6Å; K1438-D1454 PolarHBondContact NZ-OD1 3.34Å; K1438-D1454 IonicContact NZ-OD2 2.98Å; K1438-D1454 PolarHBondContact NZ-OD2 3.38Å
1439	V	91.1	Very high	77.8	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-54.2	-46.8	169.2	170.9	0	0	0	0	110.9	M1387 I1397 F1412 M1434 P1435 L1436 C1442 S1443	M1387-V1439 HydrophobicContact SD-CG1 4.21Å; I1397-V1439 HydrophobicContact CB-CG1 4.29Å; I1397-V1439 HydrophobicContact CD1-CG1 4.04Å; I1397-V1439 HydrophobicContact CG2-CG1 4.04Å; F1412-V1439 HydrophobicContact CB-CG1 3.73Å; F1412-V1439 HydrophobicContact CD1-CG1 4.06Å; F1412-V1439 HydrophobicContact CD1-CG2 3.94Å; F1412-V1439 HydrophobicContact CD2-CG1 3.72Å; F1412-V1439 HydrophobicContact CE1-CG2 4.17Å; F1412-V1439 HydrophobicContact CE2-CG1 4.26Å; F1412-V1439 HydrophobicContact CG-CG1 3.59Å; F1412-V1439 HydrophobicContact CG-CG2 4.34Å; M1434-V1439 HydrophobicContact CB-CG2 3.92Å; M1434-V1439 HydrophobicContact CG-CG2 3.84Å; M1434-V1439 HydrophobicContact SD-CG2 3.89Å; P1435-V1439 PolarHBondContact O-N 2.97Å; L1436-V1439 PolarHBondContact O-N 3.49Å; V1439-C1442 WeakPolarHBondContact O-CB 2.89Å; V1439-C1442 PolarHBondContact O-N 3.11Å; V1439-S1443 PolarHBondContact O-N 2.88Å
1440	L	92.8	Very high	79.3	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.5	-43.4	175	-71.4	176.4	0	0	0	112.5	A1334 I1335 A1338 V1377 V1381 I1397 L1436 K1438 C1442 S1443 S1444	A1334-L1440 HydrophobicContact CB-CD2 3.88Å; A1334-L1440 VanDerWaalsContact O-CD2 3.31Å; A1334-L1440 WeakPolarHBondContact O-CD2 3.44Å; I1335-L1440 HydrophobicContact CB-CD2 4.45Å; I1335-L1440 HydrophobicContact CG1-CB 4.3Å; I1335-L1440 HydrophobicContact CG1-CD1 4.46Å; I1335-L1440 HydrophobicContact CG1-CD2 4.03Å; A1338-L1440 HydrophobicContact CB-CD1 3.97Å; A1338-L1440 HydrophobicContact CB-CD2 3.93Å; A1338-L1440 HydrophobicContact CB-CG 4.34Å; V1377-L1440 HydrophobicContact CG1-CB 4.15Å; V1377-L1440 HydrophobicContact CG1-CD1 3.83Å; V1381-L1440 HydrophobicContact CG1-CD1 3.85Å; V1381-L1440 HydrophobicContact CG2-CD1 4.23Å; I1397-L1440 HydrophobicContact CD1-CD2 3.9Å; L1436-L1440 HydrophobicContact CG-CD1 4.39Å; L1436-L1440 WeakPolarHBondContact O-CB 3.45Å; L1436-L1440 VanDerWaalsContact O-CG 3.26Å; L1436-L1440 WeakPolarHBondContact O-CG 3.4Å; L1436-L1440 PolarHBondContact O-N 3.49Å; K1438-L1440 VanDerWaalsContact C-N 3.29Å; K1438-L1440 PolarHBondContact O-N 3.33Å; L1440-C1442 VanDerWaalsContact C-N 3.32Å; L1440-C1442 PolarHBondContact O-N 3.44Å; L1440-S1443 PolarHBondContact O-N 2.84Å; L1440-S1444 WeakPolarHBondContact O-CB 3.48Å; L1440-S1444 PolarHBondContact O-N 3.05Å; L1440-S1444 PolarHBondContact O-OG 2.95Å
1441	R	91.2	Very high	80.4	Confident	4 Å²	4	24.2 Å²	24.2	2%	0.015	12%	0.124	C	C	.	.	H	α-helix	trans	-65.8	-30.4	177.3	-179.2	58.1	-170.4	82.9	8.1	112.8	E1374 W1437 K1438 A1445 T1451 V1453	E1374-R1441 HydrophobicContact CG-CG 4.01Å; W1437-R1441 VanDerWaalsContact O-CB 3.3Å; W1437-R1441 WeakPolarHBondContact O-CB 3.46Å; W1437-R1441 PolarHBondContact O-N 2.9Å; K1438-R1441 CarbonylContact O-C 3.45Å; K1438-R1441 PolarHBondContact O-N 3.25Å; K1438-R1441 VanDerWaalsContact O-N 3.12Å; R1441-A1445 VanDerWaalsContact NH1-CB 3.31Å; R1441-A1445 WeakPolarHBondContact O-CB 3.28Å; R1441-A1445 PolarHBondContact O-N 3.15Å; R1441-T1451 PolarHBondContact NH1-O 2.98Å; R1441-T1451 VanDerWaalsContact NH1-O 3.13Å; R1441-T1451 PolarHBondContact NH2-O 3.43Å; R1441-T1451 PolarHBondContact NH2-OG1 2.97Å; R1441-T1451 VanDerWaalsContact NH2-OG1 3.09Å; R1441-V1453 HydrophobicContact CB-CG2 4.43Å; R1441-V1453 HydrophobicContact CG-CG2 3.77Å; R1441-V1453 WeakPolarHBondContact O-CG2 3.43Å
1442	C	90.6	Very high	81.5	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-68.3	-45.9	169.4	-68	0	0	0	0	111.7	S1399 F1412 K1438 V1439 L1440 S1444 A1445 F1457 V1458	S1399-C1442 PolarHBondContact OG-O 3.19Å; F1412-C1442 HydrophobicContact CE2-CB 4.01Å; F1412-C1442 HydrophobicContact CZ-CB 4.01Å; K1438-C1442 PolarHBondContact O-N 3.24Å; K1438-C1442 PolarHBondContact O-SG 3.27Å; V1439-C1442 WeakPolarHBondContact O-CB 2.89Å; V1439-C1442 PolarHBondContact O-N 3.11Å; L1440-C1442 VanDerWaalsContact C-N 3.32Å; L1440-C1442 PolarHBondContact O-N 3.44Å; C1442-S1444 VanDerWaalsContact C-N 3.27Å; C1442-S1444 PolarHBondContact O-N 2.85Å; C1442-A1445 PolarHBondContact O-N 3.47Å; C1442-F1457 HydrophobicContact CB-CB 3.79Å; C1442-F1457 HydrophobicContact CB-CD2 4.47Å; C1442-F1457 HydrophobicContact CB-CG 4.04Å; C1442-V1458 CarbonylContact O-C 3.54Å
1443	S	92.3	Very high	82.7	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.1	-29.9	179.3	-168.8	0	0	0	0	113.3	S1331 I1397 T1398 V1439 L1440 D1459 G1460	S1331-S1443 WeakPolarHBondContact CA-O 3.47Å; S1331-S1443 PolarHBondContact N-OG 2.9Å; I1397-S1443 VanDerWaalsContact CG2-CB 3.48Å; I1397-S1443 WeakPolarHBondContact CG2-OG 3.47Å; T1398-S1443 WeakPolarHBondContact O-CB 3.45Å; T1398-S1443 PolarHBondContact O-OG 3.47Å; V1439-S1443 PolarHBondContact O-N 2.88Å; L1440-S1443 PolarHBondContact O-N 2.84Å; S1443-D1459 VanDerWaalsContact O-CA 3.31Å; S1443-D1459 WeakPolarHBondContact O-CA 3.41Å; S1443-G1460 PolarHBondContact O-N 3.09Å
1444	S	89.3	Confident	83.3	Confident	5 Å²	5	17.7 Å²	17.7	4%	0.035	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	16.5	-176.8	57.7	0	0	0	0	114.5	M1373 L1440 C1442 A1446 D1459	M1373-S1444 WeakPolarHBondContact CE-OG 3.38Å; L1440-S1444 WeakPolarHBondContact O-CB 3.48Å; L1440-S1444 PolarHBondContact O-N 3.05Å; L1440-S1444 PolarHBondContact O-OG 2.95Å; C1442-S1444 VanDerWaalsContact C-N 3.27Å; C1442-S1444 PolarHBondContact O-N 2.85Å; S1444-A1446 PolarHBondContact O-N 3.47Å; S1444-D1459 WeakPolarHBondContact CA-OD2 3.48Å
1445	A	82.4	Confident	83.1	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.111	C	C	.	.			trans	-74.8	59.5	178.8	0	0	0	0	0	112.7	R1441 C1442 P1447 V1453 D1459	R1441-A1445 VanDerWaalsContact NH1-CB 3.31Å; R1441-A1445 WeakPolarHBondContact O-CB 3.28Å; R1441-A1445 PolarHBondContact O-N 3.15Å; C1442-A1445 PolarHBondContact O-N 3.47Å; A1445-P1447 WeakPolarHBondContact O-CD 3.37Å; A1445-V1453 HydrophobicContact CB-CG2 4.31Å; A1445-D1459 PolarHBondContact O-N 3.35Å
1446	A	80.7	Confident	82.6	Confident	16 Å²	16	21.2 Å²	21.2	13%	0.132	11%	0.109	C	C	.	.			trans	-64.9	111.9	-173.8	0	0	0	0	0	111.1	S1444 Y1449 F1450 D1459	S1444-A1446 PolarHBondContact O-N 3.47Å; A1446-Y1449 HydrophobicContact CB-CD2 4.31Å; A1446-Y1449 HydrophobicContact CB-CG 4.43Å; A1446-Y1449 WeakPolarHBondContact O-CA 3.27Å; A1446-Y1449 WeakPolarHBondContact O-CB 3.41Å; A1446-Y1449 PolarHBondContact O-N 3.38Å; A1446-F1450 PolarHBondContact O-N 2.77Å; A1446-D1459 HydrophobicContact CB-CB 4.37Å
1447	P	67	Low	82.3	Confident	10 Å²	10	21.3 Å²	21.3	7%	0.065	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	146.9	-175	-26.1	37.9	0	0	0	112.1	F768 Y783 A1445 Y1449 V1458 L1462	F768-P1447 HydrophobicContact CE2-CB 4.26Å; Y783-P1447 HydrophobicContact CD2-CB 3.98Å; Y783-P1447 HydrophobicContact CD2-CG 4.22Å; Y783-P1447 HydrophobicContact CE1-CB 4.29Å; Y783-P1447 HydrophobicContact CE2-CB 3.57Å; Y783-P1447 HydrophobicContact CE2-CG 3.64Å; A1445-P1447 WeakPolarHBondContact O-CD 3.37Å; P1447-Y1449 PolarHBondContact O-N 2.71Å; P1447-Y1449 VanDerWaalsContact O-N 3.16Å; P1447-V1458 HydrophobicContact CG-CB 4.15Å; P1447-V1458 HydrophobicContact CG-CG1 4.34Å; P1447-L1462 HydrophobicContact CG-CD1 4.31Å
1448	T	69.7	Low	82	Confident	28 Å²	28	19.9 Å²	19.9	17%	0.172	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	-14.7	-165.6	79.2	0	0	0	0	116.2	F768 R1366	F768-T1448 HydrophobicContact CE1-CG2 4.35Å; F768-T1448 HydrophobicContact CE2-CG2 4.23Å; F768-T1448 HydrophobicContact CZ-CG2 4.15Å; R1366-T1448 WeakPolarHBondContact CB-O 3.24Å; R1366-T1448 WeakPolarHBondContact CD-O 3.19Å
1449	Y	73.1	Confident	81.9	Confident	29 Å²	29	18.4 Å²	18.4	11%	0.114	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-44.6	171.9	-66.6	-107.9	0	0	0	111.2	R1366 Y1368 A1446 P1447 L1588 D1589	R1366-Y1449 VanDerWaalsContact NH1-CZ 3.26Å; R1366-Y1449 PolarHBondContact NH1-OH 3.13Å; R1366-Y1449 VanDerWaalsContact NH2-CE1 3.28Å; R1366-Y1449 PolarHBondContact NH2-OH 3.39Å; Y1368-Y1449 WeakPolarHBondContact CB-O 3.27Å; Y1368-Y1449 WeakPolarHBondContact CD2-O 3.33Å; Y1368-Y1449 HydrophobicContact CE2-CD1 4.13Å; Y1368-Y1449 PolarHBondContact N-O 3.09Å; A1446-Y1449 HydrophobicContact CB-CD2 4.31Å; A1446-Y1449 HydrophobicContact CB-CG 4.43Å; A1446-Y1449 WeakPolarHBondContact O-CA 3.27Å; A1446-Y1449 WeakPolarHBondContact O-CB 3.41Å; A1446-Y1449 PolarHBondContact O-N 3.38Å; P1447-Y1449 PolarHBondContact O-N 2.71Å; P1447-Y1449 VanDerWaalsContact O-N 3.16Å; Y1449-L1588 HydrophobicContact CE1-CB 3.8Å; Y1449-L1588 HydrophobicContact CE1-CD1 4.47Å; Y1449-L1588 HydrophobicContact CE2-CD1 3.9Å; Y1449-D1589 HydrophobicContact CD1-CB 4.13Å; Y1449-D1589 HydrophobicContact CE1-CB 3.93Å
1450	F	80.1	Confident	81.6	Confident	15 Å²	15	18.4 Å²	18.4	7%	0.066	10%	0.099	C	C	.	.	S	Bend	trans	-135.2	165.1	178.6	-60.7	-74.8	0	0	0	110.8	F1361 Y1368 T1370 M1373 A1446	F1361-F1450 HydrophobicContact CE1-CE2 4.38Å; F1361-F1450 AromaticContact CE1-CZ 3.91Å; F1361-F1450 HydrophobicContact CE1-CZ 3.91Å; F1361-F1450 HydrophobicContact CZ-CZ 4.49Å; Y1368-F1450 HydrophobicContact CD2-CE1 4.47Å; Y1368-F1450 HydrophobicContact CD2-CZ 4.44Å; Y1368-F1450 HydrophobicContact CG-CE1 4.44Å; T1370-F1450 HydrophobicContact CG2-CD1 4.38Å; M1373-F1450 HydrophobicContact CB-CE1 4.15Å; M1373-F1450 HydrophobicContact CE-CE2 4.16Å; M1373-F1450 HydrophobicContact CE-CZ 4.32Å; M1373-F1450 HydrophobicContact CG-CE1 4.4Å; M1373-F1450 HydrophobicContact CG-CZ 4.46Å; M1373-F1450 HydrophobicContact SD-CD1 3.93Å; M1373-F1450 HydrophobicContact SD-CD2 4.06Å; M1373-F1450 HydrophobicContact SD-CE1 3.67Å; M1373-F1450 HydrophobicContact SD-CE2 3.82Å; M1373-F1450 HydrophobicContact SD-CG 4.11Å; M1373-F1450 HydrophobicContact SD-CZ 3.62Å; A1446-F1450 PolarHBondContact O-N 2.77Å
1451	T	76.2	Confident	81.3	Confident	20 Å²	20	18.4 Å²	18.4	12%	0.123	10%	0.099	C	C	.	.	P	Polyproline II helix	trans	-76.7	158.7	176.4	67.9	0	0	0	0	112.2	D769 T1370 R1441	D769-T1451 WeakPolarHBondContact OD1-CG2 3.46Å; D769-T1451 WeakPolarHBondContact OD2-CG2 3.38Å; T1370-T1451 HydrophobicContact CG2-CG2 4.21Å; R1441-T1451 PolarHBondContact NH1-O 2.98Å; R1441-T1451 VanDerWaalsContact NH1-O 3.13Å; R1441-T1451 PolarHBondContact NH2-O 3.43Å; R1441-T1451 PolarHBondContact NH2-OG1 2.97Å; R1441-T1451 VanDerWaalsContact NH2-OG1 3.09Å
1452	S	77.1	Confident	81	Confident	10 Å²	10	18.5 Å²	18.5	7%	0.07	10%	0.1	C	C	.	.	P	Polyproline II helix	trans	-69.1	132.7	169.7	53.7	0	0	0	0	111.8	I766 N1455 F1457	I766-S1452 PolarHBondContact O-OG 3.45Å; S1452-N1455 PolarHBondContact O-N 3.19Å; S1452-F1457 CarbonylContact C-O 3.53Å; S1452-F1457 VanDerWaalsContact CA-O 3.24Å; S1452-F1457 WeakPolarHBondContact CA-O 3.36Å; S1452-F1457 WeakPolarHBondContact CB-O 3.35Å
1453	V	79.7	Confident	80.8	Confident	9 Å²	9	19.6 Å²	19.6	6%	0.055	11%	0.105	C	C	.	.	B	Isolated β-bridge	trans	-75.2	133	179.1	-172.8	0	0	0	0	110.4	K1438 R1441 A1445 N1455 K1456 F1457	K1438-V1453 HydrophobicContact CG-CG1 4.2Å; R1441-V1453 HydrophobicContact CB-CG2 4.43Å; R1441-V1453 HydrophobicContact CG-CG2 3.77Å; R1441-V1453 WeakPolarHBondContact O-CG2 3.43Å; A1445-V1453 HydrophobicContact CB-CG2 4.31Å; V1453-N1455 PolarHBondContact O-N 3.15Å; V1453-K1456 PolarHBondContact O-N 2.83Å; V1453-F1457 HydrophobicContact CB-CB 4.38Å; V1453-F1457 PolarHBondContact N-O 2.9Å; V1453-F1457 PolarHBondContact O-N 3.36Å
1454	D	77	Confident	80.7	Confident	79 Å²	79	19.7 Å²	19.7	42%	0.422	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.1	14.8	-174.6	-57	-27	0	0	0	114.7	K1438 K1456	K1438-D1454 WeakPolarHBondContact CE-OD1 3.49Å; K1438-D1454 VanDerWaalsContact CE-OD2 3.23Å; K1438-D1454 WeakPolarHBondContact CE-OD2 3.28Å; K1438-D1454 IonicContact NZ-OD1 3.6Å; K1438-D1454 PolarHBondContact NZ-OD1 3.34Å; K1438-D1454 IonicContact NZ-OD2 2.98Å; K1438-D1454 PolarHBondContact NZ-OD2 3.38Å; D1454-K1456 HydrophobicContact CB-CB 4.42Å; D1454-K1456 HydrophobicContact CB-CD 4.28Å; D1454-K1456 HydrophobicContact CB-CG 4.05Å; D1454-K1456 PolarHBondContact O-N 2.8Å
1455	N	72.4	Confident	80.8	Confident	84 Å²	84	20.3 Å²	20.3	45%	0.449	11%	0.109	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	18.3	-163.7	-57.1	-44.1	0	0	0	114.5	V765 S1452 V1453	V765-N1455 HydrophobicContact CB-CB 4.39Å; V765-N1455 HydrophobicContact CG1-CB 3.7Å; V765-N1455 VanDerWaalsContact CG1-OD1 3.23Å; V765-N1455 WeakPolarHBondContact CG1-OD1 3.45Å; V765-N1455 HydrophobicContact CG2-CB 3.8Å; S1452-N1455 PolarHBondContact O-N 3.19Å; V1453-N1455 PolarHBondContact O-N 3.15Å
1456	K	77.8	Confident	81.4	Confident	57 Å²	57	20.5 Å²	20.5	25%	0.248	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-45	-179.6	-58.7	-173.4	-175.4	179.2	0	113.2	L1401 A1402 Q1403 D1429 V1453 D1454	L1401-K1456 HydrophobicContact CD1-CB 4.08Å; A1402-K1456 PolarHBondContact N-O 3.19Å; Q1403-K1456 HydrophobicContact CG-CB 4.07Å; Q1403-K1456 HydrophobicContact CG-CG 3.99Å; D1429-K1456 IonicContact OD1-NZ 2.7Å; D1429-K1456 PolarHBondContact OD1-NZ 3.26Å; D1429-K1456 IonicContact OD2-NZ 3.27Å; V1453-K1456 PolarHBondContact O-N 2.83Å; D1454-K1456 HydrophobicContact CB-CB 4.42Å; D1454-K1456 HydrophobicContact CB-CD 4.28Å; D1454-K1456 HydrophobicContact CB-CG 4.05Å; D1454-K1456 PolarHBondContact O-N 2.8Å
1457	F	84.7	Confident	82.1	Confident	3 Å²	3	19.8 Å²	19.8	1%	0.013	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	139.9	-167.6	-63.8	-80.9	0	0	0	113.1	V1400 L1401 H1410 F1412 C1442 S1452 V1453	V1400-F1457 WeakPolarHBondContact O-CA 3.19Å; L1401-F1457 HydrophobicContact CD1-CD1 4.23Å; L1401-F1457 HydrophobicContact CD1-CE1 3.86Å; L1401-F1457 HydrophobicContact CD1-CZ 4.08Å; H1410-F1457 HydrophobicContact CB-CE1 4.35Å; H1410-F1457 AromaticContact CD2-CE1 3.93Å; H1410-F1457 AromaticContact CG-CE1 4Å; F1412-F1457 HydrophobicContact CZ-CD1 4.25Å; F1412-F1457 AromaticContact CZ-CE1 3.91Å; F1412-F1457 HydrophobicContact CZ-CE1 3.91Å; F1412-F1457 HydrophobicContact CZ-CZ 4.15Å; C1442-F1457 HydrophobicContact CB-CB 3.79Å; C1442-F1457 HydrophobicContact CB-CD2 4.47Å; C1442-F1457 HydrophobicContact CB-CG 4.04Å; S1452-F1457 CarbonylContact C-O 3.53Å; S1452-F1457 VanDerWaalsContact CA-O 3.24Å; S1452-F1457 WeakPolarHBondContact CA-O 3.36Å; S1452-F1457 WeakPolarHBondContact CB-O 3.35Å; V1453-F1457 HydrophobicContact CB-CB 4.38Å; V1453-F1457 PolarHBondContact N-O 2.9Å; V1453-F1457 PolarHBondContact O-N 3.36Å
1458	V	85.4	Confident	83.4	Confident	4 Å²	4	19.3 Å²	19.3	2%	0.024	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	168.3	170.2	-59.2	0	0	0	0	110.6	S1399 V1400 A1402 C1442 P1447 L1462	S1399-V1458 PolarHBondContact OG-O 3.16Å; V1400-V1458 HydrophobicContact CB-CG2 3.81Å; V1400-V1458 HydrophobicContact CG1-CG2 4.07Å; V1400-V1458 PolarHBondContact N-O 2.76Å; V1400-V1458 PolarHBondContact O-N 2.92Å; A1402-V1458 HydrophobicContact CB-CG1 4.25Å; A1402-V1458 HydrophobicContact CB-CG2 4.13Å; C1442-V1458 CarbonylContact O-C 3.54Å; P1447-V1458 HydrophobicContact CG-CB 4.15Å; P1447-V1458 HydrophobicContact CG-CG1 4.34Å; V1458-L1462 HydrophobicContact CG2-CD1 3.71Å
1459	D	88.4	Confident	84.5	Confident	13 Å²	13	18.2 Å²	18.2	7%	0.07	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.7	135.2	-173.5	-164.3	-62.2	0	0	0	113.9	S1331 S1443 S1444 A1445 A1446 G1461 L1462	S1331-D1459 WeakPolarHBondContact CB-OD1 3.35Å; S1331-D1459 VanDerWaalsContact CB-OD2 3.24Å; S1331-D1459 WeakPolarHBondContact CB-OD2 3.48Å; S1331-D1459 PolarHBondContact OG-OD2 2.92Å; S1443-D1459 VanDerWaalsContact O-CA 3.31Å; S1443-D1459 WeakPolarHBondContact O-CA 3.41Å; S1444-D1459 WeakPolarHBondContact CA-OD2 3.48Å; A1445-D1459 PolarHBondContact O-N 3.35Å; A1446-D1459 HydrophobicContact CB-CB 4.37Å; D1459-G1461 PolarHBondContact O-N 3.46Å; D1459-G1461 VanDerWaalsContact O-N 3.16Å; D1459-G1461 WeakPolarHBondContact OD1-CA 3.43Å; D1459-G1461 PolarHBondContact OD1-N 3.34Å; D1459-L1462 PolarHBondContact O-N 3.34Å
1460	G	85.9	Confident	85.5	Confident	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-61	-22.6	179.1	0	0	0	0	0	113.7	S1443 L1462 I1463 A1464	S1443-G1460 PolarHBondContact O-N 3.09Å; G1460-L1462 PolarHBondContact O-N 3.16Å; G1460-I1463 PolarHBondContact O-N 3.16Å; G1460-I1463 VanDerWaalsContact O-N 3.09Å; G1460-A1464 PolarHBondContact O-N 3.27Å
1461	G	87.1	Confident	86.2	Confident	1 Å²	1	16.4 Å²	16.4	1%	0.01	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-60.4	-11.8	176.9	0	0	0	0	0	115.1	D1459 I1463 N1465 T1554	D1459-G1461 PolarHBondContact O-N 3.46Å; D1459-G1461 VanDerWaalsContact O-N 3.16Å; D1459-G1461 WeakPolarHBondContact OD1-CA 3.43Å; D1459-G1461 PolarHBondContact OD1-N 3.34Å; G1461-I1463 VanDerWaalsContact C-N 3.32Å; G1461-N1465 WeakPolarHBondContact CA-OD1 3.23Å; G1461-T1554 WeakPolarHBondContact O-CA 3.3Å
1462	L	84.2	Confident	87	Confident	6 Å²	6	15.5 Å²	15.5	3%	0.031	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-78.1	-10	172.9	-59.1	-179.1	0	0	0	114.7	Y783 V1400 P1447 V1458 D1459 G1460 M1550 V1553 T1554	Y783-L1462 HydrophobicContact CE2-CD1 4.06Å; Y783-L1462 HydrophobicContact CE2-CD2 4.29Å; V1400-L1462 HydrophobicContact CG2-CB 4.18Å; P1447-L1462 HydrophobicContact CG-CD1 4.31Å; V1458-L1462 HydrophobicContact CG2-CD1 3.71Å; D1459-L1462 PolarHBondContact O-N 3.34Å; G1460-L1462 PolarHBondContact O-N 3.16Å; L1462-M1550 HydrophobicContact CD2-CE 4.46Å; L1462-V1553 HydrophobicContact CB-CG1 4.11Å; L1462-V1553 HydrophobicContact CD2-CG1 3.76Å; L1462-V1553 WeakPolarHBondContact O-CG1 3.41Å; L1462-T1554 HydrophobicContact CD2-CG2 4.42Å
1463	I	86.3	Confident	87.5	Confident	22 Å²	22	15.8 Å²	15.8	11%	0.113	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-139	-31.7	178.3	-58.6	179.1	0	0	0	112.6	Q790 A797 R801 V1400 V1407 L1409 G1460 G1461	Q790-I1463 HydrophobicContact CG-CD1 4.39Å; Q790-I1463 HydrophobicContact CG-CG1 4.02Å; A797-I1463 HydrophobicContact CB-CG2 3.9Å; R801-I1463 PolarHBondContact NH2-O 2.75Å; V1400-I1463 HydrophobicContact CB-CD1 4.43Å; V1400-I1463 HydrophobicContact CG1-CD1 3.89Å; V1400-I1463 HydrophobicContact CG2-CB 4.15Å; V1400-I1463 HydrophobicContact CG2-CD1 3.71Å; V1400-I1463 HydrophobicContact CG2-CG1 3.73Å; V1407-I1463 HydrophobicContact CG2-CD1 4.41Å; L1409-I1463 HydrophobicContact CB-CD1 4.31Å; L1409-I1463 HydrophobicContact CB-CG2 4.11Å; L1409-I1463 HydrophobicContact CD1-CB 4.16Å; L1409-I1463 HydrophobicContact CD1-CG2 4.16Å; G1460-I1463 PolarHBondContact O-N 3.16Å; G1460-I1463 VanDerWaalsContact O-N 3.09Å; G1461-I1463 VanDerWaalsContact C-N 3.32Å
1464	A	90	Very high	87.9	Confident	2 Å²	2	15.6 Å²	15.6	2%	0.017	8%	0.082	C	C	.	.			trans	-138.4	44.5	-170	0	0	0	0	0	112.4	T1330 T1398 L1409 G1460 N1466 D1470	T1330-A1464 PolarHBondContact OG1-O 3.17Å; T1398-A1464 HydrophobicContact CG2-CB 3.88Å; L1409-A1464 HydrophobicContact CD1-CB 3.75Å; L1409-A1464 HydrophobicContact CD2-CB 4.49Å; G1460-A1464 PolarHBondContact O-N 3.27Å; A1464-N1466 PolarHBondContact O-N 3.47Å; A1464-D1470 WeakPolarHBondContact CB-OD2 3.4Å
1465	N	92	Very high	88.4	Confident	18 Å²	18	11.9 Å²	11.9	10%	0.096	6%	0.062	C	C	.	.	S	Bend	trans	-62.4	-25.7	-177.1	-151.1	24.8	0	0	0	114.1	D1296 G1297 G1461 T1554 T1556	D1296-N1465 VanDerWaalsContact CA-O 3.29Å; D1296-N1465 WeakPolarHBondContact CA-O 3.45Å; G1297-N1465 WeakPolarHBondContact CA-OD1 3.26Å; G1297-N1465 PolarHBondContact N-O 3.39Å; G1297-N1465 PolarHBondContact N-OD1 2.94Å; G1461-N1465 WeakPolarHBondContact CA-OD1 3.23Å; N1465-T1554 PolarHBondContact ND2-O 2.84Å; N1465-T1556 HydrophobicContact CB-CG2 4.09Å; N1465-T1556 WeakPolarHBondContact ND2-CG2 3.39Å
1466	N	93.9	Very high	89	Confident	5 Å²	5	8.8 Å²	8.8	3%	0.027	5%	0.045	C	C	.	.	S	Bend	trans	-113.8	101.6	164.1	172.6	-21.3	0	0	0	107.4	D1296 A1464 S1468 N1514 T1556 P1560 R1577	D1296-N1466 VanDerWaalsContact OD1-CA 3.29Å; D1296-N1466 WeakPolarHBondContact OD1-CA 3.31Å; D1296-N1466 VanDerWaalsContact OD1-CB 3.31Å; D1296-N1466 WeakPolarHBondContact OD1-CB 3.17Å; A1464-N1466 PolarHBondContact O-N 3.47Å; N1466-S1468 VanDerWaalsContact C-N 3.26Å; N1466-S1468 PolarHBondContact O-N 3.28Å; N1466-S1468 WeakPolarHBondContact OD1-CB 3.35Å; N1466-S1468 PolarHBondContact OD1-N 2.82Å; N1466-N1514 PolarHBondContact ND2-ND2 2.9Å; N1466-N1514 PolarHBondContact OD1-ND2 3.36Å; N1466-T1556 PolarHBondContact ND2-O 3.32Å; N1466-P1560 HydrophobicContact CB-CB 4.03Å; N1466-R1577 PolarHBondContact ND2-NH1 3.07Å
1467	P	95.3	Very high	89	Confident	0 Å²	0	9 Å²	9	0%	0	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	15.1	-169.3	32.8	-35.3	0	0	0	114.1	A1328 T1330 T1398 D1470 L1471	A1328-P1467 HydrophobicContact CB-CB 4.14Å; A1328-P1467 HydrophobicContact CB-CG 4.02Å; T1330-P1467 WeakPolarHBondContact OG1-CG 3.25Å; T1398-P1467 HydrophobicContact CG2-CB 3.95Å; P1467-D1470 PolarHBondContact O-N 3.29Å; P1467-L1471 WeakPolarHBondContact O-CB 3.41Å; P1467-L1471 PolarHBondContact O-N 2.94Å
1468	S	95.7	Very high	88.8	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-66.2	-41.3	-179	-76.9	0	0	0	0	113.8	S1294 N1466 D1470 L1471 L1472 N1514	S1294-S1468 WeakPolarHBondContact CB-OG 3.39Å; S1294-S1468 WeakPolarHBondContact OG-CA 3.35Å; S1294-S1468 PolarHBondContact OG-N 3.37Å; S1294-S1468 PolarHBondContact OG-OG 2.88Å; N1466-S1468 VanDerWaalsContact C-N 3.26Å; N1466-S1468 PolarHBondContact O-N 3.28Å; N1466-S1468 WeakPolarHBondContact OD1-CB 3.35Å; N1466-S1468 PolarHBondContact OD1-N 2.82Å; S1468-D1470 VanDerWaalsContact C-N 3.29Å; S1468-D1470 PolarHBondContact O-N 3.41Å; S1468-L1471 PolarHBondContact O-N 2.85Å; S1468-L1472 WeakPolarHBondContact O-CG 3.36Å; S1468-L1472 PolarHBondContact O-N 3.43Å; S1468-L1472 VanDerWaalsContact O-N 3.11Å; S1468-N1514 PolarHBondContact OG-ND2 2.83Å
1469	V	93.2	Very high	88.5	Confident	6 Å²	6	12.2 Å²	12.2	4%	0.036	6%	0.062	C	C	.	.	H	α-helix	trans	-68	-35.9	178.2	-172.6	0	0	0	0	110.1	R801 S1473 P1560 R1563 A1564 W1567	R801-V1469 HydrophobicContact CB-CG1 3.98Å; R801-V1469 HydrophobicContact CG-CG1 3.86Å; V1469-S1473 PolarHBondContact O-N 3.13Å; V1469-S1473 VanDerWaalsContact O-N 3.08Å; V1469-P1560 WeakPolarHBondContact CG2-O 3.42Å; V1469-R1563 HydrophobicContact CG2-CB 4.2Å; V1469-A1564 HydrophobicContact CG2-CB 3.91Å; V1469-W1567 HydrophobicContact CG1-CE3 4.03Å; V1469-W1567 HydrophobicContact CG1-CZ3 3.72Å; V1469-W1567 WeakPolarHBondContact O-CZ3 3.41Å
1470	D	93.4	Very high	87.6	Confident	5 Å²	5	12.6 Å²	12.6	3%	0.027	6%	0.063	C	C	.	.	H	α-helix	trans	-70	-37.6	176.2	-56.7	-75.9	0	0	0	112.3	R801 L1409 A1464 P1467 S1468 S1473 E1474	R801-D1470 IonicContact CZ-OD1 3.85Å; R801-D1470 IonicContact CZ-OD2 2.78Å; R801-D1470 IonicContact NE-OD1 2.77Å; R801-D1470 PolarHBondContact NE-OD1 3.41Å; R801-D1470 IonicContact NE-OD2 3.57Å; R801-D1470 IonicContact NH2-OD1 3.79Å; R801-D1470 PolarHBondContact NH2-OD1 2.98Å; R801-D1470 IonicContact NH2-OD2 2.71Å; R801-D1470 PolarHBondContact NH2-OD2 3.4Å; L1409-D1470 WeakPolarHBondContact CD2-OD1 3.42Å; A1464-D1470 WeakPolarHBondContact CB-OD2 3.4Å; P1467-D1470 PolarHBondContact O-N 3.29Å; S1468-D1470 VanDerWaalsContact C-N 3.29Å; S1468-D1470 PolarHBondContact O-N 3.41Å; D1470-S1473 WeakPolarHBondContact O-CB 3.24Å; D1470-S1473 PolarHBondContact O-N 3.24Å; D1470-E1474 WeakPolarHBondContact O-CB 3.36Å; D1470-E1474 PolarHBondContact O-N 2.79Å
1471	L	93.9	Very high	86.8	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.2	-42.6	173.9	178.1	58.9	0	0	0	112.1	L1292 W1326 A1328 I1396 P1467 S1468 E1474 I1475	L1292-L1471 HydrophobicContact CB-CD2 4.12Å; W1326-L1471 HydrophobicContact CB-CD1 4.3Å; W1326-L1471 HydrophobicContact CE3-CD1 3.94Å; A1328-L1471 HydrophobicContact CB-CB 4.01Å; A1328-L1471 HydrophobicContact CB-CD1 4.25Å; A1328-L1471 HydrophobicContact CB-CD2 3.9Å; A1328-L1471 HydrophobicContact CB-CG 4.27Å; I1396-L1471 HydrophobicContact CD1-CB 4.04Å; I1396-L1471 HydrophobicContact CD1-CD1 3.71Å; I1396-L1471 HydrophobicContact CD1-CG 4.48Å; I1396-L1471 HydrophobicContact CG1-CD1 4.25Å; P1467-L1471 WeakPolarHBondContact O-CB 3.41Å; P1467-L1471 PolarHBondContact O-N 2.94Å; S1468-L1471 PolarHBondContact O-N 2.85Å; L1471-E1474 PolarHBondContact O-N 3.35Å; L1471-I1475 HydrophobicContact CD1-CD1 3.86Å; L1471-I1475 HydrophobicContact CD1-CG1 4.19Å; L1471-I1475 HydrophobicContact CG-CD1 3.93Å; L1471-I1475 WeakPolarHBondContact O-CB 3.35Å; L1471-I1475 WeakPolarHBondContact O-CD1 3.45Å; L1471-I1475 VanDerWaalsContact O-CG1 3.25Å; L1471-I1475 WeakPolarHBondContact O-CG1 3.4Å; L1471-I1475 PolarHBondContact O-N 3.46Å
1472	L	92.7	Very high	85.9	Confident	2 Å²	2	15.1 Å²	15.1	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-64.1	-44.3	174.9	-66.6	177.7	0	0	0	111.3	L1292 S1468 E1474 I1475 Q1476 I1509 L1512 W1567 M1571	L1292-L1472 HydrophobicContact CD1-CD2 4.27Å; S1468-L1472 WeakPolarHBondContact O-CG 3.36Å; S1468-L1472 PolarHBondContact O-N 3.43Å; S1468-L1472 VanDerWaalsContact O-N 3.11Å; L1472-E1474 VanDerWaalsContact C-N 3.33Å; L1472-E1474 PolarHBondContact O-N 3.45Å; L1472-I1475 PolarHBondContact O-N 3.3Å; L1472-Q1476 PolarHBondContact O-N 3.46Å; L1472-I1509 HydrophobicContact CD2-CD1 4.05Å; L1472-L1512 HydrophobicContact CD1-CD1 4.36Å; L1472-L1512 HydrophobicContact CD2-CD1 3.79Å; L1472-L1512 HydrophobicContact CG-CD1 4.01Å; L1472-W1567 HydrophobicContact CB-CD2 3.98Å; L1472-W1567 HydrophobicContact CB-CE3 3.91Å; L1472-W1567 HydrophobicContact CB-CH2 3.62Å; L1472-W1567 HydrophobicContact CB-CZ2 3.68Å; L1472-W1567 HydrophobicContact CB-CZ3 3.74Å; L1472-W1567 HydrophobicContact CD1-CB 4.04Å; L1472-W1567 HydrophobicContact CD1-CD2 3.66Å; L1472-W1567 HydrophobicContact CD1-CE3 3.83Å; L1472-W1567 HydrophobicContact CD1-CG 3.77Å; L1472-W1567 HydrophobicContact CD1-CZ3 4.49Å; L1472-W1567 HydrophobicContact CG-CD2 4.46Å; L1472-M1571 HydrophobicContact CD1-CE 4.37Å; L1472-M1571 HydrophobicContact CD2-CE 4.03Å
1473	S	89.2	Confident	84.9	Confident	15 Å²	15	19.4 Å²	19.4	11%	0.105	10%	0.097	C	C	.	.	H	α-helix	trans	-57	-44.5	173.4	-94.3	0	0	0	0	113.6	R801 S804 V1469 D1470 Q1476 L1477	R801-S1473 WeakPolarHBondContact CA-OG 3.14Å; S804-S1473 WeakPolarHBondContact CB-OG 3.46Å; S804-S1473 WeakPolarHBondContact OG-CA 3.28Å; S804-S1473 WeakPolarHBondContact OG-CB 3.5Å; S804-S1473 PolarHBondContact OG-OG 3Å; V1469-S1473 PolarHBondContact O-N 3.13Å; V1469-S1473 VanDerWaalsContact O-N 3.08Å; D1470-S1473 WeakPolarHBondContact O-CB 3.24Å; D1470-S1473 PolarHBondContact O-N 3.24Å; S1473-Q1476 PolarHBondContact O-N 3.14Å; S1473-L1477 PolarHBondContact O-N 2.84Å
1474	E	87.8	Confident	83.5	Confident	5 Å²	5	22.3 Å²	22.3	2%	0.023	11%	0.108	C	C	.	.	H	α-helix	trans	-70.5	-36.9	-178.2	-179.8	57.9	-145.1	0	0	112	I1396 R1413 Y1415 D1470 L1471 L1472 Q1476 L1477 Y1478	I1396-E1474 HydrophobicContact CD1-CB 4.29Å; I1396-E1474 HydrophobicContact CD1-CG 4.29Å; I1396-E1474 HydrophobicContact CG2-CG 4.15Å; R1413-E1474 IonicContact CZ-OE1 3.84Å; R1413-E1474 IonicContact CZ-OE2 3.82Å; R1413-E1474 VanDerWaalsContact NE-CD 3.31Å; R1413-E1474 IonicContact NE-OE1 2.68Å; R1413-E1474 PolarHBondContact NE-OE1 3.16Å; R1413-E1474 IonicContact NE-OE2 3.86Å; R1413-E1474 PolarHBondContact NE-OE2 2.73Å; R1413-E1474 IonicContact NH2-OE1 2.68Å; R1413-E1474 PolarHBondContact NH2-OE1 3.17Å; R1413-E1474 IonicContact NH2-OE2 2.89Å; R1413-E1474 PolarHBondContact NH2-OE2 3.37Å; Y1415-E1474 VanDerWaalsContact OH-CD 3.31Å; Y1415-E1474 WeakPolarHBondContact OH-CG 3.1Å; Y1415-E1474 PolarHBondContact OH-OE1 2.81Å; D1470-E1474 WeakPolarHBondContact O-CB 3.36Å; D1470-E1474 PolarHBondContact O-N 2.79Å; L1471-E1474 PolarHBondContact O-N 3.35Å; L1472-E1474 VanDerWaalsContact C-N 3.33Å; L1472-E1474 PolarHBondContact O-N 3.45Å; E1474-Q1476 VanDerWaalsContact C-N 3.34Å; E1474-L1477 PolarHBondContact O-N 3.24Å; E1474-Y1478 WeakPolarHBondContact O-CB 3.35Å; E1474-Y1478 PolarHBondContact O-N 3.34Å
1475	I	88.2	Confident	81.6	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-63.9	-39.7	171.7	-71.8	165.9	0	0	0	111	L1292 W1326 L1471 L1472 Y1478 K1479 L1507 I1509	L1292-I1475 HydrophobicContact CD1-CD1 3.58Å; L1292-I1475 HydrophobicContact CD2-CD1 3.75Å; L1292-I1475 HydrophobicContact CG-CD1 4.31Å; W1326-I1475 HydrophobicContact CD2-CD1 4.1Å; W1326-I1475 HydrophobicContact CD2-CG1 3.83Å; W1326-I1475 HydrophobicContact CE3-CD1 4.32Å; W1326-I1475 HydrophobicContact CE3-CG1 3.79Å; W1326-I1475 HydrophobicContact CG-CD1 4.25Å; W1326-I1475 HydrophobicContact CG-CG1 4.48Å; W1326-I1475 HydrophobicContact CH2-CG1 3.93Å; W1326-I1475 HydrophobicContact CZ2-CG1 3.98Å; W1326-I1475 HydrophobicContact CZ3-CG1 3.83Å; L1471-I1475 HydrophobicContact CD1-CD1 3.86Å; L1471-I1475 HydrophobicContact CD1-CG1 4.19Å; L1471-I1475 HydrophobicContact CG-CD1 3.93Å; L1471-I1475 WeakPolarHBondContact O-CB 3.35Å; L1471-I1475 WeakPolarHBondContact O-CD1 3.45Å; L1471-I1475 VanDerWaalsContact O-CG1 3.25Å; L1471-I1475 WeakPolarHBondContact O-CG1 3.4Å; L1471-I1475 PolarHBondContact O-N 3.46Å; L1472-I1475 PolarHBondContact O-N 3.3Å; I1475-Y1478 PolarHBondContact O-N 2.62Å; I1475-K1479 WeakPolarHBondContact O-CG 3.47Å; I1475-K1479 PolarHBondContact O-N 2.81Å; I1475-L1507 HydrophobicContact CG2-CD2 3.68Å; I1475-I1509 HydrophobicContact CG2-CD1 4.31Å
1476	Q	83	Confident	79.4	Confident	19 Å²	19	27.6 Å²	27.6	9%	0.089	14%	0.14	C	C	.	.	H	α-helix	trans	-69.7	-35.7	175.5	-179.1	57.5	5.8	0	0	112.7	Q807 D808 L1472 S1473 E1474 Y1478 K1479 M1480	Q807-Q1476 HydrophobicContact CB-CG 4.26Å; D808-Q1476 PolarHBondContact OD1-OE1 3.14Å; D808-Q1476 VanDerWaalsContact OD1-OE1 3.07Å; L1472-Q1476 PolarHBondContact O-N 3.46Å; S1473-Q1476 PolarHBondContact O-N 3.14Å; E1474-Q1476 VanDerWaalsContact C-N 3.34Å; Q1476-Y1478 VanDerWaalsContact C-N 3.33Å; Q1476-K1479 PolarHBondContact O-N 2.97Å; Q1476-M1480 WeakPolarHBondContact O-CG 3.36Å; Q1476-M1480 PolarHBondContact O-N 3.3Å
1477	L	79	Confident	76.9	Confident	63 Å²	63	31.6 Å²	31.6	33%	0.33	18%	0.182	S	C	.	.	H	α-helix	trans	-62.3	-41.1	170.3	-179.1	61.4	0	0	0	111.6	L1417 S1473 E1474 M1480 A1481	L1417-L1477 HydrophobicContact CD1-CD2 3.87Å; L1417-L1477 HydrophobicContact CD1-CG 4.07Å; L1417-L1477 HydrophobicContact CD2-CG 4.25Å; S1473-L1477 PolarHBondContact O-N 2.84Å; E1474-L1477 PolarHBondContact O-N 3.24Å; L1477-M1480 PolarHBondContact O-N 2.65Å; L1477-A1481 PolarHBondContact O-N 2.79Å
1478	Y	81.1	Confident	74.3	Confident	30 Å²	30	33.4 Å²	33.4	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-42.5	176.4	-174.8	-90.8	0	0	0	112.6	W1326 K1394 Y1415 L1417 P1418 E1474 I1475 Q1476 A1481 L1482 L1507	W1326-Y1478 HydrophobicContact CH2-CD1 4.22Å; W1326-Y1478 HydrophobicContact CH2-CD2 4.19Å; W1326-Y1478 AromaticContact CH2-CG 3.84Å; W1326-Y1478 HydrophobicContact CH2-CG 3.84Å; W1326-Y1478 AromaticContact CZ2-CD1 3.98Å; W1326-Y1478 HydrophobicContact CZ2-CD1 3.98Å; W1326-Y1478 HydrophobicContact CZ2-CE1 4.43Å; W1326-Y1478 HydrophobicContact CZ2-CG 4.09Å; K1394-Y1478 WeakPolarHBondContact CE-OH 3.35Å; K1394-Y1478 PolarHBondContact NZ-OH 2.76Å; Y1415-Y1478 AromaticContact CD2-CD2 3.9Å; Y1415-Y1478 HydrophobicContact CD2-CD2 3.9Å; Y1415-Y1478 AromaticContact CD2-CE2 3.9Å; Y1415-Y1478 HydrophobicContact CD2-CE2 3.9Å; Y1415-Y1478 AromaticContact CE2-CD2 3.77Å; Y1415-Y1478 HydrophobicContact CE2-CD2 3.77Å; Y1415-Y1478 HydrophobicContact CE2-CE2 4.25Å; L1417-Y1478 HydrophobicContact CD2-CD2 4.2Å; P1418-Y1478 HydrophobicContact CG-CD2 4.5Å; P1418-Y1478 HydrophobicContact CG-CE2 4Å; E1474-Y1478 WeakPolarHBondContact O-CB 3.35Å; E1474-Y1478 PolarHBondContact O-N 3.34Å; I1475-Y1478 PolarHBondContact O-N 2.62Å; Q1476-Y1478 VanDerWaalsContact C-N 3.33Å; Y1478-A1481 PolarHBondContact O-N 2.85Å; Y1478-L1482 HydrophobicContact CD1-CD1 4.13Å; Y1478-L1482 HydrophobicContact CE1-CD1 3.79Å; Y1478-L1482 HydrophobicContact CE1-CG 4.25Å; Y1478-L1482 PolarHBondContact O-N 3.39Å; Y1478-L1507 HydrophobicContact CD1-CD1 4.08Å; Y1478-L1507 HydrophobicContact CE1-CD1 4.07Å
1479	K	79.1	Confident	71.8	Confident	44 Å²	44	36 Å²	36	19%	0.191	21%	0.209	C	C	.	.	H	α-helix	trans	-57.1	-50.6	171.5	-75.1	163.9	168.3	175.6	0	111.1	D808 I1475 Q1476 A1481 L1482 E1483 L1507	D808-K1479 IonicContact OD1-NZ 2.86Å; D808-K1479 PolarHBondContact OD1-NZ 3.47Å; I1475-K1479 WeakPolarHBondContact O-CG 3.47Å; I1475-K1479 PolarHBondContact O-N 2.81Å; Q1476-K1479 PolarHBondContact O-N 2.97Å; K1479-A1481 VanDerWaalsContact C-N 3.28Å; K1479-A1481 PolarHBondContact O-N 3.35Å; K1479-L1482 WeakPolarHBondContact O-CB 3.46Å; K1479-L1482 PolarHBondContact O-N 2.9Å; K1479-E1483 PolarHBondContact O-N 3.12Å; K1479-L1507 WeakPolarHBondContact CE-O 3.44Å; K1479-L1507 HydrophobicContact CG-CB 4.42Å
1480	M	68.9	Low	69.2	Low	20 Å²	20	44.2 Å²	44.2	10%	0.099	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-38.5	177.8	-74	-176.3	69	0	0	112.5	Q807 Q1476 L1477 L1482 E1483 Y1484	Q807-M1480 PolarHBondContact NE2-SD 2.96Å; Q1476-M1480 WeakPolarHBondContact O-CG 3.36Å; Q1476-M1480 PolarHBondContact O-N 3.3Å; L1477-M1480 PolarHBondContact O-N 2.65Å; M1480-L1482 VanDerWaalsContact C-N 3.3Å; M1480-L1482 PolarHBondContact O-N 3.23Å; M1480-E1483 PolarHBondContact O-N 2.76Å; M1480-E1483 VanDerWaalsContact O-N 3.15Å; M1480-Y1484 HydrophobicContact CB-CD2 4.02Å; M1480-Y1484 HydrophobicContact CB-CE2 4.22Å; M1480-Y1484 HydrophobicContact CE-CD2 4.11Å; M1480-Y1484 HydrophobicContact CE-CE2 3.78Å; M1480-Y1484 HydrophobicContact CG-CD2 4.47Å; M1480-Y1484 HydrophobicContact CG-CE2 4.17Å; M1480-Y1484 WeakPolarHBondContact O-CD2 3.4Å; M1480-Y1484 PolarHBondContact O-N 2.93Å
1481	A	68.9	Low	66.5	Low	8 Å²	8	52.5 Å²	52.5	7%	0.066	28%	0.279	C	S	.	.	H	α-helix	trans	-66.9	-27.4	176.2	0	0	0	0	0	113.4	L1417 P1418 L1477 Y1478 K1479	L1417-A1481 HydrophobicContact CB-CB 4.24Å; P1418-A1481 HydrophobicContact CB-CB 4.24Å; P1418-A1481 HydrophobicContact CG-CB 4.28Å; L1477-A1481 PolarHBondContact O-N 2.79Å; Y1478-A1481 PolarHBondContact O-N 2.85Å; K1479-A1481 VanDerWaalsContact C-N 3.28Å; K1479-A1481 PolarHBondContact O-N 3.35Å
1482	L	68.8	Low	63.8	Low	47 Å²	47	54 Å²	54	25%	0.246	29%	0.292	C	S	.	.	H	α-helix	trans	-71.7	-28.6	170.7	-67.8	169.9	0	0	0	112.9	P1418 Y1478 K1479 M1480 S1503	P1418-L1482 HydrophobicContact CB-CD2 4.11Å; P1418-L1482 HydrophobicContact CG-CD2 3.61Å; P1418-L1482 HydrophobicContact CG-CG 4.04Å; Y1478-L1482 HydrophobicContact CD1-CD1 4.13Å; Y1478-L1482 HydrophobicContact CE1-CD1 3.79Å; Y1478-L1482 HydrophobicContact CE1-CG 4.25Å; Y1478-L1482 PolarHBondContact O-N 3.39Å; K1479-L1482 WeakPolarHBondContact O-CB 3.46Å; K1479-L1482 PolarHBondContact O-N 2.9Å; M1480-L1482 VanDerWaalsContact C-N 3.3Å; M1480-L1482 PolarHBondContact O-N 3.23Å; L1482-S1503 PolarHBondContact O-OG 2.79Å
1483	E	63.7	Low	61.3	Low	95 Å²	95	55.2 Å²	55.2	44%	0.444	30%	0.304	S	S	.	.	H	α-helix	trans	-91.3	-34.7	-175.8	-66.1	179.5	150.1	0	0	113.4	K1479 M1480	K1479-E1483 PolarHBondContact O-N 3.12Å; M1480-E1483 PolarHBondContact O-N 2.76Å; M1480-E1483 VanDerWaalsContact O-N 3.15Å
1484	Y	55.5	Low	58.8	Low	84 Å²	84	63.6 Å²	63.6	33%	0.329	34%	0.335	S	S	.	.	S	Bend	trans	-108.2	126.2	-171.6	-62.7	-63.7	0	0	0	113.4	M1480 V1486 L1489	M1480-Y1484 HydrophobicContact CB-CD2 4.02Å; M1480-Y1484 HydrophobicContact CB-CE2 4.22Å; M1480-Y1484 HydrophobicContact CE-CD2 4.11Å; M1480-Y1484 HydrophobicContact CE-CE2 3.78Å; M1480-Y1484 HydrophobicContact CG-CD2 4.47Å; M1480-Y1484 HydrophobicContact CG-CE2 4.17Å; M1480-Y1484 WeakPolarHBondContact O-CD2 3.4Å; M1480-Y1484 PolarHBondContact O-N 2.93Å; Y1484-V1486 PolarHBondContact O-N 2.88Å; Y1484-L1489 HydrophobicContact CD2-CD2 4.42Å
1485	T	51	Low	56.3	Low	109 Å²	109	64.8 Å²	64.8	67%	0.669	34%	0.342	S	S	*	.			trans	-70.4	131.5	166.4	45.9	0	0	0	0	110.7	G1487 S1488	T1485-G1487 VanDerWaalsContact C-N 3.28Å; T1485-G1487 PolarHBondContact O-N 3.01Å; T1485-S1488 PolarHBondContact O-N 3.29Å; T1485-S1488 PolarHBondContact O-OG 3.36Å
1486	V	45.4	Very low	53.8	Low	21 Å²	21	67.6 Å²	67.6	13%	0.127	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-64.4	-19.6	-151	162.7	0	0	0	0	116.4	G1419 I1423 Y1484 S1488 L1489	G1419-V1486 WeakPolarHBondContact O-CG2 3.41Å; I1423-V1486 HydrophobicContact CD1-CG1 3.76Å; I1423-V1486 HydrophobicContact CG1-CG1 3.24Å; Y1484-V1486 PolarHBondContact O-N 2.88Å; V1486-S1488 PolarHBondContact O-N 3.36Å; V1486-L1489 HydrophobicContact CB-CD1 4.47Å; V1486-L1489 HydrophobicContact CG1-CD1 4.46Å; V1486-L1489 HydrophobicContact CG2-CD1 4.03Å; V1486-L1489 PolarHBondContact O-N 3.29Å
1487	G	41.2	Very low	51.5	Low	89 Å²	89	72.1 Å²	72.1	92%	0.918	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-64.7	-3.7	170.8	0	0	0	0	0	115.2	T1485	T1485-G1487 VanDerWaalsContact C-N 3.28Å; T1485-G1487 PolarHBondContact O-N 3.01Å
1488	S	40.8	Very low	49.2	Very low	38 Å²	38	76.3 Å²	76.3	27%	0.266	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-106.9	-12.1	-179.5	62.9	0	0	0	0	115.2	T1485 V1486 E1490 Y1491 A1492	T1485-S1488 PolarHBondContact O-N 3.29Å; T1485-S1488 PolarHBondContact O-OG 3.36Å; V1486-S1488 PolarHBondContact O-N 3.36Å; S1488-E1490 PolarHBondContact O-N 3.46Å; S1488-Y1491 CarbonylContact O-C 3.57Å; S1488-Y1491 PolarHBondContact O-N 2.89Å; S1488-A1492 PolarHBondContact O-N 3.33Å
1489	L	42.2	Very low	46.9	Very low	54 Å²	54	81.3 Å²	81.3	28%	0.283	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-36.1	-170.1	-80.8	164.7	0	0	0	114.1	Y1484 V1486 Y1491	Y1484-L1489 HydrophobicContact CD2-CD2 4.42Å; V1486-L1489 HydrophobicContact CB-CD1 4.47Å; V1486-L1489 HydrophobicContact CG1-CD1 4.46Å; V1486-L1489 HydrophobicContact CG2-CD1 4.03Å; V1486-L1489 PolarHBondContact O-N 3.29Å; L1489-Y1491 VanDerWaalsContact C-N 3.28Å; L1489-Y1491 PolarHBondContact O-N 3.14Å
1490	E	40	Very low	44.7	Very low	179 Å²	179	87 Å²	87	84%	0.836	48%	0.483	S	S	*	.	H	α-helix	trans	-68	-26.5	173.7	-66.6	-165.9	125.6	0	0	113.1	S1488	S1488-E1490 PolarHBondContact O-N 3.46Å
1491	Y	36	Very low	43.2	Very low	180 Å²	180	94.5 Å²	94.5	71%	0.706	52%	0.518	S	S	*	.	H	α-helix	trans	-92.6	-34.7	-178.6	-99.5	-94.3	0	0	0	113.4	S1488 L1489 G1493 Y1494 V1495	S1488-Y1491 CarbonylContact O-C 3.57Å; S1488-Y1491 PolarHBondContact O-N 2.89Å; L1489-Y1491 VanDerWaalsContact C-N 3.28Å; L1489-Y1491 PolarHBondContact O-N 3.14Å; Y1491-G1493 PolarHBondContact O-N 3Å; Y1491-Y1494 PolarHBondContact O-N 3.05Å; Y1491-V1495 PolarHBondContact O-N 3.29Å
1492	A	37.8	Very low	41.8	Very low	32 Å²	32	101.2 Å²	101.2	26%	0.264	55%	0.546	S	S	.	.	H	α-helix	trans	-59.7	-29.3	176.2	0	0	0	0	0	112	S1488 Y1494	S1488-A1492 PolarHBondContact O-N 3.33Å; A1492-Y1494 PolarHBondContact O-N 3.05Å
1493	G	39.4	Very low	40.5	Very low	26 Å²	26	101.4 Å²	101.4	27%	0.268	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.5	-4.5	172.6	0	0	0	0	0	115.9	R803 Y1491	R803-G1493 PolarHBondContact NH1-O 3.25Å; Y1491-G1493 PolarHBondContact O-N 3Å
1494	Y	36.7	Very low	39.5	Very low	192 Å²	192	103.8 Å²	103.8	75%	0.753	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	-17.5	-177.8	-85.1	-81.3	0	0	0	115.2	Y1491 A1492	Y1491-Y1494 PolarHBondContact O-N 3.05Å; A1492-Y1494 PolarHBondContact O-N 3.05Å
1495	V	34.9	Very low	39.3	Very low	29 Å²	29	106.7 Å²	106.7	18%	0.176	59%	0.589	C	S	.	*			trans	-134.3	116	-177.1	-157.5	0	0	0	0	111	L522 Y1491 L1497	L522-V1495 HydrophobicContact CB-CG1 3.81Å; L522-V1495 HydrophobicContact CD1-CG1 3.99Å; L522-V1495 HydrophobicContact CD1-CG2 3.93Å; L522-V1495 HydrophobicContact CD2-CG1 4.15Å; L522-V1495 HydrophobicContact CG-CG1 4.19Å; Y1491-V1495 PolarHBondContact O-N 3.29Å; V1495-L1497 HydrophobicContact CB-CD1 4.27Å; V1495-L1497 HydrophobicContact CB-CG 4.48Å; V1495-L1497 HydrophobicContact CG1-CD1 3.79Å; V1495-L1497 HydrophobicContact CG1-CG 3.77Å; V1495-L1497 PolarHBondContact O-N 3.39Å
1496	G	36.9	Very low	39.5	Very low	61 Å²	61	106.2 Å²	106.2	63%	0.629	58%	0.579	S	S	*	*			trans	-74.6	100.9	167.7	0	0	0	0	0	109.7
1497	L	34.8	Very low	40.6	Very low	113 Å²	113	106.8 Å²	106.8	59%	0.592	58%	0.582	S	S	*	*			trans	-121.4	119.5	178.6	-86.8	166.5	0	0	0	111.3	V1495	V1495-L1497 HydrophobicContact CB-CD1 4.27Å; V1495-L1497 HydrophobicContact CB-CG 4.48Å; V1495-L1497 HydrophobicContact CG1-CD1 3.79Å; V1495-L1497 HydrophobicContact CG1-CG 3.77Å; V1495-L1497 PolarHBondContact O-N 3.39Å
1498	N	30.5	Very low	42.3	Very low	151 Å²	151	105.6 Å²	105.6	81%	0.807	55%	0.552	S	S	*	*			trans	-60.2	160.4	150.4	-62.7	-33.9	0	0	0	109
1499	V	32.9	Very low	44.5	Very low	135 Å²	135	104.9 Å²	104.9	82%	0.818	55%	0.545	S	S	*	.			trans	83.7	93.9	-172.7	-171.3	0	0	0	0	113.9
1500	L	33.6	Very low	46.6	Very low	163 Å²	163	102.6 Å²	102.6	85%	0.853	53%	0.534	S	S	*	.			trans	-173.5	173.3	130.8	-96.3	163.2	0	0	0	108.5
1501	Q	36.3	Very low	49.1	Very low	179 Å²	179	94 Å²	94	84%	0.836	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-84.6	133.6	-166	-65.9	173.9	-68.9	0	0	113.6
1502	K	39.7	Very low	51.8	Low	149 Å²	149	85.5 Å²	85.5	65%	0.648	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-60.3	136.8	169.5	-97.6	-165.4	168.4	-171.1	0	111.9	E1506	K1502-E1506 IonicContact NZ-OE1 3.61Å; K1502-E1506 PolarHBondContact NZ-OE1 3.15Å
1503	S	41.2	Very low	54.6	Low	51 Å²	51	84 Å²	84	36%	0.357	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-78.9	165.9	155.6	51	0	0	0	0	111.2	L1482	L1482-S1503 PolarHBondContact O-OG 2.79Å
1504	T	43.5	Very low	57.3	Low	145 Å²	145	82.7 Å²	82.7	89%	0.89	44%	0.435	S	S	*	.	S	Bend	trans	-98.9	1.1	-165.6	47.6	0	0	0	0	116.8
1505	E	50.6	Low	60.2	Low	144 Å²	144	73.6 Å²	73.6	67%	0.673	40%	0.4	S	S	*	.			trans	-96.6	97.4	173.8	-71.6	-161	126.9	0	0	111.7	L1507	E1505-L1507 PolarHBondContact O-N 2.98Å
1506	E	54.6	Low	63.1	Low	100 Å²	100	72.2 Å²	72.2	47%	0.467	39%	0.391	S	S	.	.			trans	-80	105.5	172	-64.8	-168	147.8	0	0	110.7	K1287 K1502 E1508	K1287-E1506 IonicContact NZ-OE2 2.88Å; K1287-E1506 PolarHBondContact NZ-OE2 3.26Å; K1502-E1506 IonicContact NZ-OE1 3.61Å; K1502-E1506 PolarHBondContact NZ-OE1 3.15Å; E1506-E1508 PolarHBondContact O-N 2.87Å
1507	L	68.9	Low	65.8	Low	33 Å²	33	69.4 Å²	69.4	17%	0.173	36%	0.362	C	S	.	.			trans	-85.5	89.7	179.2	-167.1	150.8	0	0	0	110.8	K1290 W1326 I1475 Y1478 K1479 E1505	K1290-L1507 HydrophobicContact CG-CG 4.48Å; W1326-L1507 HydrophobicContact CZ2-CD1 4.34Å; I1475-L1507 HydrophobicContact CG2-CD2 3.68Å; Y1478-L1507 HydrophobicContact CD1-CD1 4.08Å; Y1478-L1507 HydrophobicContact CE1-CD1 4.07Å; K1479-L1507 WeakPolarHBondContact CE-O 3.44Å; K1479-L1507 HydrophobicContact CG-CB 4.42Å; E1505-L1507 PolarHBondContact O-N 2.98Å
1508	E	77.5	Confident	68.4	Low	64 Å²	64	64.2 Å²	64.2	30%	0.299	34%	0.336	S	S	.	.			trans	-95	139.5	178.3	-70.1	-177.7	174	0	0	112.7	K1287 L1289 K1290 E1506	K1287-E1508 VanDerWaalsContact CD-CD 3.45Å; K1287-E1508 VanDerWaalsContact CD-OE1 3.31Å; K1287-E1508 WeakPolarHBondContact CD-OE1 3.48Å; K1287-E1508 WeakPolarHBondContact CD-OE2 3.41Å; K1287-E1508 IonicContact NZ-OE1 3.26Å; K1287-E1508 PolarHBondContact NZ-OE1 3.41Å; L1289-E1508 HydrophobicContact CD2-CB 3.67Å; K1290-E1508 WeakPolarHBondContact CB-O 3.19Å; K1290-E1508 WeakPolarHBondContact CG-O 3.37Å; K1290-E1508 PolarHBondContact N-O 3.28Å; E1506-E1508 PolarHBondContact O-N 2.87Å
1509	I	86.9	Confident	71.2	Confident	22 Å²	22	60.8 Å²	60.8	11%	0.113	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.3	-177.4	-57	168.8	0	0	0	109.2	L1292 L1472 I1475 M1571 V1573	L1292-I1509 HydrophobicContact CD1-CB 4.44Å; L1292-I1509 HydrophobicContact CD1-CD1 4.03Å; L1292-I1509 HydrophobicContact CD1-CG1 4.14Å; L1292-I1509 HydrophobicContact CD1-CG2 3.45Å; L1292-I1509 VanDerWaalsContact CD1-CG2 3.45Å; L1292-I1509 HydrophobicContact CG-CG2 3.83Å; L1472-I1509 HydrophobicContact CD2-CD1 4.05Å; I1475-I1509 HydrophobicContact CG2-CD1 4.31Å; I1509-M1571 HydrophobicContact CD1-CE 4.34Å; I1509-V1573 HydrophobicContact CB-CG1 4.43Å; I1509-V1573 HydrophobicContact CB-CG2 3.92Å; I1509-V1573 HydrophobicContact CG2-CG1 3.63Å; I1509-V1573 HydrophobicContact CG2-CG2 4.04Å
1510	G	85.6	Confident	73.6	Confident	6 Å²	6	55.9 Å²	55.9	6%	0.062	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	-30.8	179.9	0	0	0	0	0	115.1	K1290 P1574	K1290-G1510 PolarHBondContact O-N 3.06Å; G1510-P1574 WeakPolarHBondContact O-CD 3.46Å
1511	C	92.2	Very high	75.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	143.7	178.1	179.6	0	0	0	0	110.9	K1290 F1291 L1292 L1620 L1624	K1290-C1511 PolarHBondContact O-N 3.22Å; F1291-C1511 HydrophobicContact CD2-CB 4.12Å; L1292-C1511 PolarHBondContact N-O 3.47Å; C1511-L1620 HydrophobicContact CB-CD2 3.87Å; C1511-L1620 HydrophobicContact CB-CG 4.42Å; C1511-L1624 HydrophobicContact CB-CD1 3.66Å
1512	L	94.2	Very high	78	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.5	166	-165.2	159.3	0	0	0	110.3	L1292 L1472 N1514 P1574 F1575 F1576	L1292-L1512 HydrophobicContact CB-CB 4.36Å; L1292-L1512 HydrophobicContact CB-CG 4.09Å; L1292-L1512 HydrophobicContact CD1-CB 4.44Å; L1292-L1512 HydrophobicContact CD1-CD1 4.09Å; L1292-L1512 HydrophobicContact CD1-CG 4.37Å; L1472-L1512 HydrophobicContact CD1-CD1 4.36Å; L1472-L1512 HydrophobicContact CD2-CD1 3.79Å; L1472-L1512 HydrophobicContact CG-CD1 4.01Å; L1512-N1514 HydrophobicContact CD2-CB 3.97Å; L1512-P1574 PolarHBondContact N-O 3.12Å; L1512-F1575 HydrophobicContact CB-CD2 4.49Å; L1512-F1575 HydrophobicContact CD2-CD2 3.88Å; L1512-F1575 HydrophobicContact CD2-CE2 3.86Å; L1512-F1576 PolarHBondContact O-N 3.32Å
1513	L	96.1	Very high	79.5	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	125.2	169.5	176.7	60.8	0	0	0	110.2	F1291 L1292 L1293 S1294 I1312 L1515 F1576 F1578 L1617	F1291-L1513 HydrophobicContact CE2-CB 3.71Å; F1291-L1513 HydrophobicContact CZ-CB 3.98Å; F1291-L1513 HydrophobicContact CZ-CD2 4.01Å; L1292-L1513 PolarHBondContact O-N 3.25Å; L1293-L1513 CarbonylContact C-O 3.56Å; L1293-L1513 WeakPolarHBondContact CA-O 3.26Å; L1293-L1513 HydrophobicContact CD1-CB 4.22Å; L1293-L1513 HydrophobicContact CD1-CD2 3.93Å; L1293-L1513 HydrophobicContact CD1-CG 3.93Å; S1294-L1513 PolarHBondContact N-O 2.98Å; I1312-L1513 HydrophobicContact CD1-CD2 4.15Å; L1513-L1515 HydrophobicContact CD1-CD2 3.88Å; L1513-L1515 HydrophobicContact CG-CD2 4.19Å; L1513-L1515 HydrophobicContact CG-CG 4.31Å; L1513-F1576 HydrophobicContact CD1-CB 3.86Å; L1513-F1578 HydrophobicContact CD1-CD2 3.83Å; L1513-F1578 HydrophobicContact CD1-CE2 4.07Å; L1513-L1617 HydrophobicContact CB-CD1 4.46Å; L1513-L1617 HydrophobicContact CD1-CD1 4.23Å; L1513-L1617 HydrophobicContact CD1-CD2 3.76Å; L1513-L1617 HydrophobicContact CD2-CD1 4.48Å; L1513-L1617 HydrophobicContact CD2-CD2 3.94Å; L1513-L1617 HydrophobicContact CG-CD2 4.46Å
1514	N	96.5	Very high	80.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127.8	175.3	-175.8	-17.6	0	0	0	110.5	S1294 N1466 S1468 L1512 F1575 F1576 R1577 F1578	S1294-N1514 WeakPolarHBondContact O-CA 3.45Å; N1466-N1514 PolarHBondContact ND2-ND2 2.9Å; N1466-N1514 PolarHBondContact OD1-ND2 3.36Å; S1468-N1514 PolarHBondContact OG-ND2 2.83Å; L1512-N1514 HydrophobicContact CD2-CB 3.97Å; N1514-F1575 HydrophobicContact CB-CE2 4.22Å; N1514-F1575 HydrophobicContact CB-CZ 4.3Å; N1514-F1576 PolarHBondContact N-O 2.89Å; N1514-R1577 VanDerWaalsContact CG-NH1 3.34Å; N1514-R1577 PolarHBondContact ND2-NH1 3.13Å; N1514-R1577 WeakPolarHBondContact O-CA 3.5Å; N1514-R1577 PolarHBondContact OD1-NH1 3.39Å; N1514-F1578 PolarHBondContact O-N 2.89Å; N1514-F1578 VanDerWaalsContact O-N 3.1Å
1515	L	97	Very high	81.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	123.6	-179.8	-61.1	-174.3	0	0	0	111.3	L1293 S1294 L1295 D1296 L1305 M1308 L1309 I1312 L1513 F1578	L1293-L1515 HydrophobicContact CD1-CD1 4.39Å; L1293-L1515 HydrophobicContact CD1-CG 4.41Å; S1294-L1515 PolarHBondContact O-N 2.9Å; L1295-L1515 HydrophobicContact CD2-CB 3.97Å; L1295-L1515 HydrophobicContact CD2-CD1 4.01Å; L1295-L1515 HydrophobicContact CD2-CG 4.31Å; D1296-L1515 PolarHBondContact N-O 3.26Å; L1305-L1515 HydrophobicContact CD2-CB 3.83Å; L1305-L1515 WeakPolarHBondContact CD2-O 3.47Å; M1308-L1515 HydrophobicContact CE-CB 3.81Å; M1308-L1515 HydrophobicContact CE-CD2 4.08Å; M1308-L1515 HydrophobicContact CE-CG 4.4Å; L1309-L1515 HydrophobicContact CD1-CD1 4.27Å; L1309-L1515 HydrophobicContact CD2-CD1 3.36Å; L1309-L1515 HydrophobicContact CG-CD1 3.48Å; L1309-L1515 VanDerWaalsContact CG-CD1 3.48Å; I1312-L1515 HydrophobicContact CD1-CD2 4.2Å; L1513-L1515 HydrophobicContact CD1-CD2 3.88Å; L1513-L1515 HydrophobicContact CG-CD2 4.19Å; L1513-L1515 HydrophobicContact CG-CG 4.31Å; L1515-F1578 HydrophobicContact CD2-CB 3.81Å; L1515-F1578 HydrophobicContact CD2-CD2 4.18Å; L1515-F1578 HydrophobicContact CD2-CG 4.42Å
1516	G	95	Very high	82.2	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.			trans	-98.5	146.6	-178.9	0	0	0	0	0	114.9	D1296 M1308 G1518 F1578	D1296-G1516 VanDerWaalsContact OD2-CA 3.25Å; D1296-G1516 WeakPolarHBondContact OD2-CA 3.32Å; M1308-G1516 VanDerWaalsContact CE-O 3.24Å; M1308-G1516 WeakPolarHBondContact CE-O 3.44Å; G1516-G1518 PolarHBondContact O-N 3.33Å; G1516-F1578 PolarHBondContact N-O 3.27Å
1517	T	94	Very high	82.1	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.018	21%	0.205	C	C	.	.	S	Bend	trans	-75.9	30.3	178.1	46.9	0	0	0	0	114	D1296 G1297 R1301 I1304 L1305 T1332	D1296-T1517 HydrophobicContact CB-CG2 4.21Å; G1297-T1517 WeakPolarHBondContact O-CB 3.34Å; G1297-T1517 VanDerWaalsContact O-CG2 3.26Å; G1297-T1517 WeakPolarHBondContact O-CG2 3.42Å; G1297-T1517 PolarHBondContact O-OG1 3.27Å; R1301-T1517 HydrophobicContact CB-CG2 4.19Å; R1301-T1517 VanDerWaalsContact CD-O 3.25Å; R1301-T1517 WeakPolarHBondContact CD-O 3.22Å; I1304-T1517 VanDerWaalsContact CD1-O 3.27Å; I1304-T1517 WeakPolarHBondContact CD1-O 3.11Å; L1305-T1517 HydrophobicContact CD1-CG2 3.88Å; L1305-T1517 HydrophobicContact CD2-CG2 3.98Å; L1305-T1517 HydrophobicContact CG-CG2 3.85Å; T1332-T1517 HydrophobicContact CG2-CG2 4.01Å
1518	G	90.1	Very high	81.4	Confident	4 Å²	4	37.8 Å²	37.8	4%	0.041	20%	0.202	C	C	.	.			trans	82.5	149.7	179.2	0	0	0	0	0	114.7	G1516 P1580	G1516-G1518 PolarHBondContact O-N 3.33Å; G1518-P1580 WeakPolarHBondContact CA-O 3.39Å
1519	R	89.6	Confident	80	Confident	79 Å²	79	37.4 Å²	37.4	30%	0.298	20%	0.202	S	C	.	.	B	Isolated β-bridge	trans	-103.3	129.3	-176.1	-52.3	-169.9	-84.3	125.6	2.4	110.5	E1557 S1579 P1580 Q1581 M1582	R1519-E1557 VanDerWaalsContact CD-CD 3.41Å; R1519-E1557 HydrophobicContact CG-CG 3.71Å; R1519-S1579 WeakPolarHBondContact CG-OG 3.34Å; R1519-S1579 PolarHBondContact NE-O 2.57Å; R1519-S1579 PolarHBondContact NH2-O 3.38Å; R1519-P1580 PolarHBondContact N-O 2.71Å; R1519-Q1581 VanDerWaalsContact NH1-OE1 3.08Å; R1519-Q1581 PolarHBondContact O-NE2 2.85Å; R1519-Q1581 VanDerWaalsContact O-NE2 3.07Å; R1519-M1582 WeakPolarHBondContact O-CB 3.32Å; R1519-M1582 PolarHBondContact O-N 3.49Å
1520	I	82.7	Confident	77.7	Confident	32 Å²	32	39.5 Å²	39.5	16%	0.164	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-64.2	143.4	173.7	-57.3	178.7	0	0	0	108.8	M1523 Q1581 D1585	I1520-M1523 HydrophobicContact CG2-CE 3.91Å; I1520-Q1581 VanDerWaalsContact C-NE2 3.32Å; I1520-Q1581 PolarHBondContact O-NE2 3.1Å; I1520-D1585 WeakPolarHBondContact CD1-OD1 3.39Å; I1520-D1585 WeakPolarHBondContact CG1-OD1 3.46Å; I1520-D1585 HydrophobicContact CG2-CB 4.26Å
1521	P	82.2	Confident	75.3	Confident	31 Å²	31	41.7 Å²	41.7	20%	0.201	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-64.2	148.2	173	26.6	-35.8	0	0	0	112.6	M1523	P1521-M1523 PolarHBondContact O-N 3.4Å
1522	D	78.9	Confident	72.7	Confident	88 Å²	88	46.1 Å²	46.1	47%	0.471	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-64.1	120.8	172	-87.5	-24.7	0	0	0	110.3	H673 R676	H673-D1522 CarbonylContact O-C 3.4Å; H673-D1522 WeakPolarHBondContact O-CA 3.49Å; R676-D1522 IonicContact CZ-OD1 2.85Å; R676-D1522 IonicContact CZ-OD2 3.39Å; R676-D1522 IonicContact NH2-OD1 3.17Å; R676-D1522 PolarHBondContact NH2-OD1 3.02Å; R676-D1522 IonicContact NH2-OD2 2.68Å; R676-D1522 PolarHBondContact NH2-OD2 2.94Å
1523	M	71.7	Confident	69.9	Low	79 Å²	79	51.8 Å²	51.8	39%	0.389	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143.9	179.5	-66.3	178.1	-67.2	0	0	111	N672 H673 I1520 P1521	N672-M1523 CarbonylContact C-O 3.57Å; N672-M1523 VanDerWaalsContact CA-O 3.25Å; N672-M1523 WeakPolarHBondContact CA-O 3.39Å; H673-M1523 HydrophobicContact CB-CB 4.47Å; H673-M1523 PolarHBondContact N-O 3.42Å; H673-M1523 PolarHBondContact O-N 3.05Å; I1520-M1523 HydrophobicContact CG2-CE 3.91Å; P1521-M1523 PolarHBondContact O-N 3.4Å
1524	P	67.8	Low	67	Low	117 Å²	117	54 Å²	54	76%	0.76	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.2	144	173	30.1	-34.2	0	0	0	111.1
1525	I	65.2	Low	63.9	Low	31 Å²	31	58.4 Å²	58.4	16%	0.159	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-103.3	132	175.2	-57.6	178.4	0	0	0	109.4	K671 N672 H673 L675 M1548	K671-I1525 PolarHBondContact O-N 3.22Å; N672-I1525 VanDerWaalsContact C-CD1 3.47Å; N672-I1525 WeakPolarHBondContact O-CD1 3.24Å; H673-I1525 HydrophobicContact CB-CD1 3.89Å; H673-I1525 HydrophobicContact CB-CG1 3.83Å; L675-I1525 HydrophobicContact CD2-CD1 3.88Å; I1525-M1548 HydrophobicContact CD1-CE 3.88Å; I1525-M1548 HydrophobicContact CD1-CG 4.2Å; I1525-M1548 HydrophobicContact CD1-SD 4.09Å; I1525-M1548 HydrophobicContact CG2-CE 4.31Å; I1525-M1548 HydrophobicContact CG2-SD 3.89Å
1526	E	59.4	Low	61	Low	150 Å²	150	64 Å²	64	70%	0.701	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-67	135.2	170.5	-65.9	-177.5	150.2	0	0	110.8	L1528	E1526-L1528 PolarHBondContact O-N 3.34Å
1527	S	53.2	Low	58.2	Low	64 Å²	64	65 Å²	65	45%	0.448	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-56.6	124.1	-167.6	55	0	0	0	0	113.9	N1529	S1527-N1529 PolarHBondContact O-N 3.4Å
1528	L	54.6	Low	55.4	Low	23 Å²	23	66.1 Å²	66.1	12%	0.12	39%	0.389	C	S	.	.	S	Bend	trans	-63.9	-7.6	176.4	-68.9	178.8	0	0	0	114.5	I670 E1526 V1530 V1541 L1545 M1548	I670-L1528 HydrophobicContact CD1-CB 4.28Å; I670-L1528 HydrophobicContact CD1-CD1 3.95Å; I670-L1528 HydrophobicContact CD1-CG 4.27Å; E1526-L1528 PolarHBondContact O-N 3.34Å; L1528-V1530 PolarHBondContact O-N 3.28Å; L1528-V1541 HydrophobicContact CD2-CG1 3.85Å; L1528-L1545 HydrophobicContact CD1-CD1 4.34Å; L1528-L1545 HydrophobicContact CD2-CB 4.26Å; L1528-M1548 HydrophobicContact CD1-CE 3.83Å; L1528-M1548 HydrophobicContact CD2-SD 4.35Å; L1528-M1548 HydrophobicContact CG-CE 4.43Å
1529	N	46.2	Very low	52.9	Low	56 Å²	56	68.3 Å²	68.3	30%	0.299	40%	0.402	S	S	.	.			trans	-85.4	92.4	174.1	-73.6	-13.8	0	0	0	110.8	S706 N709 S1527	S706-N1529 PolarHBondContact N-OD1 2.83Å; S706-N1529 VanDerWaalsContact N-OD1 3.15Å; S706-N1529 PolarHBondContact OG-ND2 2.73Å; S706-N1529 VanDerWaalsContact OG-ND2 3.09Å; S706-N1529 PolarHBondContact OG-OD1 3.07Å; N709-N1529 VanDerWaalsContact OD1-CB 3.32Å; N709-N1529 WeakPolarHBondContact OD1-CB 3.29Å; N709-N1529 PolarHBondContact OD1-ND2 2.9Å; S1527-N1529 PolarHBondContact O-N 3.4Å
1530	V	38.6	Very low	50.8	Low	66 Å²	66	66.1 Å²	66.1	40%	0.4	40%	0.404	S	S	.	.			trans	-119.2	129	162.1	-178.4	0	0	0	0	108.4	L1528 I1532 V1541	L1528-V1530 PolarHBondContact O-N 3.28Å; V1530-I1532 PolarHBondContact O-N 3.44Å; V1530-V1541 HydrophobicContact CB-CG2 3.8Å; V1530-V1541 HydrophobicContact CG2-CG2 3.42Å; V1530-V1541 VanDerWaalsContact CG2-CG2 3.42Å
1531	G	36.6	Very low	49.1	Very low	52 Å²	52	65.8 Å²	65.8	54%	0.536	40%	0.403	S	S	.	.			trans	-60.8	131.4	173.3	0	0	0	0	0	110.3	S1533	G1531-S1533 PolarHBondContact O-N 2.71Å; G1531-S1533 PolarHBondContact O-OG 2.67Å
1532	I	37.4	Very low	47.5	Very low	93 Å²	93	65.1 Å²	65.1	48%	0.477	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	17.7	-174.9	-76.8	176.4	0	0	0	113.1	P635 V1530 S1534 M1538	P635-I1532 HydrophobicContact CG-CD1 4.01Å; V1530-I1532 PolarHBondContact O-N 3.44Å; I1532-S1534 PolarHBondContact O-N 3.03Å; I1532-M1538 HydrophobicContact CD1-SD 4.13Å; I1532-M1538 HydrophobicContact CG1-CE 4.43Å; I1532-M1538 HydrophobicContact CG1-CG 4.14Å; I1532-M1538 HydrophobicContact CG1-SD 4.14Å; I1532-M1538 HydrophobicContact CG2-CE 3.91Å; I1532-M1538 HydrophobicContact CG2-SD 4.44Å
1533	S	35.5	Very low	46.4	Very low	120 Å²	120	63.6 Å²	63.6	84%	0.839	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-7.1	173.2	49.8	0	0	0	0	114.7	G1531	G1531-S1533 PolarHBondContact O-N 2.71Å; G1531-S1533 PolarHBondContact O-OG 2.67Å
1534	S	34.3	Very low	45.8	Very low	47 Å²	47	61.7 Å²	61.7	33%	0.329	38%	0.378	S	S	.	.			trans	-133.6	137.6	169	78.4	0	0	0	0	112.6	I1532 I1536 G1537	I1532-S1534 PolarHBondContact O-N 3.03Å; S1534-I1536 VanDerWaalsContact C-N 3.31Å; S1534-I1536 PolarHBondContact O-N 2.91Å; S1534-G1537 PolarHBondContact OG-N 3.49Å
1535	P	33	Very low	45.5	Very low	91 Å²	91	56.8 Å²	56.8	59%	0.591	35%	0.346	S	S	*	.	H	α-helix	trans	-63.8	-34.9	173.3	-23.8	34.6	0	0	0	113.4	M1538	P1535-M1538 WeakPolarHBondContact O-CB 3.39Å; P1535-M1538 PolarHBondContact O-N 3.46Å
1536	I	34.9	Very low	45.3	Very low	117 Å²	117	56 Å²	56	60%	0.6	35%	0.345	S	S	*	.	H	α-helix	trans	-67	-44.9	-174.3	-58.8	175.1	0	0	0	111	M56 S1534 M1538 V1539	M56-I1536 HydrophobicContact SD-CD1 4.21Å; M56-I1536 HydrophobicContact SD-CG1 4.15Å; S1534-I1536 VanDerWaalsContact C-N 3.31Å; S1534-I1536 PolarHBondContact O-N 2.91Å; I1536-M1538 PolarHBondContact O-N 3.14Å; I1536-V1539 PolarHBondContact O-N 3.12Å; I1536-V1539 VanDerWaalsContact O-N 3.09Å
1537	G	37.4	Very low	45.6	Very low	21 Å²	21	53.6 Å²	53.6	22%	0.216	33%	0.33	C	S	.	.	H	α-helix	trans	-60.8	-31	178.1	0	0	0	0	0	113.4	S1534 V1539 G1540 V1541	S1534-G1537 PolarHBondContact OG-N 3.49Å; G1537-V1539 PolarHBondContact O-N 3.24Å; G1537-G1540 PolarHBondContact O-N 2.89Å; G1537-V1541 PolarHBondContact O-N 3.09Å
1538	M	35.1	Very low	46.2	Very low	28 Å²	28	50.9 Å²	50.9	14%	0.138	31%	0.311	C	S	.	.	H	α-helix	trans	-63.3	-39.4	174.3	-111.6	-172.1	-60.9	0	0	112.5	P32 I1532 P1535 I1536 G1540 V1541 L1542	P32-M1538 HydrophobicContact CB-CB 4.18Å; P32-M1538 HydrophobicContact CB-CE 4.45Å; P32-M1538 HydrophobicContact CB-SD 3.85Å; P32-M1538 HydrophobicContact CG-CE 4.08Å; P32-M1538 HydrophobicContact CG-SD 3.85Å; I1532-M1538 HydrophobicContact CD1-SD 4.13Å; I1532-M1538 HydrophobicContact CG1-CE 4.43Å; I1532-M1538 HydrophobicContact CG1-CG 4.14Å; I1532-M1538 HydrophobicContact CG1-SD 4.14Å; I1532-M1538 HydrophobicContact CG2-CE 3.91Å; I1532-M1538 HydrophobicContact CG2-SD 4.44Å; P1535-M1538 WeakPolarHBondContact O-CB 3.39Å; P1535-M1538 PolarHBondContact O-N 3.46Å; I1536-M1538 PolarHBondContact O-N 3.14Å; M1538-G1540 VanDerWaalsContact C-N 3.29Å; M1538-G1540 PolarHBondContact O-N 3Å; M1538-V1541 PolarHBondContact O-N 3.14Å; M1538-L1542 HydrophobicContact CB-CD1 4.03Å; M1538-L1542 HydrophobicContact CG-CD1 3.9Å; M1538-L1542 VanDerWaalsContact O-CB 3.26Å; M1538-L1542 WeakPolarHBondContact O-CB 3.42Å; M1538-L1542 WeakPolarHBondContact O-CD1 3.46Å; M1538-L1542 WeakPolarHBondContact O-CG 3.27Å; M1538-L1542 PolarHBondContact O-N 3.16Å; M1538-L1542 HydrophobicContact SD-CD1 4.23Å
1539	V	37.7	Very low	46.8	Very low	49 Å²	49	50.8 Å²	50.8	30%	0.297	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-39.1	-177.8	-177.4	0	0	0	0	111.3	I1536 G1537 K1543	I1536-V1539 PolarHBondContact O-N 3.12Å; I1536-V1539 VanDerWaalsContact O-N 3.09Å; G1537-V1539 PolarHBondContact O-N 3.24Å; V1539-K1543 WeakPolarHBondContact O-CB 3.42Å; V1539-K1543 PolarHBondContact O-N 3.38Å
1540	G	44.2	Very low	47.8	Very low	34 Å²	34	50.8 Å²	50.8	35%	0.351	31%	0.309	S	S	.	.	H	α-helix	trans	-65.2	-53.6	175.6	0	0	0	0	0	112.9	G1537 M1538 L1542 K1543 N1544	G1537-G1540 PolarHBondContact O-N 2.89Å; M1538-G1540 VanDerWaalsContact C-N 3.29Å; M1538-G1540 PolarHBondContact O-N 3Å; G1540-L1542 VanDerWaalsContact C-N 3.25Å; G1540-L1542 PolarHBondContact O-N 2.64Å; G1540-K1543 PolarHBondContact O-N 3.5Å; G1540-N1544 PolarHBondContact O-N 3.44Å
1541	V	47.2	Very low	49.4	Very low	24 Å²	24	49.6 Å²	49.6	15%	0.145	30%	0.301	C	S	.	.	H	α-helix	trans	-54.3	-43.3	177.3	170.9	0	0	0	0	111.6	L1528 V1530 G1537 M1538 N1544 L1545	L1528-V1541 HydrophobicContact CD2-CG1 3.85Å; V1530-V1541 HydrophobicContact CB-CG2 3.8Å; V1530-V1541 HydrophobicContact CG2-CG2 3.42Å; V1530-V1541 VanDerWaalsContact CG2-CG2 3.42Å; G1537-V1541 PolarHBondContact O-N 3.09Å; M1538-V1541 PolarHBondContact O-N 3.14Å; V1541-N1544 PolarHBondContact O-N 2.87Å; V1541-L1545 VanDerWaalsContact O-CB 3.3Å; V1541-L1545 WeakPolarHBondContact O-CB 3.44Å; V1541-L1545 PolarHBondContact O-N 2.84Å
1542	L	49.7	Very low	51.2	Low	18 Å²	18	48.5 Å²	48.5	9%	0.094	28%	0.282	C	S	.	.	H	α-helix	trans	-83.7	-26.9	-172.8	-59.6	169.2	0	0	0	112.9	P32 L33 M1538 G1540 L1545 G1546	P32-L1542 HydrophobicContact CB-CD1 3.64Å; L33-L1542 HydrophobicContact CB-CB 4.42Å; L33-L1542 HydrophobicContact CB-CD1 4.07Å; L33-L1542 HydrophobicContact CB-CD2 4.27Å; L33-L1542 HydrophobicContact CB-CG 4.48Å; L33-L1542 HydrophobicContact CD1-CD2 4.01Å; L33-L1542 HydrophobicContact CG-CB 4.26Å; L33-L1542 HydrophobicContact CG-CD2 3.94Å; L33-L1542 HydrophobicContact CG-CG 4.47Å; M1538-L1542 HydrophobicContact CB-CD1 4.03Å; M1538-L1542 HydrophobicContact CG-CD1 3.9Å; M1538-L1542 VanDerWaalsContact O-CB 3.26Å; M1538-L1542 WeakPolarHBondContact O-CB 3.42Å; M1538-L1542 WeakPolarHBondContact O-CD1 3.46Å; M1538-L1542 WeakPolarHBondContact O-CG 3.27Å; M1538-L1542 PolarHBondContact O-N 3.16Å; M1538-L1542 HydrophobicContact SD-CD1 4.23Å; G1540-L1542 VanDerWaalsContact C-N 3.25Å; G1540-L1542 PolarHBondContact O-N 2.64Å; L1542-L1545 HydrophobicContact CD2-CD2 4.17Å; L1542-G1546 PolarHBondContact O-N 3.48Å
1543	K	55.4	Low	53.1	Low	56 Å²	56	44.9 Å²	44.9	24%	0.243	26%	0.263	C	S	.	.	H	α-helix	trans	-61.6	-50.6	164.3	175.7	-177.4	174.1	-173.6	0	110.5	V1539 G1540 G1546 Y1547	V1539-K1543 WeakPolarHBondContact O-CB 3.42Å; V1539-K1543 PolarHBondContact O-N 3.38Å; G1540-K1543 PolarHBondContact O-N 3.5Å; K1543-G1546 PolarHBondContact O-N 2.91Å; K1543-G1546 VanDerWaalsContact O-N 3.16Å; K1543-Y1547 HydrophobicContact CD-CE2 4.36Å; K1543-Y1547 HydrophobicContact CG-CD2 4.18Å; K1543-Y1547 HydrophobicContact CG-CE2 3.68Å; K1543-Y1547 WeakPolarHBondContact O-CD2 3.5Å; K1543-Y1547 PolarHBondContact O-N 3Å
1544	N	59.3	Low	55.2	Low	38 Å²	38	40.8 Å²	40.8	20%	0.203	23%	0.233	C	C	.	.	H	α-helix	trans	-60.7	-49.3	179.3	-67.8	-5.1	0	0	0	110.7	G1540 V1541 G1546 Y1547 M1548	G1540-N1544 PolarHBondContact O-N 3.44Å; V1541-N1544 PolarHBondContact O-N 2.87Å; N1544-G1546 VanDerWaalsContact C-N 3.25Å; N1544-G1546 PolarHBondContact O-N 3.46Å; N1544-Y1547 PolarHBondContact O-N 2.96Å; N1544-M1548 HydrophobicContact CB-SD 4.36Å; N1544-M1548 WeakPolarHBondContact O-CG 3.37Å; N1544-M1548 PolarHBondContact O-N 3.35Å; N1544-M1548 VanDerWaalsContact O-SD 3.35Å
1545	L	60.4	Low	57.6	Low	14 Å²	14	39.7 Å²	39.7	7%	0.073	23%	0.227	C	C	.	.	H	α-helix	trans	-57.4	-36.3	175.3	-174.9	63	0	0	0	112.5	L1528 V1541 L1542 M1548 I1549	L1528-L1545 HydrophobicContact CD1-CD1 4.34Å; L1528-L1545 HydrophobicContact CD2-CB 4.26Å; V1541-L1545 VanDerWaalsContact O-CB 3.3Å; V1541-L1545 WeakPolarHBondContact O-CB 3.44Å; V1541-L1545 PolarHBondContact O-N 2.84Å; L1542-L1545 HydrophobicContact CD2-CD2 4.17Å; L1545-M1548 PolarHBondContact O-N 3.48Å; L1545-I1549 HydrophobicContact CD1-CD1 4.13Å; L1545-I1549 HydrophobicContact CD1-CG1 4.33Å; L1545-I1549 HydrophobicContact CD2-CD1 4.44Å; L1545-I1549 HydrophobicContact CG-CD1 3.78Å; L1545-I1549 HydrophobicContact CG-CG1 4.41Å; L1545-I1549 VanDerWaalsContact O-CB 3.27Å; L1545-I1549 WeakPolarHBondContact O-CB 3.4Å; L1545-I1549 WeakPolarHBondContact O-CD1 3.42Å; L1545-I1549 WeakPolarHBondContact O-CG1 3.34Å; L1545-I1549 PolarHBondContact O-N 3.11Å
1546	G	61.4	Low	60.2	Low	14 Å²	14	36.2 Å²	36.2	14%	0.144	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-46.1	176.9	0	0	0	0	0	113.9	L1542 K1543 N1544 M1550	L1542-G1546 PolarHBondContact O-N 3.48Å; K1543-G1546 PolarHBondContact O-N 2.91Å; K1543-G1546 VanDerWaalsContact O-N 3.16Å; N1544-G1546 VanDerWaalsContact C-N 3.25Å; N1544-G1546 PolarHBondContact O-N 3.46Å; G1546-M1550 PolarHBondContact O-N 3.12Å
1547	Y	64.5	Low	62.6	Low	100 Å²	100	33.4 Å²	33.4	39%	0.392	19%	0.189	S	C	.	.	H	α-helix	trans	-63.6	-50.7	172.7	-69.7	-72.7	0	0	0	110.9	K1543 N1544 I1549 M1550 D1551	K1543-Y1547 HydrophobicContact CD-CE2 4.36Å; K1543-Y1547 HydrophobicContact CG-CD2 4.18Å; K1543-Y1547 HydrophobicContact CG-CE2 3.68Å; K1543-Y1547 WeakPolarHBondContact O-CD2 3.5Å; K1543-Y1547 PolarHBondContact O-N 3Å; N1544-Y1547 PolarHBondContact O-N 2.96Å; Y1547-I1549 PolarHBondContact O-N 3.27Å; Y1547-M1550 PolarHBondContact O-N 2.87Å; Y1547-D1551 PolarHBondContact O-N 3.34Å; Y1547-D1551 VanDerWaalsContact O-OD2 3.04Å
1548	M	66.2	Low	64.9	Low	8 Å²	8	34.3 Å²	34.3	4%	0.039	20%	0.198	C	C	.	.	H	α-helix	trans	-53.1	-40.9	178.8	-66.3	159.4	67.9	0	0	112.5	I670 L675 I1525 L1528 N1544 L1545 Q1552	I670-M1548 HydrophobicContact CB-CE 4.46Å; I670-M1548 HydrophobicContact CG2-CE 4.26Å; L675-M1548 HydrophobicContact CD1-CB 4.05Å; L675-M1548 HydrophobicContact CD1-CE 3.93Å; L675-M1548 HydrophobicContact CD2-CE 3.98Å; L675-M1548 HydrophobicContact CG-CE 4.32Å; I1525-M1548 HydrophobicContact CD1-CE 3.88Å; I1525-M1548 HydrophobicContact CD1-CG 4.2Å; I1525-M1548 HydrophobicContact CD1-SD 4.09Å; I1525-M1548 HydrophobicContact CG2-CE 4.31Å; I1525-M1548 HydrophobicContact CG2-SD 3.89Å; L1528-M1548 HydrophobicContact CD1-CE 3.83Å; L1528-M1548 HydrophobicContact CD2-SD 4.35Å; L1528-M1548 HydrophobicContact CG-CE 4.43Å; N1544-M1548 HydrophobicContact CB-SD 4.36Å; N1544-M1548 WeakPolarHBondContact O-CG 3.37Å; N1544-M1548 PolarHBondContact O-N 3.35Å; N1544-M1548 VanDerWaalsContact O-SD 3.35Å; L1545-M1548 PolarHBondContact O-N 3.48Å; M1548-Q1552 VanDerWaalsContact O-CG 3.3Å; M1548-Q1552 WeakPolarHBondContact O-CG 3.25Å; M1548-Q1552 PolarHBondContact O-N 2.92Å
1549	I	67.3	Low	67.3	Low	20 Å²	20	33.9 Å²	33.9	10%	0.103	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-47.3	175.4	-81.6	167.9	0	0	0	111.6	V787 M788 L791 L1545 Y1547 Q1552 V1553	V787-I1549 HydrophobicContact CG1-CG2 3.34Å; M788-I1549 HydrophobicContact SD-CD1 3.71Å; M788-I1549 HydrophobicContact SD-CG1 4.36Å; M788-I1549 HydrophobicContact SD-CG2 4.44Å; L791-I1549 HydrophobicContact CD1-CB 4.09Å; L791-I1549 HydrophobicContact CD1-CG1 3.87Å; L791-I1549 HydrophobicContact CD1-CG2 3.82Å; L1545-I1549 HydrophobicContact CD1-CD1 4.13Å; L1545-I1549 HydrophobicContact CD1-CG1 4.33Å; L1545-I1549 HydrophobicContact CD2-CD1 4.44Å; L1545-I1549 HydrophobicContact CG-CD1 3.78Å; L1545-I1549 HydrophobicContact CG-CG1 4.41Å; L1545-I1549 VanDerWaalsContact O-CB 3.27Å; L1545-I1549 WeakPolarHBondContact O-CB 3.4Å; L1545-I1549 WeakPolarHBondContact O-CD1 3.42Å; L1545-I1549 WeakPolarHBondContact O-CG1 3.34Å; L1545-I1549 PolarHBondContact O-N 3.11Å; Y1547-I1549 PolarHBondContact O-N 3.27Å; I1549-Q1552 PolarHBondContact O-N 3.3Å; I1549-V1553 PolarHBondContact O-N 3.47Å
1550	M	68.7	Low	69.8	Low	56 Å²	56	32.9 Å²	32.9	28%	0.276	19%	0.189	S	C	.	.	H	α-helix	trans	-64.4	-47.9	-178.2	-174.6	61	-174.6	0	0	111.4	Y783 L1462 G1546 Y1547 Q1552 V1553 T1554	Y783-M1550 VanDerWaalsContact OH-CE 3.27Å; Y783-M1550 WeakPolarHBondContact OH-CE 3.32Å; Y783-M1550 PolarHBondContact OH-SD 2.98Å; Y783-M1550 VanDerWaalsContact OH-SD 3.37Å; L1462-M1550 HydrophobicContact CD2-CE 4.46Å; G1546-M1550 PolarHBondContact O-N 3.12Å; Y1547-M1550 PolarHBondContact O-N 2.87Å; M1550-Q1552 PolarHBondContact O-N 3.1Å; M1550-V1553 PolarHBondContact O-N 3.45Å; M1550-T1554 HydrophobicContact CE-CG2 3.65Å; M1550-T1554 PolarHBondContact O-N 3.39Å; M1550-T1554 PolarHBondContact O-OG1 2.99Å; M1550-T1554 HydrophobicContact SD-CG2 4.41Å
1551	D	71.7	Confident	72	Confident	42 Å²	42	31.7 Å²	31.7	23%	0.225	18%	0.176	C	C	.	.	H	α-helix	trans	-66.2	-22.9	-177.6	-63.4	-47.9	0	0	0	113.2	H673 Y1547 A1555	H673-D1551 IonicContact CD2-OD2 3.45Å; H673-D1551 IonicContact CE1-OD2 3.36Å; H673-D1551 IonicContact NE2-OD2 3.48Å; H673-D1551 PolarHBondContact NE2-OD2 3.04Å; Y1547-D1551 PolarHBondContact O-N 3.34Å; Y1547-D1551 VanDerWaalsContact O-OD2 3.04Å; D1551-A1555 WeakPolarHBondContact O-CA 3.23Å; D1551-A1555 PolarHBondContact O-N 3.23Å
1552	Q	74.6	Confident	74.1	Confident	29 Å²	29	32.9 Å²	32.9	14%	0.136	18%	0.182	C	C	.	.	H	α-helix	trans	-81.7	-33.4	171.1	-67.4	-49.9	-84.9	0	0	113.3	L675 M717 L791 M1548 I1549 M1550 A1555	L675-Q1552 HydrophobicContact CB-CG 4.12Å; L675-Q1552 HydrophobicContact CD1-CG 4.03Å; M717-Q1552 PolarHBondContact SD-OE1 3.07Å; L791-Q1552 HydrophobicContact CD2-CB 3.71Å; M1548-Q1552 VanDerWaalsContact O-CG 3.3Å; M1548-Q1552 WeakPolarHBondContact O-CG 3.25Å; M1548-Q1552 PolarHBondContact O-N 2.92Å; I1549-Q1552 PolarHBondContact O-N 3.3Å; M1550-Q1552 PolarHBondContact O-N 3.1Å; Q1552-A1555 WeakPolarHBondContact O-CB 3.5Å; Q1552-A1555 PolarHBondContact O-N 3.06Å
1553	V	75.5	Confident	76.2	Confident	16 Å²	16	33.6 Å²	33.6	10%	0.097	18%	0.183	C	C	.	.	H	α-helix	trans	-66.8	-43.9	172.3	166.6	0	0	0	0	110.9	V787 L791 L1462 I1549 M1550 A1555	V787-V1553 HydrophobicContact CG1-CG2 3.75Å; L791-V1553 HydrophobicContact CD1-CG2 4.33Å; L791-V1553 HydrophobicContact CD2-CB 4.4Å; L791-V1553 HydrophobicContact CD2-CG2 3.4Å; L791-V1553 VanDerWaalsContact CD2-CG2 3.4Å; L791-V1553 HydrophobicContact CG-CG2 3.51Å; L1462-V1553 HydrophobicContact CB-CG1 4.11Å; L1462-V1553 HydrophobicContact CD2-CG1 3.76Å; L1462-V1553 WeakPolarHBondContact O-CG1 3.41Å; I1549-V1553 PolarHBondContact O-N 3.47Å; M1550-V1553 PolarHBondContact O-N 3.45Å; V1553-A1555 VanDerWaalsContact C-N 3.28Å; V1553-A1555 PolarHBondContact O-N 3.04Å
1554	T	80.5	Confident	78	Confident	34 Å²	34	30.9 Å²	30.9	21%	0.209	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	22.5	178.2	62.4	0	0	0	0	113.5	G1461 L1462 N1465 M1550 T1556	G1461-T1554 WeakPolarHBondContact O-CA 3.3Å; L1462-T1554 HydrophobicContact CD2-CG2 4.42Å; N1465-T1554 PolarHBondContact ND2-O 2.84Å; M1550-T1554 HydrophobicContact CE-CG2 3.65Å; M1550-T1554 PolarHBondContact O-N 3.39Å; M1550-T1554 PolarHBondContact O-OG1 2.99Å; M1550-T1554 HydrophobicContact SD-CG2 4.41Å; T1554-T1556 PolarHBondContact O-N 3.2Å
1555	A	84.4	Confident	79.6	Confident	24 Å²	24	34.1 Å²	34.1	20%	0.198	18%	0.184	C	C	.	.			trans	-64.2	124.4	-177.5	0	0	0	0	0	111.9	D1551 Q1552 V1553	D1551-A1555 WeakPolarHBondContact O-CA 3.23Å; D1551-A1555 PolarHBondContact O-N 3.23Å; Q1552-A1555 WeakPolarHBondContact O-CB 3.5Å; Q1552-A1555 PolarHBondContact O-N 3.06Å; V1553-A1555 VanDerWaalsContact C-N 3.28Å; V1553-A1555 PolarHBondContact O-N 3.04Å
1556	T	88	Confident	81.1	Confident	18 Å²	18	33.6 Å²	33.6	11%	0.11	18%	0.181	C	C	.	.			trans	-98.7	-32.2	171.1	45.8	0	0	0	0	112.6	D1296 N1465 N1466 T1554 R1577	D1296-T1556 HydrophobicContact CB-CG2 3.89Å; D1296-T1556 WeakPolarHBondContact OD2-CB 3.33Å; D1296-T1556 VanDerWaalsContact OD2-CG2 3.23Å; D1296-T1556 WeakPolarHBondContact OD2-CG2 3.42Å; N1465-T1556 HydrophobicContact CB-CG2 4.09Å; N1465-T1556 WeakPolarHBondContact ND2-CG2 3.39Å; N1466-T1556 PolarHBondContact ND2-O 3.32Å; T1554-T1556 PolarHBondContact O-N 3.2Å; T1556-R1577 PolarHBondContact O-NH2 2.84Å
1557	E	86.1	Confident	82.6	Confident	59 Å²	59	33 Å²	33	28%	0.276	18%	0.175	S	C	.	.	S	Bend	trans	-97.7	169	-178.6	-68.9	-61.1	152.8	0	0	112.9	R1519 R1559 P1560 R1577 S1579	R1519-E1557 VanDerWaalsContact CD-CD 3.41Å; R1519-E1557 HydrophobicContact CG-CG 3.71Å; E1557-R1559 PolarHBondContact O-N 3.44Å; E1557-P1560 WeakPolarHBondContact O-CD 3.1Å; E1557-R1577 IonicContact OE1-CZ 2.76Å; E1557-R1577 IonicContact OE1-NE 3.97Å; E1557-R1577 PolarHBondContact OE1-NE 3.32Å; E1557-R1577 IonicContact OE1-NH2 2.73Å; E1557-R1577 PolarHBondContact OE1-NH2 3.31Å; E1557-S1579 WeakPolarHBondContact OE1-CB 3.38Å; E1557-S1579 PolarHBondContact OE1-OG 2.81Å
1558	G	84.9	Confident	83.8	Confident	39 Å²	39	28.2 Å²	28.2	40%	0.402	16%	0.156	S	C	.	.	S	Bend	trans	73.5	-120.8	179.8	0	0	0	0	0	110.8	A1561 D1562	G1558-A1561 PolarHBondContact O-N 3.27Å; G1558-D1562 WeakPolarHBondContact O-CB 3.39Å; G1558-D1562 PolarHBondContact O-N 3.48Å
1559	R	86.4	Confident	84.9	Confident	19 Å²	19	30.9 Å²	30.9	7%	0.072	17%	0.171	C	C	.	.	H	α-helix	trans	-62.9	-36.5	-166.6	-68.3	-58.3	-178.9	138.5	-8.1	116.3	L677 I679 M717 D724 E1557 R1563	L677-R1559 HydrophobicContact CB-CG 4.12Å; L677-R1559 HydrophobicContact CD2-CG 4.09Å; L677-R1559 PolarHBondContact O-NH2 3.31Å; I679-R1559 VanDerWaalsContact CD1-NH2 3.31Å; M717-R1559 HydrophobicContact CE-CG 4.3Å; D724-R1559 WeakPolarHBondContact OD1-CD 3.48Å; D724-R1559 IonicContact OD1-CZ 3.56Å; D724-R1559 IonicContact OD1-NE 3.29Å; D724-R1559 IonicContact OD1-NH1 3.4Å; D724-R1559 PolarHBondContact OD1-NH1 3.42Å; E1557-R1559 PolarHBondContact O-N 3.44Å; R1559-R1563 VanDerWaalsContact O-CB 3.3Å; R1559-R1563 WeakPolarHBondContact O-CB 3.5Å; R1559-R1563 VanDerWaalsContact O-CD 3.24Å; R1559-R1563 WeakPolarHBondContact O-CD 3.45Å; R1559-R1563 WeakPolarHBondContact O-CG 3.36Å; R1559-R1563 PolarHBondContact O-N 2.98Å
1560	P	88.8	Confident	85.7	Confident	28 Å²	28	33.4 Å²	33.4	18%	0.182	18%	0.182	C	C	.	.	H	α-helix	trans	-59.7	-47.2	171.9	-25.5	36.5	0	0	0	112.7	N1466 V1469 E1557 A1564	N1466-P1560 HydrophobicContact CB-CB 4.03Å; V1469-P1560 WeakPolarHBondContact CG2-O 3.42Å; E1557-P1560 WeakPolarHBondContact O-CD 3.1Å; P1560-A1564 WeakPolarHBondContact O-CB 3.3Å; P1560-A1564 PolarHBondContact O-N 3.47Å; P1560-A1564 VanDerWaalsContact O-N 3.08Å
1561	A	91.1	Very high	86.4	Confident	10 Å²	10	33.1 Å²	33.1	8%	0.083	18%	0.18	C	C	.	.	H	α-helix	trans	-70	-39.9	178.8	0	0	0	0	0	112.9	G1558 A1564 K1565	G1558-A1561 PolarHBondContact O-N 3.27Å; A1561-A1564 PolarHBondContact O-N 3.04Å; A1561-K1565 WeakPolarHBondContact O-CB 3.4Å; A1561-K1565 PolarHBondContact O-N 2.95Å
1562	D	91.1	Very high	87	Confident	49 Å²	49	34.2 Å²	34.2	26%	0.262	20%	0.202	S	C	.	.	H	α-helix	trans	-59.3	-47.1	174.6	-87	-16.1	0	0	0	111.9	T727 R731 G1558 K1565 A1566	T727-D1562 HydrophobicContact CG2-CB 4.38Å; R731-D1562 IonicContact CZ-OD2 3.48Å; R731-D1562 IonicContact NH1-OD2 2.82Å; R731-D1562 IonicContact NH2-OD1 3.75Å; R731-D1562 PolarHBondContact NH2-OD1 2.82Å; R731-D1562 IonicContact NH2-OD2 3.52Å; R731-D1562 PolarHBondContact NH2-OD2 2.96Å; G1558-D1562 WeakPolarHBondContact O-CB 3.39Å; G1558-D1562 PolarHBondContact O-N 3.48Å; D1562-K1565 PolarHBondContact O-N 2.89Å; D1562-A1566 WeakPolarHBondContact O-CB 3.47Å; D1562-A1566 PolarHBondContact O-N 3Å
1563	R	93.1	Very high	87.6	Confident	32 Å²	32	33.3 Å²	33.3	12%	0.121	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-45.5	-179.9	-70.4	162.7	-174.5	165.5	1.5	110.6	M717 L723 D724 T727 W805 V1469 R1559 A1566 W1567	M717-R1563 PolarHBondContact O-NH2 2.85Å; L723-R1563 HydrophobicContact CB-CG 4.3Å; D724-R1563 IonicContact OD1-CZ 2.65Å; D724-R1563 IonicContact OD1-NE 2.73Å; D724-R1563 PolarHBondContact OD1-NE 2.94Å; D724-R1563 IonicContact OD1-NH2 2.7Å; D724-R1563 PolarHBondContact OD1-NH2 3.43Å; D724-R1563 IonicContact OD2-CZ 2.84Å; D724-R1563 IonicContact OD2-NE 3.27Å; D724-R1563 IonicContact OD2-NH2 3.03Å; D724-R1563 PolarHBondContact OD2-NH2 3.37Å; T727-R1563 WeakPolarHBondContact OG1-CG 3.4Å; W805-R1563 HydrophobicContact CZ3-CB 4.43Å; V1469-R1563 HydrophobicContact CG2-CB 4.2Å; R1559-R1563 VanDerWaalsContact O-CB 3.3Å; R1559-R1563 WeakPolarHBondContact O-CB 3.5Å; R1559-R1563 VanDerWaalsContact O-CD 3.24Å; R1559-R1563 WeakPolarHBondContact O-CD 3.45Å; R1559-R1563 WeakPolarHBondContact O-CG 3.36Å; R1559-R1563 PolarHBondContact O-N 2.98Å; R1563-A1566 PolarHBondContact O-N 3.2Å; R1563-W1567 WeakPolarHBondContact O-CB 3.32Å; R1563-W1567 PolarHBondContact O-N 3.26Å
1564	A	93.1	Very high	88.3	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-45.9	175.7	0	0	0	0	0	112	V1469 P1560 A1561 A1566 W1567 C1568 F1575	V1469-A1564 HydrophobicContact CG2-CB 3.91Å; P1560-A1564 WeakPolarHBondContact O-CB 3.3Å; P1560-A1564 PolarHBondContact O-N 3.47Å; P1560-A1564 VanDerWaalsContact O-N 3.08Å; A1561-A1564 PolarHBondContact O-N 3.04Å; A1564-A1566 PolarHBondContact O-N 3Å; A1564-W1567 PolarHBondContact O-N 3.21Å; A1564-C1568 WeakPolarHBondContact O-CB 3.46Å; A1564-C1568 PolarHBondContact O-N 2.95Å; A1564-C1568 PolarHBondContact O-SG 2.79Å; A1564-C1568 VanDerWaalsContact O-SG 3.41Å; A1564-F1575 HydrophobicContact CB-CD2 4.46Å; A1564-F1575 HydrophobicContact CB-CE2 3.69Å; A1564-F1575 HydrophobicContact CB-CZ 4.13Å
1565	K	93.6	Very high	88.8	Confident	106 Å²	106	34.8 Å²	34.8	46%	0.461	21%	0.206	S	C	.	.	H	α-helix	trans	-60.5	-45.6	176.5	-177.5	169.3	178.8	171.8	0	112.3	A1561 D1562 C1568 N1569 F1575	A1561-K1565 WeakPolarHBondContact O-CB 3.4Å; A1561-K1565 PolarHBondContact O-N 2.95Å; D1562-K1565 PolarHBondContact O-N 2.89Å; K1565-C1568 PolarHBondContact O-N 3.23Å; K1565-N1569 WeakPolarHBondContact O-CB 3.38Å; K1565-N1569 PolarHBondContact O-N 3.06Å; K1565-N1569 PolarHBondContact O-OD1 3.09Å; K1565-F1575 HydrophobicContact CB-CD1 3.57Å; K1565-F1575 HydrophobicContact CB-CE1 3.72Å; K1565-F1575 HydrophobicContact CB-CG 4.11Å; K1565-F1575 HydrophobicContact CB-CZ 4.37Å; K1565-F1575 HydrophobicContact CD-CD1 4.11Å; K1565-F1575 HydrophobicContact CG-CD1 3.75Å; K1565-F1575 HydrophobicContact CG-CE1 4.3Å; K1565-F1575 HydrophobicContact CG-CG 4.32Å
1566	A	92.5	Very high	89.3	Confident	3 Å²	3	35.2 Å²	35.2	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-40.7	179.8	0	0	0	0	0	112.4	T727 H730 W805 D1562 R1563 A1564 N1569 E1570	T727-A1566 HydrophobicContact CG2-CB 4.02Å; H730-A1566 HydrophobicContact CB-CB 4.15Å; H730-A1566 VanDerWaalsContact CD2-CB 3.47Å; H730-A1566 WeakPolarHBondContact CD2-CB 3.37Å; W805-A1566 HydrophobicContact CH2-CB 3.78Å; W805-A1566 HydrophobicContact CZ2-CB 3.96Å; D1562-A1566 WeakPolarHBondContact O-CB 3.47Å; D1562-A1566 PolarHBondContact O-N 3Å; R1563-A1566 PolarHBondContact O-N 3.2Å; A1564-A1566 PolarHBondContact O-N 3Å; A1566-N1569 PolarHBondContact O-N 3.38Å; A1566-E1570 WeakPolarHBondContact O-CG 3.34Å; A1566-E1570 PolarHBondContact O-N 2.72Å
1567	W	93.2	Very high	89.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.6	-48.5	175.9	-170.7	-11.6	0	0	0	111.4	W805 D808 V1469 L1472 R1563 A1564 N1569 E1570 M1571	W805-W1567 HydrophobicContact CB-CD2 3.75Å; W805-W1567 HydrophobicContact CB-CE3 3.96Å; W805-W1567 HydrophobicContact CB-CG 4.34Å; W805-W1567 HydrophobicContact CB-CH2 4.09Å; W805-W1567 HydrophobicContact CB-CZ2 3.88Å; W805-W1567 HydrophobicContact CB-CZ3 4.13Å; W805-W1567 AromaticContact CD1-CD1 3.33Å; W805-W1567 AromaticContact CD1-CD2 3.86Å; W805-W1567 AromaticContact CD1-CE2 3.96Å; W805-W1567 AromaticContact CD1-CG 3.51Å; W805-W1567 AromaticContact CD1-NE1 3.64Å; W805-W1567 HydrophobicContact CD2-CB 3.88Å; W805-W1567 AromaticContact CD2-CD2 3.95Å; W805-W1567 HydrophobicContact CD2-CD2 3.95Å; W805-W1567 HydrophobicContact CD2-CE3 4.2Å; W805-W1567 AromaticContact CD2-CG 3.82Å; W805-W1567 HydrophobicContact CD2-CG 3.82Å; W805-W1567 AromaticContact CE2-CG 3.84Å; W805-W1567 HydrophobicContact CE3-CB 4.39Å; W805-W1567 HydrophobicContact CE3-CD2 4.5Å; W805-W1567 HydrophobicContact CE3-CE3 4.3Å; W805-W1567 HydrophobicContact CG-CB 4.26Å; W805-W1567 AromaticContact CG-CD1 3.88Å; W805-W1567 AromaticContact CG-CD2 3.59Å; W805-W1567 HydrophobicContact CG-CD2 3.59Å; W805-W1567 AromaticContact CG-CE2 3.85Å; W805-W1567 HydrophobicContact CG-CE3 4.07Å; W805-W1567 AromaticContact CG-CG 3.66Å; W805-W1567 HydrophobicContact CG-CG 3.66Å; W805-W1567 HydrophobicContact CH2-CB 4.39Å; W805-W1567 HydrophobicContact CZ2-CB 3.89Å; W805-W1567 AromaticContact NE1-CD1 3.63Å; W805-W1567 AromaticContact NE1-CG 3.64Å; D808-W1567 VanDerWaalsContact OD2-CZ2 3.31Å; D808-W1567 WeakPolarHBondContact OD2-CZ2 3.08Å; D808-W1567 PolarHBondContact OD2-NE1 3.19Å; V1469-W1567 HydrophobicContact CG1-CE3 4.03Å; V1469-W1567 HydrophobicContact CG1-CZ3 3.72Å; V1469-W1567 WeakPolarHBondContact O-CZ3 3.41Å; L1472-W1567 HydrophobicContact CB-CD2 3.98Å; L1472-W1567 HydrophobicContact CB-CE3 3.91Å; L1472-W1567 HydrophobicContact CB-CH2 3.62Å; L1472-W1567 HydrophobicContact CB-CZ2 3.68Å; L1472-W1567 HydrophobicContact CB-CZ3 3.74Å; L1472-W1567 HydrophobicContact CD1-CB 4.04Å; L1472-W1567 HydrophobicContact CD1-CD2 3.66Å; L1472-W1567 HydrophobicContact CD1-CE3 3.83Å; L1472-W1567 HydrophobicContact CD1-CG 3.77Å; L1472-W1567 HydrophobicContact CD1-CZ3 4.49Å; L1472-W1567 HydrophobicContact CG-CD2 4.46Å; R1563-W1567 WeakPolarHBondContact O-CB 3.32Å; R1563-W1567 PolarHBondContact O-N 3.26Å; A1564-W1567 PolarHBondContact O-N 3.21Å; W1567-N1569 PolarHBondContact O-N 3.03Å; W1567-E1570 PolarHBondContact O-N 3.25Å; W1567-M1571 VanDerWaalsContact CD1-CE 3.45Å; W1567-M1571 HydrophobicContact CG-CE 4.27Å; W1567-M1571 WeakPolarHBondContact O-CG 3.48Å; W1567-M1571 PolarHBondContact O-N 3.27Å
1568	C	90.1	Very high	90.1	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.8	-47.8	174.2	-72.7	0	0	0	0	112	A1564 K1565 E1570 M1571 G1572 V1573 F1575	A1564-C1568 WeakPolarHBondContact O-CB 3.46Å; A1564-C1568 PolarHBondContact O-N 2.95Å; A1564-C1568 PolarHBondContact O-SG 2.79Å; A1564-C1568 VanDerWaalsContact O-SG 3.41Å; K1565-C1568 PolarHBondContact O-N 3.23Å; C1568-E1570 PolarHBondContact O-N 3.2Å; C1568-M1571 CarbonylContact O-C 3.47Å; C1568-M1571 PolarHBondContact O-N 2.98Å; C1568-M1571 VanDerWaalsContact O-N 3.14Å; C1568-G1572 PolarHBondContact O-N 3.15Å; C1568-V1573 CarbonylContact C-O 3.59Å; C1568-V1573 HydrophobicContact CB-CB 4.07Å; C1568-V1573 HydrophobicContact CB-CG1 4.32Å; C1568-V1573 WeakPolarHBondContact CB-O 3.35Å; C1568-V1573 WeakPolarHBondContact O-CB 3.44Å; C1568-V1573 PolarHBondContact O-N 3.11Å; C1568-F1575 HydrophobicContact CB-CB 3.74Å; C1568-F1575 HydrophobicContact CB-CD2 4.41Å; C1568-F1575 HydrophobicContact CB-CG 4.45Å
1569	N	87.6	Confident	90.5	Very high	65 Å²	65	31.3 Å²	31.3	35%	0.348	17%	0.173	S	C	.	.	H	α-helix	trans	-59	-45.5	178.7	-75.8	-0.8	0	0	0	113.1	H730 K1565 A1566 W1567 M1571 G1572	H730-N1569 WeakPolarHBondContact CE1-CB 3.5Å; H730-N1569 WeakPolarHBondContact NE2-CB 3.1Å; H730-N1569 PolarHBondContact NE2-ND2 3.24Å; K1565-N1569 WeakPolarHBondContact O-CB 3.38Å; K1565-N1569 PolarHBondContact O-N 3.06Å; K1565-N1569 PolarHBondContact O-OD1 3.09Å; A1566-N1569 PolarHBondContact O-N 3.38Å; W1567-N1569 PolarHBondContact O-N 3.03Å; N1569-M1571 PolarHBondContact O-N 2.91Å; N1569-G1572 PolarHBondContact O-N 3.19Å
1570	E	85	Confident	90.9	Very high	73 Å²	73	30.4 Å²	30.4	34%	0.341	17%	0.169	S	C	.	.	H	α-helix	trans	-63.3	-28.2	177.6	-72.3	-74.2	132.8	0	0	112.4	H730 L809 A1566 W1567 C1568 G1572	H730-E1570 WeakPolarHBondContact CA-OE1 3.41Å; H730-E1570 HydrophobicContact CB-CG 4.02Å; H730-E1570 WeakPolarHBondContact CB-OE1 3.2Å; H730-E1570 IonicContact CE1-OE1 2.7Å; H730-E1570 IonicContact CG-OE1 3.74Å; H730-E1570 IonicContact ND1-OE1 3.71Å; H730-E1570 PolarHBondContact ND1-OE1 2.82Å; L809-E1570 HydrophobicContact CD1-CB 4.37Å; L809-E1570 HydrophobicContact CD2-CB 4.08Å; A1566-E1570 WeakPolarHBondContact O-CG 3.34Å; A1566-E1570 PolarHBondContact O-N 2.72Å; W1567-E1570 PolarHBondContact O-N 3.25Å; C1568-E1570 PolarHBondContact O-N 3.2Å; E1570-G1572 VanDerWaalsContact C-N 3.31Å
1571	M	84	Confident	90.9	Very high	49 Å²	49	33.1 Å²	33.1	24%	0.241	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	0.3	172.5	-63.2	-175.1	-60.5	0	0	113.7	D808 L1472 I1509 W1567 C1568 N1569 V1573	D808-M1571 HydrophobicContact CB-SD 4.22Å; L1472-M1571 HydrophobicContact CD1-CE 4.37Å; L1472-M1571 HydrophobicContact CD2-CE 4.03Å; I1509-M1571 HydrophobicContact CD1-CE 4.34Å; W1567-M1571 VanDerWaalsContact CD1-CE 3.45Å; W1567-M1571 HydrophobicContact CG-CE 4.27Å; W1567-M1571 WeakPolarHBondContact O-CG 3.48Å; W1567-M1571 PolarHBondContact O-N 3.27Å; C1568-M1571 CarbonylContact O-C 3.47Å; C1568-M1571 PolarHBondContact O-N 2.98Å; C1568-M1571 VanDerWaalsContact O-N 3.14Å; N1569-M1571 PolarHBondContact O-N 2.91Å; M1571-V1573 HydrophobicContact CB-CG2 3.81Å; M1571-V1573 HydrophobicContact CE-CG2 4.27Å; M1571-V1573 PolarHBondContact O-N 3Å
1572	G	82.5	Confident	91	Very high	66 Å²	66	33.2 Å²	33.2	68%	0.68	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.7	11.3	-172.9	0	0	0	0	0	114.9	C1568 N1569 E1570	C1568-G1572 PolarHBondContact O-N 3.15Å; N1569-G1572 PolarHBondContact O-N 3.19Å; E1570-G1572 VanDerWaalsContact C-N 3.31Å
1573	V	87.3	Confident	90.8	Very high	9 Å²	9	35.7 Å²	35.7	6%	0.055	20%	0.195	C	C	.	.			trans	-86	125.1	-175.5	177.5	0	0	0	0	111	I1509 C1568 M1571 F1575	I1509-V1573 HydrophobicContact CB-CG1 4.43Å; I1509-V1573 HydrophobicContact CB-CG2 3.92Å; I1509-V1573 HydrophobicContact CG2-CG1 3.63Å; I1509-V1573 HydrophobicContact CG2-CG2 4.04Å; C1568-V1573 CarbonylContact C-O 3.59Å; C1568-V1573 HydrophobicContact CB-CB 4.07Å; C1568-V1573 HydrophobicContact CB-CG1 4.32Å; C1568-V1573 WeakPolarHBondContact CB-O 3.35Å; C1568-V1573 WeakPolarHBondContact O-CB 3.44Å; C1568-V1573 PolarHBondContact O-N 3.11Å; M1571-V1573 HydrophobicContact CB-CG2 3.81Å; M1571-V1573 HydrophobicContact CE-CG2 4.27Å; M1571-V1573 PolarHBondContact O-N 3Å; V1573-F1575 PolarHBondContact O-N 3.16Å
1574	P	90.5	Very high	90.5	Very high	53 Å²	53	37.8 Å²	37.8	34%	0.344	21%	0.205	S	C	.	.			trans	-58.8	123.1	169.4	-25.7	35.5	0	0	0	112.8	G1510 L1512 F1576 L1620	G1510-P1574 WeakPolarHBondContact O-CD 3.46Å; L1512-P1574 PolarHBondContact N-O 3.12Å; P1574-F1576 HydrophobicContact CB-CD2 4.5Å; P1574-F1576 HydrophobicContact CB-CE2 3.89Å; P1574-L1620 HydrophobicContact CB-CD2 3.82Å; P1574-L1620 HydrophobicContact CG-CD2 3.95Å
1575	F	92	Very high	90	Very high	28 Å²	28	40.9 Å²	40.9	12%	0.123	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	121.2	176.6	175.4	-90.4	0	0	0	111.3	L1512 N1514 A1564 K1565 C1568 V1573 R1577	L1512-F1575 HydrophobicContact CB-CD2 4.49Å; L1512-F1575 HydrophobicContact CD2-CD2 3.88Å; L1512-F1575 HydrophobicContact CD2-CE2 3.86Å; N1514-F1575 HydrophobicContact CB-CE2 4.22Å; N1514-F1575 HydrophobicContact CB-CZ 4.3Å; A1564-F1575 HydrophobicContact CB-CD2 4.46Å; A1564-F1575 HydrophobicContact CB-CE2 3.69Å; A1564-F1575 HydrophobicContact CB-CZ 4.13Å; K1565-F1575 HydrophobicContact CB-CD1 3.57Å; K1565-F1575 HydrophobicContact CB-CE1 3.72Å; K1565-F1575 HydrophobicContact CB-CG 4.11Å; K1565-F1575 HydrophobicContact CB-CZ 4.37Å; K1565-F1575 HydrophobicContact CD-CD1 4.11Å; K1565-F1575 HydrophobicContact CG-CD1 3.75Å; K1565-F1575 HydrophobicContact CG-CE1 4.3Å; K1565-F1575 HydrophobicContact CG-CG 4.32Å; C1568-F1575 HydrophobicContact CB-CB 3.74Å; C1568-F1575 HydrophobicContact CB-CD2 4.41Å; C1568-F1575 HydrophobicContact CB-CG 4.45Å; V1573-F1575 PolarHBondContact O-N 3.16Å; F1575-R1577 HydrophobicContact CE1-CB 3.63Å; F1575-R1577 HydrophobicContact CZ-CB 4.01Å
1576	F	94.7	Very high	89.7	Confident	33 Å²	33	36.2 Å²	36.2	15%	0.145	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.4	176.8	-67.9	-98.2	0	0	0	110.4	L1512 L1513 N1514 P1574 F1578 L1617 L1620	L1512-F1576 PolarHBondContact O-N 3.32Å; L1513-F1576 HydrophobicContact CD1-CB 3.86Å; N1514-F1576 PolarHBondContact N-O 2.89Å; P1574-F1576 HydrophobicContact CB-CD2 4.5Å; P1574-F1576 HydrophobicContact CB-CE2 3.89Å; F1576-F1578 HydrophobicContact CB-CE2 4.01Å; F1576-F1578 HydrophobicContact CD1-CE2 4.19Å; F1576-F1578 HydrophobicContact CD1-CZ 4.46Å; F1576-L1617 HydrophobicContact CB-CD1 4.34Å; F1576-L1617 HydrophobicContact CD1-CB 4.05Å; F1576-L1617 HydrophobicContact CD1-CD1 4.34Å; F1576-L1617 HydrophobicContact CD2-CD1 3.8Å; F1576-L1617 HydrophobicContact CE1-CB 3.9Å; F1576-L1617 HydrophobicContact CE2-CD1 4.12Å; F1576-L1617 HydrophobicContact CG-CB 4.48Å; F1576-L1617 HydrophobicContact CG-CD1 3.92Å; F1576-L1617 HydrophobicContact CZ-CB 4.21Å; F1576-L1620 HydrophobicContact CE2-CD2 3.9Å; F1576-L1620 HydrophobicContact CZ-CD2 4.47Å
1577	R	94.5	Very high	89.4	Confident	32 Å²	32	40 Å²	40	12%	0.121	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	109.3	174.3	173.8	63.7	174.4	-166.4	2.2	110.2	D1296 N1466 N1514 T1556 E1557 F1575	D1296-R1577 IonicContact OD1-NH1 3.23Å; D1296-R1577 PolarHBondContact OD1-NH1 3.28Å; D1296-R1577 IonicContact OD2-CZ 2.62Å; D1296-R1577 IonicContact OD2-NH1 2.77Å; D1296-R1577 PolarHBondContact OD2-NH1 3.33Å; D1296-R1577 IonicContact OD2-NH2 2.66Å; D1296-R1577 PolarHBondContact OD2-NH2 2.89Å; N1466-R1577 PolarHBondContact ND2-NH1 3.07Å; N1514-R1577 VanDerWaalsContact CG-NH1 3.34Å; N1514-R1577 PolarHBondContact ND2-NH1 3.13Å; N1514-R1577 WeakPolarHBondContact O-CA 3.5Å; N1514-R1577 PolarHBondContact OD1-NH1 3.39Å; T1556-R1577 PolarHBondContact O-NH2 2.84Å; E1557-R1577 IonicContact OE1-CZ 2.76Å; E1557-R1577 IonicContact OE1-NE 3.97Å; E1557-R1577 PolarHBondContact OE1-NE 3.32Å; E1557-R1577 IonicContact OE1-NH2 2.73Å; E1557-R1577 PolarHBondContact OE1-NH2 3.31Å; F1575-R1577 HydrophobicContact CE1-CB 3.63Å; F1575-R1577 HydrophobicContact CZ-CB 4.01Å
1578	F	95.6	Very high	89	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	128.8	171.1	-65.2	-89.7	0	0	0	109.6	M1308 L1513 N1514 L1515 G1516 F1576 Y1606 M1607 R1610 E1613 L1617	M1308-F1578 HydrophobicContact SD-CB 3.75Å; L1513-F1578 HydrophobicContact CD1-CD2 3.83Å; L1513-F1578 HydrophobicContact CD1-CE2 4.07Å; N1514-F1578 PolarHBondContact O-N 2.89Å; N1514-F1578 VanDerWaalsContact O-N 3.1Å; L1515-F1578 HydrophobicContact CD2-CB 3.81Å; L1515-F1578 HydrophobicContact CD2-CD2 4.18Å; L1515-F1578 HydrophobicContact CD2-CG 4.42Å; G1516-F1578 PolarHBondContact N-O 3.27Å; F1576-F1578 HydrophobicContact CB-CE2 4.01Å; F1576-F1578 HydrophobicContact CD1-CE2 4.19Å; F1576-F1578 HydrophobicContact CD1-CZ 4.46Å; F1578-Y1606 HydrophobicContact CB-CE1 4.25Å; F1578-Y1606 HydrophobicContact CD1-CE1 4.3Å; F1578-M1607 HydrophobicContact CB-SD 4.43Å; F1578-M1607 HydrophobicContact CD1-CE 4.15Å; F1578-M1607 HydrophobicContact CD1-SD 3.99Å; F1578-M1607 HydrophobicContact CE1-CE 4.46Å; F1578-M1607 HydrophobicContact CG-SD 4.43Å; F1578-R1610 HydrophobicContact CE1-CB 4.29Å; F1578-E1613 HydrophobicContact CE1-CB 4.22Å; F1578-E1613 HydrophobicContact CE1-CG 4.04Å; F1578-E1613 WeakPolarHBondContact CE1-OE2 3.3Å; F1578-E1613 HydrophobicContact CZ-CB 4.21Å; F1578-E1613 HydrophobicContact CZ-CG 3.79Å; F1578-L1617 HydrophobicContact CE2-CD2 3.91Å
1579	S	94.1	Very high	88.8	Confident	3 Å²	3	43 Å²	43	2%	0.021	24%	0.236	C	C	.	.			trans	-161.9	102.6	-176.8	-166.9	0	0	0	0	108.7	R1519 E1557 Y1606	R1519-S1579 WeakPolarHBondContact CG-OG 3.34Å; R1519-S1579 PolarHBondContact NE-O 2.57Å; R1519-S1579 PolarHBondContact NH2-O 3.38Å; E1557-S1579 WeakPolarHBondContact OE1-CB 3.38Å; E1557-S1579 PolarHBondContact OE1-OG 2.81Å; S1579-Y1606 PolarHBondContact N-OH 2.92Å; S1579-Y1606 PolarHBondContact O-OH 3.39Å
1580	P	93.7	Very high	88.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.223	C	C	.	.			trans	-64.7	143	-175	24.7	-34.6	0	0	0	111.6	I1304 G1518 R1519 M1582 T1603 Y1606	I1304-P1580 HydrophobicContact CG2-CG 3.52Å; G1518-P1580 WeakPolarHBondContact CA-O 3.39Å; R1519-P1580 PolarHBondContact N-O 2.71Å; P1580-M1582 HydrophobicContact CB-CE 3.83Å; P1580-M1582 HydrophobicContact CG-CE 3.52Å; P1580-M1582 PolarHBondContact O-N 3.01Å; P1580-T1603 HydrophobicContact CG-CG2 4.28Å; P1580-Y1606 HydrophobicContact CB-CD1 3.63Å; P1580-Y1606 HydrophobicContact CB-CD2 4.18Å; P1580-Y1606 HydrophobicContact CB-CE1 4.23Å; P1580-Y1606 HydrophobicContact CB-CG 3.59Å; P1580-Y1606 HydrophobicContact CG-CD1 4.36Å
1581	Q	90.6	Very high	88.8	Confident	85 Å²	85	39.5 Å²	39.5	40%	0.397	22%	0.218	S	C	.	.	B	Isolated β-bridge	trans	-79	114.2	169.7	-174.1	62.6	58.6	0	0	108.5	R1519 I1520	R1519-Q1581 VanDerWaalsContact NH1-OE1 3.08Å; R1519-Q1581 PolarHBondContact O-NE2 2.85Å; R1519-Q1581 VanDerWaalsContact O-NE2 3.07Å; I1520-Q1581 VanDerWaalsContact C-NE2 3.32Å; I1520-Q1581 PolarHBondContact O-NE2 3.1Å
1582	M	91.6	Very high	89	Confident	12 Å²	12	40.5 Å²	40.5	6%	0.059	23%	0.227	C	C	.	.			trans	-79.3	149.2	179.3	-66.2	-78.9	127.7	0	0	111	I1304 R1519 P1580 K1584 Y1586 M1599 E1602	I1304-M1582 HydrophobicContact CD1-CE 3.68Å; I1304-M1582 HydrophobicContact CD1-SD 4.11Å; I1304-M1582 HydrophobicContact CG1-CE 4.14Å; R1519-M1582 WeakPolarHBondContact O-CB 3.32Å; R1519-M1582 PolarHBondContact O-N 3.49Å; P1580-M1582 HydrophobicContact CB-CE 3.83Å; P1580-M1582 HydrophobicContact CG-CE 3.52Å; P1580-M1582 PolarHBondContact O-N 3.01Å; M1582-K1584 VanDerWaalsContact C-N 3.26Å; M1582-K1584 VanDerWaalsContact CB-O 3.3Å; M1582-K1584 WeakPolarHBondContact CB-O 3.49Å; M1582-K1584 PolarHBondContact O-N 2.86Å; M1582-Y1586 HydrophobicContact CB-CD2 4.11Å; M1582-Y1586 HydrophobicContact CB-CE2 4.23Å; M1582-Y1586 HydrophobicContact CG-CD2 4.1Å; M1582-Y1586 HydrophobicContact CG-CE2 4.42Å; M1582-Y1586 HydrophobicContact SD-CD2 3.54Å; M1582-Y1586 VanDerWaalsContact SD-CD2 3.54Å; M1582-Y1586 HydrophobicContact SD-CE2 3.58Å; M1582-Y1586 VanDerWaalsContact SD-CE2 3.58Å; M1582-M1599 HydrophobicContact CE-CG 4.43Å; M1582-M1599 HydrophobicContact SD-CG 3.96Å; M1582-E1602 WeakPolarHBondContact CA-OE2 3.41Å; M1582-E1602 HydrophobicContact CE-CB 4.29Å
1583	T	87.7	Confident	89.3	Confident	101 Å²	101	38.4 Å²	38.4	62%	0.62	20%	0.2	S	C	*	.	S	Bend	trans	-67.9	-24.4	173.8	58.6	0	0	0	0	113.1	E1602	T1583-E1602 HydrophobicContact CG2-CG 4.29Å; T1583-E1602 WeakPolarHBondContact CG2-OE1 3.37Å; T1583-E1602 WeakPolarHBondContact CG2-OE2 3.12Å; T1583-E1602 PolarHBondContact N-OE2 3.14Å; T1583-E1602 PolarHBondContact OG1-OE1 3.24Å; T1583-E1602 PolarHBondContact OG1-OE2 2.89Å
1584	K	86	Confident	89.6	Confident	75 Å²	75	45.2 Å²	45.2	33%	0.326	23%	0.225	S	C	.	.	S	Bend	trans	-154.3	173.6	-179.8	63.4	173.8	174.5	-179.1	0	111.7	M1582 Y1586 E1595	M1582-K1584 VanDerWaalsContact C-N 3.26Å; M1582-K1584 VanDerWaalsContact CB-O 3.3Å; M1582-K1584 WeakPolarHBondContact CB-O 3.49Å; M1582-K1584 PolarHBondContact O-N 2.86Å; K1584-Y1586 HydrophobicContact CD-CE1 4.37Å; K1584-Y1586 HydrophobicContact CG-CD1 4.5Å; K1584-Y1586 HydrophobicContact CG-CD2 4.04Å; K1584-Y1586 HydrophobicContact CG-CE1 4.28Å; K1584-Y1586 HydrophobicContact CG-CE2 3.81Å; K1584-Y1586 HydrophobicContact CG-CG 4.39Å; K1584-Y1586 WeakPolarHBondContact O-CD2 3.22Å; K1584-Y1586 PolarHBondContact O-N 3.32Å; K1584-E1595 IonicContact NZ-OE1 2.74Å; K1584-E1595 PolarHBondContact NZ-OE1 3.2Å
1585	D	82.9	Confident	89.7	Confident	65 Å²	65	45.6 Å²	45.6	35%	0.348	22%	0.222	S	C	.	.			trans	-78.7	104.5	169.5	-171.4	42.4	0	0	0	111.5	R1301 I1520 L1587	R1301-D1585 IonicContact CZ-OD1 2.69Å; R1301-D1585 IonicContact NH1-OD1 3.98Å; R1301-D1585 IonicContact NH2-OD1 2.72Å; R1301-D1585 PolarHBondContact NH2-OD1 2.88Å; I1520-D1585 WeakPolarHBondContact CD1-OD1 3.39Å; I1520-D1585 WeakPolarHBondContact CG1-OD1 3.46Å; I1520-D1585 HydrophobicContact CG2-CB 4.26Å; D1585-L1587 PolarHBondContact O-N 3.36Å
1586	Y	87.8	Confident	89.7	Confident	8 Å²	8	44.3 Å²	44.3	3%	0.031	22%	0.216	C	C	.	.			trans	-85.9	99.5	175.8	-72.1	-84.2	0	0	0	109.9	R1301 M1582 K1584 T1590 E1595 M1598 M1599 E1602	R1301-Y1586 PolarHBondContact NE-O 3.27Å; R1301-Y1586 PolarHBondContact NH2-O 3.48Å; M1582-Y1586 HydrophobicContact CB-CD2 4.11Å; M1582-Y1586 HydrophobicContact CB-CE2 4.23Å; M1582-Y1586 HydrophobicContact CG-CD2 4.1Å; M1582-Y1586 HydrophobicContact CG-CE2 4.42Å; M1582-Y1586 HydrophobicContact SD-CD2 3.54Å; M1582-Y1586 VanDerWaalsContact SD-CD2 3.54Å; M1582-Y1586 HydrophobicContact SD-CE2 3.58Å; M1582-Y1586 VanDerWaalsContact SD-CE2 3.58Å; K1584-Y1586 HydrophobicContact CD-CE1 4.37Å; K1584-Y1586 HydrophobicContact CG-CD1 4.5Å; K1584-Y1586 HydrophobicContact CG-CD2 4.04Å; K1584-Y1586 HydrophobicContact CG-CE1 4.28Å; K1584-Y1586 HydrophobicContact CG-CE2 3.81Å; K1584-Y1586 HydrophobicContact CG-CG 4.39Å; K1584-Y1586 WeakPolarHBondContact O-CD2 3.22Å; K1584-Y1586 PolarHBondContact O-N 3.32Å; Y1586-T1590 VanDerWaalsContact C-OG1 3.22Å; Y1586-T1590 HydrophobicContact CD1-CG2 4.37Å; Y1586-E1595 HydrophobicContact CD1-CB 4.15Å; Y1586-E1595 HydrophobicContact CE1-CB 3.92Å; Y1586-E1595 HydrophobicContact CE1-CG 4.47Å; Y1586-E1595 VanDerWaalsContact CE1-O 3.22Å; Y1586-E1595 WeakPolarHBondContact CE1-O 3.5Å; Y1586-M1598 WeakPolarHBondContact OH-CB 3.34Å; Y1586-M1599 HydrophobicContact CD1-CB 4.12Å; Y1586-M1599 HydrophobicContact CD2-CB 4.35Å; Y1586-M1599 HydrophobicContact CD2-CG 4.29Å; Y1586-M1599 HydrophobicContact CE1-CB 4.02Å; Y1586-M1599 HydrophobicContact CE2-CB 4.26Å; Y1586-M1599 HydrophobicContact CG-CB 4.27Å; Y1586-M1599 HydrophobicContact CG-CG 4.29Å; Y1586-M1599 HydrophobicContact CG-SD 4.37Å; Y1586-E1602 PolarHBondContact OH-OE1 3.16Å
1587	L	85.1	Confident	89.7	Confident	84 Å²	84	42.8 Å²	42.8	44%	0.44	21%	0.209	S	C	.	.			trans	-49.6	153.7	-174.4	-62.1	179.3	0	0	0	114.8	D1585 D1589 T1590	D1585-L1587 PolarHBondContact O-N 3.36Å; L1587-D1589 PolarHBondContact O-N 2.87Å; L1587-T1590 PolarHBondContact N-OG1 2.92Å; L1587-T1590 WeakPolarHBondContact O-CB 3.49Å; L1587-T1590 PolarHBondContact O-N 3.08Å; L1587-T1590 PolarHBondContact O-OG1 3.11Å
1588	L	84.9	Confident	89.7	Confident	53 Å²	53	43.2 Å²	43.2	28%	0.277	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-25.4	-178.1	-62	176.5	0	0	0	114.1	G1298 I1300 Y1449	G1298-L1588 VanDerWaalsContact C-CD2 3.42Å; G1298-L1588 VanDerWaalsContact O-CD2 3.3Å; G1298-L1588 WeakPolarHBondContact O-CD2 3.5Å; I1300-L1588 WeakPolarHBondContact CG2-O 3.36Å; I1300-L1588 PolarHBondContact N-O 2.89Å; Y1449-L1588 HydrophobicContact CE1-CB 3.8Å; Y1449-L1588 HydrophobicContact CE1-CD1 4.47Å; Y1449-L1588 HydrophobicContact CE2-CD1 3.9Å
1589	D	86.8	Confident	89.6	Confident	8 Å²	8	43.2 Å²	43.2	4%	0.043	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	36.3	175.7	63.9	-17.2	0	0	0	112.2	F1361 R1366 Y1368 Y1449 L1587 K1591	F1361-D1589 HydrophobicContact CB-CB 4.48Å; F1361-D1589 HydrophobicContact CD1-CB 3.74Å; F1361-D1589 HydrophobicContact CD2-CB 4.11Å; F1361-D1589 HydrophobicContact CE1-CB 3.88Å; F1361-D1589 HydrophobicContact CE2-CB 4.26Å; F1361-D1589 HydrophobicContact CG-CB 3.86Å; F1361-D1589 HydrophobicContact CZ-CB 4.15Å; R1366-D1589 IonicContact CZ-OD1 2.78Å; R1366-D1589 IonicContact CZ-OD2 2.62Å; R1366-D1589 VanDerWaalsContact CZ-OD2 3.27Å; R1366-D1589 IonicContact NE-OD2 3.44Å; R1366-D1589 PolarHBondContact NE-OD2 3.41Å; R1366-D1589 IonicContact NH2-OD1 2.74Å; R1366-D1589 PolarHBondContact NH2-OD1 3.2Å; R1366-D1589 IonicContact NH2-OD2 2.72Å; R1366-D1589 PolarHBondContact NH2-OD2 3.07Å; Y1368-D1589 HydrophobicContact CE2-CB 4.05Å; Y1368-D1589 WeakPolarHBondContact CE2-OD2 3.22Å; Y1368-D1589 PolarHBondContact OH-OD2 2.87Å; Y1449-D1589 HydrophobicContact CD1-CB 4.13Å; Y1449-D1589 HydrophobicContact CE1-CB 3.93Å; L1587-D1589 PolarHBondContact O-N 2.87Å; D1589-K1591 WeakPolarHBondContact O-CG 3.36Å; D1589-K1591 PolarHBondContact O-N 3.18Å
1590	T	87.8	Confident	89.7	Confident	10 Å²	10	43.1 Å²	43.1	6%	0.061	21%	0.213	C	C	.	.			trans	-52	113.3	175	-64.5	0	0	0	0	110.6	Y1586 L1587 E1595 V1596	Y1586-T1590 VanDerWaalsContact C-OG1 3.22Å; Y1586-T1590 HydrophobicContact CD1-CG2 4.37Å; L1587-T1590 PolarHBondContact N-OG1 2.92Å; L1587-T1590 WeakPolarHBondContact O-CB 3.49Å; L1587-T1590 PolarHBondContact O-N 3.08Å; L1587-T1590 PolarHBondContact O-OG1 3.11Å; T1590-E1595 HydrophobicContact CG2-CB 3.6Å; T1590-V1596 HydrophobicContact CG2-CG2 3.86Å
1591	K	84.3	Confident	89.7	Confident	56 Å²	56	43.2 Å²	43.2	24%	0.243	21%	0.213	C	C	.	.			trans	-93.1	-37.9	-169.7	-47.9	-170.3	-178.9	-162.8	0	113.1	K1357 F1361 R1364 Y1368 D1589	K1357-K1591 WeakPolarHBondContact CD-O 3.31Å; K1357-K1591 PolarHBondContact NZ-O 3.3Å; F1361-K1591 HydrophobicContact CB-CD 4.15Å; F1361-K1591 HydrophobicContact CB-CG 3.97Å; F1361-K1591 VanDerWaalsContact O-CD 3.32Å; F1361-K1591 WeakPolarHBondContact O-CD 3.43Å; F1361-K1591 VanDerWaalsContact O-CE 3.25Å; F1361-K1591 WeakPolarHBondContact O-CE 3.26Å; F1361-K1591 PolarHBondContact O-NZ 2.85Å; R1364-K1591 PolarHBondContact O-NZ 3.45Å; Y1368-K1591 WeakPolarHBondContact OH-CE 3.26Å; Y1368-K1591 PolarHBondContact OH-NZ 2.95Å; D1589-K1591 WeakPolarHBondContact O-CG 3.36Å; D1589-K1591 PolarHBondContact O-N 3.18Å
1592	T	88.2	Confident	89.9	Confident	69 Å²	69	40 Å²	40	42%	0.423	20%	0.198	S	C	.	.			trans	-75.8	134.3	-164.3	82.8	0	0	0	0	111.6	R1594 E1595 V1596	T1592-R1594 VanDerWaalsContact C-N 3.25Å; T1592-R1594 PolarHBondContact O-N 2.97Å; T1592-E1595 WeakPolarHBondContact CG2-OE2 3.31Å; T1592-E1595 PolarHBondContact O-N 3.2Å; T1592-E1595 VanDerWaalsContact O-N 3.1Å; T1592-E1595 WeakPolarHBondContact OG1-CB 3.28Å; T1592-E1595 WeakPolarHBondContact OG1-CG 3.35Å; T1592-E1595 PolarHBondContact OG1-N 3.23Å; T1592-E1595 PolarHBondContact OG1-OE2 3.44Å; T1592-V1596 PolarHBondContact O-N 3.4Å; T1592-V1596 VanDerWaalsContact O-N 3.1Å
1593	D	90.3	Very high	90.1	Very high	23 Å²	23	39.4 Å²	39.4	12%	0.123	20%	0.195	C	C	.	.	H	α-helix	trans	-58	-39.6	-174.4	-63.8	-39.6	0	0	0	112.2	K1141 L1176 L1180 K1357 E1595 V1596 V1597	K1141-D1593 WeakPolarHBondContact CD-OD2 3.27Å; K1141-D1593 WeakPolarHBondContact CE-OD2 3.38Å; K1141-D1593 IonicContact NZ-OD1 3.54Å; K1141-D1593 PolarHBondContact NZ-OD1 3.24Å; K1141-D1593 IonicContact NZ-OD2 2.66Å; K1141-D1593 PolarHBondContact NZ-OD2 3.19Å; L1176-D1593 HydrophobicContact CD2-CB 4.21Å; L1176-D1593 HydrophobicContact CG-CB 4.31Å; L1180-D1593 HydrophobicContact CD1-CB 3.61Å; K1357-D1593 WeakPolarHBondContact CE-OD1 3.38Å; K1357-D1593 IonicContact NZ-OD1 3.64Å; K1357-D1593 PolarHBondContact NZ-OD1 3.22Å; D1593-E1595 PolarHBondContact O-N 2.88Å; D1593-V1596 PolarHBondContact O-N 2.92Å; D1593-V1597 WeakPolarHBondContact O-CB 3.48Å; D1593-V1597 WeakPolarHBondContact O-CG2 3.44Å; D1593-V1597 PolarHBondContact O-N 2.95Å
1594	R	92.4	Very high	90.4	Very high	152 Å²	152	35.7 Å²	35.7	57%	0.574	17%	0.172	S	C	*	.	H	α-helix	trans	-61.8	-43	176.7	-166.8	-177.1	-162	-150.2	-0.6	112.7	L1176 D1210 T1592 M1598	L1176-R1594 HydrophobicContact CD2-CB 4.25Å; D1210-R1594 IonicContact OD1-NE 3.12Å; D1210-R1594 IonicContact OD1-NH2 3.92Å; D1210-R1594 IonicContact OD2-CZ 2.7Å; D1210-R1594 IonicContact OD2-NE 2.92Å; D1210-R1594 PolarHBondContact OD2-NE 3.26Å; D1210-R1594 IonicContact OD2-NH2 2.73Å; D1210-R1594 PolarHBondContact OD2-NH2 3.25Å; T1592-R1594 VanDerWaalsContact C-N 3.25Å; T1592-R1594 PolarHBondContact O-N 2.97Å; R1594-M1598 WeakPolarHBondContact O-CB 3.34Å; R1594-M1598 WeakPolarHBondContact O-CG 3.27Å; R1594-M1598 PolarHBondContact O-N 3.21Å
1595	E	92.1	Very high	90.6	Very high	61 Å²	61	34.5 Å²	34.5	29%	0.285	17%	0.168	S	C	.	.	H	α-helix	trans	-71	-38.6	-179.3	-69.7	176.9	126.5	0	0	111.6	K1584 Y1586 T1590 T1592 D1593 M1598 M1599	K1584-E1595 IonicContact NZ-OE1 2.74Å; K1584-E1595 PolarHBondContact NZ-OE1 3.2Å; Y1586-E1595 HydrophobicContact CD1-CB 4.15Å; Y1586-E1595 HydrophobicContact CE1-CB 3.92Å; Y1586-E1595 HydrophobicContact CE1-CG 4.47Å; Y1586-E1595 VanDerWaalsContact CE1-O 3.22Å; Y1586-E1595 WeakPolarHBondContact CE1-O 3.5Å; T1590-E1595 HydrophobicContact CG2-CB 3.6Å; T1592-E1595 WeakPolarHBondContact CG2-OE2 3.31Å; T1592-E1595 PolarHBondContact O-N 3.2Å; T1592-E1595 VanDerWaalsContact O-N 3.1Å; T1592-E1595 WeakPolarHBondContact OG1-CB 3.28Å; T1592-E1595 WeakPolarHBondContact OG1-CG 3.35Å; T1592-E1595 PolarHBondContact OG1-N 3.23Å; T1592-E1595 PolarHBondContact OG1-OE2 3.44Å; D1593-E1595 PolarHBondContact O-N 2.88Å; E1595-M1598 PolarHBondContact O-N 3.47Å; E1595-M1599 VanDerWaalsContact O-CB 3.3Å; E1595-M1599 WeakPolarHBondContact O-CB 3.28Å; E1595-M1599 PolarHBondContact O-N 3.45Å
1596	V	92.6	Very high	91.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-70.2	-36.5	177.8	173.6	0	0	0	0	111.9	L1303 L1354 K1357 T1590 T1592 D1593 M1599 M1600	L1303-V1596 HydrophobicContact CD1-CG1 3.42Å; L1303-V1596 VanDerWaalsContact CD1-CG1 3.42Å; L1354-V1596 HydrophobicContact CD2-CG1 3.88Å; K1357-V1596 HydrophobicContact CD-CB 4.37Å; K1357-V1596 HydrophobicContact CD-CG1 4.47Å; K1357-V1596 HydrophobicContact CD-CG2 3.71Å; T1590-V1596 HydrophobicContact CG2-CG2 3.86Å; T1592-V1596 PolarHBondContact O-N 3.4Å; T1592-V1596 VanDerWaalsContact O-N 3.1Å; D1593-V1596 PolarHBondContact O-N 2.92Å; V1596-M1599 HydrophobicContact CG1-CE 4.44Å; V1596-M1600 HydrophobicContact CG1-CE 4.21Å; V1596-M1600 WeakPolarHBondContact O-CG 3.39Å; V1596-M1600 PolarHBondContact O-N 3.42Å; V1596-M1600 VanDerWaalsContact O-N 3.1Å
1597	V	94.1	Very high	91.5	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-45.5	169.9	167.7	0	0	0	0	111.5	L1176 L1180 K1213 A1214 D1593 M1600 W1601	L1176-V1597 HydrophobicContact CD1-CG2 4.38Å; L1180-V1597 HydrophobicContact CD1-CG2 4.22Å; L1180-V1597 HydrophobicContact CD2-CG2 4.09Å; K1213-V1597 HydrophobicContact CB-CG1 3.97Å; A1214-V1597 HydrophobicContact CB-CG1 3.93Å; A1214-V1597 HydrophobicContact CB-CG2 3.75Å; D1593-V1597 WeakPolarHBondContact O-CB 3.48Å; D1593-V1597 WeakPolarHBondContact O-CG2 3.44Å; D1593-V1597 PolarHBondContact O-N 2.95Å; V1597-M1600 HydrophobicContact CG2-CE 4.49Å; V1597-M1600 PolarHBondContact O-N 3.07Å; V1597-W1601 WeakPolarHBondContact O-CB 3.35Å; V1597-W1601 PolarHBondContact O-N 3.1Å
1598	M	94.3	Very high	91.7	Very high	42 Å²	42	31.8 Å²	31.8	21%	0.207	15%	0.15	C	C	.	.	H	α-helix	trans	-64.5	-40.6	178.1	-77.6	-62.1	-56.6	0	0	112.7	K1213 Y1586 R1594 E1595 M1600 W1601 E1602	K1213-M1598 HydrophobicContact CD-SD 3.81Å; Y1586-M1598 WeakPolarHBondContact OH-CB 3.34Å; R1594-M1598 WeakPolarHBondContact O-CB 3.34Å; R1594-M1598 WeakPolarHBondContact O-CG 3.27Å; R1594-M1598 PolarHBondContact O-N 3.21Å; E1595-M1598 PolarHBondContact O-N 3.47Å; M1598-M1600 PolarHBondContact O-N 3.06Å; M1598-W1601 PolarHBondContact O-N 3.4Å; M1598-W1601 VanDerWaalsContact O-N 3.14Å; M1598-E1602 WeakPolarHBondContact O-CB 3.35Å; M1598-E1602 WeakPolarHBondContact O-CG 3.48Å; M1598-E1602 PolarHBondContact O-N 3.23Å
1599	M	94.4	Very high	91.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.2	-41.7	174.1	-177	-174.2	67.9	0	0	112.2	R1301 L1303 I1304 M1582 Y1586 E1595 V1596 T1603	R1301-M1599 HydrophobicContact CG-SD 4.21Å; L1303-M1599 HydrophobicContact CB-CE 3.97Å; L1303-M1599 HydrophobicContact CD1-CE 4.35Å; I1304-M1599 HydrophobicContact CD1-CG 3.63Å; I1304-M1599 HydrophobicContact CD1-SD 3.81Å; I1304-M1599 HydrophobicContact CG1-CE 4.44Å; I1304-M1599 HydrophobicContact CG1-CG 3.69Å; I1304-M1599 HydrophobicContact CG1-SD 4.05Å; M1582-M1599 HydrophobicContact CE-CG 4.43Å; M1582-M1599 HydrophobicContact SD-CG 3.96Å; Y1586-M1599 HydrophobicContact CD1-CB 4.12Å; Y1586-M1599 HydrophobicContact CD2-CB 4.35Å; Y1586-M1599 HydrophobicContact CD2-CG 4.29Å; Y1586-M1599 HydrophobicContact CE1-CB 4.02Å; Y1586-M1599 HydrophobicContact CE2-CB 4.26Å; Y1586-M1599 HydrophobicContact CG-CB 4.27Å; Y1586-M1599 HydrophobicContact CG-CG 4.29Å; Y1586-M1599 HydrophobicContact CG-SD 4.37Å; E1595-M1599 VanDerWaalsContact O-CB 3.3Å; E1595-M1599 WeakPolarHBondContact O-CB 3.28Å; E1595-M1599 PolarHBondContact O-N 3.45Å; V1596-M1599 HydrophobicContact CG1-CE 4.44Å; M1599-T1603 PolarHBondContact O-N 3.01Å; M1599-T1603 PolarHBondContact O-OG1 3.09Å
1600	M	95.4	Very high	92.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.2	-40.8	172	-73.6	-170.2	-69.2	0	0	111.9	V1217 L1303 Q1307 L1354 V1596 V1597 M1598 T1603 V1604	V1217-M1600 HydrophobicContact CB-CB 4.1Å; V1217-M1600 HydrophobicContact CG1-CB 4.15Å; V1217-M1600 HydrophobicContact CG2-CB 4.1Å; V1217-M1600 HydrophobicContact CG2-CE 3.81Å; V1217-M1600 HydrophobicContact CG2-SD 4.31Å; L1303-M1600 HydrophobicContact CB-CG 4.12Å; L1303-M1600 HydrophobicContact CB-SD 4.36Å; L1303-M1600 HydrophobicContact CD1-SD 4.39Å; L1303-M1600 HydrophobicContact CD2-SD 4.1Å; Q1307-M1600 HydrophobicContact CG-CB 4.01Å; Q1307-M1600 HydrophobicContact CG-CG 3.9Å; Q1307-M1600 HydrophobicContact CG-SD 4.33Å; Q1307-M1600 PolarHBondContact NE2-SD 2.93Å; Q1307-M1600 VanDerWaalsContact NE2-SD 3.36Å; L1354-M1600 HydrophobicContact CD2-CE 4.32Å; V1596-M1600 HydrophobicContact CG1-CE 4.21Å; V1596-M1600 WeakPolarHBondContact O-CG 3.39Å; V1596-M1600 PolarHBondContact O-N 3.42Å; V1596-M1600 VanDerWaalsContact O-N 3.1Å; V1597-M1600 HydrophobicContact CG2-CE 4.49Å; V1597-M1600 PolarHBondContact O-N 3.07Å; M1598-M1600 PolarHBondContact O-N 3.06Å; M1600-T1603 WeakPolarHBondContact O-CB 3.41Å; M1600-T1603 PolarHBondContact O-N 3.2Å; M1600-V1604 PolarHBondContact O-N 2.72Å; M1600-V1604 VanDerWaalsContact O-N 3.1Å
1601	W	95.1	Very high	92.2	Very high	2 Å²	2	42 Å²	42	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-48.7	-179.8	-178.1	-96.6	0	0	0	112.5	K1213 L1216 V1217 C1249 I1252 V1597 M1598 T1603 V1604 E1605	K1213-W1601 HydrophobicContact CB-CB 4.48Å; K1213-W1601 HydrophobicContact CB-CD2 4.07Å; K1213-W1601 HydrophobicContact CB-CE3 3.87Å; K1213-W1601 HydrophobicContact CB-CG 4.28Å; K1213-W1601 HydrophobicContact CD-CB 4.35Å; K1213-W1601 HydrophobicContact CD-CD2 3.97Å; K1213-W1601 HydrophobicContact CD-CG 3.74Å; K1213-W1601 HydrophobicContact CG-CD2 3.59Å; K1213-W1601 HydrophobicContact CG-CE3 3.75Å; K1213-W1601 HydrophobicContact CG-CG 3.88Å; K1213-W1601 HydrophobicContact CG-CZ3 4.43Å; L1216-W1601 HydrophobicContact CB-CZ3 4.02Å; L1216-W1601 HydrophobicContact CD1-CH2 4.22Å; L1216-W1601 HydrophobicContact CD1-CZ3 3.93Å; V1217-W1601 HydrophobicContact CG1-CB 4.33Å; V1217-W1601 HydrophobicContact CG1-CE3 3.8Å; C1249-W1601 HydrophobicContact CB-CH2 3.79Å; C1249-W1601 HydrophobicContact CB-CZ2 3.81Å; C1249-W1601 HydrophobicContact CB-CZ3 4.49Å; C1249-W1601 VanDerWaalsContact O-CH2 3.31Å; C1249-W1601 WeakPolarHBondContact O-CH2 3.28Å; I1252-W1601 HydrophobicContact CB-CH2 3.93Å; I1252-W1601 HydrophobicContact CB-CZ2 3.98Å; I1252-W1601 HydrophobicContact CD1-CZ2 4.24Å; I1252-W1601 HydrophobicContact CG2-CH2 3.76Å; I1252-W1601 HydrophobicContact CG2-CZ2 3.82Å; V1597-W1601 WeakPolarHBondContact O-CB 3.35Å; V1597-W1601 PolarHBondContact O-N 3.1Å; M1598-W1601 PolarHBondContact O-N 3.4Å; M1598-W1601 VanDerWaalsContact O-N 3.14Å; W1601-T1603 PolarHBondContact O-N 3.48Å; W1601-V1604 PolarHBondContact O-N 3.09Å; W1601-E1605 HydrophobicContact CZ2-CG 4.18Å; W1601-E1605 PolarHBondContact NE1-OE1 3.14Å; W1601-E1605 PolarHBondContact O-N 2.85Å
1602	E	94.3	Very high	92.4	Very high	17 Å²	17	45.2 Å²	45.2	8%	0.079	21%	0.205	C	C	.	.	H	α-helix	trans	-55.5	-34	174.6	-73.2	174.7	-141.8	0	0	111.8	M1582 T1583 Y1586 M1598 Y1606	M1582-E1602 WeakPolarHBondContact CA-OE2 3.41Å; M1582-E1602 HydrophobicContact CE-CB 4.29Å; T1583-E1602 HydrophobicContact CG2-CG 4.29Å; T1583-E1602 WeakPolarHBondContact CG2-OE1 3.37Å; T1583-E1602 WeakPolarHBondContact CG2-OE2 3.12Å; T1583-E1602 PolarHBondContact N-OE2 3.14Å; T1583-E1602 PolarHBondContact OG1-OE1 3.24Å; T1583-E1602 PolarHBondContact OG1-OE2 2.89Å; Y1586-E1602 PolarHBondContact OH-OE1 3.16Å; M1598-E1602 WeakPolarHBondContact O-CB 3.35Å; M1598-E1602 WeakPolarHBondContact O-CG 3.48Å; M1598-E1602 PolarHBondContact O-N 3.23Å; E1602-Y1606 WeakPolarHBondContact O-CB 3.28Å; E1602-Y1606 PolarHBondContact O-N 3.41Å
1603	T	95.4	Very high	92.4	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-69.3	-44.9	175.6	-55.3	0	0	0	0	112.1	I1304 Q1307 M1308 P1580 M1599 M1600 W1601 Y1606 M1607	I1304-T1603 HydrophobicContact CG2-CG2 3.93Å; Q1307-T1603 HydrophobicContact CB-CG2 3.77Å; M1308-T1603 HydrophobicContact CG-CG2 3.51Å; P1580-T1603 HydrophobicContact CG-CG2 4.28Å; M1599-T1603 PolarHBondContact O-N 3.01Å; M1599-T1603 PolarHBondContact O-OG1 3.09Å; M1600-T1603 WeakPolarHBondContact O-CB 3.41Å; M1600-T1603 PolarHBondContact O-N 3.2Å; W1601-T1603 PolarHBondContact O-N 3.48Å; T1603-Y1606 PolarHBondContact O-N 2.93Å; T1603-M1607 WeakPolarHBondContact O-CG 3.32Å; T1603-M1607 PolarHBondContact O-N 3.16Å
1604	V	93.6	Very high	92.4	Very high	24 Å²	24	44 Å²	44	15%	0.145	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-42.4	175.5	176.2	0	0	0	0	110.8	V1217 I1252 M1600 W1601 Y1606 M1607 Q1608	V1217-V1604 HydrophobicContact CG1-CG2 4.19Å; I1252-V1604 HydrophobicContact CG2-CG1 4.01Å; M1600-V1604 PolarHBondContact O-N 2.72Å; M1600-V1604 VanDerWaalsContact O-N 3.1Å; W1601-V1604 PolarHBondContact O-N 3.09Å; V1604-Y1606 VanDerWaalsContact C-N 3.33Å; V1604-Y1606 PolarHBondContact O-N 3.31Å; V1604-M1607 PolarHBondContact O-N 3.49Å; V1604-Q1608 WeakPolarHBondContact O-CB 3.2Å; V1604-Q1608 PolarHBondContact O-N 3.44Å
1605	E	91.7	Very high	92.2	Very high	50 Å²	50	40.3 Å²	40.3	23%	0.234	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-42.1	174.1	-65.2	-153.3	-179.8	0	0	112.8	I1252 W1601 K1609	I1252-E1605 HydrophobicContact CD1-CG 4.05Å; I1252-E1605 HydrophobicContact CG2-CG 4.4Å; W1601-E1605 HydrophobicContact CZ2-CG 4.18Å; W1601-E1605 PolarHBondContact NE1-OE1 3.14Å; W1601-E1605 PolarHBondContact O-N 2.85Å; E1605-K1609 WeakPolarHBondContact O-CB 3.46Å; E1605-K1609 VanDerWaalsContact O-CD 3.25Å; E1605-K1609 WeakPolarHBondContact O-CD 3.43Å; E1605-K1609 WeakPolarHBondContact O-CG 2.76Å; E1605-K1609 PolarHBondContact O-N 2.98Å; E1605-K1609 IonicContact OE2-NZ 3.11Å; E1605-K1609 PolarHBondContact OE2-NZ 3.5Å
1606	Y	94.4	Very high	92.1	Very high	27 Å²	27	44.5 Å²	44.5	11%	0.106	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-44.3	179.3	165	-99.8	0	0	0	112	M1308 F1578 S1579 P1580 E1602 T1603 V1604 K1609 R1610	M1308-Y1606 HydrophobicContact SD-CE1 4.21Å; F1578-Y1606 HydrophobicContact CB-CE1 4.25Å; F1578-Y1606 HydrophobicContact CD1-CE1 4.3Å; S1579-Y1606 PolarHBondContact N-OH 2.92Å; S1579-Y1606 PolarHBondContact O-OH 3.39Å; P1580-Y1606 HydrophobicContact CB-CD1 3.63Å; P1580-Y1606 HydrophobicContact CB-CD2 4.18Å; P1580-Y1606 HydrophobicContact CB-CE1 4.23Å; P1580-Y1606 HydrophobicContact CB-CG 3.59Å; P1580-Y1606 HydrophobicContact CG-CD1 4.36Å; E1602-Y1606 WeakPolarHBondContact O-CB 3.28Å; E1602-Y1606 PolarHBondContact O-N 3.41Å; T1603-Y1606 PolarHBondContact O-N 2.93Å; V1604-Y1606 VanDerWaalsContact C-N 3.33Å; V1604-Y1606 PolarHBondContact O-N 3.31Å; Y1606-K1609 PolarHBondContact O-N 2.93Å; Y1606-R1610 PolarHBondContact O-N 3.22Å; Y1606-R1610 PolarHBondContact OH-NE 2.81Å; Y1606-R1610 PolarHBondContact OH-NH1 3.32Å
1607	M	94.1	Very high	92	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-66.3	-41	177.4	-67.4	-56.3	-67.7	0	0	111.7	M1308 F1311 I1312 F1578 T1603 V1604 K1609 R1610 K1611	M1308-M1607 HydrophobicContact CB-CE 4.39Å; M1308-M1607 HydrophobicContact CB-CG 4.37Å; M1308-M1607 HydrophobicContact CB-SD 4.06Å; M1308-M1607 HydrophobicContact CG-CG 3.89Å; M1308-M1607 HydrophobicContact CG-SD 3.68Å; M1308-M1607 HydrophobicContact SD-SD 3.97Å; F1311-M1607 HydrophobicContact CB-CB 4.15Å; F1311-M1607 HydrophobicContact CB-CE 4.35Å; F1311-M1607 HydrophobicContact CB-CG 4.28Å; F1311-M1607 HydrophobicContact CD1-CB 3.66Å; F1311-M1607 HydrophobicContact CD1-CE 3.73Å; F1311-M1607 HydrophobicContact CD1-CG 4.37Å; F1311-M1607 HydrophobicContact CD2-CB 3.84Å; F1311-M1607 HydrophobicContact CE1-CB 3.89Å; F1311-M1607 HydrophobicContact CE1-CE 4.42Å; F1311-M1607 HydrophobicContact CE2-CB 4.07Å; F1311-M1607 HydrophobicContact CG-CB 3.61Å; F1311-M1607 HydrophobicContact CG-CE 4.34Å; F1311-M1607 HydrophobicContact CG-CG 4.26Å; F1311-M1607 HydrophobicContact CZ-CB 4.09Å; I1312-M1607 HydrophobicContact CD1-CE 4.32Å; I1312-M1607 HydrophobicContact CG1-CE 4.02Å; F1578-M1607 HydrophobicContact CB-SD 4.43Å; F1578-M1607 HydrophobicContact CD1-CE 4.15Å; F1578-M1607 HydrophobicContact CD1-SD 3.99Å; F1578-M1607 HydrophobicContact CE1-CE 4.46Å; F1578-M1607 HydrophobicContact CG-SD 4.43Å; T1603-M1607 WeakPolarHBondContact O-CG 3.32Å; T1603-M1607 PolarHBondContact O-N 3.16Å; V1604-M1607 PolarHBondContact O-N 3.49Å; M1607-K1609 VanDerWaalsContact C-N 3.29Å; M1607-K1609 PolarHBondContact O-N 2.85Å; M1607-R1610 CarbonylContact O-C 3.48Å; M1607-R1610 VanDerWaalsContact O-C 3.27Å; M1607-R1610 WeakPolarHBondContact O-CA 3.5Å; M1607-R1610 PolarHBondContact O-N 3.34Å; M1607-K1611 PolarHBondContact O-N 2.99Å; M1607-K1611 VanDerWaalsContact O-N 3.07Å
1608	Q	88.7	Confident	91.8	Very high	71 Å²	71	44.6 Å²	44.6	33%	0.332	20%	0.198	S	C	.	.	H	α-helix	trans	-63.1	-34.1	175	-170.8	67.2	-9.6	0	0	112.4	I1252 F1311 V1604 R1610	I1252-Q1608 HydrophobicContact CG2-CB 4.32Å; I1252-Q1608 HydrophobicContact CG2-CG 4.42Å; F1311-Q1608 HydrophobicContact CE2-CB 4.47Å; V1604-Q1608 WeakPolarHBondContact O-CB 3.2Å; V1604-Q1608 PolarHBondContact O-N 3.44Å; Q1608-R1610 PolarHBondContact O-N 3.34Å
1609	K	90	Very high	91.5	Very high	146 Å²	146	46.7 Å²	46.7	64%	0.635	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-9.1	172	-68.5	160	-163.9	166.5	0	113.6	E1605 Y1606 M1607	E1605-K1609 WeakPolarHBondContact O-CB 3.46Å; E1605-K1609 VanDerWaalsContact O-CD 3.25Å; E1605-K1609 WeakPolarHBondContact O-CD 3.43Å; E1605-K1609 WeakPolarHBondContact O-CG 2.76Å; E1605-K1609 PolarHBondContact O-N 2.98Å; E1605-K1609 IonicContact OE2-NZ 3.11Å; E1605-K1609 PolarHBondContact OE2-NZ 3.5Å; Y1606-K1609 PolarHBondContact O-N 2.93Å; M1607-K1609 VanDerWaalsContact C-N 3.29Å; M1607-K1609 PolarHBondContact O-N 2.85Å
1610	R	91.1	Very high	91.2	Very high	81 Å²	81	49 Å²	49	31%	0.306	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123	19.8	179.3	-79.6	-179.4	165.5	-129.6	0.5	113.6	F1578 Y1606 M1607 Q1608 E1612 E1613 C1614	F1578-R1610 HydrophobicContact CE1-CB 4.29Å; Y1606-R1610 PolarHBondContact O-N 3.22Å; Y1606-R1610 PolarHBondContact OH-NE 2.81Å; Y1606-R1610 PolarHBondContact OH-NH1 3.32Å; M1607-R1610 CarbonylContact O-C 3.48Å; M1607-R1610 VanDerWaalsContact O-C 3.27Å; M1607-R1610 WeakPolarHBondContact O-CA 3.5Å; M1607-R1610 PolarHBondContact O-N 3.34Å; Q1608-R1610 PolarHBondContact O-N 3.34Å; R1610-E1612 PolarHBondContact O-N 3.41Å; R1610-E1612 VanDerWaalsContact O-N 3.12Å; R1610-E1613 HydrophobicContact CB-CB 4.46Å; R1610-E1613 WeakPolarHBondContact CD-OE2 3.45Å; R1610-E1613 WeakPolarHBondContact CG-OE2 3.49Å; R1610-E1613 IonicContact CZ-OE1 2.64Å; R1610-E1613 IonicContact CZ-OE2 3.33Å; R1610-E1613 IonicContact NE-OE2 2.71Å; R1610-E1613 PolarHBondContact NE-OE2 2.75Å; R1610-E1613 IonicContact NH1-OE1 3.5Å; R1610-E1613 PolarHBondContact NH1-OE1 3.3Å; R1610-E1613 IonicContact NH1-OE2 3.47Å; R1610-E1613 PolarHBondContact NH1-OE2 3.44Å; R1610-E1613 WeakPolarHBondContact O-CB 3.31Å; R1610-E1613 PolarHBondContact O-N 2.7Å; R1610-C1614 PolarHBondContact O-N 3.48Å
1611	K	89.3	Confident	90.9	Very high	60 Å²	60	49.1 Å²	49.1	26%	0.261	22%	0.223	S	C	.	.	H	α-helix	trans	-48.5	-42.7	-178.5	-161.6	-166.8	177.8	-143.7	0	113	F1311 F1315 M1607 E1613 C1614 Y1615	F1311-K1611 HydrophobicContact CZ-CG 4.36Å; F1315-K1611 HydrophobicContact CZ-CG 4.16Å; M1607-K1611 PolarHBondContact O-N 2.99Å; M1607-K1611 VanDerWaalsContact O-N 3.07Å; K1611-E1613 PolarHBondContact O-N 3.06Å; K1611-C1614 CarbonylContact O-C 3.59Å; K1611-C1614 WeakPolarHBondContact O-CB 3.29Å; K1611-C1614 PolarHBondContact O-N 3.37Å; K1611-Y1615 HydrophobicContact CD-CE2 3.8Å; K1611-Y1615 WeakPolarHBondContact CE-OH 3.47Å; K1611-Y1615 HydrophobicContact CG-CD2 4.15Å; K1611-Y1615 HydrophobicContact CG-CE2 3.78Å; K1611-Y1615 PolarHBondContact NZ-OH 2.98Å; K1611-Y1615 WeakPolarHBondContact O-CD2 3.29Å; K1611-Y1615 PolarHBondContact O-N 3.44Å
1612	E	88	Confident	90.4	Very high	123 Å²	123	51.3 Å²	51.3	58%	0.575	23%	0.232	S	C	*	.	H	α-helix	trans	-67.5	-32.3	179.3	-52.3	-43.7	119.1	0	0	114.5	R1610 K1616	R1610-E1612 PolarHBondContact O-N 3.41Å; R1610-E1612 VanDerWaalsContact O-N 3.12Å; E1612-K1616 WeakPolarHBondContact O-CG 3.42Å; E1612-K1616 PolarHBondContact O-N 3.34Å
1613	E	89	Confident	89.9	Confident	66 Å²	66	52.7 Å²	52.7	31%	0.308	25%	0.247	S	C	.	.	H	α-helix	trans	-74	-36	174	-165.3	-176.7	-165.9	0	0	110.3	F1578 R1610 K1611 K1616 L1617	F1578-E1613 HydrophobicContact CE1-CB 4.22Å; F1578-E1613 HydrophobicContact CE1-CG 4.04Å; F1578-E1613 WeakPolarHBondContact CE1-OE2 3.3Å; F1578-E1613 HydrophobicContact CZ-CB 4.21Å; F1578-E1613 HydrophobicContact CZ-CG 3.79Å; R1610-E1613 HydrophobicContact CB-CB 4.46Å; R1610-E1613 WeakPolarHBondContact CD-OE2 3.45Å; R1610-E1613 WeakPolarHBondContact CG-OE2 3.49Å; R1610-E1613 IonicContact CZ-OE1 2.64Å; R1610-E1613 IonicContact CZ-OE2 3.33Å; R1610-E1613 IonicContact NE-OE2 2.71Å; R1610-E1613 PolarHBondContact NE-OE2 2.75Å; R1610-E1613 IonicContact NH1-OE1 3.5Å; R1610-E1613 PolarHBondContact NH1-OE1 3.3Å; R1610-E1613 IonicContact NH1-OE2 3.47Å; R1610-E1613 PolarHBondContact NH1-OE2 3.44Å; R1610-E1613 WeakPolarHBondContact O-CB 3.31Å; R1610-E1613 PolarHBondContact O-N 2.7Å; K1611-E1613 PolarHBondContact O-N 3.06Å; E1613-K1616 PolarHBondContact O-N 2.99Å; E1613-L1617 PolarHBondContact O-N 2.85Å; E1613-L1617 VanDerWaalsContact O-N 3.14Å
1614	C	89.9	Confident	89.2	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.9	-41.7	173.5	-168.5	0	0	0	0	112.1	F1311 R1610 K1611 K1616 L1617 V1618	F1311-C1614 HydrophobicContact CE1-CB 4.22Å; R1610-C1614 PolarHBondContact O-N 3.48Å; K1611-C1614 CarbonylContact O-C 3.59Å; K1611-C1614 WeakPolarHBondContact O-CB 3.29Å; K1611-C1614 PolarHBondContact O-N 3.37Å; C1614-K1616 PolarHBondContact O-N 3.43Å; C1614-L1617 WeakPolarHBondContact O-CB 3.36Å; C1614-L1617 PolarHBondContact O-N 3.16Å; C1614-V1618 WeakPolarHBondContact O-CB 3.23Å; C1614-V1618 VanDerWaalsContact O-CG2 3.24Å; C1614-V1618 WeakPolarHBondContact O-CG2 3.39Å; C1614-V1618 PolarHBondContact O-N 2.97Å
1615	Y	88.3	Confident	88.3	Confident	74 Å²	74	55.4 Å²	55.4	29%	0.29	26%	0.26	S	S	.	.	H	α-helix	trans	-61	-42.6	174.5	-81.8	-54.5	0	0	0	112.5	F1315 K1611 L1617 V1618 N1619	F1315-Y1615 HydrophobicContact CD1-CD1 4.21Å; F1315-Y1615 AromaticContact CD1-CE1 3.48Å; F1315-Y1615 HydrophobicContact CD1-CE1 3.48Å; F1315-Y1615 VanDerWaalsContact CD1-CE1 3.48Å; F1315-Y1615 AromaticContact CE1-CE1 3.66Å; F1315-Y1615 HydrophobicContact CE1-CE1 3.66Å; F1315-Y1615 AromaticContact CE1-CZ 3.71Å; F1315-Y1615 HydrophobicContact CG-CE1 4.19Å; K1611-Y1615 HydrophobicContact CD-CE2 3.8Å; K1611-Y1615 WeakPolarHBondContact CE-OH 3.47Å; K1611-Y1615 HydrophobicContact CG-CD2 4.15Å; K1611-Y1615 HydrophobicContact CG-CE2 3.78Å; K1611-Y1615 PolarHBondContact NZ-OH 2.98Å; K1611-Y1615 WeakPolarHBondContact O-CD2 3.29Å; K1611-Y1615 PolarHBondContact O-N 3.44Å; Y1615-L1617 PolarHBondContact O-N 3.21Å; Y1615-V1618 PolarHBondContact O-N 3.19Å; Y1615-N1619 WeakPolarHBondContact O-CB 3.28Å; Y1615-N1619 PolarHBondContact O-N 3.02Å
1616	K	89.4	Confident	87.1	Confident	150 Å²	150	60.9 Å²	60.9	65%	0.652	29%	0.286	S	S	*	.	H	α-helix	trans	-62.2	-43.2	176.9	-70.9	174.7	-176.4	-174.1	0	112.2	E1612 E1613 C1614 L1620	E1612-K1616 WeakPolarHBondContact O-CG 3.42Å; E1612-K1616 PolarHBondContact O-N 3.34Å; E1613-K1616 PolarHBondContact O-N 2.99Å; C1614-K1616 PolarHBondContact O-N 3.43Å; K1616-L1620 WeakPolarHBondContact O-CB 3.31Å; K1616-L1620 PolarHBondContact O-N 3.1Å
1617	L	90.6	Very high	85	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59	-48.6	171.6	169.6	70.1	0	0	0	111.8	I1312 L1513 F1576 F1578 E1613 C1614 Y1615 L1620 I1621	I1312-L1617 HydrophobicContact CD1-CD2 4.08Å; I1312-L1617 HydrophobicContact CG1-CD2 4.34Å; I1312-L1617 HydrophobicContact CG2-CD2 4.26Å; L1513-L1617 HydrophobicContact CB-CD1 4.46Å; L1513-L1617 HydrophobicContact CD1-CD1 4.23Å; L1513-L1617 HydrophobicContact CD1-CD2 3.76Å; L1513-L1617 HydrophobicContact CD2-CD1 4.48Å; L1513-L1617 HydrophobicContact CD2-CD2 3.94Å; L1513-L1617 HydrophobicContact CG-CD2 4.46Å; F1576-L1617 HydrophobicContact CB-CD1 4.34Å; F1576-L1617 HydrophobicContact CD1-CB 4.05Å; F1576-L1617 HydrophobicContact CD1-CD1 4.34Å; F1576-L1617 HydrophobicContact CD2-CD1 3.8Å; F1576-L1617 HydrophobicContact CE1-CB 3.9Å; F1576-L1617 HydrophobicContact CE2-CD1 4.12Å; F1576-L1617 HydrophobicContact CG-CB 4.48Å; F1576-L1617 HydrophobicContact CG-CD1 3.92Å; F1576-L1617 HydrophobicContact CZ-CB 4.21Å; F1578-L1617 HydrophobicContact CE2-CD2 3.91Å; E1613-L1617 PolarHBondContact O-N 2.85Å; E1613-L1617 VanDerWaalsContact O-N 3.14Å; C1614-L1617 WeakPolarHBondContact O-CB 3.36Å; C1614-L1617 PolarHBondContact O-N 3.16Å; Y1615-L1617 PolarHBondContact O-N 3.21Å; L1617-L1620 WeakPolarHBondContact O-CB 3.37Å; L1617-L1620 PolarHBondContact O-N 3.42Å; L1617-I1621 HydrophobicContact CD1-CD1 3.81Å; L1617-I1621 HydrophobicContact CD1-CG1 4.22Å; L1617-I1621 HydrophobicContact CD2-CD1 4.43Å; L1617-I1621 HydrophobicContact CG-CD1 3.8Å; L1617-I1621 WeakPolarHBondContact O-CG1 3.28Å; L1617-I1621 PolarHBondContact O-N 3.47Å
1618	V	90.6	Very high	84.5	Confident	2 Å²	2	66.3 Å²	66.3	1%	0.012	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-42.8	-175.7	165.6	0	0	0	0	111.5	I1312 F1315 L1316 C1614 Y1615 L1620 I1621 K1622	I1312-V1618 HydrophobicContact CG2-CG2 4.14Å; F1315-V1618 HydrophobicContact CB-CB 4.38Å; F1315-V1618 HydrophobicContact CB-CG1 3.84Å; F1315-V1618 HydrophobicContact CB-CG2 4Å; L1316-V1618 HydrophobicContact CD2-CG1 3.91Å; L1316-V1618 HydrophobicContact CG-CG1 4.35Å; C1614-V1618 WeakPolarHBondContact O-CB 3.23Å; C1614-V1618 VanDerWaalsContact O-CG2 3.24Å; C1614-V1618 WeakPolarHBondContact O-CG2 3.39Å; C1614-V1618 PolarHBondContact O-N 2.97Å; Y1615-V1618 PolarHBondContact O-N 3.19Å; V1618-L1620 VanDerWaalsContact C-N 3.31Å; V1618-L1620 PolarHBondContact O-N 3.26Å; V1618-I1621 PolarHBondContact O-N 3.48Å; V1618-K1622 HydrophobicContact CG1-CD 4.4Å; V1618-K1622 WeakPolarHBondContact O-CG 3.4Å; V1618-K1622 PolarHBondContact O-N 2.96Å
1619	N	88.6	Confident	84.3	Confident	87 Å²	87	66 Å²	66	47%	0.465	31%	0.311	S	S	.	.	H	α-helix	trans	-62.7	-39.2	176.2	-71.2	-0.4	0	0	0	111.3	Y1615 K1622 A1623	Y1615-N1619 WeakPolarHBondContact O-CB 3.28Å; Y1615-N1619 PolarHBondContact O-N 3.02Å; N1619-K1622 PolarHBondContact O-N 3.21Å; N1619-A1623 WeakPolarHBondContact O-CB 3.36Å; N1619-A1623 PolarHBondContact O-N 3.21Å
1620	L	87.9	Confident	84	Confident	48 Å²	48	61.6 Å²	61.6	25%	0.251	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-46.6	172.7	179.7	62.6	0	0	0	111.9	C1511 P1574 F1576 K1616 L1617 V1618 K1622 A1623 L1624	C1511-L1620 HydrophobicContact CB-CD2 3.87Å; C1511-L1620 HydrophobicContact CB-CG 4.42Å; P1574-L1620 HydrophobicContact CB-CD2 3.82Å; P1574-L1620 HydrophobicContact CG-CD2 3.95Å; F1576-L1620 HydrophobicContact CE2-CD2 3.9Å; F1576-L1620 HydrophobicContact CZ-CD2 4.47Å; K1616-L1620 WeakPolarHBondContact O-CB 3.31Å; K1616-L1620 PolarHBondContact O-N 3.1Å; L1617-L1620 WeakPolarHBondContact O-CB 3.37Å; L1617-L1620 PolarHBondContact O-N 3.42Å; V1618-L1620 VanDerWaalsContact C-N 3.31Å; V1618-L1620 PolarHBondContact O-N 3.26Å; L1620-K1622 VanDerWaalsContact C-N 3.32Å; L1620-K1622 PolarHBondContact O-N 3.1Å; L1620-A1623 PolarHBondContact O-N 3.29Å; L1620-L1624 HydrophobicContact CD1-CD1 4.18Å; L1620-L1624 HydrophobicContact CD1-CG 4.12Å; L1620-L1624 HydrophobicContact CG-CD1 3.97Å; L1620-L1624 HydrophobicContact CG-CG 4.37Å; L1620-L1624 WeakPolarHBondContact O-CB 3.39Å; L1620-L1624 VanDerWaalsContact O-CG 3.25Å; L1620-L1624 WeakPolarHBondContact O-CG 3.22Å; L1620-L1624 PolarHBondContact O-N 3.01Å
1621	I	88.1	Confident	83.6	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-59	-42.2	176.4	-69.6	167.6	0	0	0	111.3	F1291 L1316 L1320 Y1323 L1617 V1618 N1625	F1291-I1621 HydrophobicContact CD1-CG1 4.4Å; F1291-I1621 HydrophobicContact CD1-CG2 4.45Å; F1291-I1621 HydrophobicContact CD2-CG1 4.32Å; F1291-I1621 HydrophobicContact CE1-CD1 3.87Å; F1291-I1621 HydrophobicContact CE1-CG1 4.07Å; F1291-I1621 HydrophobicContact CE1-CG2 4.4Å; F1291-I1621 HydrophobicContact CE2-CD1 4.02Å; F1291-I1621 HydrophobicContact CE2-CG1 3.98Å; F1291-I1621 HydrophobicContact CZ-CD1 3.5Å; F1291-I1621 VanDerWaalsContact CZ-CD1 3.5Å; F1291-I1621 HydrophobicContact CZ-CG1 3.86Å; L1316-I1621 HydrophobicContact CD2-CB 4.47Å; L1316-I1621 HydrophobicContact CD2-CG2 3.95Å; L1320-I1621 HydrophobicContact CD1-CD1 4.4Å; Y1323-I1621 HydrophobicContact CD1-CG2 3.57Å; Y1323-I1621 HydrophobicContact CD2-CG2 4.46Å; Y1323-I1621 HydrophobicContact CE1-CG2 4.25Å; Y1323-I1621 HydrophobicContact CG-CG2 3.72Å; L1617-I1621 HydrophobicContact CD1-CD1 3.81Å; L1617-I1621 HydrophobicContact CD1-CG1 4.22Å; L1617-I1621 HydrophobicContact CD2-CD1 4.43Å; L1617-I1621 HydrophobicContact CG-CD1 3.8Å; L1617-I1621 WeakPolarHBondContact O-CG1 3.28Å; L1617-I1621 PolarHBondContact O-N 3.47Å; V1618-I1621 PolarHBondContact O-N 3.48Å; I1621-N1625 PolarHBondContact O-N 3.41Å
1622	K	85.8	Confident	83.2	Confident	48 Å²	48	60.4 Å²	60.4	21%	0.209	29%	0.294	C	S	.	.	H	α-helix	trans	-64.8	-43	176.9	-70.2	-173	-172.3	-165.1	0	111.8	F1315 L1316 D1317 V1618 N1619 L1620 N1625 Q1626	F1315-K1622 WeakPolarHBondContact O-CE 3.49Å; F1315-K1622 PolarHBondContact O-NZ 3.02Å; L1316-K1622 HydrophobicContact CD2-CG 4.03Å; D1317-K1622 IonicContact OD1-NZ 3.36Å; D1317-K1622 PolarHBondContact OD1-NZ 2.8Å; D1317-K1622 WeakPolarHBondContact OD2-CD 3.45Å; D1317-K1622 WeakPolarHBondContact OD2-CE 3.01Å; D1317-K1622 IonicContact OD2-NZ 2.67Å; D1317-K1622 PolarHBondContact OD2-NZ 3.47Å; V1618-K1622 HydrophobicContact CG1-CD 4.4Å; V1618-K1622 WeakPolarHBondContact O-CG 3.4Å; V1618-K1622 PolarHBondContact O-N 2.96Å; N1619-K1622 PolarHBondContact O-N 3.21Å; L1620-K1622 VanDerWaalsContact C-N 3.32Å; L1620-K1622 PolarHBondContact O-N 3.1Å; K1622-N1625 PolarHBondContact O-N 3.17Å; K1622-Q1626 WeakPolarHBondContact O-CG 3.41Å; K1622-Q1626 PolarHBondContact O-N 3.46Å
1623	A	82.7	Confident	82.9	Confident	47 Å²	47	56.3 Å²	56.3	39%	0.388	28%	0.276	S	S	.	.	H	α-helix	trans	-64.3	-45.2	177.3	0	0	0	0	0	112.6	N1619 L1620 N1625 Q1626	N1619-A1623 WeakPolarHBondContact O-CB 3.36Å; N1619-A1623 PolarHBondContact O-N 3.21Å; L1620-A1623 PolarHBondContact O-N 3.29Å; A1623-N1625 PolarHBondContact O-N 2.64Å; A1623-Q1626 PolarHBondContact O-N 3.45Å
1624	L	80.4	Confident	82.5	Confident	14 Å²	14	55.6 Å²	55.6	7%	0.073	27%	0.273	C	S	.	.	H	α-helix	trans	-59.5	-32.3	178.1	-70.1	171.9	0	0	0	112.9	L1289 C1511 L1620	L1289-L1624 HydrophobicContact CB-CD2 3.55Å; L1289-L1624 HydrophobicContact CD1-CD2 3.64Å; L1289-L1624 HydrophobicContact CG-CD2 4.25Å; C1511-L1624 HydrophobicContact CB-CD1 3.66Å; L1620-L1624 HydrophobicContact CD1-CD1 4.18Å; L1620-L1624 HydrophobicContact CD1-CG 4.12Å; L1620-L1624 HydrophobicContact CG-CD1 3.97Å; L1620-L1624 HydrophobicContact CG-CG 4.37Å; L1620-L1624 WeakPolarHBondContact O-CB 3.39Å; L1620-L1624 VanDerWaalsContact O-CG 3.25Å; L1620-L1624 WeakPolarHBondContact O-CG 3.22Å; L1620-L1624 PolarHBondContact O-N 3.01Å
1625	N	74.6	Confident	81.9	Confident	66 Å²	66	59.8 Å²	59.8	35%	0.353	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	1.1	178.1	-169.2	102.4	0	0	0	113.3	Y1323 I1621 K1622 A1623 Q1627	Y1323-N1625 HydrophobicContact CD1-CB 3.56Å; Y1323-N1625 HydrophobicContact CE1-CB 3.99Å; I1621-N1625 PolarHBondContact O-N 3.41Å; K1622-N1625 PolarHBondContact O-N 3.17Å; A1623-N1625 PolarHBondContact O-N 2.64Å; N1625-Q1627 VanDerWaalsContact C-N 3.34Å
1626	Q	66.8	Low	81.4	Confident	165 Å²	165	58.7 Å²	58.7	77%	0.771	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-2.3	168.7	-72.2	171.7	3.7	0	0	112.3	K1622 A1623	K1622-Q1626 WeakPolarHBondContact O-CG 3.41Å; K1622-Q1626 PolarHBondContact O-N 3.46Å; A1623-Q1626 PolarHBondContact O-N 3.45Å
1627	Q	51	Low	80.7	Confident	75 Å²	75	50.4 Å²	50.4	35%	0.35	26%	0.262	S	S	.	.			trans	-103.6	0	175.1	-62.8	172.3	-19.3	0	0	111.3	K1288 N1625	K1288-Q1627 PolarHBondContact NZ-O 3.44Å; K1288-Q1627 PolarHBondContact NZ-OXT 3.41Å; N1625-Q1627 VanDerWaalsContact C-N 3.34Å

Retrieved 1,627 of 1,627 residues in 461.3 ms (Link to these results)

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